A0A077ZI57_TRITR Loading...

BPD transp 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZI57, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 624 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
1M62.6Low80Confident162 Ų16271.6 Ų71.680%0.79840%0.398SS*.  0-65.30-74.1-47.6-169.800111.8Q3 L4 V5M1-Q3 PolarHBondContact O-N 3.2Å; M1-Q3 VanDerWaalsContact O-N 3.07Å; M1-L4 PolarHBondContact O-N 2.75Å; M1-L4 HydrophobicContact SD-CD1 4.43Å; M1-V5 PolarHBondContact O-N 3.33Å
2P79.2Confident80.4Confident96 Ų9673 Ų7362%0.62340%0.403SS*.Hα-helixtrans-55.9-29.2178.622.3-34000113.3L4 V5 A6P2-L4 PolarHBondContact O-N 2.7Å; P2-V5 PolarHBondContact O-N 3.42Å; P2-A6 WeakPolarHBondContact O-CB 3.18Å; P2-A6 PolarHBondContact O-N 2.86Å
3Q79.4Confident79.9Confident30 Ų3073.5 Ų73.514%0.1441%0.41CS..Hα-helixtrans-57.9-43.6172.6-59.883.22.200113.4M1 V5 A6 L7 I249 L263 V266 I270M1-Q3 PolarHBondContact O-N 3.2Å; M1-Q3 VanDerWaalsContact O-N 3.07Å; Q3-V5 VanDerWaalsContact C-N 3.33Å; Q3-A6 PolarHBondContact O-N 2.94Å; Q3-L7 PolarHBondContact O-N 3.29Å; Q3-I249 WeakPolarHBondContact CG-O 3.29Å; Q3-I249 PolarHBondContact NE2-O 2.85Å; Q3-L263 HydrophobicContact CB-CD2 4.32Å; Q3-L263 HydrophobicContact CG-CD2 4.43Å; Q3-V266 HydrophobicContact CB-CG1 4.11Å; Q3-I270 HydrophobicContact CB-CD1 4.49Å; Q3-I270 WeakPolarHBondContact O-CD1 3.11Å
4L84.6Confident79.8Confident78 Ų7868.8 Ų68.841%0.40838%0.383SS..Hα-helixtrans-71.1-33.9-180-63.1174.5000110.8M1 P2 L8 V266M1-L4 PolarHBondContact O-N 2.75Å; M1-L4 HydrophobicContact SD-CD1 4.43Å; P2-L4 PolarHBondContact O-N 2.7Å; L4-L8 WeakPolarHBondContact O-CB 3.22Å; L4-L8 VanDerWaalsContact O-CG 3.24Å; L4-L8 WeakPolarHBondContact O-CG 3.38Å; L4-L8 PolarHBondContact O-N 3.41Å; L4-V266 HydrophobicContact CD2-CG1 4.14Å; L4-V266 HydrophobicContact CD2-CG2 4.21Å
5V82.6Confident80.1Confident87 Ų8766.3 Ų66.353%0.52737%0.372SS..Hα-helixtrans-66.3-42.1171.9-1770000110.6M1 P2 Q3 L8 L9M1-V5 PolarHBondContact O-N 3.33Å; P2-V5 PolarHBondContact O-N 3.42Å; Q3-V5 VanDerWaalsContact C-N 3.33Å; V5-L8 PolarHBondContact O-N 3.33Å; V5-L9 HydrophobicContact CG1-CD1 4.04Å; V5-L9 HydrophobicContact CG1-CG 4.4Å; V5-L9 WeakPolarHBondContact O-CB 3.28Å; V5-L9 VanDerWaalsContact O-CG 3.28Å; V5-L9 WeakPolarHBondContact O-CG 3.33Å; V5-L9 PolarHBondContact O-N 3.48Å
6A74.1Confident80.1Confident36 Ų3670.7 Ų70.730%0.29839%0.394SS..Hα-helixtrans-62-44.8175.500000112.1P2 Q3 L9 V10 I270P2-A6 WeakPolarHBondContact O-CB 3.18Å; P2-A6 PolarHBondContact O-N 2.86Å; Q3-A6 PolarHBondContact O-N 2.94Å; A6-L9 PolarHBondContact O-N 3.37Å; A6-V10 WeakPolarHBondContact O-CG2 3.22Å; A6-V10 PolarHBondContact O-N 3.07Å; A6-I270 HydrophobicContact CB-CD1 4.23Å
7L84.9Confident79.7Confident26 Ų2671.4 Ų71.414%0.13640%0.4CS..Hα-helixtrans-61.3-44.7174.7-178.458.8000111.8Q3 L9 V10 L11 V266 L269 I270Q3-L7 PolarHBondContact O-N 3.29Å; L7-L9 VanDerWaalsContact C-N 3.32Å; L7-L9 PolarHBondContact O-N 2.95Å; L7-V10 PolarHBondContact O-N 3.04Å; L7-L11 HydrophobicContact CD1-CD1 4.07Å; L7-L11 HydrophobicContact CD1-CG 4.16Å; L7-L11 HydrophobicContact CG-CD1 4Å; L7-L11 HydrophobicContact CG-CG 4.5Å; L7-L11 VanDerWaalsContact O-CG 3.29Å; L7-L11 WeakPolarHBondContact O-CG 3.35Å; L7-L11 PolarHBondContact O-N 3.12Å; L7-V266 HydrophobicContact CD2-CG1 4.28Å; L7-L269 HydrophobicContact CD1-CB 4.13Å; L7-L269 HydrophobicContact CD2-CB 4.34Å; L7-I270 HydrophobicContact CB-CD1 4.26Å; L7-I270 HydrophobicContact CB-CG1 3.7Å; L7-I270 HydrophobicContact CD1-CG1 3.98Å; L7-I270 HydrophobicContact CG-CG1 4.38Å
8L87.3Confident79.3Confident119 Ų11968.3 Ų68.362%0.62339%0.385SS*.Hα-helixtrans-63.7-35.8176.3-73.2168.7000112.5L4 V5 L12L4-L8 WeakPolarHBondContact O-CB 3.22Å; L4-L8 VanDerWaalsContact O-CG 3.24Å; L4-L8 WeakPolarHBondContact O-CG 3.38Å; L4-L8 PolarHBondContact O-N 3.41Å; V5-L8 PolarHBondContact O-N 3.33Å; L8-L12 WeakPolarHBondContact O-CB 3.31Å; L8-L12 PolarHBondContact O-N 2.92Å
9L83.3Confident79.1Confident102 Ų10271.2 Ų71.253%0.53441%0.407SS..Hα-helixtrans-69.2-41175.6-75169.8000112.2V5 A6 L7 L12 V13V5-L9 HydrophobicContact CG1-CD1 4.04Å; V5-L9 HydrophobicContact CG1-CG 4.4Å; V5-L9 WeakPolarHBondContact O-CB 3.28Å; V5-L9 VanDerWaalsContact O-CG 3.28Å; V5-L9 WeakPolarHBondContact O-CG 3.33Å; V5-L9 PolarHBondContact O-N 3.48Å; A6-L9 PolarHBondContact O-N 3.37Å; L7-L9 VanDerWaalsContact C-N 3.32Å; L7-L9 PolarHBondContact O-N 2.95Å; L9-L12 PolarHBondContact O-N 2.9Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.46Å
10V76.1Confident79.1Confident23 Ų2374.2 Ų74.214%0.13942%0.417CS..Hα-helixtrans-61.2-54.7174.5168.80000110.2A6 L7 L12 V13 D14 I270 G273 M274A6-V10 WeakPolarHBondContact O-CG2 3.22Å; A6-V10 PolarHBondContact O-N 3.07Å; L7-V10 PolarHBondContact O-N 3.04Å; V10-L12 PolarHBondContact O-N 3.38Å; V10-V13 PolarHBondContact O-N 3.19Å; V10-D14 PolarHBondContact O-N 3.45Å; V10-I270 HydrophobicContact CG2-CG2 4.44Å; V10-G273 VanDerWaalsContact CG1-C 3.46Å; V10-M274 HydrophobicContact CG1-CG 3.98Å; V10-M274 HydrophobicContact CG2-CG 3.74Å; V10-M274 HydrophobicContact CG2-SD 4.39Å
11L85.9Confident79.3Confident29 Ų2970.7 Ų70.715%0.15240%0.397CS..Hα-helixtrans-60.5-30.6178.8-63.8171.9000113L7 S15 F21 W22 I38L7-L11 HydrophobicContact CD1-CD1 4.07Å; L7-L11 HydrophobicContact CD1-CG 4.16Å; L7-L11 HydrophobicContact CG-CD1 4Å; L7-L11 HydrophobicContact CG-CG 4.5Å; L7-L11 VanDerWaalsContact O-CG 3.29Å; L7-L11 WeakPolarHBondContact O-CG 3.35Å; L7-L11 PolarHBondContact O-N 3.12Å; L11-S15 WeakPolarHBondContact O-CB 3.41Å; L11-S15 PolarHBondContact O-N 3.49Å; L11-S15 VanDerWaalsContact O-N 3.11Å; L11-S15 PolarHBondContact O-OG 3.08Å; L11-F21 HydrophobicContact CB-CE1 4.47Å; L11-F21 HydrophobicContact CD2-CE1 4.13Å; L11-F21 HydrophobicContact CD2-CZ 3.74Å; L11-W22 HydrophobicContact CB-CH2 4.12Å; L11-W22 HydrophobicContact CB-CZ2 4.4Å; L11-I38 HydrophobicContact CD2-CD1 3.86Å
12L84.7Confident80.4Confident88 Ų8870.3 Ų70.346%0.46139%0.387SS..Hα-helixtrans-69.1-46.9173.3-174.6155.2000111L8 L9 V10 S15 L16L8-L12 WeakPolarHBondContact O-CB 3.31Å; L8-L12 PolarHBondContact O-N 2.92Å; L9-L12 PolarHBondContact O-N 2.9Å; V10-L12 PolarHBondContact O-N 3.38Å; L12-S15 PolarHBondContact O-N 2.81Å; L12-S15 PolarHBondContact O-OG 3.49Å; L12-L16 HydrophobicContact CD2-CD1 3.69Å; L12-L16 HydrophobicContact CD2-CG 4.26Å; L12-L16 WeakPolarHBondContact O-CG 3.24Å; L12-L16 PolarHBondContact O-N 3.18Å
13V74.5Confident80.7Confident80 Ų8070.9 Ų70.949%0.48538%0.381SS..Hα-helixtrans-59.7-47.5175.1168.90000110.8L9 V10 S15 L16 V17L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 3.46Å; V10-V13 PolarHBondContact O-N 3.19Å; V13-S15 PolarHBondContact O-N 3.29Å; V13-L16 PolarHBondContact O-N 3.28Å; V13-V17 HydrophobicContact CG1-CG2 4.46Å; V13-V17 WeakPolarHBondContact O-CG2 3.48Å; V13-V17 PolarHBondContact O-N 2.82Å
14D77.8Confident81Confident7 Ų772.8 Ų72.84%0.03740%0.395CS..Hα-helixtrans-56.3-40.7177.1-57.3-26.2000111.1V10 L16 V17 A18 F21 G277V10-D14 PolarHBondContact O-N 3.45Å; D14-L16 VanDerWaalsContact C-N 3.34Å; D14-L16 PolarHBondContact O-N 3.01Å; D14-V17 PolarHBondContact O-N 3.07Å; D14-A18 PolarHBondContact O-N 2.93Å; D14-F21 HydrophobicContact CB-CD2 3.77Å; D14-F21 HydrophobicContact CB-CE1 4.3Å; D14-F21 HydrophobicContact CB-CE2 3.35Å; D14-F21 HydrophobicContact CB-CG 4.4Å; D14-F21 HydrophobicContact CB-CZ 3.65Å; D14-G277 VanDerWaalsContact OD1-CA 3.31Å; D14-G277 WeakPolarHBondContact OD1-CA 3.23Å
15S84.2Confident81.2Confident31 Ų3171.8 Ų71.822%0.21739%0.392CS..Hα-helixtrans-74-16.8177.476.70000115.7L11 L12 V13 W22L11-S15 WeakPolarHBondContact O-CB 3.41Å; L11-S15 PolarHBondContact O-N 3.49Å; L11-S15 VanDerWaalsContact O-N 3.11Å; L11-S15 PolarHBondContact O-OG 3.08Å; L12-S15 PolarHBondContact O-N 2.81Å; L12-S15 PolarHBondContact O-OG 3.49Å; V13-S15 PolarHBondContact O-N 3.29Å; S15-W22 PolarHBondContact OG-NE1 3.05Å
16L80.4Confident81.4Confident137 Ų13772.2 Ų72.272%0.71739%0.39SS*.Hα-helixtrans-85-28.3169.5-68.5175.9000111.8L12 V13 D14L12-L16 HydrophobicContact CD2-CD1 3.69Å; L12-L16 HydrophobicContact CD2-CG 4.26Å; L12-L16 WeakPolarHBondContact O-CG 3.24Å; L12-L16 PolarHBondContact O-N 3.18Å; V13-L16 PolarHBondContact O-N 3.28Å; D14-L16 VanDerWaalsContact C-N 3.34Å; D14-L16 PolarHBondContact O-N 3.01Å
17V73Confident81.7Confident83 Ų8375.6 Ų75.650%0.50340%0.4SS..Hα-helixtrans-80.2-41177.1173.90000111.5V13 D14V13-V17 HydrophobicContact CG1-CG2 4.46Å; V13-V17 WeakPolarHBondContact O-CG2 3.48Å; V13-V17 PolarHBondContact O-N 2.82Å; D14-V17 PolarHBondContact O-N 3.07Å
18A73.7Confident81.4Confident16 Ų1682.5 Ų82.513%0.13244%0.437CS..  trans-114.4104.9-177.400000111.8D14 H20 F21 L280D14-A18 PolarHBondContact O-N 2.93Å; A18-H20 PolarHBondContact O-N 3.26Å; A18-F21 HydrophobicContact CB-CB 4.19Å; A18-F21 VanDerWaalsContact O-CB 3.22Å; A18-F21 WeakPolarHBondContact O-CB 3.4Å; A18-F21 PolarHBondContact O-N 3Å; A18-L280 HydrophobicContact CB-CD1 4Å
19P74.4Confident81.1Confident123 Ų12378.5 Ų78.580%0.79943%0.425SS*.THydrogen-bonded Turntrans-57.8-23.2-176.2-28.435.8000115.7
20H79.4Confident81.2Confident131 Ų13174.8 Ų74.861%0.60640%0.404SS*.THydrogen-bonded Turntrans-100.59.1179.7-64.5-84.6000113.6A18 W22 Q23A18-H20 PolarHBondContact O-N 3.26Å; H20-W22 VanDerWaalsContact C-N 3.26Å; H20-W22 PolarHBondContact O-N 2.98Å; H20-W22 VanDerWaalsContact O-N 3.13Å; H20-Q23 HydrophobicContact CB-CB 4.47Å; H20-Q23 PolarHBondContact ND1-OE1 3.49Å; H20-Q23 WeakPolarHBondContact O-CB 3.48Å; H20-Q23 PolarHBondContact O-N 2.99Å
21F83.2Confident81.7Confident1 Ų175.8 Ų75.80%0.00441%0.408CS..THydrogen-bonded Turntrans-52.9-38.6-173.8-176.6-97.1000114.1L11 D14 A18 Q23 S34 P35 I38 L280L11-F21 HydrophobicContact CB-CE1 4.47Å; L11-F21 HydrophobicContact CD2-CE1 4.13Å; L11-F21 HydrophobicContact CD2-CZ 3.74Å; D14-F21 HydrophobicContact CB-CD2 3.77Å; D14-F21 HydrophobicContact CB-CE1 4.3Å; D14-F21 HydrophobicContact CB-CE2 3.35Å; D14-F21 HydrophobicContact CB-CG 4.4Å; D14-F21 HydrophobicContact CB-CZ 3.65Å; A18-F21 HydrophobicContact CB-CB 4.19Å; A18-F21 VanDerWaalsContact O-CB 3.22Å; A18-F21 WeakPolarHBondContact O-CB 3.4Å; A18-F21 PolarHBondContact O-N 3Å; F21-Q23 VanDerWaalsContact C-N 3.31Å; F21-Q23 PolarHBondContact O-N 3.04Å; F21-S34 VanDerWaalsContact CD2-CB 3.42Å; F21-P35 HydrophobicContact CE1-CG 4.39Å; F21-P35 VanDerWaalsContact O-CD 3.25Å; F21-P35 WeakPolarHBondContact O-CD 3.17Å; F21-I38 HydrophobicContact CE2-CD1 3.79Å; F21-I38 HydrophobicContact CZ-CD1 3.6Å; F21-L280 HydrophobicContact CD2-CD1 4.23Å
22W86.6Confident81.6Confident154 Ų15477.6 Ų77.658%0.58342%0.415SS*.THydrogen-bonded Turntrans-85.12.2-179.9-62.6112.7000114.4L11 S15 H20 V24 P35L11-W22 HydrophobicContact CB-CH2 4.12Å; L11-W22 HydrophobicContact CB-CZ2 4.4Å; S15-W22 PolarHBondContact OG-NE1 3.05Å; H20-W22 VanDerWaalsContact C-N 3.26Å; H20-W22 PolarHBondContact O-N 2.98Å; H20-W22 VanDerWaalsContact O-N 3.13Å; W22-V24 PolarHBondContact O-N 2.98Å; W22-P35 HydrophobicContact CE3-CG 3.97Å; W22-P35 HydrophobicContact CZ3-CG 4.14Å
23Q84.7Confident81.6Confident108 Ų10874.1 Ų74.151%0.50540%0.401SS..  trans-79.3105.1-178.7-173172-1800110.9H20 F21 V25H20-Q23 HydrophobicContact CB-CB 4.47Å; H20-Q23 PolarHBondContact ND1-OE1 3.49Å; H20-Q23 WeakPolarHBondContact O-CB 3.48Å; H20-Q23 PolarHBondContact O-N 2.99Å; F21-Q23 VanDerWaalsContact C-N 3.31Å; F21-Q23 PolarHBondContact O-N 3.04Å; Q23-V25 HydrophobicContact CG-CG2 4.31Å
24V86.4Confident82.1Confident69 Ų6971.4 Ų71.442%0.41839%0.385SS..  trans-101.1132.7174.4179.80000109.9W22 L31 F32 I36W22-V24 PolarHBondContact O-N 2.98Å; V24-L31 HydrophobicContact CG1-CB 4.35Å; V24-L31 HydrophobicContact CG1-CD2 3.92Å; V24-F32 CarbonylContact C-O 3.57Å; V24-F32 WeakPolarHBondContact CA-O 3.26Å; V24-I36 HydrophobicContact CG1-CG1 4.09Å; V24-I36 HydrophobicContact CG2-CG1 4.35Å
25V87.3Confident82.6Confident57 Ų5772.3 Ų72.335%0.34539%0.392SS..EExtended strand (participates in β ladder)trans-126.2140.2-179.3-170.80000109.6Q23 Q27 F32Q23-V25 HydrophobicContact CG-CG2 4.31Å; V25-Q27 HydrophobicContact CG1-CG 3.91Å; V25-F32 PolarHBondContact N-O 3.07Å; V25-F32 PolarHBondContact O-N 3.45Å
26L87.5Confident82.9Confident96 Ų9671.7 Ų71.750%0.50339%0.385SS..EExtended strand (participates in β ladder)trans-93.5120.4170.7-172.474.9000109.2L31 F156L26-L31 HydrophobicContact CB-CD2 4.29Å; L26-L31 HydrophobicContact CD1-CD2 3.76Å; L26-L31 HydrophobicContact CD1-CG 4.15Å; L26-F156 HydrophobicContact CD1-CB 4.16Å; L26-F156 HydrophobicContact CD1-CD1 3.78Å; L26-F156 HydrophobicContact CD1-CG 4.27Å; L26-F156 HydrophobicContact CD2-CD1 4.48Å
27Q80.5Confident83.1Confident107 Ų10767.4 Ų67.450%0.536%0.364SS..EExtended strand (participates in β ladder)trans-133.6134.9176.1-59.2-176.9-13.900108.7V25 G29 R30 F32V25-Q27 HydrophobicContact CG1-CG 3.91Å; Q27-G29 PolarHBondContact O-N 3.46Å; Q27-R30 PolarHBondContact N-O 2.99Å; Q27-R30 PolarHBondContact O-N 3.17Å; Q27-F32 HydrophobicContact CB-CD2 3.87Å; Q27-F32 HydrophobicContact CB-CE2 3.9Å; Q27-F32 HydrophobicContact CG-CD2 4.37Å
28D78.1Confident83.8Confident171 Ų17163.8 Ų63.891%0.91434%0.341SS*.THydrogen-bonded Turntrans49.130.9179.7-56.1-27.3000115.4R30D28-R30 VanDerWaalsContact C-N 3.31Å; D28-R30 PolarHBondContact O-N 2.87Å
29G81.2Confident84.6Confident36 Ų3666 Ų6637%0.37135%0.351SS..THydrogen-bonded Turntrans79.45-177.700000115.3Q27 F156Q27-G29 PolarHBondContact O-N 3.46Å; G29-F156 WeakPolarHBondContact O-CA 3.35Å
30R84.9Confident85.3Confident23 Ų2361 Ų619%0.08732%0.317CS..EExtended strand (participates in β ladder)trans-112.5142.4176.3175.8171.9160.9149.91.5110.8Q27 D28 F32 S151 P158Q27-R30 PolarHBondContact N-O 2.99Å; Q27-R30 PolarHBondContact O-N 3.17Å; D28-R30 VanDerWaalsContact C-N 3.31Å; D28-R30 PolarHBondContact O-N 2.87Å; R30-F32 HydrophobicContact CB-CD2 4.42Å; R30-F32 HydrophobicContact CB-CE2 3.72Å; R30-F32 HydrophobicContact CB-CZ 4.2Å; R30-F32 HydrophobicContact CG-CD2 4.21Å; R30-F32 HydrophobicContact CG-CE1 4.45Å; R30-F32 HydrophobicContact CG-CE2 3.68Å; R30-F32 HydrophobicContact CG-CZ 3.82Å; R30-F32 WeakPolarHBondContact O-CD2 3.25Å; R30-S151 VanDerWaalsContact NH1-C 3.33Å; R30-S151 PolarHBondContact NH1-O 3Å; R30-P158 HydrophobicContact CG-CG 4.46Å
31L87.3Confident85.6Confident44 Ų4461.9 Ų61.923%0.2332%0.315CS..EExtended strand (participates in β ladder)trans-80.3140.9170.4-65.2168.5000110.8V24 L26 I36 F156 L157V24-L31 HydrophobicContact CG1-CB 4.35Å; V24-L31 HydrophobicContact CG1-CD2 3.92Å; L26-L31 HydrophobicContact CB-CD2 4.29Å; L26-L31 HydrophobicContact CD1-CD2 3.76Å; L26-L31 HydrophobicContact CD1-CG 4.15Å; L31-I36 HydrophobicContact CB-CD1 4.23Å; L31-I36 HydrophobicContact CB-CG1 4.03Å; L31-I36 HydrophobicContact CB-CG2 4.15Å; L31-I36 HydrophobicContact CD1-CD1 4.34Å; L31-I36 WeakPolarHBondContact O-CG2 3.44Å; L31-F156 HydrophobicContact CD1-CB 4.09Å; L31-F156 HydrophobicContact CG-CB 3.95Å; L31-F156 PolarHBondContact N-O 3.19Å; L31-L157 HydrophobicContact CD1-CD2 4.44Å
32F84Confident85.9Confident67 Ų6762 Ų6229%0.29432%0.316SS..EExtended strand (participates in β ladder)trans-134.9159177.3-68.3-87.5000110.6V24 V25 Q27 R30V24-F32 CarbonylContact C-O 3.57Å; V24-F32 WeakPolarHBondContact CA-O 3.26Å; V25-F32 PolarHBondContact N-O 3.07Å; V25-F32 PolarHBondContact O-N 3.45Å; Q27-F32 HydrophobicContact CB-CD2 3.87Å; Q27-F32 HydrophobicContact CB-CE2 3.9Å; Q27-F32 HydrophobicContact CG-CD2 4.37Å; R30-F32 HydrophobicContact CB-CD2 4.42Å; R30-F32 HydrophobicContact CB-CE2 3.72Å; R30-F32 HydrophobicContact CB-CZ 4.2Å; R30-F32 HydrophobicContact CG-CD2 4.21Å; R30-F32 HydrophobicContact CG-CE1 4.45Å; R30-F32 HydrophobicContact CG-CE2 3.68Å; R30-F32 HydrophobicContact CG-CZ 3.82Å; R30-F32 WeakPolarHBondContact O-CD2 3.25Å
33G84.8Confident86.2Confident16 Ų1654.8 Ų54.817%0.16529%0.289CS..SBendtrans122.6152.8-177.200000111.2P35 I36 D37G33-P35 VanDerWaalsContact C-N 3.34Å; G33-P35 WeakPolarHBondContact O-CD 3.36Å; G33-I36 WeakPolarHBondContact O-CA 3.46Å; G33-I36 WeakPolarHBondContact O-CB 3.26Å; G33-I36 PolarHBondContact O-N 3.23Å; G33-D37 WeakPolarHBondContact CA-OD2 3.48Å; G33-D37 PolarHBondContact N-OD2 3.34Å; G33-D37 PolarHBondContact O-N 2.95Å; G33-D37 VanDerWaalsContact O-OD2 3.13Å
34S85.7Confident86.5Confident23 Ų2350.3 Ų50.316%0.16127%0.269CS..Hα-helixtrans-46.8-39-164.7-49.70000116.6F21 D37 I38F21-S34 VanDerWaalsContact CD2-CB 3.42Å; S34-D37 PolarHBondContact O-N 3.03Å; S34-I38 WeakPolarHBondContact O-CB 3.48Å; S34-I38 VanDerWaalsContact O-CG1 3.26Å; S34-I38 WeakPolarHBondContact O-CG1 3.24Å; S34-I38 PolarHBondContact O-N 3.4Å
35P87.3Confident86.7Confident26 Ų2647.3 Ų47.317%0.16925%0.251CS..Hα-helixtrans-71.9-31.9178.8-16.633.4000112.4F21 W22 G33 L39F21-P35 HydrophobicContact CE1-CG 4.39Å; F21-P35 VanDerWaalsContact O-CD 3.25Å; F21-P35 WeakPolarHBondContact O-CD 3.17Å; W22-P35 HydrophobicContact CE3-CG 3.97Å; W22-P35 HydrophobicContact CZ3-CG 4.14Å; G33-P35 VanDerWaalsContact C-N 3.34Å; G33-P35 WeakPolarHBondContact O-CD 3.36Å; P35-L39 WeakPolarHBondContact O-CG 3.46Å; P35-L39 PolarHBondContact O-N 2.97Å; P35-L39 VanDerWaalsContact O-N 3.12Å
36I89.5Confident87Confident17 Ų1744.8 Ų44.89%0.08724%0.237CC..Hα-helixtrans-75.9-36.9174.7-48.9-63000110.2V24 L31 G33 L39 N40 P158V24-I36 HydrophobicContact CG1-CG1 4.09Å; V24-I36 HydrophobicContact CG2-CG1 4.35Å; L31-I36 HydrophobicContact CB-CD1 4.23Å; L31-I36 HydrophobicContact CB-CG1 4.03Å; L31-I36 HydrophobicContact CB-CG2 4.15Å; L31-I36 HydrophobicContact CD1-CD1 4.34Å; L31-I36 WeakPolarHBondContact O-CG2 3.44Å; G33-I36 WeakPolarHBondContact O-CA 3.46Å; G33-I36 WeakPolarHBondContact O-CB 3.26Å; G33-I36 PolarHBondContact O-N 3.23Å; I36-L39 HydrophobicContact CD1-CD1 4.44Å; I36-L39 WeakPolarHBondContact O-CB 3.24Å; I36-L39 PolarHBondContact O-N 3.18Å; I36-N40 WeakPolarHBondContact O-CB 3.41Å; I36-N40 PolarHBondContact O-N 3.44Å; I36-P158 HydrophobicContact CG2-CG 3.84Å
37D85.4Confident87.4Confident48 Ų4840.2 Ų40.226%0.25721%0.213SC..Hα-helixtrans-68.7-35.1175.1-62.9-50.7000111.8G33 S34 N40 R41G33-D37 WeakPolarHBondContact CA-OD2 3.48Å; G33-D37 PolarHBondContact N-OD2 3.34Å; G33-D37 PolarHBondContact O-N 2.95Å; G33-D37 VanDerWaalsContact O-OD2 3.13Å; S34-D37 PolarHBondContact O-N 3.03Å; D37-N40 PolarHBondContact O-N 3.26Å; D37-R41 VanDerWaalsContact O-CB 3.31Å; D37-R41 WeakPolarHBondContact O-CB 3.43Å; D37-R41 VanDerWaalsContact O-CG 3.3Å; D37-R41 WeakPolarHBondContact O-CG 3.4Å; D37-R41 PolarHBondContact O-N 2.87Å
38I87.1Confident88.1Confident6 Ų635.2 Ų35.23%0.03119%0.189CC..Hα-helixtrans-60.5-49.9167.5-74.3162.7000110.5L11 F21 S34 N40 A42 L269 Q272 T276L11-I38 HydrophobicContact CD2-CD1 3.86Å; F21-I38 HydrophobicContact CE2-CD1 3.79Å; F21-I38 HydrophobicContact CZ-CD1 3.6Å; S34-I38 WeakPolarHBondContact O-CB 3.48Å; S34-I38 VanDerWaalsContact O-CG1 3.26Å; S34-I38 WeakPolarHBondContact O-CG1 3.24Å; S34-I38 PolarHBondContact O-N 3.4Å; I38-N40 VanDerWaalsContact C-N 3.3Å; I38-N40 PolarHBondContact O-N 2.98Å; I38-A42 WeakPolarHBondContact O-CB 3.43Å; I38-A42 PolarHBondContact O-N 3.27Å; I38-L269 HydrophobicContact CG2-CD2 4.33Å; I38-Q272 HydrophobicContact CB-CG 4.46Å; I38-Q272 HydrophobicContact CG2-CB 4.38Å; I38-Q272 HydrophobicContact CG2-CG 4.21Å; I38-Q272 WeakPolarHBondContact O-CG 3.43Å; I38-T276 HydrophobicContact CD1-CG2 4.07Å; I38-T276 HydrophobicContact CG1-CG2 3.82Å; I38-T276 WeakPolarHBondContact CG1-OG1 3.4Å
39L91.4Very high88.8Confident64 Ų6427 Ų2734%0.33515%0.146SC..Hα-helixtrans-58-42.8176.8-72.7167.3000111.8P35 I36 A43 V161 L269P35-L39 WeakPolarHBondContact O-CG 3.46Å; P35-L39 PolarHBondContact O-N 2.97Å; P35-L39 VanDerWaalsContact O-N 3.12Å; I36-L39 HydrophobicContact CD1-CD1 4.44Å; I36-L39 WeakPolarHBondContact O-CB 3.24Å; I36-L39 PolarHBondContact O-N 3.18Å; L39-A43 PolarHBondContact O-N 3.36Å; L39-V161 HydrophobicContact CB-CG1 4.25Å; L39-V161 HydrophobicContact CB-CG2 3.9Å; L39-L269 HydrophobicContact CD2-CD2 3.86Å
40N89.9Confident89.6Confident17 Ų1725.3 Ų25.39%0.09113%0.128CC..Hα-helixtrans-68.9-49.3-177.6-167.261.4000112.3I36 D37 I38 A42 A43 P158 P160 V161I36-N40 WeakPolarHBondContact O-CB 3.41Å; I36-N40 PolarHBondContact O-N 3.44Å; D37-N40 PolarHBondContact O-N 3.26Å; I38-N40 VanDerWaalsContact C-N 3.3Å; I38-N40 PolarHBondContact O-N 2.98Å; N40-A42 VanDerWaalsContact C-N 3.31Å; N40-A42 PolarHBondContact O-N 2.95Å; N40-A43 VanDerWaalsContact O-CB 3.32Å; N40-A43 WeakPolarHBondContact O-CB 3.45Å; N40-A43 PolarHBondContact O-N 2.93Å; N40-P158 HydrophobicContact CB-CB 4.38Å; N40-P158 HydrophobicContact CB-CG 4.3Å; N40-P158 WeakPolarHBondContact OD1-CB 3.1Å; N40-P160 WeakPolarHBondContact OD1-CD 3.47Å; N40-P160 VanDerWaalsContact OD1-CG 3.31Å; N40-P160 WeakPolarHBondContact OD1-CG 3.31Å; N40-V161 HydrophobicContact CB-CG2 4.26Å
41R85.4Confident90.1Very high150 Ų15024.2 Ų24.257%0.56612%0.124SC*.Hα-helixtrans-70.4-26.9179.6-67.1174.1178.7-89.5-0.3112.5D37 A43 P44 Q272D37-R41 VanDerWaalsContact O-CB 3.31Å; D37-R41 WeakPolarHBondContact O-CB 3.43Å; D37-R41 VanDerWaalsContact O-CG 3.3Å; D37-R41 WeakPolarHBondContact O-CG 3.4Å; D37-R41 PolarHBondContact O-N 2.87Å; R41-A43 VanDerWaalsContact C-N 3.28Å; R41-A43 PolarHBondContact O-N 3.46Å; R41-P44 WeakPolarHBondContact O-CD 3.47Å; R41-Q272 HydrophobicContact CB-CG 3.83Å
42A88.9Confident90.4Very high2 Ų222.1 Ų22.12%0.01711%0.113CC..Hα-helixtrans-72.4-18.917300000113I38 N40 V45 A46 L269 Q272I38-A42 WeakPolarHBondContact O-CB 3.43Å; I38-A42 PolarHBondContact O-N 3.27Å; N40-A42 VanDerWaalsContact C-N 3.31Å; N40-A42 PolarHBondContact O-N 2.95Å; A42-V45 PolarHBondContact O-N 3.3Å; A42-A46 VanDerWaalsContact O-CB 3.23Å; A42-A46 WeakPolarHBondContact O-CB 3.09Å; A42-A46 PolarHBondContact O-N 2.85Å; A42-L269 HydrophobicContact CB-CD2 3.68Å; A42-Q272 HydrophobicContact CB-CB 3.68Å; A42-Q272 HydrophobicContact CB-CG 4.01Å
43A92.6Very high90.9Very high3 Ų319 Ų193%0.02510%0.099CC..Hα-helixtrans-60.5-43.7-17100000114.1L39 N40 R41 A46 L47 P160 A164L39-A43 PolarHBondContact O-N 3.36Å; N40-A43 VanDerWaalsContact O-CB 3.32Å; N40-A43 WeakPolarHBondContact O-CB 3.45Å; N40-A43 PolarHBondContact O-N 2.93Å; R41-A43 VanDerWaalsContact C-N 3.28Å; R41-A43 PolarHBondContact O-N 3.46Å; A43-A46 PolarHBondContact O-N 3.03Å; A43-L47 VanDerWaalsContact O-CG 3.29Å; A43-L47 WeakPolarHBondContact O-CG 3.43Å; A43-L47 PolarHBondContact O-N 3.13Å; A43-P160 HydrophobicContact CB-CB 3.66Å; A43-P160 WeakPolarHBondContact CB-O 3.47Å; A43-A164 HydrophobicContact CB-CB 4Å
44P91.6Very high91.4Very high14 Ų1418.2 Ų18.29%0.0919%0.091CC..Hα-helixtrans-59.5-50.5171.6-24.736000112.6R41 A46 L47 L48 A219 I222 V223R41-P44 WeakPolarHBondContact O-CD 3.47Å; P44-A46 VanDerWaalsContact C-N 3.31Å; P44-A46 PolarHBondContact O-N 3.41Å; P44-L47 WeakPolarHBondContact O-CB 3.37Å; P44-L47 PolarHBondContact O-N 3.2Å; P44-L47 VanDerWaalsContact O-N 3.16Å; P44-L48 WeakPolarHBondContact O-CG 3.12Å; P44-L48 PolarHBondContact O-N 3.04Å; P44-A219 HydrophobicContact CB-CB 4.25Å; P44-I222 HydrophobicContact CG-CG2 4.48Å; P44-V223 HydrophobicContact CB-CG2 4.1Å; P44-V223 HydrophobicContact CG-CG2 3.74Å
45V89.8Confident91.8Very high6 Ų617.1 Ų17.14%0.0368%0.083CC..Hα-helixtrans-61.6-39179.6-177.80000111.4A42 L48 A49 L239 D242 A268A42-V45 PolarHBondContact O-N 3.3Å; V45-L48 PolarHBondContact O-N 3.26Å; V45-A49 WeakPolarHBondContact O-CB 3.3Å; V45-A49 PolarHBondContact O-N 3.49Å; V45-L239 HydrophobicContact CG2-CD2 4.11Å; V45-D242 HydrophobicContact CG1-CB 3.82Å; V45-D242 HydrophobicContact CG2-CB 4.34Å; V45-A268 HydrophobicContact CB-CB 4.22Å; V45-A268 HydrophobicContact CG1-CB 3.8Å
46A94Very high92.1Very high5 Ų516 Ų164%0.0418%0.076CC..Hα-helixtrans-64.7-40.6175.900000112.2A42 A43 P44 A49 I50 V265 A268A42-A46 VanDerWaalsContact O-CB 3.23Å; A42-A46 WeakPolarHBondContact O-CB 3.09Å; A42-A46 PolarHBondContact O-N 2.85Å; A43-A46 PolarHBondContact O-N 3.03Å; P44-A46 VanDerWaalsContact C-N 3.31Å; P44-A46 PolarHBondContact O-N 3.41Å; A46-A49 PolarHBondContact O-N 3.23Å; A46-I50 WeakPolarHBondContact O-CB 3.29Å; A46-I50 WeakPolarHBondContact O-CD1 3.48Å; A46-I50 WeakPolarHBondContact O-CG1 3.41Å; A46-I50 PolarHBondContact O-N 2.92Å; A46-V265 HydrophobicContact CB-CG1 4.12Å; A46-V265 HydrophobicContact CB-CG2 4.22Å; A46-A268 HydrophobicContact CB-CB 4.04Å
47L96.5Very high92.2Very high0 Ų015.1 Ų15.10%07%0.072CC..Hα-helixtrans-62.3-49.8172.8-74.3163.5000111A43 P44 A49 I50 G51 A164 T167 C215 I218 A219 I222A43-L47 VanDerWaalsContact O-CG 3.29Å; A43-L47 WeakPolarHBondContact O-CG 3.43Å; A43-L47 PolarHBondContact O-N 3.13Å; P44-L47 WeakPolarHBondContact O-CB 3.37Å; P44-L47 PolarHBondContact O-N 3.2Å; P44-L47 VanDerWaalsContact O-N 3.16Å; L47-A49 VanDerWaalsContact C-N 3.31Å; L47-A49 PolarHBondContact O-N 3.16Å; L47-I50 WeakPolarHBondContact O-CB 3.18Å; L47-I50 PolarHBondContact O-N 3.24Å; L47-G51 PolarHBondContact O-N 3.48Å; L47-A164 HydrophobicContact CG-CB 4.22Å; L47-T167 HydrophobicContact CD2-CG2 3.72Å; L47-T167 WeakPolarHBondContact CD2-OG1 3.46Å; L47-C215 VanDerWaalsContact O-CB 3.28Å; L47-C215 WeakPolarHBondContact O-CB 3.31Å; L47-I218 HydrophobicContact CD1-CG2 3.87Å; L47-I218 HydrophobicContact CD2-CG2 4.1Å; L47-A219 HydrophobicContact CB-CB 4.22Å; L47-A219 HydrophobicContact CD1-CB 4.22Å; L47-I222 HydrophobicContact CD1-CD1 3.56Å
48L94.8Very high92.6Very high1 Ų113.8 Ų13.81%0.0057%0.065CC..Hα-helixtrans-59.4-43.6176.4-58.9-163.3000111.2P44 V45 I50 G51 M52 V65 M69 A216 A219 L239 A243P44-L48 WeakPolarHBondContact O-CG 3.12Å; P44-L48 PolarHBondContact O-N 3.04Å; V45-L48 PolarHBondContact O-N 3.26Å; L48-I50 PolarHBondContact O-N 2.97Å; L48-G51 PolarHBondContact O-N 3.44Å; L48-M52 WeakPolarHBondContact O-CB 3.33Å; L48-M52 PolarHBondContact O-N 2.94Å; L48-V65 HydrophobicContact CD1-CB 4.39Å; L48-V65 HydrophobicContact CD1-CG2 4.07Å; L48-V65 HydrophobicContact CD2-CB 4.27Å; L48-M69 HydrophobicContact CD1-SD 4.48Å; L48-A216 HydrophobicContact CD2-CB 3.9Å; L48-A219 HydrophobicContact CD2-CB 3.84Å; L48-A219 HydrophobicContact CG-CB 4.49Å; L48-L239 HydrophobicContact CD1-CB 3.65Å; L48-A243 HydrophobicContact CB-CB 3.59Å
49A93.6Very high92.5Very high0 Ų015.3 Ų15.30%08%0.082CC..Hα-helixtrans-63.3-37.2177.800000112.5V45 A46 L47 T53 A246 V247V45-A49 WeakPolarHBondContact O-CB 3.3Å; V45-A49 PolarHBondContact O-N 3.49Å; A46-A49 PolarHBondContact O-N 3.23Å; L47-A49 VanDerWaalsContact C-N 3.31Å; L47-A49 PolarHBondContact O-N 3.16Å; A49-T53 VanDerWaalsContact O-CB 3.31Å; A49-T53 WeakPolarHBondContact O-CB 3.29Å; A49-T53 PolarHBondContact O-N 2.96Å; A49-T53 PolarHBondContact O-OG1 2.93Å; A49-A246 HydrophobicContact CB-CB 3.87Å; A49-V247 HydrophobicContact CB-CG2 4.4Å
50I96.2Very high92.3Very high0 Ų012.4 Ų12.40%07%0.068CC..Hα-helixtrans-60.1-46.3174.4-76159.7000110.9A46 L47 L48 T167 L168 F171 L261 V265A46-I50 WeakPolarHBondContact O-CB 3.29Å; A46-I50 WeakPolarHBondContact O-CD1 3.48Å; A46-I50 WeakPolarHBondContact O-CG1 3.41Å; A46-I50 PolarHBondContact O-N 2.92Å; L47-I50 WeakPolarHBondContact O-CB 3.18Å; L47-I50 PolarHBondContact O-N 3.24Å; L48-I50 PolarHBondContact O-N 2.97Å; I50-T167 HydrophobicContact CG2-CG2 4.33Å; I50-L168 HydrophobicContact CD1-CB 3.84Å; I50-L168 HydrophobicContact CD1-CD1 4.25Å; I50-L168 HydrophobicContact CG1-CD1 4.25Å; I50-F171 HydrophobicContact CG2-CB 3.98Å; I50-F171 HydrophobicContact CG2-CD1 3.33Å; I50-F171 HydrophobicContact CG2-CD2 4.45Å; I50-F171 HydrophobicContact CG2-CE1 3.85Å; I50-F171 HydrophobicContact CG2-CG 3.68Å; I50-L261 HydrophobicContact CG2-CD2 4.25Å; I50-V265 HydrophobicContact CD1-CG2 3.86Å; I50-V265 HydrophobicContact CG1-CG2 3.74Å
51G95.8Very high92.3Very high0 Ų012.8 Ų12.80%07%0.07CC..Hα-helixtrans-65.2-53.5175.400000112.7L47 L48 T53 L54 V55L47-G51 PolarHBondContact O-N 3.48Å; L48-G51 PolarHBondContact O-N 3.44Å; G51-T53 PolarHBondContact O-N 2.99Å; G51-L54 PolarHBondContact O-N 3.34Å; G51-V55 PolarHBondContact O-N 3.44Å
52M94.5Very high92.6Very high0 Ų05.7 Ų5.70%04%0.043CC..Hα-helixtrans-54.8-36.8177.9-174.9686900112.4L48 L54 V55 I56 I61 D62 V65 A243 I244 V247L48-M52 WeakPolarHBondContact O-CB 3.33Å; L48-M52 PolarHBondContact O-N 2.94Å; M52-L54 VanDerWaalsContact C-N 3.26Å; M52-L54 PolarHBondContact O-N 3.19Å; M52-V55 PolarHBondContact O-N 3.05Å; M52-I56 HydrophobicContact CG-CD1 3.62Å; M52-I56 HydrophobicContact CG-CG1 4.14Å; M52-I56 WeakPolarHBondContact O-CB 3.47Å; M52-I56 WeakPolarHBondContact O-CG1 3.49Å; M52-I56 PolarHBondContact O-N 3.47Å; M52-I56 HydrophobicContact SD-CD1 4.09Å; M52-I56 HydrophobicContact SD-CG1 4.22Å; M52-I61 HydrophobicContact SD-CG2 4.09Å; M52-D62 HydrophobicContact CE-CB 4.4Å; M52-D62 WeakPolarHBondContact CE-O 3.42Å; M52-D62 HydrophobicContact SD-CB 4.42Å; M52-D62 PolarHBondContact SD-N 3Å; M52-V65 HydrophobicContact CE-CG1 4.43Å; M52-V65 HydrophobicContact CE-CG2 3.93Å; M52-A243 HydrophobicContact CB-CB 4.33Å; M52-A243 HydrophobicContact CE-CB 4.35Å; M52-I244 HydrophobicContact CE-CD1 3.89Å; M52-I244 HydrophobicContact CE-CG1 3.54Å; M52-I244 HydrophobicContact CG-CG1 3.87Å; M52-I244 HydrophobicContact SD-CD1 4.21Å; M52-I244 HydrophobicContact SD-CG1 3.57Å; M52-I244 VanDerWaalsContact SD-CG1 3.57Å; M52-V247 HydrophobicContact CB-CG2 4.29Å; M52-V247 HydrophobicContact CG-CG2 4.2Å
53T94.5Very high92.6Very high0 Ų05.6 Ų5.60%04%0.042CC..Hα-helixtrans-54.7-41.8176.2-620000111.7A49 G51 A57 V247 F259 L261 S264A49-T53 VanDerWaalsContact O-CB 3.31Å; A49-T53 WeakPolarHBondContact O-CB 3.29Å; A49-T53 PolarHBondContact O-N 2.96Å; A49-T53 PolarHBondContact O-OG1 2.93Å; G51-T53 PolarHBondContact O-N 2.99Å; T53-A57 WeakPolarHBondContact O-CB 3.38Å; T53-A57 PolarHBondContact O-N 3.33Å; T53-V247 WeakPolarHBondContact OG1-CG2 3.31Å; T53-F259 HydrophobicContact CG2-CB 3.67Å; T53-F259 HydrophobicContact CG2-CD2 3.57Å; T53-F259 HydrophobicContact CG2-CG 3.99Å; T53-L261 HydrophobicContact CG2-CD2 3.74Å; T53-L261 HydrophobicContact CG2-CG 4.32Å; T53-S264 VanDerWaalsContact OG1-CB 3.23Å; T53-S264 WeakPolarHBondContact OG1-CB 3.26Å; T53-S264 PolarHBondContact OG1-OG 3.22Å
54L95Very high92.6Very high0 Ų05.5 Ų5.50%04%0.041CC..Hα-helixtrans-73.8-36.2-178.4-56.8-173.7000111.8G51 M52 A57 T58 F171 T175 I184 T208 L211 F259 L261G51-L54 PolarHBondContact O-N 3.34Å; M52-L54 VanDerWaalsContact C-N 3.26Å; M52-L54 PolarHBondContact O-N 3.19Å; L54-A57 PolarHBondContact O-N 3.13Å; L54-T58 PolarHBondContact O-N 2.91Å; L54-F171 HydrophobicContact CD1-CD1 3.77Å; L54-F171 HydrophobicContact CD1-CE1 3.87Å; L54-T175 HydrophobicContact CD2-CG2 3.84Å; L54-I184 HydrophobicContact CB-CD1 4.44Å; L54-I184 HydrophobicContact CD2-CD1 4.19Å; L54-T208 HydrophobicContact CB-CG2 3.87Å; L54-T208 WeakPolarHBondContact O-CG2 3.4Å; L54-L211 HydrophobicContact CD1-CB 4.13Å; L54-L211 HydrophobicContact CD1-CD1 3.71Å; L54-F259 HydrophobicContact CD2-CD2 4.46Å; L54-F259 HydrophobicContact CD2-CE2 3.88Å; L54-F259 HydrophobicContact CD2-CZ 4.07Å; L54-L261 HydrophobicContact CD2-CD2 4.17Å
55V95Very high92.7Very high0 Ų04.9 Ų4.90%04%0.037CC..Hα-helixtrans-66.6-50175.3177.30000110.4G51 M52 A57 T58 G59 G60 D62 Y209G51-V55 PolarHBondContact O-N 3.44Å; M52-V55 PolarHBondContact O-N 3.05Å; V55-A57 VanDerWaalsContact C-N 3.29Å; V55-A57 PolarHBondContact O-N 2.87Å; V55-T58 PolarHBondContact O-N 3.29Å; V55-T58 PolarHBondContact O-OG1 3.19Å; V55-G59 PolarHBondContact O-N 3.11Å; V55-G60 PolarHBondContact O-N 3.03Å; V55-G60 VanDerWaalsContact O-N 3.07Å; V55-D62 HydrophobicContact CB-CB 4.43Å; V55-D62 HydrophobicContact CG1-CB 4.09Å; V55-D62 HydrophobicContact CG2-CB 4.14Å; V55-Y209 HydrophobicContact CG1-CD1 4.19Å; V55-Y209 HydrophobicContact CG1-CE1 3.51Å; V55-Y209 HydrophobicContact CG1-CE2 4.35Å; V55-Y209 HydrophobicContact CG2-CD1 4.03Å; V55-Y209 HydrophobicContact CG2-CE1 4.19Å; V55-Y209 HydrophobicContact CG2-CG 4.36Å
56I91.9Very high92.7Very high2 Ų24.6 Ų4.61%0.014%0.036CC..Hα-helixtrans-57.2-41.7174.1-72.2176.2000111.1M52 T58 G59 G60 I61 I244 V247 S253 L254 G256M52-I56 HydrophobicContact CG-CD1 3.62Å; M52-I56 HydrophobicContact CG-CG1 4.14Å; M52-I56 WeakPolarHBondContact O-CB 3.47Å; M52-I56 WeakPolarHBondContact O-CG1 3.49Å; M52-I56 PolarHBondContact O-N 3.47Å; M52-I56 HydrophobicContact SD-CD1 4.09Å; M52-I56 HydrophobicContact SD-CG1 4.22Å; I56-T58 PolarHBondContact O-N 2.97Å; I56-T58 VanDerWaalsContact O-N 3.16Å; I56-G59 PolarHBondContact O-N 2.96Å; I56-G60 WeakPolarHBondContact CA-O 3.29Å; I56-G60 WeakPolarHBondContact CG1-O 3.41Å; I56-G60 PolarHBondContact N-O 3.33Å; I56-I61 HydrophobicContact CG1-CG1 4.42Å; I56-I244 HydrophobicContact CD1-CG1 4.46Å; I56-I244 HydrophobicContact CD1-CG2 4.48Å; I56-V247 HydrophobicContact CB-CG1 4.31Å; I56-V247 HydrophobicContact CD1-CB 3.93Å; I56-V247 HydrophobicContact CD1-CG1 3.75Å; I56-V247 HydrophobicContact CD1-CG2 4.34Å; I56-V247 HydrophobicContact CG2-CG1 4.05Å; I56-S253 WeakPolarHBondContact CG2-O 3.46Å; I56-L254 HydrophobicContact CD1-CD2 3.93Å; I56-L254 HydrophobicContact CG1-CD2 4.38Å; I56-L254 HydrophobicContact CG2-CD2 4.39Å; I56-G256 WeakPolarHBondContact O-CA 3.33Å
57A93Very high92.5Very high0 Ų04.4 Ų4.40%03%0.034CC..Hα-helixtrans-58.4-28.8175.700000113.9T53 L54 V55 G59 I184 G188 G257 F259T53-A57 WeakPolarHBondContact O-CB 3.38Å; T53-A57 PolarHBondContact O-N 3.33Å; L54-A57 PolarHBondContact O-N 3.13Å; V55-A57 VanDerWaalsContact C-N 3.29Å; V55-A57 PolarHBondContact O-N 2.87Å; A57-G59 VanDerWaalsContact C-N 3.35Å; A57-I184 HydrophobicContact CB-CG2 3.35Å; A57-G188 VanDerWaalsContact O-CA 3.3Å; A57-G188 WeakPolarHBondContact O-CA 3.46Å; A57-G257 PolarHBondContact O-N 2.89Å; A57-F259 HydrophobicContact CB-CB 3.86Å; A57-F259 HydrophobicContact CB-CD1 3.38Å; A57-F259 HydrophobicContact CB-CE1 4.07Å; A57-F259 HydrophobicContact CB-CG 3.81Å
58T92.5Very high92.5Very high19 Ų194.4 Ų4.412%0.1173%0.034CC..THydrogen-bonded Turntrans-85.82173.259.70000114.8L54 V55 I56 I184 V187 T208L54-T58 PolarHBondContact O-N 2.91Å; V55-T58 PolarHBondContact O-N 3.29Å; V55-T58 PolarHBondContact O-OG1 3.19Å; I56-T58 PolarHBondContact O-N 2.97Å; I56-T58 VanDerWaalsContact O-N 3.16Å; T58-I184 HydrophobicContact CG2-CG1 4.45Å; T58-I184 HydrophobicContact CG2-CG2 4.07Å; T58-V187 HydrophobicContact CG2-CG1 4.11Å; T58-T208 HydrophobicContact CG2-CG2 3.8Å
59G85.3Confident92.5Very high38 Ų384.5 Ų4.539%0.3923%0.034SC..THydrogen-bonded Turntrans81.122.7-17500000113.8V55 I56 A57V55-G59 PolarHBondContact O-N 3.11Å; I56-G59 PolarHBondContact O-N 2.96Å; A57-G59 VanDerWaalsContact C-N 3.35Å
60G87.8Confident92.4Very high3 Ų34.5 Ų4.53%0.0314%0.035CC..  trans-110.1178.9173.300000113.1V55 I56 P115V55-G60 PolarHBondContact O-N 3.03Å; V55-G60 VanDerWaalsContact O-N 3.07Å; I56-G60 WeakPolarHBondContact CA-O 3.29Å; I56-G60 WeakPolarHBondContact CG1-O 3.41Å; I56-G60 PolarHBondContact N-O 3.33Å; G60-P115 VanDerWaalsContact CA-CB 3.49Å
61I89.3Confident92.4Very high26 Ų265.4 Ų5.413%0.1334%0.039CC..  trans-144.1138169.4-58.7178.5000105.7M52 I56 L63 F116 I244 L254M52-I61 HydrophobicContact SD-CG2 4.09Å; I56-I61 HydrophobicContact CG1-CG1 4.42Å; I61-L63 HydrophobicContact CG2-CD2 3.98Å; I61-L63 HydrophobicContact CG2-CG 4.02Å; I61-F116 HydrophobicContact CB-CD2 3.84Å; I61-F116 HydrophobicContact CB-CE2 4.21Å; I61-F116 HydrophobicContact CD1-CD2 4.01Å; I61-F116 HydrophobicContact CD1-CE2 3.74Å; I61-F116 HydrophobicContact CG1-CD2 4.44Å; I61-F116 HydrophobicContact CG2-CD2 3.98Å; I61-F116 HydrophobicContact CG2-CE2 3.99Å; I61-I244 HydrophobicContact CG2-CD1 3.29Å; I61-I244 HydrophobicContact CG2-CG1 3.9Å; I61-L254 HydrophobicContact CD1-CD2 4.29Å
62D93Very high92.4Very high1 Ų15.4 Ų5.41%0.0054%0.039CC..  trans-116.686-178.7-176.21.6000112M52 V55 S64 V65 N104 T119 Y209 S212M52-D62 HydrophobicContact CE-CB 4.4Å; M52-D62 WeakPolarHBondContact CE-O 3.42Å; M52-D62 HydrophobicContact SD-CB 4.42Å; M52-D62 PolarHBondContact SD-N 3Å; V55-D62 HydrophobicContact CB-CB 4.43Å; V55-D62 HydrophobicContact CG1-CB 4.09Å; V55-D62 HydrophobicContact CG2-CB 4.14Å; D62-S64 PolarHBondContact O-N 3.46Å; D62-S64 WeakPolarHBondContact OD1-CB 3.29Å; D62-S64 PolarHBondContact OD1-N 2.95Å; D62-S64 PolarHBondContact OD1-OG 3.01Å; D62-V65 HydrophobicContact CB-CG1 4.3Å; D62-V65 WeakPolarHBondContact O-CG1 3.43Å; D62-V65 WeakPolarHBondContact O-CG2 3.27Å; D62-N104 PolarHBondContact OD1-ND2 3Å; D62-N104 VanDerWaalsContact OD1-ND2 3.12Å; D62-T119 HydrophobicContact CB-CG2 4.16Å; D62-T119 WeakPolarHBondContact OD1-CG2 3.31Å; D62-Y209 HydrophobicContact CB-CD1 3.93Å; D62-Y209 HydrophobicContact CB-CE1 3.85Å; D62-S212 VanDerWaalsContact OD2-CB 3.29Å; D62-S212 WeakPolarHBondContact OD2-CB 3.33Å; D62-S212 PolarHBondContact OD2-OG 3.45Å
63L88.3Confident92.4Very high0 Ų05.5 Ų5.50%04%0.04CC..THydrogen-bonded Turntrans-76.8-9.8-177.1-60.7158.8000113I61 V65 F116 T119 E240 L241 I244 Q289 E290I61-L63 HydrophobicContact CG2-CD2 3.98Å; I61-L63 HydrophobicContact CG2-CG 4.02Å; L63-V65 PolarHBondContact O-N 3.36Å; L63-F116 HydrophobicContact CD1-CD1 4.35Å; L63-F116 HydrophobicContact CD1-CD2 3.2Å; L63-F116 HydrophobicContact CD1-CE2 3.42Å; L63-F116 VanDerWaalsContact CD1-CE2 3.42Å; L63-F116 HydrophobicContact CD1-CG 3.74Å; L63-F116 HydrophobicContact CD1-CZ 4.12Å; L63-F116 HydrophobicContact CD2-CD2 4.45Å; L63-F116 HydrophobicContact CD2-CE2 4.03Å; L63-F116 HydrophobicContact CG-CD2 3.97Å; L63-F116 HydrophobicContact CG-CE2 4.04Å; L63-T119 PolarHBondContact N-OG1 3.18Å; L63-E240 WeakPolarHBondContact O-CB 3.2Å; L63-L241 HydrophobicContact CD2-CD2 3.66Å; L63-I244 HydrophobicContact CD2-CD1 3.42Å; L63-I244 VanDerWaalsContact CD2-CD1 3.42Å; L63-I244 HydrophobicContact CG-CD1 4.49Å; L63-Q289 WeakPolarHBondContact CB-O 3.34Å; L63-Q289 WeakPolarHBondContact CD2-O 3.49Å; L63-E290 HydrophobicContact CD1-CB 4.12Å; L63-E290 WeakPolarHBondContact CD1-O 3.39Å
64S92.8Very high92.4Very high1 Ų15.6 Ų5.61%0.0074%0.041CC..THydrogen-bonded Turntrans-71.8-15.7178.977.50000112.4D62 G66 A67 V68 N104D62-S64 PolarHBondContact O-N 3.46Å; D62-S64 WeakPolarHBondContact OD1-CB 3.29Å; D62-S64 PolarHBondContact OD1-N 2.95Å; D62-S64 PolarHBondContact OD1-OG 3.01Å; S64-G66 VanDerWaalsContact C-N 3.26Å; S64-G66 PolarHBondContact O-N 2.94Å; S64-G66 VanDerWaalsContact O-N 3.09Å; S64-A67 CarbonylContact O-C 3.54Å; S64-A67 WeakPolarHBondContact O-CA 3.22Å; S64-A67 WeakPolarHBondContact O-CB 3.15Å; S64-A67 PolarHBondContact O-N 3.28Å; S64-V68 WeakPolarHBondContact O-CG2 3.28Å; S64-V68 PolarHBondContact O-N 3.36Å; S64-N104 PolarHBondContact OG-ND2 3.4Å
65V92.9Very high92.4Very high1 Ų16.3 Ų6.31%0.0065%0.045CC..Hα-helixtrans-51.7-39.4-171.2-68.30000113.9L48 M52 D62 L63 V68 M69 S212 A216 E240L48-V65 HydrophobicContact CD1-CB 4.39Å; L48-V65 HydrophobicContact CD1-CG2 4.07Å; L48-V65 HydrophobicContact CD2-CB 4.27Å; M52-V65 HydrophobicContact CE-CG1 4.43Å; M52-V65 HydrophobicContact CE-CG2 3.93Å; D62-V65 HydrophobicContact CB-CG1 4.3Å; D62-V65 WeakPolarHBondContact O-CG1 3.43Å; D62-V65 WeakPolarHBondContact O-CG2 3.27Å; L63-V65 PolarHBondContact O-N 3.36Å; V65-V68 PolarHBondContact O-N 3.16Å; V65-M69 VanDerWaalsContact O-CB 3.29Å; V65-M69 WeakPolarHBondContact O-CB 3.34Å; V65-M69 PolarHBondContact O-N 3.13Å; V65-S212 VanDerWaalsContact CG1-OG 3.26Å; V65-S212 WeakPolarHBondContact CG1-OG 3.39Å; V65-A216 HydrophobicContact CB-CB 4.15Å; V65-A216 HydrophobicContact CG1-CB 4.37Å; V65-A216 WeakPolarHBondContact O-CB 3.43Å; V65-E240 HydrophobicContact CG2-CB 3.74Å
66G90.2Very high92.5Very high0 Ų06.3 Ų6.30%05%0.045CC..Hα-helixtrans-66.7-41.7174.900000113.6S64 M69 A70 G236 E240S64-G66 VanDerWaalsContact C-N 3.26Å; S64-G66 PolarHBondContact O-N 2.94Å; S64-G66 VanDerWaalsContact O-N 3.09Å; G66-M69 WeakPolarHBondContact O-CB 3.33Å; G66-M69 PolarHBondContact O-N 3.34Å; G66-A70 PolarHBondContact O-N 3.42Å; G66-G236 CarbonylContact C-O 3.6Å; G66-G236 WeakPolarHBondContact CA-O 3.4Å; G66-E240 WeakPolarHBondContact CA-OE2 3.5Å
67A90.4Very high92.6Very high0 Ų06.2 Ų6.20%05%0.045CC..Hα-helixtrans-67.9-35.2173.500000112.7S64 A70 I71 M123 R127S64-A67 CarbonylContact O-C 3.54Å; S64-A67 WeakPolarHBondContact O-CA 3.22Å; S64-A67 WeakPolarHBondContact O-CB 3.15Å; S64-A67 PolarHBondContact O-N 3.28Å; A67-A70 WeakPolarHBondContact O-CB 3.38Å; A67-A70 PolarHBondContact O-N 3.36Å; A67-I71 VanDerWaalsContact O-CG1 3.31Å; A67-I71 WeakPolarHBondContact O-CG1 3.45Å; A67-I71 PolarHBondContact O-N 2.98Å; A67-M123 HydrophobicContact CB-CG 4.39Å; A67-R127 HydrophobicContact CB-CG 3.77Å
68V95.8Very high92.6Very high1 Ų17.6 Ų7.61%0.0066%0.056CC..Hα-helixtrans-69.3-38174.6177.70000110.7S64 V65 A70 I71 A72 A100 L122 A216S64-V68 WeakPolarHBondContact O-CG2 3.28Å; S64-V68 PolarHBondContact O-N 3.36Å; V65-V68 PolarHBondContact O-N 3.16Å; V68-A70 VanDerWaalsContact C-N 3.32Å; V68-I71 PolarHBondContact O-N 3.27Å; V68-A72 WeakPolarHBondContact O-CB 3.47Å; V68-A72 PolarHBondContact O-N 3.03Å; V68-A100 HydrophobicContact CB-CB 4.36Å; V68-A100 HydrophobicContact CG1-CB 3.85Å; V68-A100 HydrophobicContact CG2-CB 3.52Å; V68-L122 HydrophobicContact CG2-CD2 4.2Å; V68-A216 HydrophobicContact CB-CB 3.93Å; V68-A216 HydrophobicContact CG1-CB 3.77Å
69M94.5Very high92.7Very high2 Ų28.3 Ų8.31%0.016%0.059CC..Hα-helixtrans-60.1-43.2170.7-158.3-170.4101.600111L48 V65 G66 A72 G73 A216 A219 G220 V223 L239L48-M69 HydrophobicContact CD1-SD 4.48Å; V65-M69 VanDerWaalsContact O-CB 3.29Å; V65-M69 WeakPolarHBondContact O-CB 3.34Å; V65-M69 PolarHBondContact O-N 3.13Å; G66-M69 WeakPolarHBondContact O-CB 3.33Å; G66-M69 PolarHBondContact O-N 3.34Å; M69-A72 PolarHBondContact O-N 2.68Å; M69-G73 PolarHBondContact O-N 3.31Å; M69-A216 WeakPolarHBondContact CG-O 3.44Å; M69-A219 HydrophobicContact CG-CB 3.94Å; M69-A219 HydrophobicContact SD-CB 3.82Å; M69-G220 VanDerWaalsContact CG-N 3.25Å; M69-G220 WeakPolarHBondContact O-CA 3.5Å; M69-V223 HydrophobicContact CE-CB 3.86Å; M69-V223 HydrophobicContact CE-CG1 3.97Å; M69-V223 HydrophobicContact CE-CG2 3.66Å; M69-V223 HydrophobicContact SD-CG2 4.47Å; M69-L239 HydrophobicContact CE-CD1 4.13Å; M69-L239 HydrophobicContact SD-CD1 4.01Å
70A92.6Very high93.2Very high1 Ų17.7 Ų7.71%0.0085%0.048CC..Hα-helixtrans-63.4-44.4174.500000112.8G66 A67 V68 G73 A74 A130 A235G66-A70 PolarHBondContact O-N 3.42Å; A67-A70 WeakPolarHBondContact O-CB 3.38Å; A67-A70 PolarHBondContact O-N 3.36Å; V68-A70 VanDerWaalsContact C-N 3.32Å; A70-G73 PolarHBondContact O-N 3.34Å; A70-A74 WeakPolarHBondContact O-CB 3.47Å; A70-A74 PolarHBondContact O-N 3.06Å; A70-A130 HydrophobicContact CB-CB 3.77Å; A70-A235 WeakPolarHBondContact CB-O 3.25Å
71I94.7Very high93.4Very high18 Ų1811.9 Ų11.99%0.0927%0.072CC..Hα-helixtrans-60.7-49.5175.6-66.9163.6000110.2A67 V68 G73 A74 T75 T96 G126 V129 A130 I133A67-I71 VanDerWaalsContact O-CG1 3.31Å; A67-I71 WeakPolarHBondContact O-CG1 3.45Å; A67-I71 PolarHBondContact O-N 2.98Å; V68-I71 PolarHBondContact O-N 3.27Å; I71-G73 PolarHBondContact O-N 3.36Å; I71-A74 PolarHBondContact O-N 3.3Å; I71-T75 WeakPolarHBondContact O-CB 3.49Å; I71-T75 PolarHBondContact O-N 3.33Å; I71-T75 PolarHBondContact O-OG1 3.47Å; I71-T96 HydrophobicContact CG2-CG2 4.09Å; I71-G126 WeakPolarHBondContact CG1-O 3.37Å; I71-V129 HydrophobicContact CD1-CG1 4.47Å; I71-V129 HydrophobicContact CG1-CB 4.46Å; I71-V129 HydrophobicContact CG1-CG1 4.28Å; I71-A130 HydrophobicContact CG1-CB 4.12Å; I71-I133 HydrophobicContact CG2-CD1 4.3Å
72A96.2Very high93.6Very high0 Ų014 Ų140%09%0.093CC..Hα-helixtrans-64.2-40.3-178.100000112.2V68 M69 T76 A217V68-A72 WeakPolarHBondContact O-CB 3.47Å; V68-A72 PolarHBondContact O-N 3.03Å; M69-A72 PolarHBondContact O-N 2.68Å; A72-T76 VanDerWaalsContact O-CB 3.28Å; A72-T76 WeakPolarHBondContact O-CB 3.35Å; A72-T76 PolarHBondContact O-N 3.41Å; A72-T76 PolarHBondContact O-OG1 2.78Å; A72-A217 HydrophobicContact CB-CB 3.73Å
73G94.5Very high93.6Very high3 Ų317 Ų173%0.03113%0.125CC..Hα-helixtrans-63.7-47.6172.900000112.3M69 A70 I71 T75 T76 A77 A230M69-G73 PolarHBondContact O-N 3.31Å; A70-G73 PolarHBondContact O-N 3.34Å; I71-G73 PolarHBondContact O-N 3.36Å; G73-T75 PolarHBondContact O-N 2.99Å; G73-T76 WeakPolarHBondContact O-CB 3.46Å; G73-T76 PolarHBondContact O-N 3.32Å; G73-A77 PolarHBondContact O-N 3.05Å; G73-A230 WeakPolarHBondContact O-CB 3.18Å
74A94.1Very high93.9Very high1 Ų122 Ų221%0.00815%0.147CC..Hα-helixtrans-59.4-45.5176.400000112.2A70 I71 A77 A78 A130 I133 T134A70-A74 WeakPolarHBondContact O-CB 3.47Å; A70-A74 PolarHBondContact O-N 3.06Å; I71-A74 PolarHBondContact O-N 3.3Å; A74-A77 PolarHBondContact O-N 3.34Å; A74-A78 WeakPolarHBondContact O-CB 3.21Å; A74-A78 PolarHBondContact O-N 3.48Å; A74-A130 HydrophobicContact CB-CB 4.31Å; A74-I133 HydrophobicContact CB-CB 3.95Å; A74-I133 HydrophobicContact CB-CD1 4.5Å; A74-I133 HydrophobicContact CB-CG2 3.76Å; A74-I133 WeakPolarHBondContact O-CG2 3.25Å; A74-T134 HydrophobicContact CB-CG2 3.64Å
75T95.9Very high94Very high16 Ų1625 Ų2510%0.09817%0.168CC..Hα-helixtrans-61.2-43.4173.7-62.70000111.6I71 G73 M79 T96I71-T75 WeakPolarHBondContact O-CB 3.49Å; I71-T75 PolarHBondContact O-N 3.33Å; I71-T75 PolarHBondContact O-OG1 3.47Å; G73-T75 PolarHBondContact O-N 2.99Å; T75-M79 HydrophobicContact CG2-CG 4.3Å; T75-M79 HydrophobicContact CG2-SD 3.96Å; T75-M79 VanDerWaalsContact O-CB 3.31Å; T75-M79 WeakPolarHBondContact O-CB 3.26Å; T75-M79 WeakPolarHBondContact O-CG 3.37Å; T75-M79 PolarHBondContact O-N 3.1Å; T75-T96 HydrophobicContact CG2-CG2 4.19Å
76T96Very high94Very high0 Ų027.1 Ų27.10%018%0.179CC..Hα-helixtrans-57.8-51.6177.8-640000111.3A72 G73 T80 V89 A93 L146 A224A72-T76 VanDerWaalsContact O-CB 3.28Å; A72-T76 WeakPolarHBondContact O-CB 3.35Å; A72-T76 PolarHBondContact O-N 3.41Å; A72-T76 PolarHBondContact O-OG1 2.78Å; G73-T76 WeakPolarHBondContact O-CB 3.46Å; G73-T76 PolarHBondContact O-N 3.32Å; T76-T80 WeakPolarHBondContact O-CB 3.22Å; T76-T80 PolarHBondContact O-N 2.84Å; T76-T80 VanDerWaalsContact O-N 3.17Å; T76-T80 PolarHBondContact O-OG1 2.99Å; T76-V89 HydrophobicContact CG2-CG1 4.01Å; T76-V89 WeakPolarHBondContact O-CG1 3.3Å; T76-A93 VanDerWaalsContact OG1-CB 3.24Å; T76-A93 WeakPolarHBondContact OG1-CB 3.29Å; T76-L146 HydrophobicContact CG2-CD1 3.93Å; T76-L146 HydrophobicContact CG2-CD2 3.69Å; T76-L146 HydrophobicContact CG2-CG 4.36Å; T76-A224 HydrophobicContact CG2-CB 4.35Å
77A94.2Very high94.3Very high0 Ų031 Ų310%020%0.204CC..Hα-helixtrans-66.9-50.6179.600000112.3G73 A74 M79 T80 V81 V139 F141 A230G73-A77 PolarHBondContact O-N 3.05Å; A74-A77 PolarHBondContact O-N 3.34Å; A77-M79 PolarHBondContact O-N 3.02Å; A77-T80 PolarHBondContact O-N 3.11Å; A77-T80 VanDerWaalsContact O-N 3.16Å; A77-V81 WeakPolarHBondContact O-CG2 3.3Å; A77-V81 PolarHBondContact O-N 3.35Å; A77-V139 HydrophobicContact CB-CB 4.24Å; A77-V139 HydrophobicContact CB-CG1 3.96Å; A77-V139 WeakPolarHBondContact CB-O 3.23Å; A77-F141 HydrophobicContact CB-CD1 3.71Å; A77-F141 HydrophobicContact CB-CE1 3.93Å; A77-A230 HydrophobicContact CB-CB 3.52Å
78A93.9Very high94.6Very high29 Ų2934.7 Ų34.724%0.2422%0.223CC..Hα-helixtrans-61.5-40.5-177.800000112.7A74 V81 A82 I133A74-A78 WeakPolarHBondContact O-CB 3.21Å; A74-A78 PolarHBondContact O-N 3.48Å; A78-V81 PolarHBondContact O-N 3.33Å; A78-A82 WeakPolarHBondContact O-CB 3.38Å; A78-A82 PolarHBondContact O-N 3.27Å; A78-I133 HydrophobicContact CB-CG2 3.71Å
79M95.2Very high94.6Very high33 Ų3334.7 Ų34.716%0.16322%0.223CC..Hα-helixtrans-72-30.1176.7-69.7-166.468.900113.1T75 A77 A82 G83 F84 I88 V89 S92T75-M79 HydrophobicContact CG2-CG 4.3Å; T75-M79 HydrophobicContact CG2-SD 3.96Å; T75-M79 VanDerWaalsContact O-CB 3.31Å; T75-M79 WeakPolarHBondContact O-CB 3.26Å; T75-M79 WeakPolarHBondContact O-CG 3.37Å; T75-M79 PolarHBondContact O-N 3.1Å; A77-M79 PolarHBondContact O-N 3.02Å; M79-A82 PolarHBondContact O-N 3.46Å; M79-G83 PolarHBondContact O-N 2.99Å; M79-F84 HydrophobicContact CB-CB 4.4Å; M79-F84 HydrophobicContact CB-CD2 4.03Å; M79-F84 HydrophobicContact CE-CB 4.05Å; M79-F84 HydrophobicContact CE-CD1 3.98Å; M79-F84 HydrophobicContact CE-CD2 3.6Å; M79-F84 HydrophobicContact CE-CE1 4.33Å; M79-F84 HydrophobicContact CE-CE2 3.98Å; M79-F84 HydrophobicContact CE-CG 3.59Å; M79-F84 HydrophobicContact CE-CZ 4.33Å; M79-F84 HydrophobicContact CG-CD2 4.28Å; M79-F84 WeakPolarHBondContact O-CB 3.42Å; M79-F84 WeakPolarHBondContact O-CD2 3.14Å; M79-F84 PolarHBondContact O-N 3.26Å; M79-I88 HydrophobicContact CE-CG2 3.8Å; M79-V89 HydrophobicContact CB-CG1 4.47Å; M79-V89 HydrophobicContact CB-CG2 3.99Å; M79-S92 WeakPolarHBondContact SD-CB 3.07Å; M79-S92 PolarHBondContact SD-OG 3.42Å
80T94.5Very high94.7Very high26 Ų2636.2 Ų36.216%0.1623%0.231CC..Hα-helixtrans-70.9-41.8174.4-580000110.9T76 A77 A82 G83 F141 L146T76-T80 WeakPolarHBondContact O-CB 3.22Å; T76-T80 PolarHBondContact O-N 2.84Å; T76-T80 VanDerWaalsContact O-N 3.17Å; T76-T80 PolarHBondContact O-OG1 2.99Å; A77-T80 PolarHBondContact O-N 3.11Å; A77-T80 VanDerWaalsContact O-N 3.16Å; T80-A82 VanDerWaalsContact C-N 3.31Å; T80-A82 PolarHBondContact O-N 2.89Å; T80-G83 PolarHBondContact O-N 2.86Å; T80-F141 HydrophobicContact CG2-CB 3.83Å; T80-F141 HydrophobicContact CG2-CD2 4.02Å; T80-F141 HydrophobicContact CG2-CG 4Å; T80-L146 HydrophobicContact CG2-CD2 4.17Å; T80-L146 VanDerWaalsContact OG1-CD2 3.29Å; T80-L146 WeakPolarHBondContact OG1-CD2 3.38Å
81V93.1Very high94.9Very high91 Ų9142.2 Ų42.255%0.55226%0.262SS*.Hα-helixtrans-64.9-34.3173.2173.80000111.8A77 A78 G83 V139 T140 F141A77-V81 WeakPolarHBondContact O-CG2 3.3Å; A77-V81 PolarHBondContact O-N 3.35Å; A78-V81 PolarHBondContact O-N 3.33Å; V81-G83 PolarHBondContact O-N 2.95Å; V81-V139 HydrophobicContact CB-CG1 4.41Å; V81-V139 HydrophobicContact CG2-CG1 3.73Å; V81-T140 VanDerWaalsContact CG2-O 3.22Å; V81-T140 WeakPolarHBondContact CG2-O 3.47Å; V81-F141 HydrophobicContact CG2-CB 4Å
82A93.4Very high95Very high69 Ų6943.3 Ų43.357%0.5727%0.272SS*.THydrogen-bonded Turntrans-74.31.8172.300000114.4A78 M79 T80 F84A78-A82 WeakPolarHBondContact O-CB 3.38Å; A78-A82 PolarHBondContact O-N 3.27Å; M79-A82 PolarHBondContact O-N 3.46Å; T80-A82 VanDerWaalsContact C-N 3.31Å; T80-A82 PolarHBondContact O-N 2.89Å; A82-F84 HydrophobicContact CB-CD2 3.92Å; A82-F84 HydrophobicContact CB-CE2 3.92Å
83G92.4Very high95Very high66 Ų6643.3 Ų43.368%0.6827%0.272SS*.THydrogen-bonded Turntrans78.916.8173.200000115.8M79 T80 V81M79-G83 PolarHBondContact O-N 2.99Å; T80-G83 PolarHBondContact O-N 2.86Å; V81-G83 PolarHBondContact O-N 2.95Å
84F95.1Very high95.1Very high104 Ų10445.3 Ų45.346%0.45628%0.281SS..  trans-70147173.3-70.9-82.6000111.5M79 A82 I88 V89M79-F84 HydrophobicContact CB-CB 4.4Å; M79-F84 HydrophobicContact CB-CD2 4.03Å; M79-F84 HydrophobicContact CE-CB 4.05Å; M79-F84 HydrophobicContact CE-CD1 3.98Å; M79-F84 HydrophobicContact CE-CD2 3.6Å; M79-F84 HydrophobicContact CE-CE1 4.33Å; M79-F84 HydrophobicContact CE-CE2 3.98Å; M79-F84 HydrophobicContact CE-CG 3.59Å; M79-F84 HydrophobicContact CE-CZ 4.33Å; M79-F84 HydrophobicContact CG-CD2 4.28Å; M79-F84 WeakPolarHBondContact O-CB 3.42Å; M79-F84 WeakPolarHBondContact O-CD2 3.14Å; M79-F84 PolarHBondContact O-N 3.26Å; A82-F84 HydrophobicContact CB-CD2 3.92Å; A82-F84 HydrophobicContact CB-CE2 3.92Å; F84-I88 HydrophobicContact CB-CB 4.49Å; F84-I88 HydrophobicContact CB-CG2 4.38Å; F84-I88 HydrophobicContact CD1-CG2 4.03Å; F84-I88 HydrophobicContact CG-CG2 4.46Å; F84-V89 HydrophobicContact CB-CG2 3.98Å
85S95Very high95.3Very high65 Ų6546.3 Ų46.346%0.45529%0.292SS..  trans-69.8147.9178.3630000112P87 I88 V89S85-P87 VanDerWaalsContact C-CD 3.44Å; S85-P87 VanDerWaalsContact C-N 3.34Å; S85-P87 VanDerWaalsContact O-N 3.14Å; S85-I88 WeakPolarHBondContact O-CA 3.46Å; S85-I88 WeakPolarHBondContact O-CB 3.46Å; S85-I88 PolarHBondContact O-N 3.2Å; S85-I88 WeakPolarHBondContact OG-CD1 3.48Å; S85-V89 PolarHBondContact O-N 2.85Å
86L93.2Very high95.3Very high45 Ų4547.1 Ų47.124%0.23630%0.297CS..Hα-helixtrans-47-44.3-175.8178.371.7000114.4I88 V89 L90 D145 L146 F149L86-I88 VanDerWaalsContact C-N 3.29Å; L86-I88 PolarHBondContact O-N 2.93Å; L86-V89 PolarHBondContact O-N 3.29Å; L86-L90 HydrophobicContact CD1-CD1 3.92Å; L86-L90 HydrophobicContact CD1-CD2 4.4Å; L86-L90 HydrophobicContact CD1-CG 3.93Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.23Å; L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 VanDerWaalsContact O-CG 3.32Å; L86-L90 WeakPolarHBondContact O-CG 3.47Å; L86-L90 PolarHBondContact O-N 3.35Å; L86-D145 HydrophobicContact CD2-CB 3.83Å; L86-L146 HydrophobicContact CD1-CB 3.99Å; L86-L146 HydrophobicContact CD1-CD1 4Å; L86-F149 HydrophobicContact CD1-CE2 4.45Å; L86-F149 HydrophobicContact CD2-CE2 4.24Å
87P95.5Very high95.4Very high81 Ų8147.1 Ų47.153%0.52630%0.297SS..Hα-helixtrans-62.1-35.5177.9-23.135.3000113.2S85 L91S85-P87 VanDerWaalsContact C-CD 3.44Å; S85-P87 VanDerWaalsContact C-N 3.34Å; S85-P87 VanDerWaalsContact O-N 3.14Å; P87-L91 VanDerWaalsContact O-CB 3.26Å; P87-L91 WeakPolarHBondContact O-CB 3.36Å; P87-L91 WeakPolarHBondContact O-CD1 3.45Å; P87-L91 WeakPolarHBondContact O-CG 3.41Å; P87-L91 PolarHBondContact O-N 3.21Å
88I96.3Very high95.5Very high77 Ų7750.4 Ų50.440%0.39531%0.314SS..Hα-helixtrans-71.6-43.6177.3-58.7176.2000110M79 F84 S85 L86 L90 L91 S92M79-I88 HydrophobicContact CE-CG2 3.8Å; F84-I88 HydrophobicContact CB-CB 4.49Å; F84-I88 HydrophobicContact CB-CG2 4.38Å; F84-I88 HydrophobicContact CD1-CG2 4.03Å; F84-I88 HydrophobicContact CG-CG2 4.46Å; S85-I88 WeakPolarHBondContact O-CA 3.46Å; S85-I88 WeakPolarHBondContact O-CB 3.46Å; S85-I88 PolarHBondContact O-N 3.2Å; S85-I88 WeakPolarHBondContact OG-CD1 3.48Å; L86-I88 VanDerWaalsContact C-N 3.29Å; L86-I88 PolarHBondContact O-N 2.93Å; I88-L90 PolarHBondContact O-N 3.03Å; I88-L91 PolarHBondContact O-N 3.5Å; I88-S92 WeakPolarHBondContact O-CB 3.27Å; I88-S92 PolarHBondContact O-N 3.42Å; I88-S92 PolarHBondContact O-OG 3.13Å
89V96Very high95.7Very high1 Ų154.6 Ų54.61%0.00633%0.331CS..Hα-helixtrans-57.2-50.4175.6178.50000110.8T76 M79 F84 S85 L86 S92 A93T76-V89 HydrophobicContact CG2-CG1 4.01Å; T76-V89 WeakPolarHBondContact O-CG1 3.3Å; M79-V89 HydrophobicContact CB-CG1 4.47Å; M79-V89 HydrophobicContact CB-CG2 3.99Å; F84-V89 HydrophobicContact CB-CG2 3.98Å; S85-V89 PolarHBondContact O-N 2.85Å; L86-V89 PolarHBondContact O-N 3.29Å; V89-S92 PolarHBondContact O-N 3.34Å; V89-A93 WeakPolarHBondContact O-CB 3.45Å; V89-A93 PolarHBondContact O-N 2.97Å
90L96.1Very high95.7Very high34 Ų3453.4 Ų53.418%0.17833%0.327CS..Hα-helixtrans-64.7-45.7-180-67.5174.3000112.1L86 I88 S92 A93 L94 L146 F149 I221L86-L90 HydrophobicContact CD1-CD1 3.92Å; L86-L90 HydrophobicContact CD1-CD2 4.4Å; L86-L90 HydrophobicContact CD1-CG 3.93Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.23Å; L86-L90 WeakPolarHBondContact O-CB 3.45Å; L86-L90 VanDerWaalsContact O-CG 3.32Å; L86-L90 WeakPolarHBondContact O-CG 3.47Å; L86-L90 PolarHBondContact O-N 3.35Å; I88-L90 PolarHBondContact O-N 3.03Å; L90-S92 PolarHBondContact O-N 3.37Å; L90-A93 PolarHBondContact O-N 3.08Å; L90-L94 WeakPolarHBondContact O-CB 3.5Å; L90-L94 VanDerWaalsContact O-CG 3.25Å; L90-L94 WeakPolarHBondContact O-CG 3.32Å; L90-L94 PolarHBondContact O-N 3.18Å; L90-L146 HydrophobicContact CD2-CD1 4.49Å; L90-F149 HydrophobicContact CD1-CE2 4.37Å; L90-F149 HydrophobicContact CD1-CZ 4Å; L90-I221 HydrophobicContact CD2-CD1 4.07Å; L90-I221 HydrophobicContact CD2-CG1 4.41Å; L90-I221 HydrophobicContact CD2-CG2 3.62Å
91L97.2Very high95.8Very high127 Ų12752.2 Ų52.267%0.66532%0.32SS*.Hα-helixtrans-64.1-38.4178.4-74.5170.5000112.4P87 I88 G95P87-L91 VanDerWaalsContact O-CB 3.26Å; P87-L91 WeakPolarHBondContact O-CB 3.36Å; P87-L91 WeakPolarHBondContact O-CD1 3.45Å; P87-L91 WeakPolarHBondContact O-CG 3.41Å; P87-L91 PolarHBondContact O-N 3.21Å; I88-L91 PolarHBondContact O-N 3.5Å; L91-G95 WeakPolarHBondContact O-CA 3.39Å; L91-G95 PolarHBondContact O-N 3.19Å
92S96.9Very high96Very high41 Ų4151.1 Ų51.129%0.28731%0.311SS..Hα-helixtrans-65.5-47.3173.5-71.70000112.2M79 I88 V89 L90 G95 T96M79-S92 WeakPolarHBondContact SD-CB 3.07Å; M79-S92 PolarHBondContact SD-OG 3.42Å; I88-S92 WeakPolarHBondContact O-CB 3.27Å; I88-S92 PolarHBondContact O-N 3.42Å; I88-S92 PolarHBondContact O-OG 3.13Å; V89-S92 PolarHBondContact O-N 3.34Å; L90-S92 PolarHBondContact O-N 3.37Å; S92-G95 CarbonylContact O-C 3.59Å; S92-G95 WeakPolarHBondContact O-CA 3.39Å; S92-G95 PolarHBondContact O-N 2.89Å; S92-G95 VanDerWaalsContact O-N 3.14Å; S92-T96 WeakPolarHBondContact O-CG2 3.48Å; S92-T96 PolarHBondContact O-N 3.3Å
93A96.3Very high96.1Very high0 Ų052.9 Ų52.90%030%0.303CS..Hα-helixtrans-61.3-48.8179.800000111.7T76 V89 L90 G95 T96 G97 A217 I221T76-A93 VanDerWaalsContact OG1-CB 3.24Å; T76-A93 WeakPolarHBondContact OG1-CB 3.29Å; V89-A93 WeakPolarHBondContact O-CB 3.45Å; V89-A93 PolarHBondContact O-N 2.97Å; L90-A93 PolarHBondContact O-N 3.08Å; A93-G95 VanDerWaalsContact C-N 3.27Å; A93-G95 PolarHBondContact O-N 3.16Å; A93-T96 PolarHBondContact O-N 2.76Å; A93-T96 PolarHBondContact O-OG1 3.36Å; A93-G97 PolarHBondContact O-N 3.07Å; A93-A217 WeakPolarHBondContact O-CB 3.49Å; A93-I221 HydrophobicContact CB-CD1 3.83Å; A93-I221 HydrophobicContact CB-CG1 3.74Å
94L97.5Very high96.3Very high45 Ų4549.7 Ų49.724%0.23627%0.27CS..Hα-helixtrans-61.3-37.1173.1-63.5173000111.7L90 G97 I98 L214 A217 I218 I221L90-L94 WeakPolarHBondContact O-CB 3.5Å; L90-L94 VanDerWaalsContact O-CG 3.25Å; L90-L94 WeakPolarHBondContact O-CG 3.32Å; L90-L94 PolarHBondContact O-N 3.18Å; L94-G97 PolarHBondContact O-N 2.74Å; L94-I98 WeakPolarHBondContact O-CG1 3.17Å; L94-I98 PolarHBondContact O-N 3.45Å; L94-L214 HydrophobicContact CB-CD1 4.39Å; L94-L214 HydrophobicContact CD2-CD1 3.9Å; L94-A217 HydrophobicContact CD2-CB 4.2Å; L94-I218 HydrophobicContact CD2-CG1 3.6Å; L94-I221 HydrophobicContact CD2-CD1 3.71Å; L94-I221 HydrophobicContact CG-CD1 3.87Å
95G97.5Very high96.2Very high22 Ų2244.8 Ų44.823%0.22725%0.248CC..Hα-helixtrans-59.8-43.3173.900000113.2L91 S92 A93 G97 I98 L99L91-G95 WeakPolarHBondContact O-CA 3.39Å; L91-G95 PolarHBondContact O-N 3.19Å; S92-G95 CarbonylContact O-C 3.59Å; S92-G95 WeakPolarHBondContact O-CA 3.39Å; S92-G95 PolarHBondContact O-N 2.89Å; S92-G95 VanDerWaalsContact O-N 3.14Å; A93-G95 VanDerWaalsContact C-N 3.27Å; A93-G95 PolarHBondContact O-N 3.16Å; G95-G97 VanDerWaalsContact C-N 3.32Å; G95-G97 PolarHBondContact O-N 2.91Å; G95-I98 PolarHBondContact O-N 2.85Å; G95-L99 WeakPolarHBondContact O-CB 3.12Å; G95-L99 VanDerWaalsContact O-CG 3.28Å; G95-L99 WeakPolarHBondContact O-CG 3.27Å; G95-L99 PolarHBondContact O-N 3.44Å
96T96.4Very high96.2Very high33 Ų3344.8 Ų44.820%0.20224%0.243CC..Hα-helixtrans-61.8-40.2175.164.90000111.9I71 T75 S92 A93 L99 A100I71-T96 HydrophobicContact CG2-CG2 4.09Å; T75-T96 HydrophobicContact CG2-CG2 4.19Å; S92-T96 WeakPolarHBondContact O-CG2 3.48Å; S92-T96 PolarHBondContact O-N 3.3Å; A93-T96 PolarHBondContact O-N 2.76Å; A93-T96 PolarHBondContact O-OG1 3.36Å; T96-L99 PolarHBondContact O-N 2.89Å; T96-A100 WeakPolarHBondContact O-CB 3.28Å; T96-A100 PolarHBondContact O-N 3.36Å
97G96.9Very high96.2Very high0 Ų042.8 Ų42.80%023%0.232CC..Hα-helixtrans-62.9-45.1174.100000113.7A93 L94 G95 A100 G101 G213A93-G97 PolarHBondContact O-N 3.07Å; L94-G97 PolarHBondContact O-N 2.74Å; G95-G97 VanDerWaalsContact C-N 3.32Å; G95-G97 PolarHBondContact O-N 2.91Å; G97-A100 PolarHBondContact O-N 2.79Å; G97-G101 PolarHBondContact O-N 3.27Å; G97-G213 CarbonylContact C-O 3.36Å; G97-G213 VanDerWaalsContact CA-O 3.23Å; G97-G213 WeakPolarHBondContact CA-O 3.26Å; G97-G213 CarbonylContact O-C 3.59Å; G97-G213 WeakPolarHBondContact O-CA 3.5Å
98I97.6Very high96Very high69 Ų6939.8 Ų39.835%0.35421%0.212SC..Hα-helixtrans-63.1-42.6176.8-71.6166.5000111.1L94 G95 L102 V210 L214L94-I98 WeakPolarHBondContact O-CG1 3.17Å; L94-I98 PolarHBondContact O-N 3.45Å; G95-I98 PolarHBondContact O-N 2.85Å; I98-L102 VanDerWaalsContact O-CB 3.25Å; I98-L102 WeakPolarHBondContact O-CB 3.41Å; I98-L102 PolarHBondContact O-N 2.91Å; I98-V210 HydrophobicContact CG2-CG1 4.19Å; I98-L214 HydrophobicContact CD1-CD1 4.24Å; I98-L214 HydrophobicContact CG1-CB 4.4Å; I98-L214 HydrophobicContact CG1-CD1 4.24Å
99L97.5Very high95.8Very high117 Ų11736.8 Ų36.861%0.61320%0.199SC*.Hα-helixtrans-68.3-40178.4-71.1170.7000112.2G95 T96 L102 W103G95-L99 WeakPolarHBondContact O-CB 3.12Å; G95-L99 VanDerWaalsContact O-CG 3.28Å; G95-L99 WeakPolarHBondContact O-CG 3.27Å; G95-L99 PolarHBondContact O-N 3.44Å; T96-L99 PolarHBondContact O-N 2.89Å; L99-L102 PolarHBondContact O-N 2.9Å; L99-W103 WeakPolarHBondContact O-CB 3.25Å; L99-W103 PolarHBondContact O-N 2.97Å
100A96.1Very high95.5Very high9 Ų940.7 Ų40.77%0.07422%0.219CC..Hα-helixtrans-60.8-49172.700000112.3V68 T96 G97 L102 W103 N104 L122V68-A100 HydrophobicContact CB-CB 4.36Å; V68-A100 HydrophobicContact CG1-CB 3.85Å; V68-A100 HydrophobicContact CG2-CB 3.52Å; T96-A100 WeakPolarHBondContact O-CB 3.28Å; T96-A100 PolarHBondContact O-N 3.36Å; G97-A100 PolarHBondContact O-N 2.79Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 3Å; A100-W103 WeakPolarHBondContact O-CB 3.36Å; A100-W103 PolarHBondContact O-N 3.46Å; A100-N104 PolarHBondContact O-N 3.35Å; A100-N104 VanDerWaalsContact O-N 3.1Å; A100-L122 HydrophobicContact CB-CD2 3.73Å; A100-L122 WeakPolarHBondContact O-CD2 3.32Å
101G96.4Very high95.1Very high1 Ų142.7 Ų42.71%0.0123%0.23CC..Hα-helixtrans-62.2-38.317500000112.7G97 G105 Y209G97-G101 PolarHBondContact O-N 3.27Å; G101-G105 PolarHBondContact O-N 2.85Å; G101-Y209 WeakPolarHBondContact CA-O 3.27Å; G101-Y209 WeakPolarHBondContact O-CB 3.32Å
102L96.9Very high94.5Very high68 Ų6843.1 Ų43.136%0.35623%0.226SC..Hα-helixtrans-65.8-40.4175-178.960.3000111.9I98 L99 A100 G105 I106 V210I98-L102 VanDerWaalsContact O-CB 3.25Å; I98-L102 WeakPolarHBondContact O-CB 3.41Å; I98-L102 PolarHBondContact O-N 2.91Å; L99-L102 PolarHBondContact O-N 2.9Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 3Å; L102-G105 PolarHBondContact O-N 3.18Å; L102-I106 HydrophobicContact CD1-CD1 4.04Å; L102-I106 HydrophobicContact CD1-CG1 4.23Å; L102-I106 HydrophobicContact CG-CD1 3.91Å; L102-I106 WeakPolarHBondContact O-CB 3.37Å; L102-I106 VanDerWaalsContact O-CG1 3.27Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 3.31Å; L102-V210 HydrophobicContact CB-CG2 3.93Å; L102-V210 HydrophobicContact CD1-CG2 4.33Å
103W96Very high93.8Very high105 Ų10541.5 Ų41.540%0.39821%0.214SC..Hα-helixtrans-57.9-55.7174.7172.6-91.7000111.2L99 A100 G105 I106 L107 F595L99-W103 WeakPolarHBondContact O-CB 3.25Å; L99-W103 PolarHBondContact O-N 2.97Å; A100-W103 WeakPolarHBondContact O-CB 3.36Å; A100-W103 PolarHBondContact O-N 3.46Å; W103-G105 VanDerWaalsContact C-N 3.29Å; W103-G105 PolarHBondContact O-N 3.16Å; W103-I106 PolarHBondContact O-N 2.87Å; W103-I106 VanDerWaalsContact O-N 3.12Å; W103-L107 HydrophobicContact CZ2-CD1 4.42Å; W103-L107 HydrophobicContact CZ2-CD2 4.38Å; W103-L107 WeakPolarHBondContact O-CG 3.39Å; W103-L107 PolarHBondContact O-N 2.87Å; W103-F595 HydrophobicContact CH2-CE1 4.34Å; W103-F595 HydrophobicContact CH2-CE2 4.43Å; W103-F595 HydrophobicContact CH2-CZ 4.25Å; W103-F595 HydrophobicContact CZ2-CD2 4.21Å; W103-F595 HydrophobicContact CZ2-CE2 4.31Å; W103-F595 HydrophobicContact CZ2-CG 4.37Å
104N95.1Very high93.1Very high0 Ų046 Ų460%024%0.235CC..Hα-helixtrans-56.5-45.5175.9-70.3-12.9000111.4D62 S64 A100 I106 L107 V108 A118 T119 L122 Y209D62-N104 PolarHBondContact OD1-ND2 3Å; D62-N104 VanDerWaalsContact OD1-ND2 3.12Å; S64-N104 PolarHBondContact OG-ND2 3.4Å; A100-N104 PolarHBondContact O-N 3.35Å; A100-N104 VanDerWaalsContact O-N 3.1Å; N104-I106 VanDerWaalsContact C-N 3.33Å; N104-I106 PolarHBondContact O-N 2.95Å; N104-L107 PolarHBondContact O-N 3.47Å; N104-V108 VanDerWaalsContact O-CG2 3.31Å; N104-V108 WeakPolarHBondContact O-CG2 3.31Å; N104-V108 PolarHBondContact O-N 3.01Å; N104-A118 PolarHBondContact OD1-O 3.19Å; N104-T119 HydrophobicContact CB-CG2 4.1Å; N104-T119 WeakPolarHBondContact ND2-CG2 3.45Å; N104-L122 WeakPolarHBondContact OD1-CB 3.5Å; N104-L122 WeakPolarHBondContact OD1-CD2 3.34Å; N104-Y209 HydrophobicContact CB-CD1 3.71Å; N104-Y209 HydrophobicContact CB-CE1 4.35Å; N104-Y209 HydrophobicContact CB-CG 3.98Å
105G94.4Very high92.6Very high0 Ų045 Ų450%023%0.232CC..Hα-helixtrans-54.1-45.3175.600000113G101 L102 W103 A109 M206G101-G105 PolarHBondContact O-N 2.85Å; L102-G105 PolarHBondContact O-N 3.18Å; W103-G105 VanDerWaalsContact C-N 3.29Å; W103-G105 PolarHBondContact O-N 3.16Å; G105-A109 WeakPolarHBondContact O-CB 3.38Å; G105-A109 PolarHBondContact O-N 3.09Å; G105-M206 WeakPolarHBondContact O-CG 3.34Å
106I95Very high91.8Very high65 Ų6544.6 Ų44.633%0.33322%0.224SC..Hα-helixtrans-66-46.1178.4-72.6165.6000111.2L102 W103 N104 V108 I110 L111 M206L102-I106 HydrophobicContact CD1-CD1 4.04Å; L102-I106 HydrophobicContact CD1-CG1 4.23Å; L102-I106 HydrophobicContact CG-CD1 3.91Å; L102-I106 WeakPolarHBondContact O-CB 3.37Å; L102-I106 VanDerWaalsContact O-CG1 3.27Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 3.31Å; W103-I106 PolarHBondContact O-N 2.87Å; W103-I106 VanDerWaalsContact O-N 3.12Å; N104-I106 VanDerWaalsContact C-N 3.33Å; N104-I106 PolarHBondContact O-N 2.95Å; I106-V108 VanDerWaalsContact C-N 3.31Å; I106-V108 PolarHBondContact O-N 2.91Å; I106-I110 HydrophobicContact CG1-CD1 4.21Å; I106-I110 HydrophobicContact CG2-CB 4.5Å; I106-I110 HydrophobicContact CG2-CD1 4.35Å; I106-I110 WeakPolarHBondContact O-CA 3.43Å; I106-I110 VanDerWaalsContact O-CB 3.31Å; I106-I110 WeakPolarHBondContact O-CB 3.28Å; I106-I110 PolarHBondContact O-N 3.37Å; I106-L111 PolarHBondContact O-N 2.87Å; I106-L111 VanDerWaalsContact O-N 3.16Å; I106-M206 HydrophobicContact CG1-SD 4.23Å
107L92.1Very high90.8Very high3 Ų343 Ų432%0.01621%0.214CC..Hα-helixtrans-57.4-45.3177.7-64.1-168.7000111.3W103 N104 L111 K112 I113 A118 I121 F595W103-L107 HydrophobicContact CZ2-CD1 4.42Å; W103-L107 HydrophobicContact CZ2-CD2 4.38Å; W103-L107 WeakPolarHBondContact O-CG 3.39Å; W103-L107 PolarHBondContact O-N 2.87Å; N104-L107 PolarHBondContact O-N 3.47Å; L107-L111 HydrophobicContact CD2-CD1 3.73Å; L107-L111 CarbonylContact O-C 3.47Å; L107-L111 WeakPolarHBondContact O-CB 3.42Å; L107-K112 PolarHBondContact O-N 3.48Å; L107-I113 HydrophobicContact CB-CD1 4.17Å; L107-I113 HydrophobicContact CD2-CD1 4.09Å; L107-I113 WeakPolarHBondContact O-CB 3.32Å; L107-I113 PolarHBondContact O-N 3.03Å; L107-A118 HydrophobicContact CB-CB 3.56Å; L107-A118 HydrophobicContact CD1-CB 3.81Å; L107-A118 HydrophobicContact CG-CB 4.33Å; L107-I121 HydrophobicContact CD1-CD1 4.35Å; L107-F595 HydrophobicContact CD2-CD2 4.08Å; L107-F595 HydrophobicContact CD2-CE2 3.57Å
108V92.1Very high90.3Very high18 Ų1843 Ų4311%0.10921%0.214CC..Hα-helixtrans-78.5-49.8-176.2179.80000112.3N104 I106 K112 P115 A118 V205 Y209N104-V108 VanDerWaalsContact O-CG2 3.31Å; N104-V108 WeakPolarHBondContact O-CG2 3.31Å; N104-V108 PolarHBondContact O-N 3.01Å; I106-V108 VanDerWaalsContact C-N 3.31Å; I106-V108 PolarHBondContact O-N 2.91Å; V108-K112 VanDerWaalsContact O-CA 3.3Å; V108-K112 WeakPolarHBondContact O-CA 3.41Å; V108-K112 PolarHBondContact O-N 3.47Å; V108-P115 HydrophobicContact CG1-CG 3.83Å; V108-A118 HydrophobicContact CG2-CB 3.53Å; V108-V205 HydrophobicContact CB-CG1 4.4Å; V108-V205 HydrophobicContact CG1-CG1 3.83Å; V108-Y209 HydrophobicContact CB-CE2 3.93Å; V108-Y209 HydrophobicContact CG1-CE2 3.95Å; V108-Y209 HydrophobicContact CG2-CE2 3.97Å
109A91.7Very high90Very high14 Ų1439.8 Ų39.812%0.11620%0.197CC..Hα-helixtrans-82.5-31.9-171.800000114.1G105 R202 V205 M206G105-A109 WeakPolarHBondContact O-CB 3.38Å; G105-A109 PolarHBondContact O-N 3.09Å; A109-R202 HydrophobicContact CB-CB 4.39Å; A109-R202 WeakPolarHBondContact CB-O 3.28Å; A109-V205 HydrophobicContact CB-CB 4.05Å; A109-V205 HydrophobicContact CB-CG1 3.99Å; A109-M206 HydrophobicContact CB-CG 3.6Å; A109-M206 HydrophobicContact CB-SD 4.48Å
110I90.2Very high89.4Confident83 Ų8334.2 Ų34.243%0.42617%0.168SC..THydrogen-bonded Turntrans-102.6-55.3-174.9-53.4-174.7000110.6I106 K112 M206I106-I110 HydrophobicContact CG1-CD1 4.21Å; I106-I110 HydrophobicContact CG2-CB 4.5Å; I106-I110 HydrophobicContact CG2-CD1 4.35Å; I106-I110 WeakPolarHBondContact O-CA 3.43Å; I106-I110 VanDerWaalsContact O-CB 3.31Å; I106-I110 WeakPolarHBondContact O-CB 3.28Å; I106-I110 PolarHBondContact O-N 3.37Å; I110-K112 PolarHBondContact O-N 3.26Å; I110-M206 HydrophobicContact CD1-SD 3.87Å; I110-M206 HydrophobicContact CG1-SD 4.1Å
111L86.5Confident88.8Confident77 Ų7734 Ų3440%0.40317%0.165SC..SBendtrans-76.6-10.8179-53.3-175.2000113.1I106 L107 I113 F595 R602I106-L111 PolarHBondContact O-N 2.87Å; I106-L111 VanDerWaalsContact O-N 3.16Å; L107-L111 HydrophobicContact CD2-CD1 3.73Å; L107-L111 CarbonylContact O-C 3.47Å; L107-L111 WeakPolarHBondContact O-CB 3.42Å; L111-I113 HydrophobicContact CB-CD1 3.91Å; L111-I113 HydrophobicContact CB-CG1 4.01Å; L111-I113 HydrophobicContact CD1-CD1 3.97Å; L111-I113 PolarHBondContact O-N 3.5Å; L111-F595 HydrophobicContact CD1-CE2 4.39Å; L111-R602 WeakPolarHBondContact O-CG 3.3Å
112K85Confident88.5Confident135 Ų13535 Ų3559%0.58717%0.17SC*.  trans54.637.2-177.4-50.6176.1-171.8167.60112.3L107 V108 I110 R602L107-K112 PolarHBondContact O-N 3.48Å; V108-K112 VanDerWaalsContact O-CA 3.3Å; V108-K112 WeakPolarHBondContact O-CA 3.41Å; V108-K112 PolarHBondContact O-N 3.47Å; I110-K112 PolarHBondContact O-N 3.26Å; K112-R602 PolarHBondContact O-NE 3.44Å; K112-R602 PolarHBondContact O-NH2 2.89Å
113I83Confident88.1Confident8 Ų832 Ų324%0.04116%0.155CC..  trans-73.2148.7167.7-65.3167.1000107.3L107 L111 V117 A118 I598L107-I113 HydrophobicContact CB-CD1 4.17Å; L107-I113 HydrophobicContact CD2-CD1 4.09Å; L107-I113 WeakPolarHBondContact O-CB 3.32Å; L107-I113 PolarHBondContact O-N 3.03Å; L111-I113 HydrophobicContact CB-CD1 3.91Å; L111-I113 HydrophobicContact CB-CG1 4.01Å; L111-I113 HydrophobicContact CD1-CD1 3.97Å; L111-I113 PolarHBondContact O-N 3.5Å; I113-V117 HydrophobicContact CG2-CG1 3.44Å; I113-V117 VanDerWaalsContact CG2-CG1 3.44Å; I113-A118 HydrophobicContact CG2-CB 4.03Å; I113-I598 HydrophobicContact CD1-CG2 4.09Å; I113-I598 HydrophobicContact CG1-CG2 4.1Å; I113-I598 HydrophobicContact CG2-CG2 3.76Å
114Q81.4Confident87.2Confident93 Ų9327.5 Ų27.544%0.43514%0.139SC..  trans-69.4132.9-179.3-167.3159.1-19.800109.7F116 V117 A118 V292 A293Q114-F116 PolarHBondContact O-N 2.9Å; Q114-F116 VanDerWaalsContact O-N 3.16Å; Q114-V117 PolarHBondContact O-N 3.48Å; Q114-V117 VanDerWaalsContact O-N 3.09Å; Q114-A118 PolarHBondContact O-N 2.88Å; Q114-V292 HydrophobicContact CB-CG1 4.2Å; Q114-V292 HydrophobicContact CG-CG1 3.87Å; Q114-V292 VanDerWaalsContact OE1-CG1 3.29Å; Q114-A293 HydrophobicContact CB-CB 4.26Å
115P87.5Confident86.7Confident25 Ų2528.2 Ų28.216%0.16215%0.145CC..Hα-helixtrans-29.5-63179.5-42.939.6000116.4G60 V108 V117 A118 T119 Y209G60-P115 VanDerWaalsContact CA-CB 3.49Å; V108-P115 HydrophobicContact CG1-CG 3.83Å; P115-V117 PolarHBondContact O-N 3.03Å; P115-A118 WeakPolarHBondContact O-CB 3.41Å; P115-A118 PolarHBondContact O-N 3.04Å; P115-T119 VanDerWaalsContact O-CG2 3.3Å; P115-T119 WeakPolarHBondContact O-CG2 3.34Å; P115-T119 PolarHBondContact O-N 2.97Å; P115-T119 VanDerWaalsContact O-N 3.12Å; P115-Y209 VanDerWaalsContact CB-OH 3.24Å; P115-Y209 WeakPolarHBondContact CB-OH 3.28Å
116F80.8Confident86.4Confident14 Ų1428.3 Ų28.36%0.06115%0.146CC..Hα-helixtrans-48.6-53.7-177.2-140.6-139.1000111.3I61 L63 Q114 T119 L120 E290 Y291 V292 I354 F410I61-F116 HydrophobicContact CB-CD2 3.84Å; I61-F116 HydrophobicContact CB-CE2 4.21Å; I61-F116 HydrophobicContact CD1-CD2 4.01Å; I61-F116 HydrophobicContact CD1-CE2 3.74Å; I61-F116 HydrophobicContact CG1-CD2 4.44Å; I61-F116 HydrophobicContact CG2-CD2 3.98Å; I61-F116 HydrophobicContact CG2-CE2 3.99Å; L63-F116 HydrophobicContact CD1-CD1 4.35Å; L63-F116 HydrophobicContact CD1-CD2 3.2Å; L63-F116 HydrophobicContact CD1-CE2 3.42Å; L63-F116 VanDerWaalsContact CD1-CE2 3.42Å; L63-F116 HydrophobicContact CD1-CG 3.74Å; L63-F116 HydrophobicContact CD1-CZ 4.12Å; L63-F116 HydrophobicContact CD2-CD2 4.45Å; L63-F116 HydrophobicContact CD2-CE2 4.03Å; L63-F116 HydrophobicContact CG-CD2 3.97Å; L63-F116 HydrophobicContact CG-CE2 4.04Å; Q114-F116 PolarHBondContact O-N 2.9Å; Q114-F116 VanDerWaalsContact O-N 3.16Å; F116-T119 CarbonylContact O-C 3.6Å; F116-T119 WeakPolarHBondContact O-CA 3.46Å; F116-T119 PolarHBondContact O-N 3.07Å; F116-T119 PolarHBondContact O-OG1 3.05Å; F116-L120 PolarHBondContact O-N 3.17Å; F116-E290 HydrophobicContact CD1-CB 4.27Å; F116-E290 HydrophobicContact CE1-CB 3.57Å; F116-E290 HydrophobicContact CE1-CG 4.26Å; F116-E290 VanDerWaalsContact CE1-OE2 3.25Å; F116-E290 WeakPolarHBondContact CE1-OE2 3.22Å; F116-E290 HydrophobicContact CE2-CB 4.37Å; F116-E290 HydrophobicContact CZ-CB 3.62Å; F116-E290 VanDerWaalsContact CZ-OE2 3.32Å; F116-E290 WeakPolarHBondContact CZ-OE2 3.28Å; F116-Y291 CarbonylContact C-O 3.59Å; F116-Y291 WeakPolarHBondContact CB-O 3.47Å; F116-Y291 VanDerWaalsContact CD1-CB 3.49Å; F116-Y291 WeakPolarHBondContact CD1-O 3.37Å; F116-Y291 WeakPolarHBondContact CG-O 3.21Å; F116-V292 HydrophobicContact CB-CB 4.02Å; F116-V292 HydrophobicContact CB-CG2 4.49Å; F116-V292 HydrophobicContact CD1-CB 3.83Å; F116-V292 HydrophobicContact CD1-CG2 3.45Å; F116-V292 VanDerWaalsContact CD1-CG2 3.45Å; F116-V292 HydrophobicContact CE1-CG2 4Å; F116-V292 HydrophobicContact CG-CB 4.45Å; F116-V292 HydrophobicContact CG-CG2 4.42Å; F116-I354 HydrophobicContact CE1-CD1 3.95Å; F116-F410 HydrophobicContact CE2-CE2 4.37Å; F116-F410 HydrophobicContact CZ-CD2 4.1Å; F116-F410 AromaticContact CZ-CE2 3.9Å; F116-F410 HydrophobicContact CZ-CE2 3.9Å
117V75.1Confident85.8Confident0 Ų025.9 Ų25.90%013%0.132CC..Hα-helixtrans-80.2-27.8-171.993.60000113.5I113 Q114 P115 T119 L120 I121 Y291 V292 I598I113-V117 HydrophobicContact CG2-CG1 3.44Å; I113-V117 VanDerWaalsContact CG2-CG1 3.44Å; Q114-V117 PolarHBondContact O-N 3.48Å; Q114-V117 VanDerWaalsContact O-N 3.09Å; P115-V117 PolarHBondContact O-N 3.03Å; V117-T119 PolarHBondContact O-N 3.39Å; V117-L120 HydrophobicContact CG2-CB 4.26Å; V117-L120 HydrophobicContact CG2-CD2 3.97Å; V117-L120 PolarHBondContact O-N 3.14Å; V117-I121 WeakPolarHBondContact O-CD1 3.25Å; V117-I121 VanDerWaalsContact O-CG1 3.24Å; V117-I121 WeakPolarHBondContact O-CG1 3.22Å; V117-I121 PolarHBondContact O-N 3.46Å; V117-Y291 WeakPolarHBondContact CA-O 3.39Å; V117-Y291 VanDerWaalsContact CB-O 3.32Å; V117-Y291 WeakPolarHBondContact CB-O 3.46Å; V117-Y291 PolarHBondContact N-O 3.02Å; V117-V292 WeakPolarHBondContact CB-O 3.15Å; V117-V292 WeakPolarHBondContact CG1-O 3.29Å; V117-I598 HydrophobicContact CB-CD1 4.28Å; V117-I598 HydrophobicContact CG1-CD1 3.83Å; V117-I598 HydrophobicContact CG1-CG1 4.27Å; V117-I598 HydrophobicContact CG1-CG2 3.95Å; V117-I598 HydrophobicContact CG2-CD1 3.41Å; V117-I598 VanDerWaalsContact CG2-CD1 3.41Å; V117-I598 HydrophobicContact CG2-CG1 4.49Å
118A86.4Confident85.3Confident0 Ų025.8 Ų25.80%013%0.132CC..Hα-helixtrans-56.3-39.8167.100000110.2N104 L107 V108 I113 Q114 P115N104-A118 PolarHBondContact OD1-O 3.19Å; L107-A118 HydrophobicContact CB-CB 3.56Å; L107-A118 HydrophobicContact CD1-CB 3.81Å; L107-A118 HydrophobicContact CG-CB 4.33Å; V108-A118 HydrophobicContact CG2-CB 3.53Å; I113-A118 HydrophobicContact CG2-CB 4.03Å; Q114-A118 PolarHBondContact O-N 2.88Å; P115-A118 WeakPolarHBondContact O-CB 3.41Å; P115-A118 PolarHBondContact O-N 3.04Å
119T91.5Very high85.2Confident0 Ų027.6 Ų27.60%014%0.143CC..Hα-helixtrans-84.2-29.2179.873.10000112.9D62 L63 N104 P115 F116 V117 L122 M123 Y209D62-T119 HydrophobicContact CB-CG2 4.16Å; D62-T119 WeakPolarHBondContact OD1-CG2 3.31Å; L63-T119 PolarHBondContact N-OG1 3.18Å; N104-T119 HydrophobicContact CB-CG2 4.1Å; N104-T119 WeakPolarHBondContact ND2-CG2 3.45Å; P115-T119 VanDerWaalsContact O-CG2 3.3Å; P115-T119 WeakPolarHBondContact O-CG2 3.34Å; P115-T119 PolarHBondContact O-N 2.97Å; P115-T119 VanDerWaalsContact O-N 3.12Å; F116-T119 CarbonylContact O-C 3.6Å; F116-T119 WeakPolarHBondContact O-CA 3.46Å; F116-T119 PolarHBondContact O-N 3.07Å; F116-T119 PolarHBondContact O-OG1 3.05Å; V117-T119 PolarHBondContact O-N 3.39Å; T119-L122 CarbonylContact O-C 3.38Å; T119-L122 PolarHBondContact O-N 3.33Å; T119-M123 VanDerWaalsContact O-CB 3.28Å; T119-M123 WeakPolarHBondContact O-CB 3.28Å; T119-M123 PolarHBondContact O-N 3.01Å; T119-Y209 HydrophobicContact CG2-CD1 4.26Å; T119-Y209 HydrophobicContact CG2-CE1 3.73Å
120L83.4Confident85.1Confident0 Ų026.9 Ų26.90%014%0.137CC..Hα-helixtrans-58.7-46.3168.6-179.968000111.3F116 V117 L122 M123 V124 L538 I541 L594F116-L120 PolarHBondContact O-N 3.17Å; V117-L120 HydrophobicContact CG2-CB 4.26Å; V117-L120 HydrophobicContact CG2-CD2 3.97Å; V117-L120 PolarHBondContact O-N 3.14Å; L120-L122 PolarHBondContact O-N 3.45Å; L120-M123 HydrophobicContact CD1-CE 3.73Å; L120-M123 HydrophobicContact CD1-SD 4.27Å; L120-M123 PolarHBondContact O-N 3.24Å; L120-M123 VanDerWaalsContact O-N 3.11Å; L120-V124 HydrophobicContact CD1-CG2 3.88Å; L120-V124 HydrophobicContact CG-CG2 4.19Å; L120-V124 WeakPolarHBondContact O-CG2 3.44Å; L120-V124 PolarHBondContact O-N 3.08Å; L120-L538 HydrophobicContact CD1-CD2 3.79Å; L120-I541 HydrophobicContact CD1-CG2 4.37Å; L120-I541 HydrophobicContact CD2-CG2 4.21Å; L120-L594 HydrophobicContact CD2-CD1 4.28Å; L120-L594 HydrophobicContact CG-CD1 4.46Å
121I84.9Confident84.9Confident4 Ų423.2 Ų23.22%0.02112%0.118CC..Hα-helixtrans-51.2-49.4176.3-76.6159.6000110L107 V117 A125 L594 F595 I598L107-I121 HydrophobicContact CD1-CD1 4.35Å; V117-I121 WeakPolarHBondContact O-CD1 3.25Å; V117-I121 VanDerWaalsContact O-CG1 3.24Å; V117-I121 WeakPolarHBondContact O-CG1 3.22Å; V117-I121 PolarHBondContact O-N 3.46Å; I121-A125 WeakPolarHBondContact O-CB 3.21Å; I121-A125 PolarHBondContact O-N 2.9Å; I121-L594 HydrophobicContact CG1-CB 3.92Å; I121-F595 HydrophobicContact CD1-CB 4.04Å; I121-F595 HydrophobicContact CD1-CD2 4.28Å; I121-F595 HydrophobicContact CG1-CB 4.26Å; I121-F595 HydrophobicContact CG2-CB 3.84Å; I121-I598 HydrophobicContact CD1-CD1 4.17Å
122L90.3Very high85Confident22 Ų2222.1 Ų22.112%0.11511%0.112CC..Hα-helixtrans-76.6-26.9-179.9-170.961.4000113.1V68 A100 N104 T119 L120 G126V68-L122 HydrophobicContact CG2-CD2 4.2Å; A100-L122 HydrophobicContact CB-CD2 3.73Å; A100-L122 WeakPolarHBondContact O-CD2 3.32Å; N104-L122 WeakPolarHBondContact OD1-CB 3.5Å; N104-L122 WeakPolarHBondContact OD1-CD2 3.34Å; T119-L122 CarbonylContact O-C 3.38Å; T119-L122 PolarHBondContact O-N 3.33Å; L120-L122 PolarHBondContact O-N 3.45Å; L122-G126 WeakPolarHBondContact O-CA 3.41Å; L122-G126 PolarHBondContact O-N 3.21Å
123M87Confident85.3Confident5 Ų518.5 Ų18.53%0.02510%0.099CC..Hα-helixtrans-67.3-49.6174.1-174.2-141.374.300110.8A67 T119 L120 R127 L538A67-M123 HydrophobicContact CB-CG 4.39Å; T119-M123 VanDerWaalsContact O-CB 3.28Å; T119-M123 WeakPolarHBondContact O-CB 3.28Å; T119-M123 PolarHBondContact O-N 3.01Å; L120-M123 HydrophobicContact CD1-CE 3.73Å; L120-M123 HydrophobicContact CD1-SD 4.27Å; L120-M123 PolarHBondContact O-N 3.24Å; L120-M123 VanDerWaalsContact O-N 3.11Å; M123-R127 PolarHBondContact O-N 3.26Å; M123-R127 VanDerWaalsContact O-N 3.14Å; M123-L538 HydrophobicContact CE-CD1 3.39Å; M123-L538 HydrophobicContact CE-CD2 3.69Å; M123-L538 HydrophobicContact CE-CG 4.14Å; M123-L538 HydrophobicContact SD-CD1 3.75Å; M123-L538 HydrophobicContact SD-CD2 4.03Å
124V78.5Confident85.5Confident11 Ų1118.2 Ų18.27%0.06710%0.098CC..Hα-helixtrans-67.6-53178.4-175.90000110.3L120 G126 G128 K587 I590 L594L120-V124 HydrophobicContact CD1-CG2 3.88Å; L120-V124 HydrophobicContact CG-CG2 4.19Å; L120-V124 WeakPolarHBondContact O-CG2 3.44Å; L120-V124 PolarHBondContact O-N 3.08Å; V124-G126 VanDerWaalsContact C-N 3.33Å; V124-G126 PolarHBondContact O-N 2.99Å; V124-G128 PolarHBondContact O-N 2.85Å; V124-K587 HydrophobicContact CG1-CB 4.44Å; V124-K587 WeakPolarHBondContact CG1-O 3.32Å; V124-K587 WeakPolarHBondContact O-CB 3.31Å; V124-I590 HydrophobicContact CG1-CB 4.23Å; V124-I590 HydrophobicContact CG1-CG2 3.98Å; V124-L594 HydrophobicContact CG2-CD1 4.22Å
125A83.9Confident85.6Confident16 Ų1618 Ų1813%0.13211%0.107CC..Hα-helixtrans-62.9-40.7178.400000112I121 G128 V129I121-A125 WeakPolarHBondContact O-CB 3.21Å; I121-A125 PolarHBondContact O-N 2.9Å; A125-G128 CarbonylContact O-C 3.37Å; A125-G128 WeakPolarHBondContact O-CA 3.29Å; A125-G128 PolarHBondContact O-N 3.45Å; A125-G128 VanDerWaalsContact O-N 3.12Å; A125-V129 WeakPolarHBondContact O-CG2 3.41Å; A125-V129 PolarHBondContact O-N 3.26Å
126G87.4Confident85.1Confident1 Ų117.2 Ų17.21%0.0110%0.103CC..Hα-helixtrans-70.1-37.7-172.800000114.1I71 L122 V124 G128 V129 A130I71-G126 WeakPolarHBondContact CG1-O 3.37Å; L122-G126 WeakPolarHBondContact O-CA 3.41Å; L122-G126 PolarHBondContact O-N 3.21Å; V124-G126 VanDerWaalsContact C-N 3.33Å; V124-G126 PolarHBondContact O-N 2.99Å; G126-G128 VanDerWaalsContact C-N 3.26Å; G126-G128 PolarHBondContact O-N 2.95Å; G126-V129 PolarHBondContact O-N 3.44Å; G126-A130 PolarHBondContact O-N 3.18Å
127R83.4Confident85.2Confident15 Ų1523 Ų236%0.05713%0.13CC..Hα-helixtrans-61.7-38.3168.8-70.1-167.6-171.2-74.3-6.7110.9A67 M123 A130 Q131 G236 E240 K587A67-R127 HydrophobicContact CB-CG 3.77Å; M123-R127 PolarHBondContact O-N 3.26Å; M123-R127 VanDerWaalsContact O-N 3.14Å; R127-A130 PolarHBondContact O-N 3.08Å; R127-Q131 WeakPolarHBondContact O-CB 3.13Å; R127-Q131 VanDerWaalsContact O-CG 3.23Å; R127-Q131 WeakPolarHBondContact O-CG 3.42Å; R127-Q131 PolarHBondContact O-N 3.22Å; R127-Q131 PolarHBondContact O-OE1 3Å; R127-G236 PolarHBondContact NH1-O 2.92Å; R127-G236 PolarHBondContact NH2-O 3.24Å; R127-E240 IonicContact CZ-OE1 3.79Å; R127-E240 VanDerWaalsContact NH2-CD 3.27Å; R127-E240 IonicContact NH2-OE1 2.69Å; R127-E240 PolarHBondContact NH2-OE1 2.97Å; R127-E240 IonicContact NH2-OE2 3.07Å; R127-E240 PolarHBondContact NH2-OE2 2.91Å; R127-K587 HydrophobicContact CB-CD 4.39Å
128G81.4Confident85.8Confident0 Ų027.6 Ų27.60%015%0.153CC..Hα-helixtrans-62.2-42171.600000113.6V124 A125 G126 Q131 L132V124-G128 PolarHBondContact O-N 2.85Å; A125-G128 CarbonylContact O-C 3.37Å; A125-G128 WeakPolarHBondContact O-CA 3.29Å; A125-G128 PolarHBondContact O-N 3.45Å; A125-G128 VanDerWaalsContact O-N 3.12Å; G126-G128 VanDerWaalsContact C-N 3.26Å; G126-G128 PolarHBondContact O-N 2.95Å; G128-Q131 PolarHBondContact O-N 2.96Å; G128-L132 PolarHBondContact O-N 3.4Å
129V89.8Confident85.9Confident56 Ų5629 Ų2934%0.33916%0.162SC..Hα-helixtrans-64.9-44.8175.9170.40000111.5I71 A125 G126 Q131 L132 I133 I588I71-V129 HydrophobicContact CD1-CG1 4.47Å; I71-V129 HydrophobicContact CG1-CB 4.46Å; I71-V129 HydrophobicContact CG1-CG1 4.28Å; A125-V129 WeakPolarHBondContact O-CG2 3.41Å; A125-V129 PolarHBondContact O-N 3.26Å; G126-V129 PolarHBondContact O-N 3.44Å; V129-Q131 VanDerWaalsContact C-N 3.32Å; V129-Q131 PolarHBondContact O-N 3.27Å; V129-L132 PolarHBondContact O-N 3.28Å; V129-I133 HydrophobicContact CG1-CD1 3.94Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.9Å; V129-I588 HydrophobicContact CG2-CD1 4.09Å; V129-I588 HydrophobicContact CG2-CG1 4.37Å
130A89.9Confident85.9Confident0 Ų033.8 Ų33.80%019%0.191CC..Hα-helixtrans-58.8-45.3174.500000111.2A70 I71 A74 G126 R127 L132 I133 T134 A232A70-A130 HydrophobicContact CB-CB 3.77Å; I71-A130 HydrophobicContact CG1-CB 4.12Å; A74-A130 HydrophobicContact CB-CB 4.31Å; G126-A130 PolarHBondContact O-N 3.18Å; R127-A130 PolarHBondContact O-N 3.08Å; A130-L132 VanDerWaalsContact C-N 3.35Å; A130-L132 PolarHBondContact O-N 2.99Å; A130-I133 PolarHBondContact O-N 3.26Å; A130-T134 PolarHBondContact O-N 3.01Å; A130-T134 VanDerWaalsContact O-N 3.13Å; A130-A232 HydrophobicContact CB-CB 3.8Å; A130-A232 WeakPolarHBondContact O-CB 3.27Å
131Q85.9Confident86.3Confident5 Ų534.6 Ų34.62%0.02320%0.195CC..Hα-helixtrans-65-33176-71.5176.6-50.300112.7R127 G128 V129 S135 G136 A232 N233 W584R127-Q131 WeakPolarHBondContact O-CB 3.13Å; R127-Q131 VanDerWaalsContact O-CG 3.23Å; R127-Q131 WeakPolarHBondContact O-CG 3.42Å; R127-Q131 PolarHBondContact O-N 3.22Å; R127-Q131 PolarHBondContact O-OE1 3Å; G128-Q131 PolarHBondContact O-N 2.96Å; V129-Q131 VanDerWaalsContact C-N 3.32Å; V129-Q131 PolarHBondContact O-N 3.27Å; Q131-S135 CarbonylContact O-C 3.53Å; Q131-S135 VanDerWaalsContact O-C 3.3Å; Q131-S135 VanDerWaalsContact O-CA 3.31Å; Q131-S135 WeakPolarHBondContact O-CA 3.22Å; Q131-S135 PolarHBondContact O-N 2.91Å; Q131-G136 PolarHBondContact O-N 3.35Å; Q131-A232 HydrophobicContact CG-CB 4.06Å; Q131-N233 PolarHBondContact NE2-OD1 3.02Å; Q131-W584 HydrophobicContact CB-CB 3.89Å; Q131-W584 HydrophobicContact CB-CD2 3.87Å; Q131-W584 HydrophobicContact CB-CE3 4.18Å; Q131-W584 HydrophobicContact CB-CG 3.72Å; Q131-W584 VanDerWaalsContact CD-CE3 3.43Å; Q131-W584 HydrophobicContact CG-CD2 4.4Å; Q131-W584 HydrophobicContact CG-CE3 4.27Å
132L88.5Confident86.5Confident54 Ų5441.5 Ų41.528%0.28323%0.232SC..Hα-helixtrans-66-43.2169.8-76.3-169.2000112.2G128 V129 A130 T134 S135 S582 W584 W585 I588G128-L132 PolarHBondContact O-N 3.4Å; V129-L132 PolarHBondContact O-N 3.28Å; A130-L132 VanDerWaalsContact C-N 3.35Å; A130-L132 PolarHBondContact O-N 2.99Å; L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.82Å; L132-S135 PolarHBondContact O-N 3.14Å; L132-S135 VanDerWaalsContact O-N 3.13Å; L132-S582 WeakPolarHBondContact CD2-OG 3.45Å; L132-W584 HydrophobicContact CD2-CB 4.05Å; L132-W584 HydrophobicContact CG-CB 4.48Å; L132-W585 HydrophobicContact CD1-CD2 4.25Å; L132-W585 HydrophobicContact CD1-CH2 4.26Å; L132-W585 HydrophobicContact CD1-CZ2 3.76Å; L132-I588 HydrophobicContact CD1-CD1 3.3Å; L132-I588 HydrophobicContact CG-CD1 3.76Å
133I90.9Very high86.5Confident59 Ų5941.5 Ų41.530%0.30323%0.234SC..Hα-helixtrans-60.8-35.9-179.8-66.4161.7000111.3I71 A74 A78 V129 A130I71-I133 HydrophobicContact CG2-CD1 4.3Å; A74-I133 HydrophobicContact CB-CB 3.95Å; A74-I133 HydrophobicContact CB-CD1 4.5Å; A74-I133 HydrophobicContact CB-CG2 3.76Å; A74-I133 WeakPolarHBondContact O-CG2 3.25Å; A78-I133 HydrophobicContact CB-CG2 3.71Å; V129-I133 HydrophobicContact CG1-CD1 3.94Å; V129-I133 WeakPolarHBondContact O-CG1 3.34Å; V129-I133 PolarHBondContact O-N 2.9Å; A130-I133 PolarHBondContact O-N 3.26Å
134T88.5Confident86.5Confident3 Ų345.5 Ų45.52%0.01826%0.26CS..THydrogen-bonded Turntrans-95.74.1176.876.50000114.8A74 A130 L132 G136 Q137 V139 A230 A232A74-T134 HydrophobicContact CB-CG2 3.64Å; A130-T134 PolarHBondContact O-N 3.01Å; A130-T134 VanDerWaalsContact O-N 3.13Å; L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.82Å; T134-G136 PolarHBondContact O-N 2.66Å; T134-G136 VanDerWaalsContact O-N 3.08Å; T134-G136 PolarHBondContact OG1-N 3.03Å; T134-Q137 WeakPolarHBondContact CB-O 3.07Å; T134-Q137 PolarHBondContact O-N 3.33Å; T134-Q137 PolarHBondContact OG1-O 3.26Å; T134-V139 HydrophobicContact CG2-CB 4.49Å; T134-V139 HydrophobicContact CG2-CG2 4.13Å; T134-A230 HydrophobicContact CG2-CB 4.3Å; T134-A232 HydrophobicContact CG2-CB 3.85Å; T134-A232 WeakPolarHBondContact OG1-CB 3.38Å
135S83.4Confident87Confident89 Ų8950.1 Ų50.162%0.62228%0.284SS*.THydrogen-bonded Turntrans52.718.3-165-55.70000114.7Q131 L132 Q137 W584Q131-S135 CarbonylContact O-C 3.53Å; Q131-S135 VanDerWaalsContact O-C 3.3Å; Q131-S135 VanDerWaalsContact O-CA 3.31Å; Q131-S135 WeakPolarHBondContact O-CA 3.22Å; Q131-S135 PolarHBondContact O-N 2.91Å; L132-S135 PolarHBondContact O-N 3.14Å; L132-S135 VanDerWaalsContact O-N 3.13Å; S135-Q137 VanDerWaalsContact C-N 3.25Å; S135-Q137 PolarHBondContact O-N 3.49Å; S135-W584 PolarHBondContact O-NE1 3.15Å; S135-W584 VanDerWaalsContact O-NE1 3.12Å
136G76.5Confident87.3Confident8 Ų849.3 Ų49.38%0.08228%0.278CS..THydrogen-bonded Turntrans81.5-4.1-174.400000114.8Q131 T134 N233Q131-G136 PolarHBondContact O-N 3.35Å; T134-G136 PolarHBondContact O-N 2.66Å; T134-G136 VanDerWaalsContact O-N 3.08Å; T134-G136 PolarHBondContact OG1-N 3.03Å; G136-N233 PolarHBondContact O-ND2 2.74Å; G136-N233 VanDerWaalsContact O-ND2 3.14Å
137Q82.5Confident87.4Confident135 Ų13550 Ų5063%0.63128%0.282SS*.SBendtrans-83.8168.7175.7-61.1-59.2-48.400111.1T134 S135 V139T134-Q137 WeakPolarHBondContact CB-O 3.07Å; T134-Q137 PolarHBondContact O-N 3.33Å; T134-Q137 PolarHBondContact OG1-O 3.26Å; S135-Q137 VanDerWaalsContact C-N 3.25Å; S135-Q137 PolarHBondContact O-N 3.49Å; Q137-V139 PolarHBondContact O-N 2.88Å
138I87.2Confident87.8Confident96 Ų9654.8 Ų54.849%0.49230%0.3SS..EExtended strand (participates in β ladder)trans-83.9107.5166.4-53.6-176.6000107.7T140 A230 D231I138-T140 HydrophobicContact CG2-CG2 4.22Å; I138-T140 PolarHBondContact O-N 3.45Å; I138-A230 WeakPolarHBondContact CA-O 3.31Å; I138-D231 HydrophobicContact CD1-CB 4.17Å; I138-D231 HydrophobicContact CG1-CB 3.88Å; I138-D231 HydrophobicContact CG2-CB 4.38Å
139V88.6Confident88.2Confident30 Ų3057.1 Ų57.118%0.18231%0.311CS..EExtended strand (participates in β ladder)trans-84102.9178173.30000108.6A77 V81 T134 Q137 G229 A230A77-V139 HydrophobicContact CB-CB 4.24Å; A77-V139 HydrophobicContact CB-CG1 3.96Å; A77-V139 WeakPolarHBondContact CB-O 3.23Å; V81-V139 HydrophobicContact CB-CG1 4.41Å; V81-V139 HydrophobicContact CG2-CG1 3.73Å; T134-V139 HydrophobicContact CG2-CB 4.49Å; T134-V139 HydrophobicContact CG2-CG2 4.13Å; Q137-V139 PolarHBondContact O-N 2.88Å; V139-G229 CarbonylContact O-C 3.3Å; V139-G229 WeakPolarHBondContact O-CA 3.3Å; V139-A230 PolarHBondContact N-O 3.04Å; V139-A230 VanDerWaalsContact N-O 3.07Å; V139-A230 PolarHBondContact O-N 3.08Å
140T91.5Very high88Confident100 Ų10054.5 Ų54.561%0.61330%0.295SS*.EExtended strand (participates in β ladder)trans-87.1151.2176.854.30000111.9V81 I138 R228V81-T140 VanDerWaalsContact CG2-O 3.22Å; V81-T140 WeakPolarHBondContact CG2-O 3.47Å; I138-T140 HydrophobicContact CG2-CG2 4.22Å; I138-T140 PolarHBondContact O-N 3.45Å; T140-R228 WeakPolarHBondContact CA-O 3.09Å
141F91.5Very high87.8Confident18 Ų1856.5 Ų56.58%0.07931%0.309CS..  trans-139.8157177.659.6-98.1000111.4A77 T80 V81 L146 A224 R228 G229A77-F141 HydrophobicContact CB-CD1 3.71Å; A77-F141 HydrophobicContact CB-CE1 3.93Å; T80-F141 HydrophobicContact CG2-CB 3.83Å; T80-F141 HydrophobicContact CG2-CD2 4.02Å; T80-F141 HydrophobicContact CG2-CG 4Å; V81-F141 HydrophobicContact CG2-CB 4Å; F141-L146 HydrophobicContact CD2-CD2 3.96Å; F141-L146 HydrophobicContact CE1-CD2 4.2Å; F141-L146 HydrophobicContact CE2-CB 4.19Å; F141-L146 HydrophobicContact CE2-CD2 3.39Å; F141-L146 HydrophobicContact CE2-CG 3.71Å; F141-L146 HydrophobicContact CZ-CD2 3.51Å; F141-L146 HydrophobicContact CZ-CG 3.92Å; F141-A224 WeakPolarHBondContact CZ-O 3.3Å; F141-R228 PolarHBondContact N-O 2.81Å; F141-G229 VanDerWaalsContact CE1-N 3.3Å
142N89.4Confident87.9Confident148 Ų14856.7 Ų56.779%0.79131%0.312SS*.  trans-121.796172.6-170.411.4000109.8
143S90Very high87.9Confident22 Ų2255.8 Ų55.815%0.15431%0.31CS..  trans-138.7110.9175.6172.30000108.4D145 L146 S147S143-D145 PolarHBondContact O-N 3.38Å; S143-L146 PolarHBondContact O-N 3.29Å; S143-L146 PolarHBondContact OG-N 3.04Å; S143-S147 WeakPolarHBondContact O-CB 3.49Å; S143-S147 PolarHBondContact O-N 2.85Å; S143-S147 PolarHBondContact O-OG 3.05Å
144P87.7Confident87.7Confident89 Ų8957.1 Ų57.158%0.57832%0.317SS*.Hα-helixtrans-56.8-50179.3-27.235.9000112.1L146 S147 W148P144-L146 VanDerWaalsContact C-N 3.3Å; P144-L146 PolarHBondContact O-N 3.1Å; P144-S147 PolarHBondContact O-N 2.89Å; P144-S147 VanDerWaalsContact O-N 3.13Å; P144-S147 PolarHBondContact O-OG 3.28Å; P144-W148 PolarHBondContact O-N 3.05Å
145D89.9Confident87.5Confident108 Ų10864 Ų6458%0.57835%0.353SS*.Hα-helixtrans-60.7-37.7-176.5-46.6-33.9000112.5L86 S143 F149L86-D145 HydrophobicContact CD2-CB 3.83Å; S143-D145 PolarHBondContact O-N 3.38Å; D145-F149 WeakPolarHBondContact O-CD2 3.49Å; D145-F149 WeakPolarHBondContact O-CE2 3.36Å
146L90.6Very high87.7Confident0 Ų065.7 Ų65.70%035%0.35CS..Hα-helixtrans-73.5-44.5174.7-178.555000111.4T76 T80 L86 L90 F141 S143 P144 W148 F149 I221 A225T76-L146 HydrophobicContact CG2-CD1 3.93Å; T76-L146 HydrophobicContact CG2-CD2 3.69Å; T76-L146 HydrophobicContact CG2-CG 4.36Å; T80-L146 HydrophobicContact CG2-CD2 4.17Å; T80-L146 VanDerWaalsContact OG1-CD2 3.29Å; T80-L146 WeakPolarHBondContact OG1-CD2 3.38Å; L86-L146 HydrophobicContact CD1-CB 3.99Å; L86-L146 HydrophobicContact CD1-CD1 4Å; L90-L146 HydrophobicContact CD2-CD1 4.49Å; F141-L146 HydrophobicContact CD2-CD2 3.96Å; F141-L146 HydrophobicContact CE1-CD2 4.2Å; F141-L146 HydrophobicContact CE2-CB 4.19Å; F141-L146 HydrophobicContact CE2-CD2 3.39Å; F141-L146 HydrophobicContact CE2-CG 3.71Å; F141-L146 HydrophobicContact CZ-CD2 3.51Å; F141-L146 HydrophobicContact CZ-CG 3.92Å; S143-L146 PolarHBondContact O-N 3.29Å; S143-L146 PolarHBondContact OG-N 3.04Å; P144-L146 VanDerWaalsContact C-N 3.3Å; P144-L146 PolarHBondContact O-N 3.1Å; L146-W148 PolarHBondContact O-N 2.96Å; L146-F149 WeakPolarHBondContact O-CD2 3.4Å; L146-F149 PolarHBondContact O-N 2.95Å; L146-I221 HydrophobicContact CD1-CG2 4.39Å; L146-A225 HydrophobicContact CD1-CB 4.49Å; L146-A225 WeakPolarHBondContact O-CB 3.22Å
147S88.9Confident88.3Confident14 Ų1468.2 Ų68.210%0.09836%0.361CS..Hα-helixtrans-60.6-27.2179.272.50000113.2S143 P144 F149 G150 S151S143-S147 WeakPolarHBondContact O-CB 3.49Å; S143-S147 PolarHBondContact O-N 2.85Å; S143-S147 PolarHBondContact O-OG 3.05Å; P144-S147 PolarHBondContact O-N 2.89Å; P144-S147 VanDerWaalsContact O-N 3.13Å; P144-S147 PolarHBondContact O-OG 3.28Å; S147-F149 PolarHBondContact O-N 3.4Å; S147-G150 PolarHBondContact O-N 2.96Å; S147-G150 VanDerWaalsContact O-N 3.14Å; S147-S151 PolarHBondContact O-N 2.92Å; S147-S151 PolarHBondContact O-OG 3.13Å
148W90.6Very high88.7Confident116 Ų11661.8 Ų61.844%0.43933%0.331SS..Hα-helixtrans-58.6-27.7174.7-17387.7000113.4P144 L146 G150 G152 L154 T159P144-W148 PolarHBondContact O-N 3.05Å; L146-W148 PolarHBondContact O-N 2.96Å; W148-G150 VanDerWaalsContact C-N 3.33Å; W148-G150 PolarHBondContact O-N 3.11Å; W148-G152 VanDerWaalsContact O-CA 3.23Å; W148-G152 WeakPolarHBondContact O-CA 3.4Å; W148-G152 PolarHBondContact O-N 3.46Å; W148-L154 HydrophobicContact CZ2-CB 4.29Å; W148-T159 HydrophobicContact CD2-CG2 3.98Å; W148-T159 HydrophobicContact CE3-CG2 3.9Å; W148-T159 HydrophobicContact CH2-CG2 3.46Å; W148-T159 VanDerWaalsContact CH2-CG2 3.46Å; W148-T159 HydrophobicContact CZ2-CG2 3.52Å; W148-T159 HydrophobicContact CZ3-CG2 3.65Å; W148-T159 WeakPolarHBondContact O-CB 3.23Å; W148-T159 PolarHBondContact O-OG1 3.38Å
149F90.9Very high88.9Confident50 Ų5057.3 Ų57.322%0.21931%0.308CS..Hα-helixtrans-68.4-29.1177.6-72.8-94.7000113.6L86 L90 D145 L146 S147 T159 I163 A225L86-F149 HydrophobicContact CD1-CE2 4.45Å; L86-F149 HydrophobicContact CD2-CE2 4.24Å; L90-F149 HydrophobicContact CD1-CE2 4.37Å; L90-F149 HydrophobicContact CD1-CZ 4Å; D145-F149 WeakPolarHBondContact O-CD2 3.49Å; D145-F149 WeakPolarHBondContact O-CE2 3.36Å; L146-F149 WeakPolarHBondContact O-CD2 3.4Å; L146-F149 PolarHBondContact O-N 2.95Å; S147-F149 PolarHBondContact O-N 3.4Å; F149-T159 PolarHBondContact O-OG1 3.35Å; F149-I163 HydrophobicContact CD1-CD1 4.03Å; F149-A225 HydrophobicContact CB-CB 4.03Å
150G86.2Confident89.1Confident0 Ų056 Ų560%030%0.301CS..Hα-helixtrans-96.4-54.7176.800000112.8S147 W148 P160S147-G150 PolarHBondContact O-N 2.96Å; S147-G150 VanDerWaalsContact O-N 3.14Å; W148-G150 VanDerWaalsContact C-N 3.33Å; W148-G150 PolarHBondContact O-N 3.11Å; G150-P160 VanDerWaalsContact O-CD 3.3Å; G150-P160 WeakPolarHBondContact O-CD 3.46Å; G150-P160 VanDerWaalsContact O-CG 3.29Å; G150-P160 WeakPolarHBondContact O-CG 3.33Å
151S85.2Confident89.1Confident43 Ų4351.9 Ų51.930%0.30128%0.275SS..Hα-helixtrans-93.9-9.5-172.568.80000114.9R30 S147R30-S151 VanDerWaalsContact NH1-C 3.33Å; R30-S151 PolarHBondContact NH1-O 3Å; S147-S151 PolarHBondContact O-N 2.92Å; S147-S151 PolarHBondContact O-OG 3.13Å
152G87.4Confident89.2Confident9 Ų952.4 Ų52.49%0.09328%0.278CS..  trans-72.1-178.6-175.400000115.2W148 P158 T159W148-G152 VanDerWaalsContact O-CA 3.23Å; W148-G152 WeakPolarHBondContact O-CA 3.4Å; W148-G152 PolarHBondContact O-N 3.46Å; G152-P158 WeakPolarHBondContact O-CA 3.2Å; G152-T159 WeakPolarHBondContact CA-OG1 3.37Å; G152-T159 PolarHBondContact N-OG1 3.24Å; G152-T159 PolarHBondContact O-N 2.83Å; G152-T159 PolarHBondContact O-OG1 2.95Å
153S87.8Confident89.5Confident34 Ų3447 Ų4724%0.23825%0.249CC..EExtended strand (participates in β ladder)trans-147.1153.317457.50000112.4L157S153-L157 CarbonylContact C-O 3.21Å; S153-L157 WeakPolarHBondContact CA-O 3.44Å; S153-L157 WeakPolarHBondContact CB-O 3.4Å
154L86.7Confident89.7Confident87 Ų8746.5 Ų46.546%0.45525%0.246SC..EExtended strand (participates in β ladder)trans-148.7135.9173.9169.966.6000108W148 F156 L157 I162W148-L154 HydrophobicContact CZ2-CB 4.29Å; L154-F156 PolarHBondContact O-N 3Å; L154-L157 PolarHBondContact N-O 2.86Å; L154-L157 PolarHBondContact O-N 3.12Å; L154-L157 VanDerWaalsContact O-N 3.12Å; L154-I162 HydrophobicContact CB-CD1 3.63Å; L154-I162 HydrophobicContact CD2-CD1 4.47Å; L154-I162 HydrophobicContact CG-CD1 4.26Å; L154-I162 WeakPolarHBondContact O-CD1 3.47Å
155L85.5Confident90Very high148 Ų14845.6 Ų45.678%0.77524%0.239SC*.THydrogen-bonded Turntrans50.440.9-172.9-57.3173.5000112.7L157L155-L157 PolarHBondContact O-N 3.37Å
156F87Confident90.3Very high124 Ų12445.6 Ų45.654%0.54424%0.238SC..THydrogen-bonded Turntrans64.6-12.7-175.6-40.3-71.6000117.3L26 G29 L31 L154L26-F156 HydrophobicContact CD1-CB 4.16Å; L26-F156 HydrophobicContact CD1-CD1 3.78Å; L26-F156 HydrophobicContact CD1-CG 4.27Å; L26-F156 HydrophobicContact CD2-CD1 4.48Å; G29-F156 WeakPolarHBondContact O-CA 3.35Å; L31-F156 HydrophobicContact CD1-CB 4.09Å; L31-F156 HydrophobicContact CG-CB 3.95Å; L31-F156 PolarHBondContact N-O 3.19Å; L154-F156 PolarHBondContact O-N 3Å
157L88.6Confident90.6Very high61 Ų6146.2 Ų46.232%0.31924%0.242SC..EExtended strand (participates in β ladder)trans-83.6148.3176.5-68.6173.6000111.4L31 S153 L154 L155 I162L31-L157 HydrophobicContact CD1-CD2 4.44Å; S153-L157 CarbonylContact C-O 3.21Å; S153-L157 WeakPolarHBondContact CA-O 3.44Å; S153-L157 WeakPolarHBondContact CB-O 3.4Å; L154-L157 PolarHBondContact N-O 2.86Å; L154-L157 PolarHBondContact O-N 3.12Å; L154-L157 VanDerWaalsContact O-N 3.12Å; L155-L157 PolarHBondContact O-N 3.37Å; L157-I162 HydrophobicContact CB-CD1 4.01Å; L157-I162 HydrophobicContact CB-CG1 3.96Å
158P90.6Very high90.9Very high0 Ų047 Ų470%025%0.245CC..EExtended strand (participates in β ladder)trans-60.5143.1170.7-22.833.8000112.3R30 I36 N40 G152 P160 V161 I162R30-P158 HydrophobicContact CG-CG 4.46Å; I36-P158 HydrophobicContact CG2-CG 3.84Å; N40-P158 HydrophobicContact CB-CB 4.38Å; N40-P158 HydrophobicContact CB-CG 4.3Å; N40-P158 WeakPolarHBondContact OD1-CB 3.1Å; G152-P158 WeakPolarHBondContact O-CA 3.2Å; P158-P160 VanDerWaalsContact C-CD 3.47Å; P158-V161 HydrophobicContact CB-CG2 4.14Å; P158-V161 HydrophobicContact CG-CG2 4.27Å; P158-V161 WeakPolarHBondContact O-CB 3.39Å; P158-V161 PolarHBondContact O-N 3.48Å; P158-I162 PolarHBondContact O-N 3.48Å
159T92.5Very high91.2Very high3 Ų345.5 Ų45.52%0.01824%0.244CC..Hα-helixtrans-57.3-37.4-179.635.60000115W148 F149 G152 V161 I162 I163W148-T159 HydrophobicContact CD2-CG2 3.98Å; W148-T159 HydrophobicContact CE3-CG2 3.9Å; W148-T159 HydrophobicContact CH2-CG2 3.46Å; W148-T159 VanDerWaalsContact CH2-CG2 3.46Å; W148-T159 HydrophobicContact CZ2-CG2 3.52Å; W148-T159 HydrophobicContact CZ3-CG2 3.65Å; W148-T159 WeakPolarHBondContact O-CB 3.23Å; W148-T159 PolarHBondContact O-OG1 3.38Å; F149-T159 PolarHBondContact O-OG1 3.35Å; G152-T159 WeakPolarHBondContact CA-OG1 3.37Å; G152-T159 PolarHBondContact N-OG1 3.24Å; G152-T159 PolarHBondContact O-N 2.83Å; G152-T159 PolarHBondContact O-OG1 2.95Å; T159-V161 VanDerWaalsContact C-N 3.34Å; T159-V161 PolarHBondContact O-N 3.42Å; T159-I162 PolarHBondContact O-N 2.85Å; T159-I163 WeakPolarHBondContact O-CD1 3.4Å; T159-I163 VanDerWaalsContact O-CG1 3.3Å; T159-I163 WeakPolarHBondContact O-CG1 3.19Å; T159-I163 PolarHBondContact O-N 2.71Å
160P92Very high91.4Very high3 Ų348.2 Ų48.22%0.01926%0.261CS..Hα-helixtrans-58.5-42.6175.4-28.438000113.3N40 A43 G150 P158 I162 I163 A164 I222N40-P160 WeakPolarHBondContact OD1-CD 3.47Å; N40-P160 VanDerWaalsContact OD1-CG 3.31Å; N40-P160 WeakPolarHBondContact OD1-CG 3.31Å; A43-P160 HydrophobicContact CB-CB 3.66Å; A43-P160 WeakPolarHBondContact CB-O 3.47Å; G150-P160 VanDerWaalsContact O-CD 3.3Å; G150-P160 WeakPolarHBondContact O-CD 3.46Å; G150-P160 VanDerWaalsContact O-CG 3.29Å; G150-P160 WeakPolarHBondContact O-CG 3.33Å; P158-P160 VanDerWaalsContact C-CD 3.47Å; P160-I162 VanDerWaalsContact C-N 3.3Å; P160-I162 PolarHBondContact O-N 3.4Å; P160-I163 PolarHBondContact O-N 2.85Å; P160-A164 WeakPolarHBondContact O-CB 3.25Å; P160-A164 PolarHBondContact O-N 3.04Å; P160-I222 HydrophobicContact CB-CG2 3.85Å; P160-I222 HydrophobicContact CG-CG2 3.83Å
161V92.9Very high91.8Very high12 Ų1248.4 Ų48.47%0.07326%0.262CS..Hα-helixtrans-60.3-43.1178.5-174.80000110.4L39 N40 P158 T159 A164 V165L39-V161 HydrophobicContact CB-CG1 4.25Å; L39-V161 HydrophobicContact CB-CG2 3.9Å; N40-V161 HydrophobicContact CB-CG2 4.26Å; P158-V161 HydrophobicContact CB-CG2 4.14Å; P158-V161 HydrophobicContact CG-CG2 4.27Å; P158-V161 WeakPolarHBondContact O-CB 3.39Å; P158-V161 PolarHBondContact O-N 3.48Å; T159-V161 VanDerWaalsContact C-N 3.34Å; T159-V161 PolarHBondContact O-N 3.42Å; V161-A164 PolarHBondContact O-N 3.16Å; V161-V165 WeakPolarHBondContact O-CB 3.33Å; V161-V165 VanDerWaalsContact O-CG2 3.3Å; V161-V165 WeakPolarHBondContact O-CG2 3.4Å; V161-V165 PolarHBondContact O-N 2.97Å
162I93.9Very high92.3Very high30 Ų3052 Ų5215%0.15427%0.269CS..Hα-helixtrans-69.3-42-178.5-58.9166.7000110.4L154 L157 P158 T159 P160 A164 V165 L166L154-I162 HydrophobicContact CB-CD1 3.63Å; L154-I162 HydrophobicContact CD2-CD1 4.47Å; L154-I162 HydrophobicContact CG-CD1 4.26Å; L154-I162 WeakPolarHBondContact O-CD1 3.47Å; L157-I162 HydrophobicContact CB-CD1 4.01Å; L157-I162 HydrophobicContact CB-CG1 3.96Å; P158-I162 PolarHBondContact O-N 3.48Å; T159-I162 PolarHBondContact O-N 2.85Å; P160-I162 VanDerWaalsContact C-N 3.3Å; P160-I162 PolarHBondContact O-N 3.4Å; I162-A164 VanDerWaalsContact C-N 3.35Å; I162-A164 PolarHBondContact O-N 2.8Å; I162-V165 PolarHBondContact O-N 3.35Å; I162-L166 HydrophobicContact CG2-CD1 3.89Å; I162-L166 HydrophobicContact CG2-CG 4.25Å; I162-L166 WeakPolarHBondContact O-CB 3.39Å; I162-L166 VanDerWaalsContact O-CG 3.27Å; I162-L166 WeakPolarHBondContact O-CG 3.46Å; I162-L166 PolarHBondContact O-N 3.29Å
163I94.9Very high92.6Very high35 Ų3555.1 Ų55.118%0.17928%0.283CS..Hα-helixtrans-64.2-40.7176.6-62.9160.1000110.6F149 T159 P160 T167 I218 I222F149-I163 HydrophobicContact CD1-CD1 4.03Å; T159-I163 WeakPolarHBondContact O-CD1 3.4Å; T159-I163 VanDerWaalsContact O-CG1 3.3Å; T159-I163 WeakPolarHBondContact O-CG1 3.19Å; T159-I163 PolarHBondContact O-N 2.71Å; P160-I163 PolarHBondContact O-N 2.85Å; I163-T167 VanDerWaalsContact O-CB 3.29Å; I163-T167 WeakPolarHBondContact O-CB 3.28Å; I163-T167 PolarHBondContact O-N 3.38Å; I163-T167 PolarHBondContact O-OG1 3.34Å; I163-I218 HydrophobicContact CG2-CG2 3.47Å; I163-I218 VanDerWaalsContact CG2-CG2 3.47Å; I163-I222 HydrophobicContact CB-CD1 4.03Å; I163-I222 HydrophobicContact CD1-CD1 3.97Å; I163-I222 HydrophobicContact CD1-CG1 4.02Å; I163-I222 HydrophobicContact CG2-CD1 3.87Å
164A93.9Very high92.9Very high10 Ų1056.2 Ų56.28%0.08329%0.286CS..Hα-helixtrans-63.6-44.3173.800000112.3A43 L47 P160 V161 I162 T167 L168A43-A164 HydrophobicContact CB-CB 4Å; L47-A164 HydrophobicContact CG-CB 4.22Å; P160-A164 WeakPolarHBondContact O-CB 3.25Å; P160-A164 PolarHBondContact O-N 3.04Å; V161-A164 PolarHBondContact O-N 3.16Å; I162-A164 VanDerWaalsContact C-N 3.35Å; I162-A164 PolarHBondContact O-N 2.8Å; A164-T167 PolarHBondContact O-N 2.8Å; A164-L168 WeakPolarHBondContact O-CB 3.48Å; A164-L168 PolarHBondContact O-N 3.32Å
165V94.6Very high93.2Very high71 Ų7152.3 Ų52.343%0.4327%0.265SS..Hα-helixtrans-65.7-43.4177.1167.90000111.9V161 I162 L168 I169V161-V165 WeakPolarHBondContact O-CB 3.33Å; V161-V165 VanDerWaalsContact O-CG2 3.3Å; V161-V165 WeakPolarHBondContact O-CG2 3.4Å; V161-V165 PolarHBondContact O-N 2.97Å; I162-V165 PolarHBondContact O-N 3.35Å; V165-L168 PolarHBondContact O-N 2.85Å; V165-I169 HydrophobicContact CG1-CD1 3.78Å; V165-I169 HydrophobicContact CG1-CG1 4.49Å; V165-I169 VanDerWaalsContact O-CG1 3.28Å; V165-I169 WeakPolarHBondContact O-CG1 3.42Å; V165-I169 PolarHBondContact O-N 2.82Å
166L95.9Very high93.5Very high108 Ų10850.5 Ų50.557%0.56525%0.248SC*.Hα-helixtrans-64.1-40.2175.6-72.3173.8000111.5I162 I169 L170I162-L166 HydrophobicContact CG2-CD1 3.89Å; I162-L166 HydrophobicContact CG2-CG 4.25Å; I162-L166 WeakPolarHBondContact O-CB 3.39Å; I162-L166 VanDerWaalsContact O-CG 3.27Å; I162-L166 WeakPolarHBondContact O-CG 3.46Å; I162-L166 PolarHBondContact O-N 3.29Å; L166-I169 PolarHBondContact O-N 3Å; L166-L170 VanDerWaalsContact O-CB 3.27Å; L166-L170 WeakPolarHBondContact O-CB 3.49Å; L166-L170 PolarHBondContact O-N 3.46Å
167T96Very high93.8Very high12 Ų1252 Ų527%0.07426%0.255CS..Hα-helixtrans-65.6-42175.3-55.90000111.2L47 I50 I163 A164 L170 F171L47-T167 HydrophobicContact CD2-CG2 3.72Å; L47-T167 WeakPolarHBondContact CD2-OG1 3.46Å; I50-T167 HydrophobicContact CG2-CG2 4.33Å; I163-T167 VanDerWaalsContact O-CB 3.29Å; I163-T167 WeakPolarHBondContact O-CB 3.28Å; I163-T167 PolarHBondContact O-N 3.38Å; I163-T167 PolarHBondContact O-OG1 3.34Å; A164-T167 PolarHBondContact O-N 2.8Å; T167-L170 PolarHBondContact O-N 3.2Å; T167-F171 HydrophobicContact CG2-CD2 3.99Å; T167-F171 HydrophobicContact CG2-CE2 3.97Å; T167-F171 WeakPolarHBondContact O-CB 3.45Å; T167-F171 WeakPolarHBondContact O-CD2 3.34Å; T167-F171 PolarHBondContact O-N 2.98Å
168L96Very high94Very high30 Ų3052.5 Ų52.516%0.15726%0.26CS..Hα-helixtrans-60.4-46.6174.1178.161.2000111.7I50 A164 V165 F171 W172 L261 V265I50-L168 HydrophobicContact CD1-CB 3.84Å; I50-L168 HydrophobicContact CD1-CD1 4.25Å; I50-L168 HydrophobicContact CG1-CD1 4.25Å; A164-L168 WeakPolarHBondContact O-CB 3.48Å; A164-L168 PolarHBondContact O-N 3.32Å; V165-L168 PolarHBondContact O-N 2.85Å; L168-F171 PolarHBondContact O-N 3.48Å; L168-W172 WeakPolarHBondContact O-CB 3.14Å; L168-W172 PolarHBondContact O-N 2.89Å; L168-L261 HydrophobicContact CD1-CB 3.76Å; L168-V265 HydrophobicContact CD1-CG2 4.05Å; L168-V265 HydrophobicContact CD2-CB 4.46Å; L168-V265 HydrophobicContact CD2-CG2 4.19Å
169I96.1Very high94.1Very high85 Ų8554.7 Ų54.744%0.43628%0.279SS..Hα-helixtrans-63.3-45.7177.8-69.9165.9000110.4V165 L166 W172 L173V165-I169 HydrophobicContact CG1-CD1 3.78Å; V165-I169 HydrophobicContact CG1-CG1 4.49Å; V165-I169 VanDerWaalsContact O-CG1 3.28Å; V165-I169 WeakPolarHBondContact O-CG1 3.42Å; V165-I169 PolarHBondContact O-N 2.82Å; L166-I169 PolarHBondContact O-N 3Å; I169-W172 PolarHBondContact O-N 3.48Å; I169-L173 HydrophobicContact CG2-CD1 3.95Å; I169-L173 HydrophobicContact CG2-CG 4.43Å; I169-L173 WeakPolarHBondContact O-CB 3.33Å; I169-L173 VanDerWaalsContact O-CG 3.29Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 2.97Å
170L96.1Very high94.2Very high107 Ų10755.4 Ų55.456%0.5628%0.282SS*.Hα-helixtrans-59.7-48.1177.7179.162.6000111.5L166 T167 L173 L174L166-L170 VanDerWaalsContact O-CB 3.27Å; L166-L170 WeakPolarHBondContact O-CB 3.49Å; L166-L170 PolarHBondContact O-N 3.46Å; T167-L170 PolarHBondContact O-N 3.2Å; L170-L173 PolarHBondContact O-N 3.36Å; L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.06Å; L170-L174 PolarHBondContact O-N 2.91Å
171F95.3Very high94.2Very high5 Ų555.2 Ų55.22%0.02228%0.281CS..Hα-helixtrans-71.8-32.5-179.7-83.5-132000112.1I50 L54 T167 L168 L174 T175 L211 C215 L261I50-F171 HydrophobicContact CG2-CB 3.98Å; I50-F171 HydrophobicContact CG2-CD1 3.33Å; I50-F171 HydrophobicContact CG2-CD2 4.45Å; I50-F171 HydrophobicContact CG2-CE1 3.85Å; I50-F171 HydrophobicContact CG2-CG 3.68Å; L54-F171 HydrophobicContact CD1-CD1 3.77Å; L54-F171 HydrophobicContact CD1-CE1 3.87Å; T167-F171 HydrophobicContact CG2-CD2 3.99Å; T167-F171 HydrophobicContact CG2-CE2 3.97Å; T167-F171 WeakPolarHBondContact O-CB 3.45Å; T167-F171 WeakPolarHBondContact O-CD2 3.34Å; T167-F171 PolarHBondContact O-N 2.98Å; L168-F171 PolarHBondContact O-N 3.48Å; F171-L174 PolarHBondContact O-N 3.07Å; F171-T175 WeakPolarHBondContact O-CB 3.19Å; F171-T175 WeakPolarHBondContact O-CG2 3.31Å; F171-T175 PolarHBondContact O-N 2.72Å; F171-T175 PolarHBondContact O-OG1 3.34Å; F171-L211 HydrophobicContact CE1-CB 3.91Å; F171-L211 HydrophobicContact CE1-CD2 4.29Å; F171-L211 HydrophobicContact CE1-CG 4.5Å; F171-L211 HydrophobicContact CE2-CD2 4.44Å; F171-L211 HydrophobicContact CZ-CB 4.07Å; F171-L211 HydrophobicContact CZ-CD2 3.82Å; F171-L211 HydrophobicContact CZ-CG 4.46Å; F171-C215 VanDerWaalsContact CE1-SG 3.58Å; F171-C215 WeakPolarHBondContact CZ-SG 3.35Å; F171-L261 HydrophobicContact CB-CD1 4Å
172W93.9Very high94.2Very high118 Ų11860.9 Ų60.945%0.44731%0.308SS..Hα-helixtrans-66.7-44.3172.4-178.991.8000111.5L168 I169 T175 R176L168-W172 WeakPolarHBondContact O-CB 3.14Å; L168-W172 PolarHBondContact O-N 2.89Å; I169-W172 PolarHBondContact O-N 3.48Å; W172-T175 PolarHBondContact O-N 2.81Å; W172-T175 PolarHBondContact O-OG1 3.43Å; W172-R176 VanDerWaalsContact O-CB 3.28Å; W172-R176 WeakPolarHBondContact O-CB 3.41Å; W172-R176 PolarHBondContact O-N 2.63Å
173L94.9Very high94.2Very high75 Ų7563 Ų6339%0.39332%0.316SS..Hα-helixtrans-61.9-47.3172.3-72.1171000110.7I169 L170 T175 R176 K177I169-L173 HydrophobicContact CG2-CD1 3.95Å; I169-L173 HydrophobicContact CG2-CG 4.43Å; I169-L173 WeakPolarHBondContact O-CB 3.33Å; I169-L173 VanDerWaalsContact O-CG 3.29Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 2.97Å; L170-L173 PolarHBondContact O-N 3.36Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.44Å; L173-R176 PolarHBondContact O-N 2.85Å; L173-K177 HydrophobicContact CD2-CG 3.85Å; L173-K177 WeakPolarHBondContact O-CA 3.48Å; L173-K177 VanDerWaalsContact O-CB 3.22Å; L173-K177 WeakPolarHBondContact O-CB 3.44Å; L173-K177 PolarHBondContact O-N 3.15Å
174L93.8Very high94.2Very high57 Ų5761.3 Ų61.330%0.29831%0.308SS..Hα-helixtrans-57.1-43.3178.1-168.373.7000111.9L170 F171 T178 L180 L211L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.06Å; L170-L174 PolarHBondContact O-N 2.91Å; F171-L174 PolarHBondContact O-N 3.07Å; L174-T178 HydrophobicContact CD1-CG2 4.45Å; L174-T178 WeakPolarHBondContact O-CB 3.45Å; L174-T178 WeakPolarHBondContact O-CG2 3.2Å; L174-T178 PolarHBondContact O-OG1 3.49Å; L174-L180 HydrophobicContact CD2-CD2 3.56Å; L174-L180 HydrophobicContact CG-CD2 3.72Å; L174-L211 HydrophobicContact CD2-CD1 4.12Å; L174-L211 HydrophobicContact CD2-CD2 4.48Å
175T93.6Very high94.2Very high4 Ų463.3 Ų63.33%0.02532%0.315CS..Hα-helixtrans-85.3-25.4-177.453.90000114.9L54 F171 W172 L173 G181 F259 L261L54-T175 HydrophobicContact CD2-CG2 3.84Å; F171-T175 WeakPolarHBondContact O-CB 3.19Å; F171-T175 WeakPolarHBondContact O-CG2 3.31Å; F171-T175 PolarHBondContact O-N 2.72Å; F171-T175 PolarHBondContact O-OG1 3.34Å; W172-T175 PolarHBondContact O-N 2.81Å; W172-T175 PolarHBondContact O-OG1 3.43Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.44Å; T175-G181 WeakPolarHBondContact O-CA 3.33Å; T175-G181 PolarHBondContact O-N 2.85Å; T175-F259 HydrophobicContact CG2-CE2 4.12Å; T175-F259 HydrophobicContact CG2-CZ 3.88Å; T175-L261 HydrophobicContact CG2-CD1 4.36Å
176R91.6Very high94.1Very high111 Ų11161.5 Ų61.542%0.41931%0.308SS..Hα-helixtrans-111.3-8.3-176.8-58.6-60.5-177.9-156.1-3.3115W172 L173 E185 F259W172-R176 VanDerWaalsContact O-CB 3.28Å; W172-R176 WeakPolarHBondContact O-CB 3.41Å; W172-R176 PolarHBondContact O-N 2.63Å; L173-R176 PolarHBondContact O-N 2.85Å; R176-E185 IonicContact CZ-OE1 2.75Å; R176-E185 IonicContact NH1-OE1 2.66Å; R176-E185 PolarHBondContact NH1-OE1 3.38Å; R176-E185 IonicContact NH1-OE2 2.74Å; R176-E185 IonicContact NH2-OE1 3.97Å; R176-E185 PolarHBondContact NH2-OE1 3.13Å; R176-E185 VanDerWaalsContact NH2-OE1 3.07Å; R176-F259 PolarHBondContact NH2-O 3.4Å
177K92Very high94Very high155 Ų15556.5 Ų56.567%0.67428%0.282SS*.Hα-helixtrans-115.5-10.6173-56.5-63.6-174176.80114.1L173L173-K177 HydrophobicContact CD2-CG 3.85Å; L173-K177 WeakPolarHBondContact O-CA 3.48Å; L173-K177 VanDerWaalsContact O-CB 3.22Å; L173-K177 WeakPolarHBondContact O-CB 3.44Å; L173-K177 PolarHBondContact O-N 3.15Å
178T94Very high93.8Very high71 Ų7156.7 Ų56.744%0.43629%0.286SS..SBendtrans-116.2167.2170.590.30000111L174 L180L174-T178 HydrophobicContact CD1-CG2 4.45Å; L174-T178 WeakPolarHBondContact O-CB 3.45Å; L174-T178 WeakPolarHBondContact O-CG2 3.2Å; L174-T178 PolarHBondContact O-OG1 3.49Å; T178-L180 PolarHBondContact O-N 3.45Å; T178-L180 VanDerWaalsContact O-N 3.15Å; T178-L180 WeakPolarHBondContact OG1-CB 3.2Å; T178-L180 PolarHBondContact OG1-N 2.81Å; T178-L180 VanDerWaalsContact OG1-N 3.13Å
179A92.7Very high93.6Very high47 Ų4761 Ų6139%0.38831%0.308SS..THydrogen-bonded Turntrans-65.4-10.1175.600000114.3G181 M182 F183A179-G181 PolarHBondContact O-N 3.5Å; A179-M182 WeakPolarHBondContact O-CB 3.17Å; A179-M182 PolarHBondContact O-N 3.33Å; A179-F183 HydrophobicContact CB-CD2 4.11Å; A179-F183 HydrophobicContact CB-CE1 4.36Å; A179-F183 HydrophobicContact CB-CE2 3.59Å; A179-F183 HydrophobicContact CB-CZ 3.74Å; A179-F183 WeakPolarHBondContact O-CD2 3.03Å; A179-F183 WeakPolarHBondContact O-CG 3.22Å; A179-F183 PolarHBondContact O-N 3.44Å
180L93.5Very high93.3Very high17 Ų1760.7 Ų60.79%0.08931%0.307CS..Hα-helixtrans-56.8-45.4-175.3-178.362.4000112.9L174 T178 M182 F183 I184 I204 L207 L211L174-L180 HydrophobicContact CD2-CD2 3.56Å; L174-L180 HydrophobicContact CG-CD2 3.72Å; T178-L180 PolarHBondContact O-N 3.45Å; T178-L180 VanDerWaalsContact O-N 3.15Å; T178-L180 WeakPolarHBondContact OG1-CB 3.2Å; T178-L180 PolarHBondContact OG1-N 2.81Å; T178-L180 VanDerWaalsContact OG1-N 3.13Å; L180-M182 VanDerWaalsContact C-N 3.34Å; L180-M182 PolarHBondContact O-N 2.91Å; L180-F183 PolarHBondContact O-N 3.18Å; L180-I184 HydrophobicContact CD1-CD1 3.92Å; L180-I184 HydrophobicContact CD1-CG1 4.15Å; L180-I184 HydrophobicContact CD2-CD1 4.33Å; L180-I184 HydrophobicContact CG-CD1 3.76Å; L180-I184 HydrophobicContact CG-CG1 4.37Å; L180-I184 WeakPolarHBondContact O-CB 3.36Å; L180-I184 WeakPolarHBondContact O-CG1 3.35Å; L180-I184 PolarHBondContact O-N 3.21Å; L180-I204 HydrophobicContact CD1-CD1 4.34Å; L180-L207 HydrophobicContact CD1-CD2 3.66Å; L180-L207 HydrophobicContact CD2-CD2 4.29Å; L180-L211 HydrophobicContact CD2-CD1 4.13Å
181G92.3Very high93Very high0 Ų059.7 Ų59.70%030%0.301CS..Hα-helixtrans-62.7-41.3179.600000112.5T175 A179 I184 E185T175-G181 WeakPolarHBondContact O-CA 3.33Å; T175-G181 PolarHBondContact O-N 2.85Å; A179-G181 PolarHBondContact O-N 3.5Å; G181-I184 PolarHBondContact O-N 2.59Å; G181-E185 WeakPolarHBondContact O-CB 3.3Å; G181-E185 WeakPolarHBondContact O-CG 3.26Å; G181-E185 PolarHBondContact O-N 2.84Å
182M92.7Very high92.8Very high131 Ų13169 Ų6965%0.64534%0.336SS*.Hα-helixtrans-62.2-43.2175-174.8-165.3-63.800111.6A179 L180 A186A179-M182 WeakPolarHBondContact O-CB 3.17Å; A179-M182 PolarHBondContact O-N 3.33Å; L180-M182 VanDerWaalsContact C-N 3.34Å; L180-M182 PolarHBondContact O-N 2.91Å; M182-A186 WeakPolarHBondContact O-CB 3.49Å; M182-A186 PolarHBondContact O-N 3.4Å
183F94.7Very high92.7Very high74 Ų7465.9 Ų65.933%0.32534%0.336SS..Hα-helixtrans-67.9-37178-63.2-30000112.7A179 L180 V187 V199 I204A179-F183 HydrophobicContact CB-CD2 4.11Å; A179-F183 HydrophobicContact CB-CE1 4.36Å; A179-F183 HydrophobicContact CB-CE2 3.59Å; A179-F183 HydrophobicContact CB-CZ 3.74Å; A179-F183 WeakPolarHBondContact O-CD2 3.03Å; A179-F183 WeakPolarHBondContact O-CG 3.22Å; A179-F183 PolarHBondContact O-N 3.44Å; L180-F183 PolarHBondContact O-N 3.18Å; F183-V187 WeakPolarHBondContact O-CB 3.32Å; F183-V187 VanDerWaalsContact O-CG2 3.26Å; F183-V187 WeakPolarHBondContact O-CG2 3.25Å; F183-V187 PolarHBondContact O-N 3.25Å; F183-V199 HydrophobicContact CB-CG1 4Å; F183-V199 HydrophobicContact CD1-CG1 3.94Å; F183-V199 HydrophobicContact CD1-CG2 3.75Å; F183-V199 HydrophobicContact CE1-CG2 4.01Å; F183-V199 HydrophobicContact CG-CG1 3.98Å; F183-I204 HydrophobicContact CB-CD1 3.62Å; F183-I204 HydrophobicContact CB-CG1 3.98Å; F183-I204 HydrophobicContact CB-CG2 4.44Å; F183-I204 HydrophobicContact CD2-CD1 3.86Å; F183-I204 HydrophobicContact CG-CD1 4.12Å
184I94.2Very high92.6Very high0 Ų062.6 Ų62.60%032%0.319CS..Hα-helixtrans-64.3-51.1173.8-73.3172.4000110.7L54 A57 T58 L180 G181 A186 V187 G188 I204 T208 F259L54-I184 HydrophobicContact CB-CD1 4.44Å; L54-I184 HydrophobicContact CD2-CD1 4.19Å; A57-I184 HydrophobicContact CB-CG2 3.35Å; T58-I184 HydrophobicContact CG2-CG1 4.45Å; T58-I184 HydrophobicContact CG2-CG2 4.07Å; L180-I184 HydrophobicContact CD1-CD1 3.92Å; L180-I184 HydrophobicContact CD1-CG1 4.15Å; L180-I184 HydrophobicContact CD2-CD1 4.33Å; L180-I184 HydrophobicContact CG-CD1 3.76Å; L180-I184 HydrophobicContact CG-CG1 4.37Å; L180-I184 WeakPolarHBondContact O-CB 3.36Å; L180-I184 WeakPolarHBondContact O-CG1 3.35Å; L180-I184 PolarHBondContact O-N 3.21Å; G181-I184 PolarHBondContact O-N 2.59Å; I184-A186 PolarHBondContact O-N 2.92Å; I184-V187 PolarHBondContact O-N 2.98Å; I184-G188 PolarHBondContact O-N 3.5Å; I184-I204 HydrophobicContact CG1-CG2 3.83Å; I184-T208 HydrophobicContact CD1-CG2 3.6Å; I184-T208 HydrophobicContact CG1-CG2 3.82Å; I184-F259 HydrophobicContact CB-CE1 4.38Å; I184-F259 HydrophobicContact CG2-CD1 4.24Å; I184-F259 HydrophobicContact CG2-CE1 3.76Å
185E93.7Very high92.5Very high51 Ų5166.4 Ų66.424%0.23833%0.334CS..Hα-helixtrans-59.3-44.3177.2-71.5174.2-17200111R176 G181 G188 I189 F259R176-E185 IonicContact CZ-OE1 2.75Å; R176-E185 IonicContact NH1-OE1 2.66Å; R176-E185 PolarHBondContact NH1-OE1 3.38Å; R176-E185 IonicContact NH1-OE2 2.74Å; R176-E185 IonicContact NH2-OE1 3.97Å; R176-E185 PolarHBondContact NH2-OE1 3.13Å; R176-E185 VanDerWaalsContact NH2-OE1 3.07Å; G181-E185 WeakPolarHBondContact O-CB 3.3Å; G181-E185 WeakPolarHBondContact O-CG 3.26Å; G181-E185 PolarHBondContact O-N 2.84Å; E185-G188 PolarHBondContact O-N 2.93Å; E185-I189 WeakPolarHBondContact O-CB 3.21Å; E185-I189 VanDerWaalsContact O-CG1 3.25Å; E185-I189 WeakPolarHBondContact O-CG1 3.22Å; E185-I189 PolarHBondContact O-N 2.97Å; E185-F259 HydrophobicContact CG-CD1 3.9Å; E185-F259 HydrophobicContact CG-CE1 3.72Å
186A93.4Very high92.6Very high33 Ų3373 Ų7327%0.27337%0.368SS..Hα-helixtrans-64-41.3177.700000113.5M182 I184 N190 A194M182-A186 WeakPolarHBondContact O-CB 3.49Å; M182-A186 PolarHBondContact O-N 3.4Å; I184-A186 PolarHBondContact O-N 2.92Å; A186-N190 CarbonylContact O-C 3.6Å; A186-N190 PolarHBondContact O-N 3.32Å; A186-A194 HydrophobicContact CB-CB 4.19Å
187V93.4Very high92.7Very high4 Ų471.6 Ų71.62%0.02438%0.381CS..Hα-helixtrans-63.1-44.2175.6163.30000111.1T58 F183 I184 N190 I191 A194 V199 T201 I204 V205T58-V187 HydrophobicContact CG2-CG1 4.11Å; F183-V187 WeakPolarHBondContact O-CB 3.32Å; F183-V187 VanDerWaalsContact O-CG2 3.26Å; F183-V187 WeakPolarHBondContact O-CG2 3.25Å; F183-V187 PolarHBondContact O-N 3.25Å; I184-V187 PolarHBondContact O-N 2.98Å; V187-N190 CarbonylContact O-C 3.59Å; V187-I191 HydrophobicContact CG1-CD1 4.37Å; V187-I191 HydrophobicContact CG1-CG1 4.27Å; V187-I191 WeakPolarHBondContact O-CA 3.22Å; V187-I191 PolarHBondContact O-N 3.39Å; V187-A194 HydrophobicContact CG2-CB 4.07Å; V187-V199 HydrophobicContact CG2-CG1 4.49Å; V187-T201 HydrophobicContact CG2-CG2 3.77Å; V187-I204 HydrophobicContact CB-CG2 4.42Å; V187-I204 HydrophobicContact CG2-CB 4.19Å; V187-I204 HydrophobicContact CG2-CG2 4.01Å; V187-V205 HydrophobicContact CG1-CG2 3.91Å
188G91.5Very high92.7Very high15 Ų1567.4 Ų67.416%0.15538%0.382CS..Hα-helixtrans-67.4-40.6178.100000113.9A57 I184 E185A57-G188 VanDerWaalsContact O-CA 3.3Å; A57-G188 WeakPolarHBondContact O-CA 3.46Å; I184-G188 PolarHBondContact O-N 3.5Å; E185-G188 PolarHBondContact O-N 2.93Å
189I91.4Very high92.7Very high122 Ų12265 Ų6563%0.62637%0.367SS*.Hα-helixtrans-65-50.1176.6-68.6165.9000110.5E185E185-I189 WeakPolarHBondContact O-CB 3.21Å; E185-I189 VanDerWaalsContact O-CG1 3.25Å; E185-I189 WeakPolarHBondContact O-CG1 3.22Å; E185-I189 PolarHBondContact O-N 2.97Å
190N91Very high92.7Very high77 Ų7767 Ų6741%0.41237%0.371SS..Hα-helixtrans-161.494.8177.7-172-26.2000112A186 V187 R192 A193 A194A186-N190 CarbonylContact O-C 3.6Å; A186-N190 PolarHBondContact O-N 3.32Å; V187-N190 CarbonylContact O-C 3.59Å; N190-R192 PolarHBondContact O-N 3.36Å; N190-R192 WeakPolarHBondContact OD1-CA 3.08Å; N190-R192 WeakPolarHBondContact OD1-CB 3.27Å; N190-R192 PolarHBondContact OD1-N 2.77Å; N190-A193 HydrophobicContact CB-CB 3.86Å; N190-A193 PolarHBondContact O-N 2.85Å; N190-A193 PolarHBondContact OD1-N 3.45Å; N190-A194 PolarHBondContact O-N 3.28Å
191I90.5Very high92.7Very high86 Ų8666.9 Ų66.944%0.44137%0.371SS..Hα-helixtrans-53.9-26.9176.9-165169.3000114.4V187 K195 T201V187-I191 HydrophobicContact CG1-CD1 4.37Å; V187-I191 HydrophobicContact CG1-CG1 4.27Å; V187-I191 WeakPolarHBondContact O-CA 3.22Å; V187-I191 PolarHBondContact O-N 3.39Å; I191-K195 WeakPolarHBondContact O-CB 3.41Å; I191-K195 PolarHBondContact O-N 3.22Å; I191-T201 HydrophobicContact CG1-CG2 4.01Å
192R90.2Very high92.8Very high201 Ų20174 Ų7476%0.75840%0.398SS*.Hα-helixtrans-76.4-43.3175.7-58.5-177.1-177.7-176.51.4111.2N190 K195 N196N190-R192 PolarHBondContact O-N 3.36Å; N190-R192 WeakPolarHBondContact OD1-CA 3.08Å; N190-R192 WeakPolarHBondContact OD1-CB 3.27Å; N190-R192 PolarHBondContact OD1-N 2.77Å; R192-K195 PolarHBondContact O-N 3.19Å; R192-N196 WeakPolarHBondContact O-CB 3.34Å; R192-N196 VanDerWaalsContact O-CG 3.23Å; R192-N196 PolarHBondContact O-N 3.1Å; R192-N196 PolarHBondContact O-OD1 3.38Å
193A91.7Very high92.9Very high52 Ų5272.1 Ų72.143%0.4339%0.389SS..Hα-helixtrans-65.4-45.8175.900000111.4N190 K195 N196 A197N190-A193 HydrophobicContact CB-CB 3.86Å; N190-A193 PolarHBondContact O-N 2.85Å; N190-A193 PolarHBondContact OD1-N 3.45Å; A193-K195 VanDerWaalsContact C-N 3.33Å; A193-K195 PolarHBondContact O-N 3.48Å; A193-N196 PolarHBondContact O-N 3.36Å; A193-N196 VanDerWaalsContact O-N 3.14Å; A193-A197 WeakPolarHBondContact O-CB 3.45Å; A193-A197 PolarHBondContact O-N 3.42Å
194A92.6Very high93Very high6 Ų669.2 Ų69.25%0.0538%0.377CS..Hα-helixtrans-57.1-45.2175.800000112A186 V187 N190 N196 A197 G198 V199 T201A186-A194 HydrophobicContact CB-CB 4.19Å; V187-A194 HydrophobicContact CG2-CB 4.07Å; N190-A194 PolarHBondContact O-N 3.28Å; A194-N196 PolarHBondContact O-N 3.01Å; A194-A197 PolarHBondContact O-N 3.34Å; A194-G198 PolarHBondContact O-N 3.43Å; A194-V199 HydrophobicContact CB-CB 4.3Å; A194-V199 HydrophobicContact CB-CG2 4.48Å; A194-V199 VanDerWaalsContact O-CB 3.27Å; A194-V199 WeakPolarHBondContact O-CB 3.42Å; A194-V199 WeakPolarHBondContact O-CG2 3.18Å; A194-V199 PolarHBondContact O-N 2.9Å; A194-T201 HydrophobicContact CB-CG2 3.96Å
195K92.8Very high93Very high138 Ų13869.8 Ų69.860%0.638%0.381SS*.Hα-helixtrans-62.1-43.1175.5-168.7-161.8174.2-154.30112.3I191 R192 A193 A197 G198 T201I191-K195 WeakPolarHBondContact O-CB 3.41Å; I191-K195 PolarHBondContact O-N 3.22Å; R192-K195 PolarHBondContact O-N 3.19Å; A193-K195 VanDerWaalsContact C-N 3.33Å; A193-K195 PolarHBondContact O-N 3.48Å; K195-A197 VanDerWaalsContact C-N 3.27Å; K195-A197 PolarHBondContact O-N 3.12Å; K195-G198 PolarHBondContact O-N 2.96Å; K195-G198 VanDerWaalsContact O-N 3.09Å; K195-T201 HydrophobicContact CB-CG2 3.87Å
196N94.4Very high93.1Very high141 Ų14169 Ų6975%0.75438%0.378SS*.Hα-helixtrans-68.9-26.4178.9-70.43.2000112.4R192 A193 A194 G198R192-N196 WeakPolarHBondContact O-CB 3.34Å; R192-N196 VanDerWaalsContact O-CG 3.23Å; R192-N196 PolarHBondContact O-N 3.1Å; R192-N196 PolarHBondContact O-OD1 3.38Å; A193-N196 PolarHBondContact O-N 3.36Å; A193-N196 VanDerWaalsContact O-N 3.14Å; A194-N196 PolarHBondContact O-N 3.01Å; N196-G198 PolarHBondContact O-N 2.66Å
197A93.5Very high93.2Very high82 Ų8270.4 Ų70.468%0.67838%0.38SS*.THydrogen-bonded Turntrans-8010.3170.600000113.8A193 A194 K195 V199A193-A197 WeakPolarHBondContact O-CB 3.45Å; A193-A197 PolarHBondContact O-N 3.42Å; A194-A197 PolarHBondContact O-N 3.34Å; K195-A197 VanDerWaalsContact C-N 3.27Å; K195-A197 PolarHBondContact O-N 3.12Å; A197-V199 PolarHBondContact O-N 2.9Å
198G92.8Very high93.3Very high67 Ų6770.2 Ų70.269%0.69138%0.379SS*.THydrogen-bonded Turntrans84.4-1.3176.700000115.6A194 K195 N196 N200A194-G198 PolarHBondContact O-N 3.43Å; K195-G198 PolarHBondContact O-N 2.96Å; K195-G198 VanDerWaalsContact O-N 3.09Å; N196-G198 PolarHBondContact O-N 2.66Å; G198-N200 PolarHBondContact O-N 2.95Å
199V92.9Very high93.6Very high20 Ų2069.5 Ų69.512%0.12137%0.372CS..  trans-67.3125.8176.2-174.40000109.2F183 V187 A194 A197 T201 I204F183-V199 HydrophobicContact CB-CG1 4Å; F183-V199 HydrophobicContact CD1-CG1 3.94Å; F183-V199 HydrophobicContact CD1-CG2 3.75Å; F183-V199 HydrophobicContact CE1-CG2 4.01Å; F183-V199 HydrophobicContact CG-CG1 3.98Å; V187-V199 HydrophobicContact CG2-CG1 4.49Å; A194-V199 HydrophobicContact CB-CB 4.3Å; A194-V199 HydrophobicContact CB-CG2 4.48Å; A194-V199 VanDerWaalsContact O-CB 3.27Å; A194-V199 WeakPolarHBondContact O-CB 3.42Å; A194-V199 WeakPolarHBondContact O-CG2 3.18Å; A194-V199 PolarHBondContact O-N 2.9Å; A197-V199 PolarHBondContact O-N 2.9Å; V199-T201 WeakPolarHBondContact O-CG2 3.43Å; V199-T201 PolarHBondContact O-N 3.21Å; V199-I204 HydrophobicContact CG1-CD1 4.48Å; V199-I204 HydrophobicContact CG1-CG1 3.79Å
200N94.4Very high93.9Very high89 Ų8965.1 Ų65.148%0.47635%0.35SS..  trans-75.378.3175.3-169.5-17.3000110.5G198 R202 I203 I204G198-N200 PolarHBondContact O-N 2.95Å; N200-R202 PolarHBondContact O-N 2.97Å; N200-I203 HydrophobicContact CB-CB 4.49Å; N200-I203 HydrophobicContact CB-CD1 4.5Å; N200-I203 VanDerWaalsContact ND2-CD1 3.26Å; N200-I203 WeakPolarHBondContact ND2-CD1 3.33Å; N200-I203 PolarHBondContact O-N 3.23Å; N200-I204 PolarHBondContact O-N 2.84Å
201T93.5Very high94.2Very high16 Ų1662.3 Ų62.310%0.09834%0.335CS..Hα-helixtrans-56.3-27.3-172.963.30000113.7V187 I191 A194 K195 V199 V205V187-T201 HydrophobicContact CG2-CG2 3.77Å; I191-T201 HydrophobicContact CG1-CG2 4.01Å; A194-T201 HydrophobicContact CB-CG2 3.96Å; K195-T201 HydrophobicContact CB-CG2 3.87Å; V199-T201 WeakPolarHBondContact O-CG2 3.43Å; V199-T201 PolarHBondContact O-N 3.21Å; T201-V205 WeakPolarHBondContact O-CG2 3.41Å; T201-V205 PolarHBondContact O-N 2.92Å
202R93.9Very high94.5Very high149 Ų14958.2 Ų58.256%0.56231%0.314SS*.Hα-helixtrans-63.3-49.1173.4-66.3-178.8176.9152.3-5111.8A109 N200 I204 V205 M206A109-R202 HydrophobicContact CB-CB 4.39Å; A109-R202 WeakPolarHBondContact CB-O 3.28Å; N200-R202 PolarHBondContact O-N 2.97Å; R202-I204 VanDerWaalsContact C-N 3.35Å; R202-V205 PolarHBondContact O-N 3.07Å; R202-M206 VanDerWaalsContact O-CG 3.31Å; R202-M206 WeakPolarHBondContact O-CG 3.37Å; R202-M206 PolarHBondContact O-N 3Å
203I95Very high94.8Very high91 Ų9148.7 Ų48.747%0.46728%0.279SS..Hα-helixtrans-66.2-40.4-179.6-65-177.9000110.3N200 V205 M206 L207N200-I203 HydrophobicContact CB-CB 4.49Å; N200-I203 HydrophobicContact CB-CD1 4.5Å; N200-I203 VanDerWaalsContact ND2-CD1 3.26Å; N200-I203 WeakPolarHBondContact ND2-CD1 3.33Å; N200-I203 PolarHBondContact O-N 3.23Å; I203-V205 PolarHBondContact O-N 2.75Å; I203-M206 HydrophobicContact CG1-CE 4.03Å; I203-M206 PolarHBondContact O-N 3.06Å; I203-L207 WeakPolarHBondContact O-CB 3.4Å; I203-L207 PolarHBondContact O-N 2.82Å
204I95.5Very high95.1Very high14 Ų1448.2 Ų48.27%0.07227%0.269CS..Hα-helixtrans-59.6-47.7176.9-57.3-57.2000111.2L180 F183 I184 V187 V199 N200 R202 L207 T208L180-I204 HydrophobicContact CD1-CD1 4.34Å; F183-I204 HydrophobicContact CB-CD1 3.62Å; F183-I204 HydrophobicContact CB-CG1 3.98Å; F183-I204 HydrophobicContact CB-CG2 4.44Å; F183-I204 HydrophobicContact CD2-CD1 3.86Å; F183-I204 HydrophobicContact CG-CD1 4.12Å; I184-I204 HydrophobicContact CG1-CG2 3.83Å; V187-I204 HydrophobicContact CB-CG2 4.42Å; V187-I204 HydrophobicContact CG2-CB 4.19Å; V187-I204 HydrophobicContact CG2-CG2 4.01Å; V199-I204 HydrophobicContact CG1-CD1 4.48Å; V199-I204 HydrophobicContact CG1-CG1 3.79Å; N200-I204 PolarHBondContact O-N 2.84Å; R202-I204 VanDerWaalsContact C-N 3.35Å; I204-L207 PolarHBondContact O-N 3.34Å; I204-T208 PolarHBondContact O-N 3.12Å; I204-T208 VanDerWaalsContact O-N 3.16Å
205V94.3Very high95.3Very high11 Ų1148 Ų487%0.06727%0.266CS..Hα-helixtrans-66.5-43.3177.7174.80000111.7V108 A109 V187 T201 R202 I203 L207 T208 Y209V108-V205 HydrophobicContact CB-CG1 4.4Å; V108-V205 HydrophobicContact CG1-CG1 3.83Å; A109-V205 HydrophobicContact CB-CB 4.05Å; A109-V205 HydrophobicContact CB-CG1 3.99Å; V187-V205 HydrophobicContact CG1-CG2 3.91Å; T201-V205 WeakPolarHBondContact O-CG2 3.41Å; T201-V205 PolarHBondContact O-N 2.92Å; R202-V205 PolarHBondContact O-N 3.07Å; I203-V205 PolarHBondContact O-N 2.75Å; V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 3.11Å; V205-T208 PolarHBondContact O-N 2.92Å; V205-T208 PolarHBondContact O-OG1 2.95Å; V205-Y209 HydrophobicContact CG1-CD2 4.22Å; V205-Y209 HydrophobicContact CG1-CE2 3.83Å; V205-Y209 VanDerWaalsContact O-CD2 3.25Å; V205-Y209 WeakPolarHBondContact O-CD2 3.07Å; V205-Y209 PolarHBondContact O-N 3.03Å
206M95.9Very high95.4Very high36 Ų3641.4 Ų41.418%0.17724%0.238CC..Hα-helixtrans-59.6-40.6175.4-70.7-174.5-59.500112.1G105 I106 A109 I110 R202 I203 T208 Y209 V210G105-M206 WeakPolarHBondContact O-CG 3.34Å; I106-M206 HydrophobicContact CG1-SD 4.23Å; A109-M206 HydrophobicContact CB-CG 3.6Å; A109-M206 HydrophobicContact CB-SD 4.48Å; I110-M206 HydrophobicContact CD1-SD 3.87Å; I110-M206 HydrophobicContact CG1-SD 4.1Å; R202-M206 VanDerWaalsContact O-CG 3.31Å; R202-M206 WeakPolarHBondContact O-CG 3.37Å; R202-M206 PolarHBondContact O-N 3Å; I203-M206 HydrophobicContact CG1-CE 4.03Å; I203-M206 PolarHBondContact O-N 3.06Å; M206-T208 PolarHBondContact O-N 3.09Å; M206-Y209 PolarHBondContact O-N 3.4Å; M206-V210 WeakPolarHBondContact O-CG2 3.34Å; M206-V210 PolarHBondContact O-N 3.03Å
207L95.9Very high95.6Very high61 Ų6134.7 Ų34.732%0.31920%0.202SC..Hα-helixtrans-67-33.8-178.8-177.858.2000112.5L180 I203 I204 V205 V210 L211L180-L207 HydrophobicContact CD1-CD2 3.66Å; L180-L207 HydrophobicContact CD2-CD2 4.29Å; I203-L207 WeakPolarHBondContact O-CB 3.4Å; I203-L207 PolarHBondContact O-N 2.82Å; I204-L207 PolarHBondContact O-N 3.34Å; V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 3.11Å; L207-V210 PolarHBondContact O-N 3.42Å; L207-L211 HydrophobicContact CD1-CD1 4.17Å; L207-L211 HydrophobicContact CD1-CG 4.09Å; L207-L211 HydrophobicContact CG-CD1 4.02Å; L207-L211 HydrophobicContact CG-CG 4.39Å; L207-L211 WeakPolarHBondContact O-CB 3.14Å; L207-L211 VanDerWaalsContact O-CG 3.25Å; L207-L211 WeakPolarHBondContact O-CG 3.38Å; L207-L211 PolarHBondContact O-N 2.96Å
208T96.1Very high95.7Very high0 Ų032.3 Ų32.30%018%0.178CC..Hα-helixtrans-68.3-38.1176.456.90000112.5L54 T58 I184 I204 V205 M206 S212L54-T208 HydrophobicContact CB-CG2 3.87Å; L54-T208 WeakPolarHBondContact O-CG2 3.4Å; T58-T208 HydrophobicContact CG2-CG2 3.8Å; I184-T208 HydrophobicContact CD1-CG2 3.6Å; I184-T208 HydrophobicContact CG1-CG2 3.82Å; I204-T208 PolarHBondContact O-N 3.12Å; I204-T208 VanDerWaalsContact O-N 3.16Å; V205-T208 PolarHBondContact O-N 2.92Å; V205-T208 PolarHBondContact O-OG1 2.95Å; M206-T208 PolarHBondContact O-N 3.09Å; T208-S212 WeakPolarHBondContact O-CB 3.29Å; T208-S212 PolarHBondContact O-N 3.23Å
209Y97.1Very high95.8Very high1 Ų129.1 Ų29.10%0.00415%0.145CC..Hα-helixtrans-69.7-37.9171.5-68.4-80.8000112.9V55 D62 G101 N104 V108 P115 T119 V205 M206 L211 S212 G213V55-Y209 HydrophobicContact CG1-CD1 4.19Å; V55-Y209 HydrophobicContact CG1-CE1 3.51Å; V55-Y209 HydrophobicContact CG1-CE2 4.35Å; V55-Y209 HydrophobicContact CG2-CD1 4.03Å; V55-Y209 HydrophobicContact CG2-CE1 4.19Å; V55-Y209 HydrophobicContact CG2-CG 4.36Å; D62-Y209 HydrophobicContact CB-CD1 3.93Å; D62-Y209 HydrophobicContact CB-CE1 3.85Å; G101-Y209 WeakPolarHBondContact CA-O 3.27Å; G101-Y209 WeakPolarHBondContact O-CB 3.32Å; N104-Y209 HydrophobicContact CB-CD1 3.71Å; N104-Y209 HydrophobicContact CB-CE1 4.35Å; N104-Y209 HydrophobicContact CB-CG 3.98Å; V108-Y209 HydrophobicContact CB-CE2 3.93Å; V108-Y209 HydrophobicContact CG1-CE2 3.95Å; V108-Y209 HydrophobicContact CG2-CE2 3.97Å; P115-Y209 VanDerWaalsContact CB-OH 3.24Å; P115-Y209 WeakPolarHBondContact CB-OH 3.28Å; T119-Y209 HydrophobicContact CG2-CD1 4.26Å; T119-Y209 HydrophobicContact CG2-CE1 3.73Å; V205-Y209 HydrophobicContact CG1-CD2 4.22Å; V205-Y209 HydrophobicContact CG1-CE2 3.83Å; V205-Y209 VanDerWaalsContact O-CD2 3.25Å; V205-Y209 WeakPolarHBondContact O-CD2 3.07Å; V205-Y209 PolarHBondContact O-N 3.03Å; M206-Y209 PolarHBondContact O-N 3.4Å; Y209-L211 VanDerWaalsContact C-N 3.33Å; Y209-L211 PolarHBondContact O-N 3.44Å; Y209-S212 WeakPolarHBondContact O-CB 3.31Å; Y209-S212 PolarHBondContact O-N 2.85Å; Y209-G213 PolarHBondContact O-N 3.29Å
210V97.6Very high95.8Very high30 Ų3028.2 Ų28.218%0.18214%0.139CC..Hα-helixtrans-61.2-41.9173.91690000111.6I98 L102 M206 L207 L214I98-V210 HydrophobicContact CG2-CG1 4.19Å; L102-V210 HydrophobicContact CB-CG2 3.93Å; L102-V210 HydrophobicContact CD1-CG2 4.33Å; M206-V210 WeakPolarHBondContact O-CG2 3.34Å; M206-V210 PolarHBondContact O-N 3.03Å; L207-V210 PolarHBondContact O-N 3.42Å; V210-L214 WeakPolarHBondContact O-CB 3.46Å; V210-L214 PolarHBondContact O-N 3.45Å
211L97Very high95.9Very high18 Ų1824.4 Ų24.49%0.09412%0.119CC..Hα-helixtrans-68.8-35.2175.1-69.5171.1000112.1L54 F171 L174 L180 L207 Y209 L214 C215L54-L211 HydrophobicContact CD1-CB 4.13Å; L54-L211 HydrophobicContact CD1-CD1 3.71Å; F171-L211 HydrophobicContact CE1-CB 3.91Å; F171-L211 HydrophobicContact CE1-CD2 4.29Å; F171-L211 HydrophobicContact CE1-CG 4.5Å; F171-L211 HydrophobicContact CE2-CD2 4.44Å; F171-L211 HydrophobicContact CZ-CB 4.07Å; F171-L211 HydrophobicContact CZ-CD2 3.82Å; F171-L211 HydrophobicContact CZ-CG 4.46Å; L174-L211 HydrophobicContact CD2-CD1 4.12Å; L174-L211 HydrophobicContact CD2-CD2 4.48Å; L180-L211 HydrophobicContact CD2-CD1 4.13Å; L207-L211 HydrophobicContact CD1-CD1 4.17Å; L207-L211 HydrophobicContact CD1-CG 4.09Å; L207-L211 HydrophobicContact CG-CD1 4.02Å; L207-L211 HydrophobicContact CG-CG 4.39Å; L207-L211 WeakPolarHBondContact O-CB 3.14Å; L207-L211 VanDerWaalsContact O-CG 3.25Å; L207-L211 WeakPolarHBondContact O-CG 3.38Å; L207-L211 PolarHBondContact O-N 2.96Å; Y209-L211 VanDerWaalsContact C-N 3.33Å; Y209-L211 PolarHBondContact O-N 3.44Å; L211-L214 PolarHBondContact O-N 2.6Å; L211-C215 PolarHBondContact O-N 3.09Å; L211-C215 PolarHBondContact O-SG 3.36Å; L211-C215 VanDerWaalsContact O-SG 3.37Å
212S96.6Very high95.9Very high0 Ų023.9 Ų23.90%012%0.116CC..Hα-helixtrans-60.5-53.3171.9-177.60000112.1D62 V65 T208 Y209 L214 C215 A216D62-S212 VanDerWaalsContact OD2-CB 3.29Å; D62-S212 WeakPolarHBondContact OD2-CB 3.33Å; D62-S212 PolarHBondContact OD2-OG 3.45Å; V65-S212 VanDerWaalsContact CG1-OG 3.26Å; V65-S212 WeakPolarHBondContact CG1-OG 3.39Å; T208-S212 WeakPolarHBondContact O-CB 3.29Å; T208-S212 PolarHBondContact O-N 3.23Å; Y209-S212 WeakPolarHBondContact O-CB 3.31Å; Y209-S212 PolarHBondContact O-N 2.85Å; S212-L214 VanDerWaalsContact C-N 3.31Å; S212-L214 PolarHBondContact O-N 2.6Å; S212-C215 WeakPolarHBondContact O-CB 3.26Å; S212-C215 PolarHBondContact O-N 3.49Å; S212-C215 VanDerWaalsContact O-N 3.16Å; S212-A216 PolarHBondContact O-N 3Å
213G96.9Very high95.7Very high1 Ų118.4 Ų18.41%0.0110%0.098CC..Hα-helixtrans-63.2-33.3177.500000113.6G97 Y209 A216 A217G97-G213 CarbonylContact C-O 3.36Å; G97-G213 VanDerWaalsContact CA-O 3.23Å; G97-G213 WeakPolarHBondContact CA-O 3.26Å; G97-G213 CarbonylContact O-C 3.59Å; G97-G213 WeakPolarHBondContact O-CA 3.5Å; Y209-G213 PolarHBondContact O-N 3.29Å; G213-A216 PolarHBondContact O-N 3.31Å; G213-A217 PolarHBondContact O-N 3.09Å
214L97.6Very high95.5Very high42 Ų4214.2 Ų14.222%0.228%0.077CC..Hα-helixtrans-63-47.8171.2177.862.5000111.8L94 I98 V210 L211 S212 A216 A217 I218L94-L214 HydrophobicContact CB-CD1 4.39Å; L94-L214 HydrophobicContact CD2-CD1 3.9Å; I98-L214 HydrophobicContact CD1-CD1 4.24Å; I98-L214 HydrophobicContact CG1-CB 4.4Å; I98-L214 HydrophobicContact CG1-CD1 4.24Å; V210-L214 WeakPolarHBondContact O-CB 3.46Å; V210-L214 PolarHBondContact O-N 3.45Å; L211-L214 PolarHBondContact O-N 2.6Å; S212-L214 VanDerWaalsContact C-N 3.31Å; S212-L214 PolarHBondContact O-N 2.6Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 2.88Å; L214-A217 PolarHBondContact O-N 2.85Å; L214-I218 HydrophobicContact CD1-CD1 4.44Å; L214-I218 HydrophobicContact CG-CD1 4.25Å; L214-I218 WeakPolarHBondContact O-CG1 3.32Å; L214-I218 PolarHBondContact O-N 2.98Å
215C97.1Very high95.4Very high0 Ų013.5 Ų13.50%07%0.074CC..Hα-helixtrans-61-39.7175.2-71.50000112.3L47 F171 L211 S212 I218 A219L47-C215 VanDerWaalsContact O-CB 3.28Å; L47-C215 WeakPolarHBondContact O-CB 3.31Å; F171-C215 VanDerWaalsContact CE1-SG 3.58Å; F171-C215 WeakPolarHBondContact CZ-SG 3.35Å; L211-C215 PolarHBondContact O-N 3.09Å; L211-C215 PolarHBondContact O-SG 3.36Å; L211-C215 VanDerWaalsContact O-SG 3.37Å; S212-C215 WeakPolarHBondContact O-CB 3.26Å; S212-C215 PolarHBondContact O-N 3.49Å; S212-C215 VanDerWaalsContact O-N 3.16Å; C215-I218 PolarHBondContact O-N 2.92Å; C215-A219 PolarHBondContact O-N 3Å
216A96.3Very high95.1Very high0 Ų016.6 Ų16.60%09%0.09CC..Hα-helixtrans-62.9-39.8174.700000112.9L48 V65 V68 M69 S212 G213 L214 A219 G220L48-A216 HydrophobicContact CD2-CB 3.9Å; V65-A216 HydrophobicContact CB-CB 4.15Å; V65-A216 HydrophobicContact CG1-CB 4.37Å; V65-A216 WeakPolarHBondContact O-CB 3.43Å; V68-A216 HydrophobicContact CB-CB 3.93Å; V68-A216 HydrophobicContact CG1-CB 3.77Å; M69-A216 WeakPolarHBondContact CG-O 3.44Å; S212-A216 PolarHBondContact O-N 3Å; G213-A216 PolarHBondContact O-N 3.31Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 2.88Å; A216-A219 PolarHBondContact O-N 3.42Å; A216-G220 PolarHBondContact O-N 3.23Å
217A97.2Very high94.7Very high0 Ų019.4 Ų19.40%010%0.104CC..Hα-helixtrans-67.9-37.8174.600000113.3A72 A93 L94 G213 L214 A219 G220 I221A72-A217 HydrophobicContact CB-CB 3.73Å; A93-A217 WeakPolarHBondContact O-CB 3.49Å; L94-A217 HydrophobicContact CD2-CB 4.2Å; G213-A217 PolarHBondContact O-N 3.09Å; L214-A217 PolarHBondContact O-N 2.85Å; A217-A219 VanDerWaalsContact C-N 3.35Å; A217-G220 PolarHBondContact O-N 3.35Å; A217-I221 WeakPolarHBondContact O-CD1 3.46Å; A217-I221 VanDerWaalsContact O-CG1 3.3Å; A217-I221 WeakPolarHBondContact O-CG1 3.26Å; A217-I221 PolarHBondContact O-N 3.27Å
218I97Very high94.4Very high33 Ų3322.3 Ų22.317%0.16911%0.111CC..Hα-helixtrans-61.6-44.5174-63.6165000110.4L47 L94 I163 L214 C215 G220 I221 I222L47-I218 HydrophobicContact CD1-CG2 3.87Å; L47-I218 HydrophobicContact CD2-CG2 4.1Å; L94-I218 HydrophobicContact CD2-CG1 3.6Å; I163-I218 HydrophobicContact CG2-CG2 3.47Å; I163-I218 VanDerWaalsContact CG2-CG2 3.47Å; L214-I218 HydrophobicContact CD1-CD1 4.44Å; L214-I218 HydrophobicContact CG-CD1 4.25Å; L214-I218 WeakPolarHBondContact O-CG1 3.32Å; L214-I218 PolarHBondContact O-N 2.98Å; C215-I218 PolarHBondContact O-N 2.92Å; I218-G220 VanDerWaalsContact C-N 3.33Å; I218-G220 PolarHBondContact O-N 3.19Å; I218-I221 PolarHBondContact O-N 2.85Å; I218-I222 HydrophobicContact CG2-CD1 4.15Å; I218-I222 WeakPolarHBondContact O-CG1 3.43Å; I218-I222 PolarHBondContact O-N 3.37Å; I218-I222 VanDerWaalsContact O-N 3.12Å
219A94.6Very high94.1Very high0 Ų022.3 Ų22.30%011%0.111CC..Hα-helixtrans-62.3-38.4174.400000112.4P44 L47 L48 M69 C215 A216 A217 I222 V223P44-A219 HydrophobicContact CB-CB 4.25Å; L47-A219 HydrophobicContact CB-CB 4.22Å; L47-A219 HydrophobicContact CD1-CB 4.22Å; L48-A219 HydrophobicContact CD2-CB 3.84Å; L48-A219 HydrophobicContact CG-CB 4.49Å; M69-A219 HydrophobicContact CG-CB 3.94Å; M69-A219 HydrophobicContact SD-CB 3.82Å; C215-A219 PolarHBondContact O-N 3Å; A216-A219 PolarHBondContact O-N 3.42Å; A217-A219 VanDerWaalsContact C-N 3.35Å; A219-I222 PolarHBondContact O-N 3.36Å; A219-V223 WeakPolarHBondContact O-CG2 3.43Å; A219-V223 PolarHBondContact O-N 2.99Å
220G93.1Very high93.7Very high1 Ų122.4 Ų22.41%0.0111%0.112CC..Hα-helixtrans-68.1-38.2178.700000113.8M69 A216 A217 I218 A224M69-G220 VanDerWaalsContact CG-N 3.25Å; M69-G220 WeakPolarHBondContact O-CA 3.5Å; A216-G220 PolarHBondContact O-N 3.23Å; A217-G220 PolarHBondContact O-N 3.35Å; I218-G220 VanDerWaalsContact C-N 3.33Å; I218-G220 PolarHBondContact O-N 3.19Å; G220-A224 VanDerWaalsContact O-CB 3.24Å; G220-A224 WeakPolarHBondContact O-CB 3.5Å; G220-A224 PolarHBondContact O-N 3.39Å
221I95.6Very high93.1Very high9 Ų922 Ų225%0.04611%0.109CC..Hα-helixtrans-62.8-45.6171.9-67.5159.6000110.3L90 A93 L94 L146 A217 I218 A225L90-I221 HydrophobicContact CD2-CD1 4.07Å; L90-I221 HydrophobicContact CD2-CG1 4.41Å; L90-I221 HydrophobicContact CD2-CG2 3.62Å; A93-I221 HydrophobicContact CB-CD1 3.83Å; A93-I221 HydrophobicContact CB-CG1 3.74Å; L94-I221 HydrophobicContact CD2-CD1 3.71Å; L94-I221 HydrophobicContact CG-CD1 3.87Å; L146-I221 HydrophobicContact CD1-CG2 4.39Å; A217-I221 WeakPolarHBondContact O-CD1 3.46Å; A217-I221 VanDerWaalsContact O-CG1 3.3Å; A217-I221 WeakPolarHBondContact O-CG1 3.26Å; A217-I221 PolarHBondContact O-N 3.27Å; I218-I221 PolarHBondContact O-N 2.85Å; I221-A225 WeakPolarHBondContact O-CB 3.25Å; I221-A225 PolarHBondContact O-N 3.07Å
222I93.4Very high92.4Very high5 Ų521.2 Ų21.23%0.02611%0.105CC..Hα-helixtrans-60.8-51.7178.6-75.6166.2000111.5P44 L47 P160 I163 I218 A219 A224 A225 D226P44-I222 HydrophobicContact CG-CG2 4.48Å; L47-I222 HydrophobicContact CD1-CD1 3.56Å; P160-I222 HydrophobicContact CB-CG2 3.85Å; P160-I222 HydrophobicContact CG-CG2 3.83Å; I163-I222 HydrophobicContact CB-CD1 4.03Å; I163-I222 HydrophobicContact CD1-CD1 3.97Å; I163-I222 HydrophobicContact CD1-CG1 4.02Å; I163-I222 HydrophobicContact CG2-CD1 3.87Å; I218-I222 HydrophobicContact CG2-CD1 4.15Å; I218-I222 WeakPolarHBondContact O-CG1 3.43Å; I218-I222 PolarHBondContact O-N 3.37Å; I218-I222 VanDerWaalsContact O-N 3.12Å; A219-I222 PolarHBondContact O-N 3.36Å; I222-A224 VanDerWaalsContact C-N 3.34Å; I222-A224 PolarHBondContact O-N 2.94Å; I222-A225 PolarHBondContact O-N 2.84Å; I222-D226 PolarHBondContact O-N 3.37Å
223V89.9Confident91.4Very high33 Ų3323.3 Ų23.320%0.212%0.116CC..Hα-helixtrans-65.4-39.3-177.5170.10000111P44 M69 A219 D226 I227P44-V223 HydrophobicContact CB-CG2 4.1Å; P44-V223 HydrophobicContact CG-CG2 3.74Å; M69-V223 HydrophobicContact CE-CB 3.86Å; M69-V223 HydrophobicContact CE-CG1 3.97Å; M69-V223 HydrophobicContact CE-CG2 3.66Å; M69-V223 HydrophobicContact SD-CG2 4.47Å; A219-V223 WeakPolarHBondContact O-CG2 3.43Å; A219-V223 PolarHBondContact O-N 2.99Å; V223-D226 PolarHBondContact O-N 3.45Å; V223-I227 PolarHBondContact O-N 3.26Å
224A91.7Very high90.4Very high3 Ų327.8 Ų27.83%0.02514%0.14CC..Hα-helixtrans-67.1-36.2175.400000112.9T76 F141 G220 I222 R228 G229T76-A224 HydrophobicContact CG2-CB 4.35Å; F141-A224 WeakPolarHBondContact CZ-O 3.3Å; G220-A224 VanDerWaalsContact O-CB 3.24Å; G220-A224 WeakPolarHBondContact O-CB 3.5Å; G220-A224 PolarHBondContact O-N 3.39Å; I222-A224 VanDerWaalsContact C-N 3.34Å; I222-A224 PolarHBondContact O-N 2.94Å; A224-R228 CarbonylContact O-C 2.99Å; A224-R228 WeakPolarHBondContact O-CA 3.45Å; A224-R228 PolarHBondContact O-N 3.26Å; A224-G229 WeakPolarHBondContact CA-O 3.38Å; A224-G229 WeakPolarHBondContact CB-O 3.47Å; A224-G229 PolarHBondContact O-N 2.96Å
225A92.7Very high89.5Confident0 Ų026.5 Ų26.50%014%0.135CC..Hα-helixtrans-67.2-38.1175.200000113.2L146 F149 I221 I222 R228L146-A225 HydrophobicContact CD1-CB 4.49Å; L146-A225 WeakPolarHBondContact O-CB 3.22Å; F149-A225 HydrophobicContact CB-CB 4.03Å; I221-A225 WeakPolarHBondContact O-CB 3.25Å; I221-A225 PolarHBondContact O-N 3.07Å; I222-A225 PolarHBondContact O-N 2.84Å; A225-R228 PolarHBondContact O-N 2.83Å
226D88.5Confident88.4Confident76 Ų7626.7 Ų26.741%0.40614%0.137SC..Hα-helixtrans-67.2-50.2-178.4-164.852.5000111.4I222 V223 R228I222-D226 PolarHBondContact O-N 3.37Å; V223-D226 PolarHBondContact O-N 3.45Å; D226-R228 VanDerWaalsContact C-N 3.27Å; D226-R228 PolarHBondContact O-N 3.41Å
227I86.9Confident87.2Confident94 Ų9428 Ų2848%0.48214%0.144SC..THydrogen-bonded Turntrans-82.2-1176.975.7179.3000113.8V223 G229V223-I227 PolarHBondContact O-N 3.26Å; I227-G229 WeakPolarHBondContact CG1-O 3.39Å; I227-G229 PolarHBondContact O-N 2.8Å
228R89.9Confident85.9Confident123 Ų12328.4 Ų28.446%0.46415%0.146SC..THydrogen-bonded Turntrans52.638.9-176.1-56-178.7-178180-0.4113.4T140 F141 A224 A225 D226T140-R228 WeakPolarHBondContact CA-O 3.09Å; F141-R228 PolarHBondContact N-O 2.81Å; A224-R228 CarbonylContact O-C 2.99Å; A224-R228 WeakPolarHBondContact O-CA 3.45Å; A224-R228 PolarHBondContact O-N 3.26Å; A225-R228 PolarHBondContact O-N 2.83Å; D226-R228 VanDerWaalsContact C-N 3.27Å; D226-R228 PolarHBondContact O-N 3.41Å
229G89Confident85.3Confident0 Ų028.1 Ų28.10%014%0.144CC..EExtended strand (participates in β ladder)trans-179.5179.8-178.600000112.7V139 F141 A224 I227V139-G229 CarbonylContact O-C 3.3Å; V139-G229 WeakPolarHBondContact O-CA 3.3Å; F141-G229 VanDerWaalsContact CE1-N 3.3Å; A224-G229 WeakPolarHBondContact CA-O 3.38Å; A224-G229 WeakPolarHBondContact CB-O 3.47Å; A224-G229 PolarHBondContact O-N 2.96Å; I227-G229 WeakPolarHBondContact CG1-O 3.39Å; I227-G229 PolarHBondContact O-N 2.8Å
230A88.7Confident84.8Confident3 Ų328.1 Ų28.13%0.02514%0.144CC..EExtended strand (participates in β ladder)trans-127.5115.2174.900000111.4G73 A77 T134 I138 V139G73-A230 WeakPolarHBondContact O-CB 3.18Å; A77-A230 HydrophobicContact CB-CB 3.52Å; T134-A230 HydrophobicContact CG2-CB 4.3Å; I138-A230 WeakPolarHBondContact CA-O 3.31Å; V139-A230 PolarHBondContact N-O 3.04Å; V139-A230 VanDerWaalsContact N-O 3.07Å; V139-A230 PolarHBondContact O-N 3.08Å
231D85.9Confident84.2Confident21 Ų2128.1 Ų28.111%0.11214%0.144CC..EExtended strand (participates in β ladder)trans-94.196.7164.5-178.4-5.9000109.2I138 N233 N234 A235I138-D231 HydrophobicContact CD1-CB 4.17Å; I138-D231 HydrophobicContact CG1-CB 3.88Å; I138-D231 HydrophobicContact CG2-CB 4.38Å; D231-N233 PolarHBondContact O-N 3.37Å; D231-N233 VanDerWaalsContact O-N 3.1Å; D231-N233 VanDerWaalsContact OD1-CB 3.24Å; D231-N233 WeakPolarHBondContact OD1-CB 3.44Å; D231-N233 PolarHBondContact OD1-N 3.04Å; D231-N233 PolarHBondContact OD1-ND2 3.44Å; D231-N234 PolarHBondContact O-N 3.3Å; D231-N234 PolarHBondContact OD1-N 3.38Å; D231-N234 PolarHBondContact OD2-ND2 2.94Å; D231-A235 WeakPolarHBondContact O-CB 3.16Å; D231-A235 PolarHBondContact O-N 3.45Å
232A81.8Confident83.6Confident1 Ų128 Ų281%0.00814%0.144CC..THydrogen-bonded Turntrans-67.5-6.2-179.800000114.7A130 Q131 T134A130-A232 HydrophobicContact CB-CB 3.8Å; A130-A232 WeakPolarHBondContact O-CB 3.27Å; Q131-A232 HydrophobicContact CG-CB 4.06Å; T134-A232 HydrophobicContact CG2-CB 3.85Å; T134-A232 WeakPolarHBondContact OG1-CB 3.38Å
233N75.1Confident83.4Confident44 Ų4427.8 Ų27.824%0.23514%0.142CC..THydrogen-bonded Turntrans-84.9-48.7176.3-48.4-76000110.3Q131 G136 D231Q131-N233 PolarHBondContact NE2-OD1 3.02Å; G136-N233 PolarHBondContact O-ND2 2.74Å; G136-N233 VanDerWaalsContact O-ND2 3.14Å; D231-N233 PolarHBondContact O-N 3.37Å; D231-N233 VanDerWaalsContact O-N 3.1Å; D231-N233 VanDerWaalsContact OD1-CB 3.24Å; D231-N233 WeakPolarHBondContact OD1-CB 3.44Å; D231-N233 PolarHBondContact OD1-N 3.04Å; D231-N233 PolarHBondContact OD1-ND2 3.44Å
234N76.6Confident83.1Confident95 Ų9526.2 Ų26.251%0.50813%0.133SC..THydrogen-bonded Turntrans-103.5-20-172.6-59.9-55000114.1D231 G236 L237D231-N234 PolarHBondContact O-N 3.3Å; D231-N234 PolarHBondContact OD1-N 3.38Å; D231-N234 PolarHBondContact OD2-ND2 2.94Å; N234-G236 PolarHBondContact O-N 3.01Å; N234-G236 VanDerWaalsContact O-N 3.1Å; N234-L237 WeakPolarHBondContact O-CB 3.23Å; N234-L237 PolarHBondContact O-N 2.86Å
235A78.7Confident82.6Confident15 Ų1528 Ų2812%0.12414%0.142CC..THydrogen-bonded Turntrans-60.7118.3179.100000110.9A70 D231 L237A70-A235 WeakPolarHBondContact CB-O 3.25Å; D231-A235 WeakPolarHBondContact O-CB 3.16Å; D231-A235 PolarHBondContact O-N 3.45Å; A235-L237 PolarHBondContact O-N 3.4Å
236G74.6Confident82.3Confident4 Ų428 Ų284%0.04114%0.142CC..THydrogen-bonded Turntrans60.529.9-179.200000111.7G66 R127 N234 W238 E240G66-G236 CarbonylContact C-O 3.6Å; G66-G236 WeakPolarHBondContact CA-O 3.4Å; R127-G236 PolarHBondContact NH1-O 2.92Å; R127-G236 PolarHBondContact NH2-O 3.24Å; N234-G236 PolarHBondContact O-N 3.01Å; N234-G236 VanDerWaalsContact O-N 3.1Å; G236-W238 PolarHBondContact O-N 2.83Å; G236-E240 VanDerWaalsContact O-OE2 3.12Å
237L71.3Confident82.3Confident27 Ų2724.5 Ų24.514%0.14112%0.123CC..SBendtrans-66127.3164.6-158.770.5000107N234 A235 L239N234-L237 WeakPolarHBondContact O-CB 3.23Å; N234-L237 PolarHBondContact O-N 2.86Å; A235-L237 PolarHBondContact O-N 3.4Å; L237-L239 PolarHBondContact O-N 2.98Å
238W69.8Low82Confident10 Ų1021.8 Ų21.84%0.03811%0.111CC..SBendtrans67.8-12.6169.3-45.1136.6000117.9G236 E240 L241 D242 E286 M287 N288 V534 L538G236-W238 PolarHBondContact O-N 2.83Å; W238-E240 WeakPolarHBondContact CA-OE2 3.42Å; W238-E240 PolarHBondContact N-OE2 3.26Å; W238-E240 PolarHBondContact O-N 2.85Å; W238-L241 PolarHBondContact O-N 2.91Å; W238-D242 PolarHBondContact O-N 3.39Å; W238-E286 HydrophobicContact CB-CB 4.02Å; W238-E286 VanDerWaalsContact CD1-CB 3.44Å; W238-E286 HydrophobicContact CG-CB 4.11Å; W238-M287 VanDerWaalsContact CD1-CA 3.41Å; W238-M287 VanDerWaalsContact CD2-C 3.42Å; W238-M287 VanDerWaalsContact CD2-CA 3.45Å; W238-M287 HydrophobicContact CD2-CG 4.38Å; W238-M287 VanDerWaalsContact CE2-CA 3.49Å; W238-M287 VanDerWaalsContact CG-C 3.46Å; W238-M287 HydrophobicContact CH2-CG 4.07Å; W238-M287 HydrophobicContact CZ2-CB 4.41Å; W238-M287 HydrophobicContact CZ2-CG 3.44Å; W238-M287 VanDerWaalsContact CZ2-CG 3.44Å; W238-N288 VanDerWaalsContact CE3-CA 3.45Å; W238-V534 HydrophobicContact CZ2-CG1 3.6Å; W238-L538 HydrophobicContact CH2-CD1 3.83Å; W238-L538 HydrophobicContact CZ3-CD1 3.54Å; W238-L538 HydrophobicContact CZ3-CG 4.45Å
239L83.5Confident81.6Confident26 Ų2618.3 Ų18.314%0.13610%0.101CC..Hα-helixtrans-59.6-18.3172.4-53.1-171.3000112.7V45 L48 M69 L237 L241 D242 A243V45-L239 HydrophobicContact CG2-CD2 4.11Å; L48-L239 HydrophobicContact CD1-CB 3.65Å; M69-L239 HydrophobicContact CE-CD1 4.13Å; M69-L239 HydrophobicContact SD-CD1 4.01Å; L237-L239 PolarHBondContact O-N 2.98Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.37Å; L239-D242 PolarHBondContact O-N 3.42Å; L239-A243 VanDerWaalsContact O-CB 3.3Å; L239-A243 WeakPolarHBondContact O-CB 3.37Å; L239-A243 PolarHBondContact O-N 2.9Å
240E84.2Confident81.3Confident0 Ų018.4 Ų18.40%010%0.102CC..Hα-helixtrans-56-38.8167.354.3-93.9-139.600113.5L63 V65 G66 R127 G236 W238 I244L63-E240 WeakPolarHBondContact O-CB 3.2Å; V65-E240 HydrophobicContact CG2-CB 3.74Å; G66-E240 WeakPolarHBondContact CA-OE2 3.5Å; R127-E240 IonicContact CZ-OE1 3.79Å; R127-E240 VanDerWaalsContact NH2-CD 3.27Å; R127-E240 IonicContact NH2-OE1 2.69Å; R127-E240 PolarHBondContact NH2-OE1 2.97Å; R127-E240 IonicContact NH2-OE2 3.07Å; R127-E240 PolarHBondContact NH2-OE2 2.91Å; G236-E240 VanDerWaalsContact O-OE2 3.12Å; W238-E240 WeakPolarHBondContact CA-OE2 3.42Å; W238-E240 PolarHBondContact N-OE2 3.26Å; W238-E240 PolarHBondContact O-N 2.85Å; E240-I244 WeakPolarHBondContact O-CD1 3.29Å; E240-I244 WeakPolarHBondContact O-CG1 3.49Å; E240-I244 PolarHBondContact O-N 3.33Å
241L81Confident80.8Confident1 Ų120.8 Ų20.81%0.00513%0.127CC..Hα-helixtrans-86.2-32.1176.2-70.1-150.5000113.5L63 W238 L239 A243 I244 L245 N288 Q289 L356 F410 L414L63-L241 HydrophobicContact CD2-CD2 3.66Å; W238-L241 PolarHBondContact O-N 2.91Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.37Å; L241-A243 PolarHBondContact O-N 2.88Å; L241-I244 HydrophobicContact CD2-CD1 3.59Å; L241-I244 PolarHBondContact O-N 3.4Å; L241-I244 VanDerWaalsContact O-N 3.1Å; L241-L245 VanDerWaalsContact O-CB 3.25Å; L241-L245 WeakPolarHBondContact O-CB 3.36Å; L241-L245 PolarHBondContact O-N 2.86Å; L241-N288 HydrophobicContact CD1-CB 3.42Å; L241-N288 VanDerWaalsContact CD1-CB 3.42Å; L241-N288 HydrophobicContact CG-CB 4.17Å; L241-N288 WeakPolarHBondContact CG-O 3.43Å; L241-Q289 HydrophobicContact CD1-CB 4.46Å; L241-L356 HydrophobicContact CD1-CD1 3.68Å; L241-F410 HydrophobicContact CD1-CE2 4.39Å; L241-F410 HydrophobicContact CD1-CZ 4.04Å; L241-F410 HydrophobicContact CD2-CE2 4.21Å; L241-F410 HydrophobicContact CD2-CZ 3.7Å; L241-L414 HydrophobicContact CD1-CD1 3.64Å; L241-L414 HydrophobicContact CD1-CD2 4Å; L241-L414 HydrophobicContact CD1-CG 4.41Å
242D81.9Confident80.5Confident7 Ų720.2 Ų20.24%0.03713%0.126CC..Hα-helixtrans-60.8-36.9170.7-77.2-1.7000110.6V45 W238 L239 A246 I271V45-D242 HydrophobicContact CG1-CB 3.82Å; V45-D242 HydrophobicContact CG2-CB 4.34Å; W238-D242 PolarHBondContact O-N 3.39Å; L239-D242 PolarHBondContact O-N 3.42Å; D242-A246 WeakPolarHBondContact O-CB 3.38Å; D242-A246 PolarHBondContact O-N 2.92Å; D242-I271 HydrophobicContact CB-CD1 4.35Å; D242-I271 HydrophobicContact CB-CG2 4.24Å; D242-I271 WeakPolarHBondContact O-CD1 3.36Å
243A89.9Confident80.4Confident0 Ų022.3 Ų22.30%014%0.141CC..Hα-helixtrans-62.9-40.617200000113.2L48 M52 L239 L241 V247L48-A243 HydrophobicContact CB-CB 3.59Å; M52-A243 HydrophobicContact CB-CB 4.33Å; M52-A243 HydrophobicContact CE-CB 4.35Å; L239-A243 VanDerWaalsContact O-CB 3.3Å; L239-A243 WeakPolarHBondContact O-CB 3.37Å; L239-A243 PolarHBondContact O-N 2.9Å; L241-A243 PolarHBondContact O-N 2.88Å; A243-V247 WeakPolarHBondContact O-CG2 3.21Å; A243-V247 PolarHBondContact O-N 2.87Å
244I84.6Confident80.5Confident1 Ų122.6 Ų22.61%0.00514%0.142CC..Hα-helixtrans-70.9-45.8177.7-70159.1000110.7M52 I56 I61 L63 E240 L241 A246 V247 V248 L254 F410M52-I244 HydrophobicContact CE-CD1 3.89Å; M52-I244 HydrophobicContact CE-CG1 3.54Å; M52-I244 HydrophobicContact CG-CG1 3.87Å; M52-I244 HydrophobicContact SD-CD1 4.21Å; M52-I244 HydrophobicContact SD-CG1 3.57Å; M52-I244 VanDerWaalsContact SD-CG1 3.57Å; I56-I244 HydrophobicContact CD1-CG1 4.46Å; I56-I244 HydrophobicContact CD1-CG2 4.48Å; I61-I244 HydrophobicContact CG2-CD1 3.29Å; I61-I244 HydrophobicContact CG2-CG1 3.9Å; L63-I244 HydrophobicContact CD2-CD1 3.42Å; L63-I244 VanDerWaalsContact CD2-CD1 3.42Å; L63-I244 HydrophobicContact CG-CD1 4.49Å; E240-I244 WeakPolarHBondContact O-CD1 3.29Å; E240-I244 WeakPolarHBondContact O-CG1 3.49Å; E240-I244 PolarHBondContact O-N 3.33Å; L241-I244 HydrophobicContact CD2-CD1 3.59Å; L241-I244 PolarHBondContact O-N 3.4Å; L241-I244 VanDerWaalsContact O-N 3.1Å; I244-A246 VanDerWaalsContact C-N 3.3Å; I244-A246 PolarHBondContact O-N 2.89Å; I244-V247 PolarHBondContact O-N 3.39Å; I244-V248 HydrophobicContact CG2-CG2 4.42Å; I244-V248 WeakPolarHBondContact O-CG2 3.28Å; I244-V248 PolarHBondContact O-N 2.98Å; I244-L254 HydrophobicContact CG2-CD2 4.34Å; I244-F410 HydrophobicContact CG2-CE1 4.07Å; I244-F410 HydrophobicContact CG2-CZ 4.28Å
245L79.3Confident80.4Confident41 Ų4126 Ų2622%0.21516%0.157CC..Hα-helixtrans-62.5-38.8177.7-176.361000110.7L241 V247 V248 I249 I271 F418L241-L245 VanDerWaalsContact O-CB 3.25Å; L241-L245 WeakPolarHBondContact O-CB 3.36Å; L241-L245 PolarHBondContact O-N 2.86Å; L245-V247 PolarHBondContact O-N 3.4Å; L245-V248 PolarHBondContact O-N 3.39Å; L245-I249 HydrophobicContact CD1-CD1 4Å; L245-I249 HydrophobicContact CD1-CG1 4.12Å; L245-I249 HydrophobicContact CD2-CD1 4.47Å; L245-I249 HydrophobicContact CG-CD1 3.79Å; L245-I249 HydrophobicContact CG-CG1 4.33Å; L245-I249 WeakPolarHBondContact O-CB 3.25Å; L245-I249 VanDerWaalsContact O-CG1 3.27Å; L245-I249 WeakPolarHBondContact O-CG1 3.4Å; L245-I249 PolarHBondContact O-N 3.05Å; L245-I271 HydrophobicContact CB-CD1 3.78Å; L245-I271 HydrophobicContact CD2-CD1 3.93Å; L245-I271 HydrophobicContact CD2-CG1 4.24Å; L245-I271 HydrophobicContact CG-CD1 3.78Å; L245-I271 HydrophobicContact CG-CG1 4.38Å; L245-F418 HydrophobicContact CD2-CE2 4.12Å
246A86.4Confident80.6Confident0 Ų025.7 Ų25.70%016%0.156CC..Hα-helixtrans-59.3-45.8172.800000112A49 D242 I244 G250 A268 I271A49-A246 HydrophobicContact CB-CB 3.87Å; D242-A246 WeakPolarHBondContact O-CB 3.38Å; D242-A246 PolarHBondContact O-N 2.92Å; I244-A246 VanDerWaalsContact C-N 3.3Å; I244-A246 PolarHBondContact O-N 2.89Å; A246-G250 PolarHBondContact O-N 3.44Å; A246-A268 HydrophobicContact CB-CB 4.05Å; A246-I271 HydrophobicContact CB-CD1 3.99Å
247V89.5Confident80.8Confident1 Ų125.6 Ų25.61%0.00616%0.155CC..Hα-helixtrans-64.8-41.6175.8176.30000111.5A49 M52 T53 I56 A243 I244 L245 G250 G251 G252A49-V247 HydrophobicContact CB-CG2 4.4Å; M52-V247 HydrophobicContact CB-CG2 4.29Å; M52-V247 HydrophobicContact CG-CG2 4.2Å; T53-V247 WeakPolarHBondContact OG1-CG2 3.31Å; I56-V247 HydrophobicContact CB-CG1 4.31Å; I56-V247 HydrophobicContact CD1-CB 3.93Å; I56-V247 HydrophobicContact CD1-CG1 3.75Å; I56-V247 HydrophobicContact CD1-CG2 4.34Å; I56-V247 HydrophobicContact CG2-CG1 4.05Å; A243-V247 WeakPolarHBondContact O-CG2 3.21Å; A243-V247 PolarHBondContact O-N 2.87Å; I244-V247 PolarHBondContact O-N 3.39Å; L245-V247 PolarHBondContact O-N 3.4Å; V247-G250 CarbonylContact O-C 3.57Å; V247-G250 WeakPolarHBondContact O-CA 3.39Å; V247-G250 PolarHBondContact O-N 3.23Å; V247-G251 PolarHBondContact O-N 2.98Å; V247-G252 WeakPolarHBondContact O-CA 3.27Å; V247-G252 PolarHBondContact O-N 3.44Å
248V81.4Confident81.3Confident38 Ų3833.8 Ų33.823%0.2318%0.184CC..Hα-helixtrans-68.7-45.3-179.8170.90000112I244 L245 G250 G251 L254 I411I244-V248 HydrophobicContact CG2-CG2 4.42Å; I244-V248 WeakPolarHBondContact O-CG2 3.28Å; I244-V248 PolarHBondContact O-N 2.98Å; L245-V248 PolarHBondContact O-N 3.39Å; V248-G250 VanDerWaalsContact C-N 3.26Å; V248-G250 PolarHBondContact O-N 2.77Å; V248-G251 WeakPolarHBondContact O-CA 3.34Å; V248-G251 PolarHBondContact O-N 3.16Å; V248-L254 HydrophobicContact CG2-CD1 4.07Å; V248-L254 HydrophobicContact CG2-CD2 3.76Å; V248-L254 HydrophobicContact CG2-CG 3.84Å; V248-I411 HydrophobicContact CG1-CD1 4.09Å
249I79.7Confident82.1Confident49 Ų4934.1 Ų34.125%0.25119%0.185SC..Hα-helixtrans-59.8-40.5171.3-69.7172.3000109.8Q3 L245 G251 I270 I271Q3-I249 WeakPolarHBondContact CG-O 3.29Å; Q3-I249 PolarHBondContact NE2-O 2.85Å; L245-I249 HydrophobicContact CD1-CD1 4Å; L245-I249 HydrophobicContact CD1-CG1 4.12Å; L245-I249 HydrophobicContact CD2-CD1 4.47Å; L245-I249 HydrophobicContact CG-CD1 3.79Å; L245-I249 HydrophobicContact CG-CG1 4.33Å; L245-I249 WeakPolarHBondContact O-CB 3.25Å; L245-I249 VanDerWaalsContact O-CG1 3.27Å; L245-I249 WeakPolarHBondContact O-CG1 3.4Å; L245-I249 PolarHBondContact O-N 3.05Å; I249-G251 PolarHBondContact O-N 2.95Å; I249-I270 HydrophobicContact CD1-CG2 4.37Å; I249-I270 HydrophobicContact CG2-CB 4.47Å; I249-I270 HydrophobicContact CG2-CD1 3.51Å; I249-I270 HydrophobicContact CG2-CG2 4.42Å; I249-I271 HydrophobicContact CD1-CD1 4.46Å; I249-I271 HydrophobicContact CD1-CG1 4.15Å
250G83.1Confident82.4Confident2 Ų236.1 Ų36.12%0.02120%0.196CC..THydrogen-bonded Turntrans-59.8-9170.800000115.1A246 V247 V248 L263A246-G250 PolarHBondContact O-N 3.44Å; V247-G250 CarbonylContact O-C 3.57Å; V247-G250 WeakPolarHBondContact O-CA 3.39Å; V247-G250 PolarHBondContact O-N 3.23Å; V248-G250 VanDerWaalsContact C-N 3.26Å; V248-G250 PolarHBondContact O-N 2.77Å; G250-L263 VanDerWaalsContact CA-O 3.22Å; G250-L263 WeakPolarHBondContact CA-O 3.33Å; G250-L263 WeakPolarHBondContact O-CB 3.25Å; G250-L263 WeakPolarHBondContact O-CD1 3.3Å
251G79.5Confident82.8Confident54 Ų5436.3 Ų36.356%0.55720%0.197SC*.THydrogen-bonded Turntrans81.518.1-178.600000114V247 V248 I249V247-G251 PolarHBondContact O-N 2.98Å; V248-G251 WeakPolarHBondContact O-CA 3.34Å; V248-G251 PolarHBondContact O-N 3.16Å; I249-G251 PolarHBondContact O-N 2.95Å
252G78.3Confident83.3Confident9 Ų940.7 Ų40.79%0.09322%0.22CC..  trans-67.3133.5168.100000111.1V247V247-G252 WeakPolarHBondContact O-CA 3.27Å; V247-G252 PolarHBondContact O-N 3.44Å
253S79.4Confident83.7Confident44 Ų4442 Ų4231%0.30823%0.227SC..  trans-81.9122.7178.7176.80000110.6I56 M255 G256I56-S253 WeakPolarHBondContact CG2-O 3.46Å; S253-M255 PolarHBondContact O-N 3.46Å; S253-M255 PolarHBondContact OG-N 2.91Å; S253-G256 WeakPolarHBondContact O-CA 3.01Å; S253-G256 PolarHBondContact O-N 3.36Å
254L77.4Confident83.7Confident51 Ų5142 Ų4227%0.26723%0.227SC..THydrogen-bonded Turntrans-63.9-14.5170.1-65.5178.5000113.2I56 I61 I244 V248 G256 I411I56-L254 HydrophobicContact CD1-CD2 3.93Å; I56-L254 HydrophobicContact CG1-CD2 4.38Å; I56-L254 HydrophobicContact CG2-CD2 4.39Å; I61-L254 HydrophobicContact CD1-CD2 4.29Å; I244-L254 HydrophobicContact CG2-CD2 4.34Å; V248-L254 HydrophobicContact CG2-CD1 4.07Å; V248-L254 HydrophobicContact CG2-CD2 3.76Å; V248-L254 HydrophobicContact CG2-CG 3.84Å; L254-G256 VanDerWaalsContact C-N 3.27Å; L254-I411 HydrophobicContact CD1-CD1 4.17Å
255M75.9Confident84.1Confident165 Ų16543.1 Ų43.181%0.81323%0.234SC*.THydrogen-bonded Turntrans-83.7-2.7169.6-57.3-179.76900112.9S253S253-M255 PolarHBondContact O-N 3.46Å; S253-M255 PolarHBondContact OG-N 2.91Å
256G81.2Confident84.6Confident10 Ų1041.9 Ų41.910%0.10323%0.228CC..  trans76.7-166.8-177.800000115.3I56 S253 L254 R258I56-G256 WeakPolarHBondContact O-CA 3.33Å; S253-G256 WeakPolarHBondContact O-CA 3.01Å; S253-G256 PolarHBondContact O-N 3.36Å; L254-G256 VanDerWaalsContact C-N 3.27Å; G256-R258 VanDerWaalsContact C-N 3.25Å; G256-R258 PolarHBondContact O-N 2.8Å; G256-R258 VanDerWaalsContact O-N 3.13Å
257G79.1Confident84.4Confident2 Ų241.9 Ų41.92%0.02123%0.228CC..SBendtrans79.1-17.1172.600000116.7A57A57-G257 PolarHBondContact O-N 2.89Å
258R82.6Confident84.3Confident199 Ų19941.8 Ų41.875%0.75123%0.227SC*.  trans-142.5133.2174.6-65.2-174.2-178.7-128.9-1.1111.1G256G256-R258 VanDerWaalsContact C-N 3.25Å; G256-R258 PolarHBondContact O-N 2.8Å; G256-R258 VanDerWaalsContact O-N 3.13Å
259F87.5Confident84.6Confident16 Ų1641.5 Ų41.57%0.0722%0.224CC..  trans-149.1158.2-178.874.9-91.1000113.6T53 L54 A57 T175 R176 I184 E185 L261T53-F259 HydrophobicContact CG2-CB 3.67Å; T53-F259 HydrophobicContact CG2-CD2 3.57Å; T53-F259 HydrophobicContact CG2-CG 3.99Å; L54-F259 HydrophobicContact CD2-CD2 4.46Å; L54-F259 HydrophobicContact CD2-CE2 3.88Å; L54-F259 HydrophobicContact CD2-CZ 4.07Å; A57-F259 HydrophobicContact CB-CB 3.86Å; A57-F259 HydrophobicContact CB-CD1 3.38Å; A57-F259 HydrophobicContact CB-CE1 4.07Å; A57-F259 HydrophobicContact CB-CG 3.81Å; T175-F259 HydrophobicContact CG2-CE2 4.12Å; T175-F259 HydrophobicContact CG2-CZ 3.88Å; R176-F259 PolarHBondContact NH2-O 3.4Å; I184-F259 HydrophobicContact CB-CE1 4.38Å; I184-F259 HydrophobicContact CG2-CD1 4.24Å; I184-F259 HydrophobicContact CG2-CE1 3.76Å; E185-F259 HydrophobicContact CG-CD1 3.9Å; E185-F259 HydrophobicContact CG-CE1 3.72Å; F259-L261 HydrophobicContact CD2-CG 4.24Å; F259-L261 HydrophobicContact CE2-CD1 4.35Å; F259-L261 HydrophobicContact CE2-CG 4.08Å
260N89.6Confident84.8Confident68 Ų6839.5 Ų39.536%0.36421%0.214SC..  trans-147.1102.2173.2-174.1-13.3000111.3L262 L263 S264N260-L262 VanDerWaalsContact C-N 3.26Å; N260-L262 PolarHBondContact O-N 2.83Å; N260-L262 PolarHBondContact OD1-N 3.27Å; N260-L263 HydrophobicContact CB-CB 4.19Å; N260-L263 HydrophobicContact CB-CD1 4.18Å; N260-L263 HydrophobicContact CB-CG 4.31Å; N260-L263 WeakPolarHBondContact ND2-CD1 2.97Å; N260-L263 WeakPolarHBondContact ND2-CG 3.38Å; N260-L263 PolarHBondContact O-N 3.39Å; N260-L263 VanDerWaalsContact O-N 3.08Å; N260-S264 PolarHBondContact O-N 2.95Å; N260-S264 PolarHBondContact O-OG 2.66Å
261L91.8Very high84.4Confident4 Ų439.8 Ų39.82%0.02122%0.215CC..Hα-helixtrans-53.1-39.5-178.5-65.7166.2000113.3I50 T53 L54 L168 F171 T175 F259 S264 V265I50-L261 HydrophobicContact CG2-CD2 4.25Å; T53-L261 HydrophobicContact CG2-CD2 3.74Å; T53-L261 HydrophobicContact CG2-CG 4.32Å; L54-L261 HydrophobicContact CD2-CD2 4.17Å; L168-L261 HydrophobicContact CD1-CB 3.76Å; F171-L261 HydrophobicContact CB-CD1 4Å; T175-L261 HydrophobicContact CG2-CD1 4.36Å; F259-L261 HydrophobicContact CD2-CG 4.24Å; F259-L261 HydrophobicContact CE2-CD1 4.35Å; F259-L261 HydrophobicContact CE2-CG 4.08Å; L261-S264 PolarHBondContact O-N 3.23Å; L261-V265 WeakPolarHBondContact O-CG2 3.29Å; L261-V265 PolarHBondContact O-N 3.03Å; L261-V265 VanDerWaalsContact O-N 3.07Å
262L91.5Very high84.4Confident94 Ų9438 Ų3849%0.49219%0.192SC..Hα-helixtrans-69-39.4-179.3-176.2151.5000111.4N260 S264 V265 V266N260-L262 VanDerWaalsContact C-N 3.26Å; N260-L262 PolarHBondContact O-N 2.83Å; N260-L262 PolarHBondContact OD1-N 3.27Å; L262-S264 VanDerWaalsContact C-N 3.35Å; L262-V265 PolarHBondContact O-N 3.45Å; L262-V266 HydrophobicContact CD2-CG2 4.23Å; L262-V266 WeakPolarHBondContact O-CG2 3.37Å; L262-V266 PolarHBondContact O-N 3.15Å
263L89.7Confident84.1Confident34 Ų3437.6 Ų37.618%0.17819%0.188CC..Hα-helixtrans-71.8-29.9175.9-68.5176.4000112.1Q3 G250 N260 V266 G267Q3-L263 HydrophobicContact CB-CD2 4.32Å; Q3-L263 HydrophobicContact CG-CD2 4.43Å; G250-L263 VanDerWaalsContact CA-O 3.22Å; G250-L263 WeakPolarHBondContact CA-O 3.33Å; G250-L263 WeakPolarHBondContact O-CB 3.25Å; G250-L263 WeakPolarHBondContact O-CD1 3.3Å; N260-L263 HydrophobicContact CB-CB 4.19Å; N260-L263 HydrophobicContact CB-CD1 4.18Å; N260-L263 HydrophobicContact CB-CG 4.31Å; N260-L263 WeakPolarHBondContact ND2-CD1 2.97Å; N260-L263 WeakPolarHBondContact ND2-CG 3.38Å; N260-L263 PolarHBondContact O-N 3.39Å; N260-L263 VanDerWaalsContact O-N 3.08Å; L263-V266 PolarHBondContact O-N 3.14Å; L263-G267 PolarHBondContact O-N 3.17Å
264S90.3Very high83.6Confident1 Ų139.8 Ų39.81%0.00719%0.194CC..Hα-helixtrans-63.5-41.7170.7-50.20000111.8T53 N260 L261 L262 G267 A268T53-S264 VanDerWaalsContact OG1-CB 3.23Å; T53-S264 WeakPolarHBondContact OG1-CB 3.26Å; T53-S264 PolarHBondContact OG1-OG 3.22Å; N260-S264 PolarHBondContact O-N 2.95Å; N260-S264 PolarHBondContact O-OG 2.66Å; L261-S264 PolarHBondContact O-N 3.23Å; L262-S264 VanDerWaalsContact C-N 3.35Å; S264-G267 WeakPolarHBondContact O-CA 3.35Å; S264-G267 PolarHBondContact O-N 3.46Å; S264-G267 VanDerWaalsContact O-N 3.13Å; S264-A268 PolarHBondContact O-N 3.39Å
265V92.6Very high83Confident24 Ų2438.5 Ų38.515%0.14519%0.188CC..Hα-helixtrans-67.3-37.1173.7173.80000111.7A46 I50 L168 L261 L262 G267 A268 L269A46-V265 HydrophobicContact CB-CG1 4.12Å; A46-V265 HydrophobicContact CB-CG2 4.22Å; I50-V265 HydrophobicContact CD1-CG2 3.86Å; I50-V265 HydrophobicContact CG1-CG2 3.74Å; L168-V265 HydrophobicContact CD1-CG2 4.05Å; L168-V265 HydrophobicContact CD2-CB 4.46Å; L168-V265 HydrophobicContact CD2-CG2 4.19Å; L261-V265 WeakPolarHBondContact O-CG2 3.29Å; L261-V265 PolarHBondContact O-N 3.03Å; L261-V265 VanDerWaalsContact O-N 3.07Å; L262-V265 PolarHBondContact O-N 3.45Å; V265-G267 VanDerWaalsContact C-N 3.27Å; V265-G267 PolarHBondContact O-N 3.11Å; V265-A268 PolarHBondContact O-N 2.94Å; V265-L269 WeakPolarHBondContact O-CG 3.12Å; V265-L269 PolarHBondContact O-N 3.48Å
266V89.8Confident82.6Confident14 Ų1431.1 Ų31.19%0.08515%0.152CC..Hα-helixtrans-61-36.8168.8169.10000111.3Q3 L4 L7 L262 L263 L269 I270Q3-V266 HydrophobicContact CB-CG1 4.11Å; L4-V266 HydrophobicContact CD2-CG1 4.14Å; L4-V266 HydrophobicContact CD2-CG2 4.21Å; L7-V266 HydrophobicContact CD2-CG1 4.28Å; L262-V266 HydrophobicContact CD2-CG2 4.23Å; L262-V266 WeakPolarHBondContact O-CG2 3.37Å; L262-V266 PolarHBondContact O-N 3.15Å; L263-V266 PolarHBondContact O-N 3.14Å; V266-L269 PolarHBondContact O-N 3.28Å; V266-I270 HydrophobicContact CG1-CD1 4.03Å; V266-I270 VanDerWaalsContact O-CG1 3.29Å; V266-I270 WeakPolarHBondContact O-CG1 3.38Å; V266-I270 PolarHBondContact O-N 3.46Å
267G82.7Confident81.4Confident0 Ų031.1 Ų31.10%015%0.152CC..Hα-helixtrans-61.4-43.2171.800000113.1L263 S264 V265 L269 I270 I271L263-G267 PolarHBondContact O-N 3.17Å; S264-G267 WeakPolarHBondContact O-CA 3.35Å; S264-G267 PolarHBondContact O-N 3.46Å; S264-G267 VanDerWaalsContact O-N 3.13Å; V265-G267 VanDerWaalsContact C-N 3.27Å; V265-G267 PolarHBondContact O-N 3.11Å; G267-L269 VanDerWaalsContact C-N 3.32Å; G267-L269 PolarHBondContact O-N 3.44Å; G267-I270 WeakPolarHBondContact O-CB 3.4Å; G267-I270 PolarHBondContact O-N 2.92Å; G267-I271 WeakPolarHBondContact O-CG1 3.5Å; G267-I271 PolarHBondContact O-N 2.69Å
268A87.4Confident80.2Confident0 Ų033.7 Ų33.70%017%0.165CC..Hα-helixtrans-64-36.1174.600000112.1V45 A46 A246 S264 V265 I271 Q272V45-A268 HydrophobicContact CB-CB 4.22Å; V45-A268 HydrophobicContact CG1-CB 3.8Å; A46-A268 HydrophobicContact CB-CB 4.04Å; A246-A268 HydrophobicContact CB-CB 4.05Å; S264-A268 PolarHBondContact O-N 3.39Å; V265-A268 PolarHBondContact O-N 2.94Å; A268-I271 PolarHBondContact O-N 3.39Å; A268-Q272 WeakPolarHBondContact O-CB 3.2Å; A268-Q272 PolarHBondContact O-N 3.46Å
269L88.7Confident78.7Confident32 Ų3228 Ų2817%0.16815%0.149CC..Hα-helixtrans-69.5-32.1173.3-67.6170.2000113L7 I38 L39 A42 V265 V266 G267 G273L7-L269 HydrophobicContact CD1-CB 4.13Å; L7-L269 HydrophobicContact CD2-CB 4.34Å; I38-L269 HydrophobicContact CG2-CD2 4.33Å; L39-L269 HydrophobicContact CD2-CD2 3.86Å; A42-L269 HydrophobicContact CB-CD2 3.68Å; V265-L269 WeakPolarHBondContact O-CG 3.12Å; V265-L269 PolarHBondContact O-N 3.48Å; V266-L269 PolarHBondContact O-N 3.28Å; G267-L269 VanDerWaalsContact C-N 3.32Å; G267-L269 PolarHBondContact O-N 3.44Å; L269-G273 PolarHBondContact O-N 2.92Å
270I82.3Confident77.3Confident6 Ų631.2 Ų31.23%0.03117%0.166CC..Hα-helixtrans-66.7-47.2172.9-70.6160.4000110Q3 A6 L7 V10 I249 V266 G267 G273 M274Q3-I270 HydrophobicContact CB-CD1 4.49Å; Q3-I270 WeakPolarHBondContact O-CD1 3.11Å; A6-I270 HydrophobicContact CB-CD1 4.23Å; L7-I270 HydrophobicContact CB-CD1 4.26Å; L7-I270 HydrophobicContact CB-CG1 3.7Å; L7-I270 HydrophobicContact CD1-CG1 3.98Å; L7-I270 HydrophobicContact CG-CG1 4.38Å; V10-I270 HydrophobicContact CG2-CG2 4.44Å; I249-I270 HydrophobicContact CD1-CG2 4.37Å; I249-I270 HydrophobicContact CG2-CB 4.47Å; I249-I270 HydrophobicContact CG2-CD1 3.51Å; I249-I270 HydrophobicContact CG2-CG2 4.42Å; V266-I270 HydrophobicContact CG1-CD1 4.03Å; V266-I270 VanDerWaalsContact O-CG1 3.29Å; V266-I270 WeakPolarHBondContact O-CG1 3.38Å; V266-I270 PolarHBondContact O-N 3.46Å; G267-I270 WeakPolarHBondContact O-CB 3.4Å; G267-I270 PolarHBondContact O-N 2.92Å; I270-G273 PolarHBondContact O-N 3.05Å; I270-M274 HydrophobicContact CG2-SD 4.12Å; I270-M274 WeakPolarHBondContact O-CG 3.4Å; I270-M274 PolarHBondContact O-N 3.47Å
271I75.5Confident75.1Confident8 Ų831 Ų314%0.04117%0.17CC..Hα-helixtrans-62-46.6177.2-66.5169.8000110.5D242 L245 A246 I249 G267 A268 G273 M274 N275D242-I271 HydrophobicContact CB-CD1 4.35Å; D242-I271 HydrophobicContact CB-CG2 4.24Å; D242-I271 WeakPolarHBondContact O-CD1 3.36Å; L245-I271 HydrophobicContact CB-CD1 3.78Å; L245-I271 HydrophobicContact CD2-CD1 3.93Å; L245-I271 HydrophobicContact CD2-CG1 4.24Å; L245-I271 HydrophobicContact CG-CD1 3.78Å; L245-I271 HydrophobicContact CG-CG1 4.38Å; A246-I271 HydrophobicContact CB-CD1 3.99Å; I249-I271 HydrophobicContact CD1-CD1 4.46Å; I249-I271 HydrophobicContact CD1-CG1 4.15Å; G267-I271 WeakPolarHBondContact O-CG1 3.5Å; G267-I271 PolarHBondContact O-N 2.69Å; A268-I271 PolarHBondContact O-N 3.39Å; I271-G273 PolarHBondContact O-N 3.16Å; I271-M274 PolarHBondContact O-N 3.48Å; I271-N275 WeakPolarHBondContact O-CB 3.21Å; I271-N275 VanDerWaalsContact O-CG 3.27Å; I271-N275 PolarHBondContact O-N 3.32Å; I271-N275 PolarHBondContact O-OD1 3.4Å
272Q79.6Confident72.7Confident17 Ų1732.8 Ų32.88%0.07919%0.189CC..Hα-helixtrans-70.2-31.3178.1-173.357.460.900113.2I38 R41 A42 A268 T276I38-Q272 HydrophobicContact CB-CG 4.46Å; I38-Q272 HydrophobicContact CG2-CB 4.38Å; I38-Q272 HydrophobicContact CG2-CG 4.21Å; I38-Q272 WeakPolarHBondContact O-CG 3.43Å; R41-Q272 HydrophobicContact CB-CG 3.83Å; A42-Q272 HydrophobicContact CB-CB 3.68Å; A42-Q272 HydrophobicContact CB-CG 4.01Å; A268-Q272 WeakPolarHBondContact O-CB 3.2Å; A268-Q272 PolarHBondContact O-N 3.46Å; Q272-T276 PolarHBondContact NE2-OG1 3.45Å; Q272-T276 VanDerWaalsContact O-CB 3.25Å; Q272-T276 WeakPolarHBondContact O-CB 3.44Å; Q272-T276 PolarHBondContact O-N 3.37Å; Q272-T276 PolarHBondContact O-OG1 3.1Å
273G71.5Confident69.9Low0 Ų030.1 Ų30.10%017%0.174CC..Hα-helixtrans-58.5-54.4169.700000110.2V10 L269 I270 I271 N275 T276 G277V10-G273 VanDerWaalsContact CG1-C 3.46Å; L269-G273 PolarHBondContact O-N 2.92Å; I270-G273 PolarHBondContact O-N 3.05Å; I271-G273 PolarHBondContact O-N 3.16Å; G273-N275 PolarHBondContact O-N 2.92Å; G273-T276 CarbonylContact O-C 3.58Å; G273-T276 PolarHBondContact O-N 3.36Å; G273-G277 PolarHBondContact O-N 3Å
274M68.6Low67.2Low90 Ų9031.3 Ų31.344%0.44318%0.184SC..Hα-helixtrans-55.6-49.4175.7-69.3173.96200111.7V10 I270 I271 T276 G277 I278V10-M274 HydrophobicContact CG1-CG 3.98Å; V10-M274 HydrophobicContact CG2-CG 3.74Å; V10-M274 HydrophobicContact CG2-SD 4.39Å; I270-M274 HydrophobicContact CG2-SD 4.12Å; I270-M274 WeakPolarHBondContact O-CG 3.4Å; I270-M274 PolarHBondContact O-N 3.47Å; I271-M274 PolarHBondContact O-N 3.48Å; M274-T276 VanDerWaalsContact C-N 3.28Å; M274-T276 PolarHBondContact O-N 2.87Å; M274-G277 PolarHBondContact O-N 3.09Å; M274-I278 HydrophobicContact CB-CD1 4.46Å; M274-I278 VanDerWaalsContact O-CB 3.23Å; M274-I278 WeakPolarHBondContact O-CB 3.42Å; M274-I278 WeakPolarHBondContact O-CD1 3.38Å; M274-I278 WeakPolarHBondContact O-CG1 3.35Å; M274-I278 PolarHBondContact O-N 3.32Å
275N65.7Low64.3Low24 Ų2432.4 Ų32.413%0.12819%0.191CC..Hα-helixtrans-63.1-32.8178.1-68.9-3.4000112I271 G273 L279 P285I271-N275 WeakPolarHBondContact O-CB 3.21Å; I271-N275 VanDerWaalsContact O-CG 3.27Å; I271-N275 PolarHBondContact O-N 3.32Å; I271-N275 PolarHBondContact O-OD1 3.4Å; G273-N275 PolarHBondContact O-N 2.92Å; N275-L279 VanDerWaalsContact O-CB 3.25Å; N275-L279 WeakPolarHBondContact O-CB 3.4Å; N275-L279 WeakPolarHBondContact O-CD1 3.25Å; N275-L279 WeakPolarHBondContact O-CG 3.24Å; N275-L279 PolarHBondContact O-N 3.36Å; N275-P285 HydrophobicContact CB-CG 4.46Å
276T67.1Low61.5Low11 Ų1135.8 Ų35.87%0.06721%0.205CC..Hα-helixtrans-73.3-42.7175-650000112I38 Q272 G273 M274 I278 L279 L280I38-T276 HydrophobicContact CD1-CG2 4.07Å; I38-T276 HydrophobicContact CG1-CG2 3.82Å; I38-T276 WeakPolarHBondContact CG1-OG1 3.4Å; Q272-T276 PolarHBondContact NE2-OG1 3.45Å; Q272-T276 VanDerWaalsContact O-CB 3.25Å; Q272-T276 WeakPolarHBondContact O-CB 3.44Å; Q272-T276 PolarHBondContact O-N 3.37Å; Q272-T276 PolarHBondContact O-OG1 3.1Å; G273-T276 CarbonylContact O-C 3.58Å; G273-T276 PolarHBondContact O-N 3.36Å; M274-T276 VanDerWaalsContact C-N 3.28Å; M274-T276 PolarHBondContact O-N 2.87Å; T276-I278 VanDerWaalsContact C-N 3.31Å; T276-I278 PolarHBondContact O-N 3.01Å; T276-L279 PolarHBondContact O-N 3.13Å; T276-L280 HydrophobicContact CG2-CD1 3.84Å; T276-L280 HydrophobicContact CG2-CG 4.29Å; T276-L280 VanDerWaalsContact O-CB 3.31Å; T276-L280 WeakPolarHBondContact O-CB 3.48Å; T276-L280 WeakPolarHBondContact O-CG 3.26Å; T276-L280 PolarHBondContact O-N 3.23Å
277G55.6Low58.7Low10 Ų1035.2 Ų35.210%0.10320%0.201CC..Hα-helixtrans-60.8-41.2171.600000112.1D14 G273 M274 L280 S281D14-G277 VanDerWaalsContact OD1-CA 3.31Å; D14-G277 WeakPolarHBondContact OD1-CA 3.23Å; G273-G277 PolarHBondContact O-N 3Å; M274-G277 PolarHBondContact O-N 3.09Å; G277-L280 PolarHBondContact O-N 3Å; G277-S281 PolarHBondContact O-N 3.43Å; G277-S281 PolarHBondContact O-OG 2.96Å
278I54.1Low56.4Low56 Ų5635.2 Ų35.229%0.28720%0.201SC..Hα-helixtrans-64.9-43.3176.2-69.1166.9000110.9M274 T276 S281 G282 F283 P285M274-I278 HydrophobicContact CB-CD1 4.46Å; M274-I278 VanDerWaalsContact O-CB 3.23Å; M274-I278 WeakPolarHBondContact O-CB 3.42Å; M274-I278 WeakPolarHBondContact O-CD1 3.38Å; M274-I278 WeakPolarHBondContact O-CG1 3.35Å; M274-I278 PolarHBondContact O-N 3.32Å; T276-I278 VanDerWaalsContact C-N 3.31Å; T276-I278 PolarHBondContact O-N 3.01Å; I278-S281 WeakPolarHBondContact CA-OG 3.5Å; I278-S281 CarbonylContact O-C 3.51Å; I278-S281 WeakPolarHBondContact O-CA 3.41Å; I278-S281 PolarHBondContact O-N 3.48Å; I278-S281 VanDerWaalsContact O-N 3.16Å; I278-S281 PolarHBondContact O-OG 3.05Å; I278-G282 PolarHBondContact O-N 3.48Å; I278-F283 HydrophobicContact CG2-CB 3.66Å; I278-F283 WeakPolarHBondContact CG2-O 3.36Å; I278-F283 PolarHBondContact O-N 2.93Å; I278-P285 HydrophobicContact CG2-CG 4.11Å
279L52.2Low53.6Low80 Ų8035.2 Ų35.242%0.41920%0.201SC..Hα-helixtrans-68.3-37.4174.2-77.4165.3000113.1N275 T276 S281 G282 F283N275-L279 VanDerWaalsContact O-CB 3.25Å; N275-L279 WeakPolarHBondContact O-CB 3.4Å; N275-L279 WeakPolarHBondContact O-CD1 3.25Å; N275-L279 WeakPolarHBondContact O-CG 3.24Å; N275-L279 PolarHBondContact O-N 3.36Å; T276-L279 PolarHBondContact O-N 3.13Å; L279-S281 PolarHBondContact O-N 3.19Å; L279-G282 PolarHBondContact O-N 3.41Å; L279-F283 WeakPolarHBondContact CD2-O 3.31Å
280L56.2Low50.9Low83 Ų8333.7 Ų33.744%0.43519%0.193SC..Hα-helixtrans-66.6-21.1171.7-73167.6000112A18 F21 T276 G277A18-L280 HydrophobicContact CB-CD1 4Å; F21-L280 HydrophobicContact CD2-CD1 4.23Å; T276-L280 HydrophobicContact CG2-CD1 3.84Å; T276-L280 HydrophobicContact CG2-CG 4.29Å; T276-L280 VanDerWaalsContact O-CB 3.31Å; T276-L280 WeakPolarHBondContact O-CB 3.48Å; T276-L280 WeakPolarHBondContact O-CG 3.26Å; T276-L280 PolarHBondContact O-N 3.23Å; G277-L280 PolarHBondContact O-N 3Å
281S43.8Very low48.5Very low63 Ų6333.4 Ų33.444%0.44119%0.192SC..THydrogen-bonded Turntrans-92.90.9167.673.60000114.8G277 I278 L279G277-S281 PolarHBondContact O-N 3.43Å; G277-S281 PolarHBondContact O-OG 2.96Å; I278-S281 WeakPolarHBondContact CA-OG 3.5Å; I278-S281 CarbonylContact O-C 3.51Å; I278-S281 WeakPolarHBondContact O-CA 3.41Å; I278-S281 PolarHBondContact O-N 3.48Å; I278-S281 VanDerWaalsContact O-N 3.16Å; I278-S281 PolarHBondContact O-OG 3.05Å; L279-S281 PolarHBondContact O-N 3.19Å
282G40.9Very low46.5Very low41 Ų4133.3 Ų33.342%0.42319%0.192SC..THydrogen-bonded Turntrans108.6-9171.800000117.5I278 L279I278-G282 PolarHBondContact O-N 3.48Å; L279-G282 PolarHBondContact O-N 3.41Å
283F33.6Very low44.3Very low39 Ų3933.3 Ų33.317%0.17120%0.195CC..  trans-106.2141.7-164.2-56.9-58.2000115.4I278 L279 L426I278-F283 HydrophobicContact CG2-CB 3.66Å; I278-F283 WeakPolarHBondContact CG2-O 3.36Å; I278-F283 PolarHBondContact O-N 2.93Å; L279-F283 WeakPolarHBondContact CD2-O 3.31Å; F283-L426 HydrophobicContact CE2-CD1 4.27Å; F283-L426 HydrophobicContact CZ-CB 4.19Å; F283-L426 HydrophobicContact CZ-CD1 3.77Å
284P33.8Very low42.4Very low59 Ų5934.9 Ų34.938%0.38320%0.204SC..  trans-103.9114.617434.6-28.1000113.4Y425P284-Y425 HydrophobicContact CG-CE1 4.07Å; P284-Y425 HydrophobicContact CG-CE2 4.4Å; P284-Y425 WeakPolarHBondContact O-CE2 3.2Å; P284-Y425 PolarHBondContact O-OH 3.5Å
285P28.9Very low40.6Very low24 Ų2433.1 Ų33.116%0.15620%0.196CC..  trans-113.8106.3-171.438-28.6000115.2N275 I278N275-P285 HydrophobicContact CB-CG 4.46Å; I278-P285 HydrophobicContact CG2-CG 4.11Å
286E33.5Very low39.6Very low95 Ų9535.2 Ų35.244%0.44420%0.204SC..  trans-147.9127.2176.5-49.7-178.6168.900112.7W238W238-E286 HydrophobicContact CB-CB 4.02Å; W238-E286 VanDerWaalsContact CD1-CB 3.44Å; W238-E286 HydrophobicContact CG-CB 4.11Å
287M32.1Very low38.8Very low1 Ų142.9 Ų42.91%0.00523%0.232CC..  trans-161.1160.1160.6-141.6172.871.800115.8W238 M417 R421 V534W238-M287 VanDerWaalsContact CD1-CA 3.41Å; W238-M287 VanDerWaalsContact CD2-C 3.42Å; W238-M287 VanDerWaalsContact CD2-CA 3.45Å; W238-M287 HydrophobicContact CD2-CG 4.38Å; W238-M287 VanDerWaalsContact CE2-CA 3.49Å; W238-M287 VanDerWaalsContact CG-C 3.46Å; W238-M287 HydrophobicContact CH2-CG 4.07Å; W238-M287 HydrophobicContact CZ2-CB 4.41Å; W238-M287 HydrophobicContact CZ2-CG 3.44Å; W238-M287 VanDerWaalsContact CZ2-CG 3.44Å; M287-M417 HydrophobicContact CB-CE 3.25Å; M287-M417 HydrophobicContact CB-CG 4.34Å; M287-M417 HydrophobicContact CB-SD 3.68Å; M287-M417 HydrophobicContact CE-CG 3.62Å; M287-M417 HydrophobicContact CE-SD 4.43Å; M287-R421 PolarHBondContact SD-NH2 3.42Å; M287-V534 HydrophobicContact SD-CG2 4.29Å
288N32.4Very low38.8Very low0 Ų047.4 Ų47.40%025%0.253CS..  trans83.6161.7164-61.8-25.9000118.4W238 L241 L356 M417 D537W238-N288 VanDerWaalsContact CE3-CA 3.45Å; L241-N288 HydrophobicContact CD1-CB 3.42Å; L241-N288 VanDerWaalsContact CD1-CB 3.42Å; L241-N288 HydrophobicContact CG-CB 4.17Å; L241-N288 WeakPolarHBondContact CG-O 3.43Å; N288-L356 HydrophobicContact CB-CD1 4.47Å; N288-L356 VanDerWaalsContact ND2-CB 3.26Å; N288-L356 WeakPolarHBondContact ND2-CB 3.39Å; N288-L356 PolarHBondContact ND2-O 3.47Å; N288-M417 WeakPolarHBondContact ND2-CG 3.27Å; N288-M417 PolarHBondContact ND2-SD 3.46Å; N288-D537 VanDerWaalsContact OD1-CG 3.27Å; N288-D537 PolarHBondContact OD1-OD2 3.19Å
289Q29.3Very low39.3Very low0 Ų047.6 Ų47.60%026%0.255CS..  cis-175.3-160.4-14-104.1170.614.400112.1L63 L241 L356 D537 L538 I541L63-Q289 WeakPolarHBondContact CB-O 3.34Å; L63-Q289 WeakPolarHBondContact CD2-O 3.49Å; L241-Q289 HydrophobicContact CD1-CB 4.46Å; Q289-L356 VanDerWaalsContact OE1-CB 3.27Å; Q289-D537 VanDerWaalsContact CG-OD2 3.31Å; Q289-D537 WeakPolarHBondContact CG-OD2 3.28Å; Q289-D537 VanDerWaalsContact NE2-CB 3.27Å; Q289-D537 VanDerWaalsContact NE2-CG 3.26Å; Q289-D537 PolarHBondContact NE2-OD2 2.86Å; Q289-L538 HydrophobicContact CB-CD2 4.16Å; Q289-L538 HydrophobicContact CB-CG 4.34Å; Q289-L538 HydrophobicContact CG-CD2 3.89Å; Q289-L538 HydrophobicContact CG-CG 3.72Å; Q289-I541 HydrophobicContact CG-CD1 3.77Å
290E31.5Very low39.9Very low0 Ų043.9 Ų43.90%024%0.235CC..  cis-167.1156.6-0.2-131.2-176.4-178.100117.9L63 F116 I354 I541L63-E290 HydrophobicContact CD1-CB 4.12Å; L63-E290 WeakPolarHBondContact CD1-O 3.39Å; F116-E290 HydrophobicContact CD1-CB 4.27Å; F116-E290 HydrophobicContact CE1-CB 3.57Å; F116-E290 HydrophobicContact CE1-CG 4.26Å; F116-E290 VanDerWaalsContact CE1-OE2 3.25Å; F116-E290 WeakPolarHBondContact CE1-OE2 3.22Å; F116-E290 HydrophobicContact CE2-CB 4.37Å; F116-E290 HydrophobicContact CZ-CB 3.62Å; F116-E290 VanDerWaalsContact CZ-OE2 3.32Å; F116-E290 WeakPolarHBondContact CZ-OE2 3.28Å; E290-I354 WeakPolarHBondContact OE1-CG2 3.37Å; E290-I354 WeakPolarHBondContact OE2-CG2 3.43Å; E290-I541 HydrophobicContact CG-CD1 3.39Å; E290-I541 HydrophobicContact CG-CG1 3.91Å; E290-I541 HydrophobicContact CG-CG2 4.39Å
291Y32.8Very low40.7Very low0 Ų041.6 Ų41.60%022%0.223CC..  trans41.8171.1135.7-87.3-20.1000132.5F116 V117 M345 I349 I354 I541 V545 L551F116-Y291 CarbonylContact C-O 3.59Å; F116-Y291 WeakPolarHBondContact CB-O 3.47Å; F116-Y291 VanDerWaalsContact CD1-CB 3.49Å; F116-Y291 WeakPolarHBondContact CD1-O 3.37Å; F116-Y291 WeakPolarHBondContact CG-O 3.21Å; V117-Y291 WeakPolarHBondContact CA-O 3.39Å; V117-Y291 VanDerWaalsContact CB-O 3.32Å; V117-Y291 WeakPolarHBondContact CB-O 3.46Å; V117-Y291 PolarHBondContact N-O 3.02Å; Y291-M345 HydrophobicContact CE2-CE 4.16Å; Y291-M345 VanDerWaalsContact OH-CE 3.27Å; Y291-M345 WeakPolarHBondContact OH-CE 3.49Å; Y291-M345 WeakPolarHBondContact OH-CG 3.46Å; Y291-M345 PolarHBondContact OH-SD 2.88Å; Y291-I349 HydrophobicContact CD1-CD1 4.3Å; Y291-I349 HydrophobicContact CE1-CD1 3.24Å; Y291-I349 HydrophobicContact CE1-CG1 3.86Å; Y291-I349 HydrophobicContact CE2-CD1 4.36Å; Y291-I349 HydrophobicContact CE2-CG1 4.06Å; Y291-I349 WeakPolarHBondContact OH-CD1 3.33Å; Y291-I349 WeakPolarHBondContact OH-CG1 3.42Å; Y291-I354 HydrophobicContact CD2-CD1 4.01Å; Y291-I354 HydrophobicContact CD2-CG1 3.75Å; Y291-I354 HydrophobicContact CE2-CG1 3.88Å; Y291-I541 HydrophobicContact CD1-CB 3.86Å; Y291-I541 HydrophobicContact CD1-CG1 3.7Å; Y291-I541 HydrophobicContact CD1-CG2 3.49Å; Y291-I541 VanDerWaalsContact CD1-CG2 3.49Å; Y291-I541 HydrophobicContact CD2-CG1 4.08Å; Y291-I541 VanDerWaalsContact CE1-CA 3.48Å; Y291-I541 HydrophobicContact CE1-CB 3.64Å; Y291-I541 HydrophobicContact CE1-CG1 3.31Å; Y291-I541 HydrophobicContact CE1-CG2 3.83Å; Y291-I541 HydrophobicContact CE2-CD1 4.43Å; Y291-I541 HydrophobicContact CE2-CG1 3.69Å; Y291-I541 HydrophobicContact CG-CG1 4.04Å; Y291-I541 HydrophobicContact CG-CG2 4.04Å; Y291-V545 HydrophobicContact CD1-CG2 3.98Å; Y291-V545 HydrophobicContact CE1-CG2 4.36Å; Y291-L551 HydrophobicContact CD1-CD1 3.14Å; Y291-L551 HydrophobicContact CD1-CD2 3.67Å; Y291-L551 HydrophobicContact CD1-CG 4.03Å; Y291-L551 HydrophobicContact CD2-CD1 4.4Å; Y291-L551 HydrophobicContact CD2-CD2 3.48Å; Y291-L551 VanDerWaalsContact CD2-CD2 3.48Å; Y291-L551 HydrophobicContact CE1-CD1 3.68Å; Y291-L551 HydrophobicContact CE1-CD2 3.78Å; Y291-L551 HydrophobicContact CE1-CG 4.28Å; Y291-L551 HydrophobicContact CE2-CD2 3.66Å; Y291-L551 HydrophobicContact CG-CD1 3.61Å; Y291-L551 HydrophobicContact CG-CD2 3.55Å; Y291-L551 HydrophobicContact CG-CG 4.23Å
292V33.2Very low42Very low7 Ų744.7 Ų44.74%0.04223%0.232CC..  trans106100.7146.4-1760000124.9Q114 F116 V117 I354 L551Q114-V292 HydrophobicContact CB-CG1 4.2Å; Q114-V292 HydrophobicContact CG-CG1 3.87Å; Q114-V292 VanDerWaalsContact OE1-CG1 3.29Å; F116-V292 HydrophobicContact CB-CB 4.02Å; F116-V292 HydrophobicContact CB-CG2 4.49Å; F116-V292 HydrophobicContact CD1-CB 3.83Å; F116-V292 HydrophobicContact CD1-CG2 3.45Å; F116-V292 VanDerWaalsContact CD1-CG2 3.45Å; F116-V292 HydrophobicContact CE1-CG2 4Å; F116-V292 HydrophobicContact CG-CB 4.45Å; F116-V292 HydrophobicContact CG-CG2 4.42Å; V117-V292 WeakPolarHBondContact CB-O 3.15Å; V117-V292 WeakPolarHBondContact CG1-O 3.29Å; V292-I354 HydrophobicContact CG2-CD1 4.43Å; V292-L551 HydrophobicContact CB-CB 3.81Å; V292-L551 HydrophobicContact CB-CD1 4.47Å; V292-L551 HydrophobicContact CG1-CB 3.84Å; V292-L551 HydrophobicContact CG2-CB 3.55Å; V292-L551 HydrophobicContact CG2-CD1 4.35Å; V292-L551 HydrophobicContact CG2-CD2 4.05Å; V292-L551 HydrophobicContact CG2-CG 4.2Å; V292-L551 VanDerWaalsContact N-CD1 3.3Å
293A32.8Very low43.5Very low17 Ų1744 Ų4414%0.1422%0.218CC..  trans91.3157.4138.700000124.1Q114Q114-A293 HydrophobicContact CB-CB 4.26Å
294V31.9Very low45.6Very low32 Ų3242.1 Ų42.119%0.19421%0.21CC..  cis-170.5131.6-28.7166.90000106.4L550 S552V294-L550 HydrophobicContact CB-CB 4.27Å; V294-L550 HydrophobicContact CB-CD1 4.01Å; V294-L550 HydrophobicContact CB-CD2 4.2Å; V294-L550 HydrophobicContact CB-CG 4.38Å; V294-L550 HydrophobicContact CG1-CD1 3.53Å; V294-L550 HydrophobicContact CG1-CD2 3.9Å; V294-L550 HydrophobicContact CG1-CG 4.22Å; V294-L550 HydrophobicContact CG2-CB 3.99Å; V294-L550 HydrophobicContact CG2-CD1 3.72Å; V294-L550 HydrophobicContact CG2-CG 4.33Å; V294-S552 WeakPolarHBondContact CG2-OG 3.48Å
295I31.1Very low47.9Very low53 Ų5341.7 Ų41.727%0.27220%0.204SC..  169.5149.5127.9-88.8166.2000115.8P300 L550 T605I295-P300 WeakPolarHBondContact O-CG 3.28Å; I295-L550 VanDerWaalsContact N-CD2 3.35Å; I295-T605 VanDerWaalsContact CB-OG1 3.3Å; I295-T605 WeakPolarHBondContact CB-OG1 3.33Å; I295-T605 HydrophobicContact CD1-CG2 3.46Å; I295-T605 VanDerWaalsContact CD1-CG2 3.46Å; I295-T605 HydrophobicContact CG2-CG2 4.19Å; I295-T605 WeakPolarHBondContact CG2-OG1 3.24Å
296K45.7Very low50.3Low69 Ų6942 Ų4230%0.321%0.211SC..  trans94.123.6169.5-51.7-148.7-171.6168.10122.7N298 L299 P300 L604K296-N298 PolarHBondContact O-N 2.89Å; K296-L299 HydrophobicContact CB-CB 3.83Å; K296-L299 HydrophobicContact CB-CD2 4.27Å; K296-L299 HydrophobicContact CD-CD2 3.86Å; K296-L299 PolarHBondContact O-N 3.08Å; K296-P300 WeakPolarHBondContact O-CD 3.31Å; K296-L604 WeakPolarHBondContact CE-O 3.23Å; K296-L604 PolarHBondContact NZ-O 2.86Å
297R50.3Low52.5Low172 Ų17239.6 Ų39.665%0.64920%0.203SC*.THydrogen-bonded Turntrans49.3-76163.7-161.1162.282.3-175.64.7119V555R297-V555 HydrophobicContact CB-CG1 3.39Å; R297-V555 HydrophobicContact CG-CG1 3.45Å; R297-V555 VanDerWaalsContact CG-CG1 3.45Å
298N55.8Low55Low105 Ų10541.2 Ų41.256%0.56121%0.21SC*.Hα-helixtrans-90.3-28.2178.2-63.837.5000111.8K296 L301 M302K296-N298 PolarHBondContact O-N 2.89Å; N298-L301 PolarHBondContact O-N 3.4Å; N298-M302 PolarHBondContact O-N 3.38Å
299L62.7Low57.5Low60 Ų6044.5 Ų44.531%0.31423%0.23SC..Hα-helixtrans-68-38.3-177.2-170.866.5000113.2K296 L301 M302 I303 L604K296-L299 HydrophobicContact CB-CB 3.83Å; K296-L299 HydrophobicContact CB-CD2 4.27Å; K296-L299 HydrophobicContact CD-CD2 3.86Å; K296-L299 PolarHBondContact O-N 3.08Å; L299-L301 PolarHBondContact O-N 2.94Å; L299-M302 PolarHBondContact O-N 2.88Å; L299-I303 HydrophobicContact CD2-CD1 4.47Å; L299-I303 HydrophobicContact CG-CD1 3.94Å; L299-I303 HydrophobicContact CG-CG1 4.34Å; L299-I303 VanDerWaalsContact O-CG1 3.27Å; L299-I303 WeakPolarHBondContact O-CG1 3.46Å; L299-I303 PolarHBondContact O-N 3.37Å; L299-L604 HydrophobicContact CD2-CD1 3.91Å
300P65.5Low60Low1 Ų150.4 Ų50.41%0.00626%0.261CS..Hα-helixtrans-54.7-49.1170.8-28.237.1000112.2I295 K296 M302 I303 T304 F597I295-P300 WeakPolarHBondContact O-CG 3.28Å; K296-P300 WeakPolarHBondContact O-CD 3.31Å; P300-M302 VanDerWaalsContact C-N 3.35Å; P300-M302 PolarHBondContact O-N 3.49Å; P300-I303 CarbonylContact O-C 3.6Å; P300-I303 WeakPolarHBondContact O-CB 3.25Å; P300-I303 PolarHBondContact O-N 2.94Å; P300-I303 VanDerWaalsContact O-N 3.1Å; P300-T304 PolarHBondContact O-N 2.96Å; P300-T304 PolarHBondContact O-OG1 3.26Å; P300-F597 HydrophobicContact CB-CZ 4.19Å
301L73Confident62.4Low36 Ų3651.6 Ų51.619%0.18827%0.273CS..Hα-helixtrans-59.2-41175.5170.1145.8000112.7N298 L299 I303 T304 I305 T557 L559N298-L301 PolarHBondContact O-N 3.4Å; L299-L301 PolarHBondContact O-N 2.94Å; L301-I303 VanDerWaalsContact C-N 3.34Å; L301-T304 PolarHBondContact O-N 2.85Å; L301-I305 HydrophobicContact CD2-CD1 3.65Å; L301-I305 HydrophobicContact CG-CD1 3.88Å; L301-I305 WeakPolarHBondContact O-CB 2.84Å; L301-I305 VanDerWaalsContact O-CG1 3.29Å; L301-I305 WeakPolarHBondContact O-CG1 3.45Å; L301-I305 PolarHBondContact O-N 3.49Å; L301-T557 HydrophobicContact CD1-CG2 4.39Å; L301-T557 VanDerWaalsContact CD1-OG1 3.3Å; L301-T557 WeakPolarHBondContact CD1-OG1 3.44Å; L301-L559 HydrophobicContact CD1-CB 4.22Å; L301-L559 HydrophobicContact CD1-CD2 4.28Å; L301-L559 HydrophobicContact CD1-CG 4.27Å
302M70.8Confident64.8Low128 Ų12853.3 Ų53.363%0.63128%0.28SS*.Hα-helixtrans-66.3-35.7175.5-69.8-175.272.800112.5N298 L299 P300 G306N298-M302 PolarHBondContact O-N 3.38Å; L299-M302 PolarHBondContact O-N 2.88Å; P300-M302 VanDerWaalsContact C-N 3.35Å; P300-M302 PolarHBondContact O-N 3.49Å; M302-G306 PolarHBondContact O-N 3.39Å
303I73.5Confident67.3Low25 Ų2557.5 Ų57.513%0.12830%0.302CS..Hα-helixtrans-67.6-47.5173.4-66.9164.6000109.8L299 P300 L301 I305 G306 V307 F597 L600 L604L299-I303 HydrophobicContact CD2-CD1 4.47Å; L299-I303 HydrophobicContact CG-CD1 3.94Å; L299-I303 HydrophobicContact CG-CG1 4.34Å; L299-I303 VanDerWaalsContact O-CG1 3.27Å; L299-I303 WeakPolarHBondContact O-CG1 3.46Å; L299-I303 PolarHBondContact O-N 3.37Å; P300-I303 CarbonylContact O-C 3.6Å; P300-I303 WeakPolarHBondContact O-CB 3.25Å; P300-I303 PolarHBondContact O-N 2.94Å; P300-I303 VanDerWaalsContact O-N 3.1Å; L301-I303 VanDerWaalsContact C-N 3.34Å; I303-I305 PolarHBondContact O-N 2.89Å; I303-G306 CarbonylContact O-C 3.48Å; I303-G306 PolarHBondContact O-N 3.4Å; I303-V307 HydrophobicContact CG2-CG2 4.14Å; I303-V307 WeakPolarHBondContact O-CB 3.31Å; I303-V307 VanDerWaalsContact O-CG2 3.27Å; I303-V307 WeakPolarHBondContact O-CG2 3.1Å; I303-V307 PolarHBondContact O-N 3.33Å; I303-F597 HydrophobicContact CB-CE2 4.02Å; I303-F597 HydrophobicContact CG2-CD2 3.71Å; I303-F597 HydrophobicContact CG2-CE2 3.56Å; I303-L600 HydrophobicContact CD1-CD2 4.04Å; I303-L600 HydrophobicContact CD1-CG 4.26Å; I303-L600 HydrophobicContact CG1-CD2 4.37Å; I303-L600 HydrophobicContact CG2-CD2 3.76Å; I303-L604 HydrophobicContact CD1-CD1 3.67Å
304T76.8Confident69.8Low0 Ų062.6 Ų62.60%032%0.318CS..Hα-helixtrans-59.8-45.7178.7-48.30000111.3P300 L301 V307 F308 I546 F563 I567 F597P300-T304 PolarHBondContact O-N 2.96Å; P300-T304 PolarHBondContact O-OG1 3.26Å; L301-T304 PolarHBondContact O-N 2.85Å; T304-V307 PolarHBondContact O-N 2.96Å; T304-F308 WeakPolarHBondContact O-CB 3.3Å; T304-F308 PolarHBondContact O-N 3.48Å; T304-I546 HydrophobicContact CG2-CG2 4.48Å; T304-I546 WeakPolarHBondContact CG2-O 3.25Å; T304-I546 PolarHBondContact OG1-O 3.44Å; T304-F563 HydrophobicContact CG2-CB 3.66Å; T304-I567 HydrophobicContact CG2-CD1 3.56Å; T304-F597 WeakPolarHBondContact OG1-CE2 3.4Å; T304-F597 WeakPolarHBondContact OG1-CZ 3.5Å
305I81.9Confident72.2Confident51 Ų5161.4 Ų61.426%0.26231%0.311SS..Hα-helixtrans-63.9-42.8175.6-68.1171.8000110.6L301 I303 F308 V309 F563L301-I305 HydrophobicContact CD2-CD1 3.65Å; L301-I305 HydrophobicContact CG-CD1 3.88Å; L301-I305 WeakPolarHBondContact O-CB 2.84Å; L301-I305 VanDerWaalsContact O-CG1 3.29Å; L301-I305 WeakPolarHBondContact O-CG1 3.45Å; L301-I305 PolarHBondContact O-N 3.49Å; I303-I305 PolarHBondContact O-N 2.89Å; I305-F308 PolarHBondContact O-N 2.89Å; I305-V309 HydrophobicContact CG2-CG2 4.31Å; I305-V309 WeakPolarHBondContact O-CB 3.18Å; I305-V309 VanDerWaalsContact O-CG2 3.28Å; I305-V309 WeakPolarHBondContact O-CG2 3.3Å; I305-V309 PolarHBondContact O-N 3.4Å; I305-F563 HydrophobicContact CD1-CD2 4.09Å; I305-F563 HydrophobicContact CD1-CE2 3.78Å; I305-F563 HydrophobicContact CD1-CZ 4.29Å; I305-F563 HydrophobicContact CG1-CD1 4.21Å; I305-F563 HydrophobicContact CG1-CD2 3.6Å; I305-F563 HydrophobicContact CG1-CE1 4.23Å; I305-F563 HydrophobicContact CG1-CE2 3.63Å; I305-F563 HydrophobicContact CG1-CG 3.91Å; I305-F563 HydrophobicContact CG1-CZ 3.96Å
306G80.6Confident74.7Confident29 Ų2961.3 Ų61.330%0.29931%0.311SS..Hα-helixtrans-61.7-43.5175.900000113M302 I303 V309 L310M302-G306 PolarHBondContact O-N 3.39Å; I303-G306 CarbonylContact O-C 3.48Å; I303-G306 PolarHBondContact O-N 3.4Å; G306-V309 PolarHBondContact O-N 3.26Å; G306-L310 VanDerWaalsContact O-CB 3.26Å; G306-L310 WeakPolarHBondContact O-CB 3.44Å; G306-L310 WeakPolarHBondContact O-CG 3.45Å; G306-L310 PolarHBondContact O-N 3.47Å
307V79.1Confident76.6Confident45 Ų4562.7 Ų62.727%0.27333%0.325SS..Hα-helixtrans-62.7-46.5175163.60000110.9I303 T304 G311 I567 L593I303-V307 HydrophobicContact CG2-CG2 4.14Å; I303-V307 WeakPolarHBondContact O-CB 3.31Å; I303-V307 VanDerWaalsContact O-CG2 3.27Å; I303-V307 WeakPolarHBondContact O-CG2 3.1Å; I303-V307 PolarHBondContact O-N 3.33Å; T304-V307 PolarHBondContact O-N 2.96Å; V307-G311 PolarHBondContact O-N 3.37Å; V307-I567 HydrophobicContact CB-CD1 4.48Å; V307-I567 HydrophobicContact CG1-CD1 3.92Å; V307-L593 HydrophobicContact CG1-CD1 3.91Å
308F84.1Confident78.2Confident36 Ų3658.9 Ų58.916%0.15832%0.315CS..Hα-helixtrans-61.4-47.9176.4178.5-101.3000111.4T304 I305 G311 Y312 F563 A566 I567 L570T304-F308 WeakPolarHBondContact O-CB 3.3Å; T304-F308 PolarHBondContact O-N 3.48Å; I305-F308 PolarHBondContact O-N 2.89Å; F308-G311 PolarHBondContact O-N 2.9Å; F308-Y312 HydrophobicContact CE1-CD2 4.47Å; F308-Y312 HydrophobicContact CZ-CD2 4.03Å; F308-Y312 VanDerWaalsContact O-CB 3.24Å; F308-Y312 WeakPolarHBondContact O-CB 3.48Å; F308-Y312 PolarHBondContact O-N 2.63Å; F308-F563 HydrophobicContact CB-CD1 4.13Å; F308-F563 AromaticContact CD1-CD1 3.78Å; F308-F563 HydrophobicContact CD1-CD1 3.78Å; F308-F563 AromaticContact CD1-CE1 3.81Å; F308-F563 HydrophobicContact CD1-CE1 3.81Å; F308-F563 HydrophobicContact CE1-CD1 4.38Å; F308-F563 HydrophobicContact CE1-CE1 4.19Å; F308-F563 AromaticContact CG-CD1 3.92Å; F308-F563 HydrophobicContact CG-CD1 3.92Å; F308-F563 HydrophobicContact CG-CE1 4.41Å; F308-A566 HydrophobicContact CD2-CB 4.13Å; F308-A566 HydrophobicContact CE2-CB 3.7Å; F308-A566 HydrophobicContact CZ-CB 4.3Å; F308-I567 HydrophobicContact CB-CD1 4.11Å; F308-I567 HydrophobicContact CB-CG1 3.78Å; F308-I567 HydrophobicContact CD2-CG1 3.79Å; F308-I567 HydrophobicContact CG-CG1 4.28Å; F308-L570 HydrophobicContact CD2-CD2 3.98Å; F308-L570 HydrophobicContact CE2-CB 4.4Å; F308-L570 HydrophobicContact CE2-CD2 4.13Å
309V84.3Confident79.5Confident69 Ų6956.2 Ų56.242%0.41830%0.298SS..Hα-helixtrans-65.2-45.1179.8169.90000111.6I305 G306 Y312 L313I305-V309 HydrophobicContact CG2-CG2 4.31Å; I305-V309 WeakPolarHBondContact O-CB 3.18Å; I305-V309 VanDerWaalsContact O-CG2 3.28Å; I305-V309 WeakPolarHBondContact O-CG2 3.3Å; I305-V309 PolarHBondContact O-N 3.4Å; G306-V309 PolarHBondContact O-N 3.26Å; V309-Y312 PolarHBondContact O-N 3Å; V309-L313 HydrophobicContact CG1-CD1 3.83Å; V309-L313 HydrophobicContact CG1-CG 4.4Å; V309-L313 WeakPolarHBondContact O-CB 3.42Å; V309-L313 WeakPolarHBondContact O-CG 3.45Å; V309-L313 PolarHBondContact O-N 2.78Å
310L83.4Confident80.3Confident124 Ų12458.1 Ų58.165%0.64931%0.314SS*.Hα-helixtrans-65.6-41.2177.2-71.6170.4000111.9G306 L313 Y314G306-L310 VanDerWaalsContact O-CB 3.26Å; G306-L310 WeakPolarHBondContact O-CB 3.44Å; G306-L310 WeakPolarHBondContact O-CG 3.45Å; G306-L310 PolarHBondContact O-N 3.47Å; L310-L313 PolarHBondContact O-N 2.78Å; L310-Y314 WeakPolarHBondContact O-CB 3.2Å; L310-Y314 PolarHBondContact O-N 3.05Å
311G80.7Confident81Confident25 Ų2559.9 Ų59.926%0.25833%0.333SS..Hα-helixtrans-62.5-43.7173.900000112.2V307 F308 Y314 C315V307-G311 PolarHBondContact O-N 3.37Å; F308-G311 PolarHBondContact O-N 2.9Å; G311-Y314 WeakPolarHBondContact O-CB 3.29Å; G311-Y314 PolarHBondContact O-N 3.16Å; G311-C315 PolarHBondContact O-N 3.23Å; G311-C315 PolarHBondContact O-SG 3.45Å
312Y83.9Confident81.3Confident36 Ų3658.2 Ų58.214%0.14132%0.324CS..Hα-helixtrans-66.2-42.6178.2-160.9-76.2000111.6F308 V309 Y314 C315 L316 F322 I328 L570F308-Y312 HydrophobicContact CE1-CD2 4.47Å; F308-Y312 HydrophobicContact CZ-CD2 4.03Å; F308-Y312 VanDerWaalsContact O-CB 3.24Å; F308-Y312 WeakPolarHBondContact O-CB 3.48Å; F308-Y312 PolarHBondContact O-N 2.63Å; V309-Y312 PolarHBondContact O-N 3Å; Y312-Y314 VanDerWaalsContact C-N 3.34Å; Y312-C315 WeakPolarHBondContact O-CB 3.32Å; Y312-C315 PolarHBondContact O-N 2.78Å; Y312-L316 HydrophobicContact CD1-CD1 3.71Å; Y312-L316 HydrophobicContact CD1-CG 3.94Å; Y312-L316 HydrophobicContact CE1-CD1 3.78Å; Y312-L316 HydrophobicContact CE1-CD2 4.16Å; Y312-L316 HydrophobicContact CE1-CG 3.88Å; Y312-L316 WeakPolarHBondContact O-CG 3.42Å; Y312-L316 PolarHBondContact O-N 2.95Å; Y312-F322 PolarHBondContact OH-O 3.26Å; Y312-I328 WeakPolarHBondContact OH-CG1 3.45Å; Y312-L570 HydrophobicContact CD2-CD1 3.89Å; Y312-L570 HydrophobicContact CE2-CD1 4.49Å
313L85.8Confident81.7Confident95 Ų9555.4 Ų55.450%0.49732%0.321SS..Hα-helixtrans-61.8-41.2173.5-73169.2000111.5V309 L310 L316 T317V309-L313 HydrophobicContact CG1-CD1 3.83Å; V309-L313 HydrophobicContact CG1-CG 4.4Å; V309-L313 WeakPolarHBondContact O-CB 3.42Å; V309-L313 WeakPolarHBondContact O-CG 3.45Å; V309-L313 PolarHBondContact O-N 2.78Å; L310-L313 PolarHBondContact O-N 2.78Å; L313-L316 HydrophobicContact CD2-CD1 4.38Å; L313-L316 WeakPolarHBondContact O-CB 3.34Å; L313-L316 PolarHBondContact O-N 3.43Å; L313-T317 WeakPolarHBondContact O-CG2 3.37Å; L313-T317 PolarHBondContact O-N 2.86Å; L313-T317 VanDerWaalsContact O-N 3.12Å
314Y84.7Confident82.2Confident124 Ų12456.2 Ų56.249%0.48633%0.329SS..Hα-helixtrans-61.1-47.7173.2-179.6-104.3000111.7L310 G311 Y312 L316 T317 Q318 Y574L310-Y314 WeakPolarHBondContact O-CB 3.2Å; L310-Y314 PolarHBondContact O-N 3.05Å; G311-Y314 WeakPolarHBondContact O-CB 3.29Å; G311-Y314 PolarHBondContact O-N 3.16Å; Y312-Y314 VanDerWaalsContact C-N 3.34Å; Y314-L316 VanDerWaalsContact C-N 3.28Å; Y314-L316 PolarHBondContact O-N 3.11Å; Y314-T317 PolarHBondContact O-N 3.39Å; Y314-T317 PolarHBondContact O-OG1 3.12Å; Y314-Q318 HydrophobicContact CD1-CG 4.5Å; Y314-Q318 HydrophobicContact CE1-CG 4Å; Y314-Q318 HydrophobicContact CE2-CG 4.17Å; Y314-Q318 PolarHBondContact O-N 3.3Å; Y314-Y574 HydrophobicContact CD1-CE2 4.31Å; Y314-Y574 AromaticContact CE1-CE2 3.95Å; Y314-Y574 HydrophobicContact CE1-CE2 3.95Å
315C82Confident82.4Confident6 Ų658.3 Ų58.34%0.04134%0.342CS..Hα-helixtrans-55.6-42.5175-62.80000111.9G311 Y312 T317 Q318 F319 F322 Y574G311-C315 PolarHBondContact O-N 3.23Å; G311-C315 PolarHBondContact O-SG 3.45Å; Y312-C315 WeakPolarHBondContact O-CB 3.32Å; Y312-C315 PolarHBondContact O-N 2.78Å; C315-T317 VanDerWaalsContact C-N 3.32Å; C315-T317 PolarHBondContact O-N 2.79Å; C315-Q318 PolarHBondContact O-N 3.29Å; C315-F319 PolarHBondContact O-N 2.82Å; C315-F322 HydrophobicContact CB-CD1 3.67Å; C315-F322 HydrophobicContact CB-CD2 4.03Å; C315-F322 HydrophobicContact CB-CE1 3.75Å; C315-F322 HydrophobicContact CB-CE2 4.07Å; C315-F322 HydrophobicContact CB-CG 3.81Å; C315-F322 HydrophobicContact CB-CZ 3.94Å; C315-Y574 HydrophobicContact CB-CD2 4.39Å; C315-Y574 VanDerWaalsContact SG-CD2 3.6Å
316L85.1Confident82.4Confident52 Ų5262.5 Ų62.527%0.27235%0.354SS..Hα-helixtrans-62-34.3175.4-74.8170.8000113.4Y312 L313 Y314 F322 A323Y312-L316 HydrophobicContact CD1-CD1 3.71Å; Y312-L316 HydrophobicContact CD1-CG 3.94Å; Y312-L316 HydrophobicContact CE1-CD1 3.78Å; Y312-L316 HydrophobicContact CE1-CD2 4.16Å; Y312-L316 HydrophobicContact CE1-CG 3.88Å; Y312-L316 WeakPolarHBondContact O-CG 3.42Å; Y312-L316 PolarHBondContact O-N 2.95Å; L313-L316 HydrophobicContact CD2-CD1 4.38Å; L313-L316 WeakPolarHBondContact O-CB 3.34Å; L313-L316 PolarHBondContact O-N 3.43Å; Y314-L316 VanDerWaalsContact C-N 3.28Å; Y314-L316 PolarHBondContact O-N 3.11Å; L316-F322 HydrophobicContact CD2-CB 3.78Å; L316-F322 HydrophobicContact CG-CB 4.31Å; L316-A323 HydrophobicContact CD2-CB 3.85Å
317T84Confident82.5Confident97 Ų9761.7 Ų61.760%0.59534%0.344SS*.Hα-helixtrans-71.6-31.2176.763.40000114L313 Y314 C315L313-T317 WeakPolarHBondContact O-CG2 3.37Å; L313-T317 PolarHBondContact O-N 2.86Å; L313-T317 VanDerWaalsContact O-N 3.12Å; Y314-T317 PolarHBondContact O-N 3.39Å; Y314-T317 PolarHBondContact O-OG1 3.12Å; C315-T317 VanDerWaalsContact C-N 3.32Å; C315-T317 PolarHBondContact O-N 2.79Å
318Q84.2Confident82.7Confident93 Ų9363.2 Ų63.244%0.43535%0.35SS..Hα-helixtrans-86.7-40.7179.3-55-49.1-73.500110.9Y314 C315 Y574Y314-Q318 HydrophobicContact CD1-CG 4.5Å; Y314-Q318 HydrophobicContact CE1-CG 4Å; Y314-Q318 HydrophobicContact CE2-CG 4.17Å; Y314-Q318 PolarHBondContact O-N 3.3Å; C315-Q318 PolarHBondContact O-N 3.29Å; Q318-Y574 HydrophobicContact CB-CE2 4.46Å; Q318-Y574 HydrophobicContact CG-CE2 4.36Å
319F83.4Confident82.8Confident48 Ų4861.8 Ų61.821%0.21134%0.344CS..  trans-134.291.5-170.9-58.8-65.4000110.9C315 G321 F322 Y574 F577 D578C315-F319 PolarHBondContact O-N 2.82Å; F319-G321 PolarHBondContact O-N 3.47Å; F319-F322 HydrophobicContact CB-CD2 3.69Å; F319-F322 HydrophobicContact CB-CE2 4.05Å; F319-F322 HydrophobicContact CD2-CE2 4.19Å; F319-F322 HydrophobicContact CG-CE2 4.49Å; F319-F322 WeakPolarHBondContact O-CB 3.08Å; F319-F322 PolarHBondContact O-N 2.84Å; F319-Y574 HydrophobicContact CD2-CD2 4.23Å; F319-Y574 HydrophobicContact CD2-CE2 4.01Å; F319-Y574 HydrophobicContact CE2-CD2 4.11Å; F319-Y574 AromaticContact CE2-CE2 3.65Å; F319-Y574 HydrophobicContact CE2-CE2 3.65Å; F319-Y574 AromaticContact CE2-CZ 3.98Å; F319-F577 HydrophobicContact CB-CD1 3.98Å; F319-F577 HydrophobicContact CD1-CD1 4.41Å; F319-F577 HydrophobicContact CD2-CB 4.07Å; F319-F577 HydrophobicContact CE2-CB 4.35Å; F319-F577 HydrophobicContact CG-CB 4.19Å; F319-F577 HydrophobicContact CG-CD1 4.17Å; F319-D578 HydrophobicContact CE2-CB 4.28Å; F319-D578 HydrophobicContact CZ-CB 3.99Å
320P79.8Confident82.8Confident101 Ų10161.5 Ų61.566%0.65634%0.34SS*.G310 helixtrans-54.8-22.1178.9-29.236.5000114.8F322 A323P320-F322 PolarHBondContact O-N 3.09Å; P320-A323 WeakPolarHBondContact O-CB 3.15Å; P320-A323 PolarHBondContact O-N 3.3Å
321G79.3Confident82.8Confident38 Ų3856 Ų5639%0.39231%0.311SS..G310 helixtrans-57.8-22.2172.600000114.9F319 A323 S324F319-G321 PolarHBondContact O-N 3.47Å; G321-A323 PolarHBondContact O-N 3.09Å; G321-S324 VanDerWaalsContact O-CB 3.24Å; G321-S324 WeakPolarHBondContact O-CB 3.11Å; G321-S324 PolarHBondContact O-N 3.34Å
322F80.3Confident83.1Confident0 Ų056.7 Ų56.70%031%0.309CS..G310 helixtrans-61.4-18.6171.8-90.6-99.8000113.8Y312 C315 L316 F319 P320 S324 V327 L570 T573 F577Y312-F322 PolarHBondContact OH-O 3.26Å; C315-F322 HydrophobicContact CB-CD1 3.67Å; C315-F322 HydrophobicContact CB-CD2 4.03Å; C315-F322 HydrophobicContact CB-CE1 3.75Å; C315-F322 HydrophobicContact CB-CE2 4.07Å; C315-F322 HydrophobicContact CB-CG 3.81Å; C315-F322 HydrophobicContact CB-CZ 3.94Å; L316-F322 HydrophobicContact CD2-CB 3.78Å; L316-F322 HydrophobicContact CG-CB 4.31Å; F319-F322 HydrophobicContact CB-CD2 3.69Å; F319-F322 HydrophobicContact CB-CE2 4.05Å; F319-F322 HydrophobicContact CD2-CE2 4.19Å; F319-F322 HydrophobicContact CG-CE2 4.49Å; F319-F322 WeakPolarHBondContact O-CB 3.08Å; F319-F322 PolarHBondContact O-N 2.84Å; P320-F322 PolarHBondContact O-N 3.09Å; F322-S324 PolarHBondContact O-N 3.01Å; F322-V327 HydrophobicContact CD1-CG1 3.82Å; F322-V327 HydrophobicContact CE1-CG1 4.11Å; F322-V327 HydrophobicContact CG-CG1 4.35Å; F322-L570 HydrophobicContact CD1-CD1 4.36Å; F322-L570 HydrophobicContact CE1-CD1 3.84Å; F322-T573 HydrophobicContact CE1-CG2 3.72Å; F322-T573 HydrophobicContact CZ-CG2 3.66Å; F322-F577 HydrophobicContact CD2-CD1 4.24Å; F322-F577 HydrophobicContact CD2-CD2 4.15Å; F322-F577 HydrophobicContact CD2-CE1 4.34Å; F322-F577 HydrophobicContact CD2-CE2 4.24Å; F322-F577 HydrophobicContact CD2-CG 4.14Å; F322-F577 HydrophobicContact CD2-CZ 4.34Å; F322-F577 HydrophobicContact CE2-CB 3.78Å; F322-F577 HydrophobicContact CE2-CD1 4.03Å; F322-F577 AromaticContact CE2-CD2 3.48Å; F322-F577 HydrophobicContact CE2-CD2 3.48Å; F322-F577 VanDerWaalsContact CE2-CD2 3.48Å; F322-F577 HydrophobicContact CE2-CE1 4.49Å; F322-F577 AromaticContact CE2-CE2 3.99Å; F322-F577 HydrophobicContact CE2-CE2 3.99Å; F322-F577 AromaticContact CE2-CG 3.49Å; F322-F577 HydrophobicContact CE2-CG 3.49Å; F322-F577 VanDerWaalsContact CE2-CG 3.49Å; F322-F577 HydrophobicContact CE2-CZ 4.46Å; F322-F577 HydrophobicContact CZ-CB 4.46Å; F322-F577 AromaticContact CZ-CD2 3.9Å; F322-F577 HydrophobicContact CZ-CD2 3.9Å; F322-F577 HydrophobicContact CZ-CE2 4.42Å; F322-F577 HydrophobicContact CZ-CG 4.28Å
323A78.8Confident83.2Confident70 Ų7055.9 Ų55.958%0.57931%0.308SS*.G310 helixtrans-71-11.5173.300000113.1L316 P320 G321L316-A323 HydrophobicContact CD2-CB 3.85Å; P320-A323 WeakPolarHBondContact O-CB 3.15Å; P320-A323 PolarHBondContact O-N 3.3Å; G321-A323 PolarHBondContact O-N 3.09Å
324S83.2Confident83.1Confident42 Ų4254.5 Ų54.529%0.29430%0.301SS..SBendtrans-67.1132.6-179.8-176.60000112G321 F322 R326 V327G321-S324 VanDerWaalsContact O-CB 3.24Å; G321-S324 WeakPolarHBondContact O-CB 3.11Å; G321-S324 PolarHBondContact O-N 3.34Å; F322-S324 PolarHBondContact O-N 3.01Å; S324-R326 PolarHBondContact O-N 2.82Å; S324-R326 WeakPolarHBondContact OG-CB 3.44Å; S324-R326 PolarHBondContact OG-N 2.97Å; S324-V327 PolarHBondContact O-N 3.19Å
325T82.5Confident83.3Confident44 Ų4449.6 Ų49.627%0.2728%0.283SS..Hα-helixtrans-58.2-21.5172.155.90000112.7C329 I449 P450 G453T325-C329 WeakPolarHBondContact O-CB 3.5Å; T325-C329 PolarHBondContact O-N 3.04Å; T325-C329 PolarHBondContact O-SG 2.92Å; T325-I449 HydrophobicContact CG2-CG2 4.37Å; T325-P450 WeakPolarHBondContact CB-O 3.42Å; T325-P450 WeakPolarHBondContact CG2-O 3.35Å; T325-P450 PolarHBondContact OG1-O 2.94Å; T325-G453 PolarHBondContact OG1-N 3.1Å
326R82.1Confident83.7Confident138 Ų13849.4 Ų49.452%0.52128%0.282SS..Hα-helixtrans-63.6-48.1171-171.2178.6-60.8158.94.6112.3S324 I328 C329 N330 G452S324-R326 PolarHBondContact O-N 2.82Å; S324-R326 WeakPolarHBondContact OG-CB 3.44Å; S324-R326 PolarHBondContact OG-N 2.97Å; R326-I328 VanDerWaalsContact C-N 3.29Å; R326-I328 PolarHBondContact O-N 3.38Å; R326-C329 PolarHBondContact O-N 3.4Å; R326-C329 VanDerWaalsContact O-N 3.12Å; R326-N330 WeakPolarHBondContact CG-OD1 3.35Å; R326-N330 WeakPolarHBondContact O-CB 3.32Å; R326-N330 PolarHBondContact O-N 3.06Å; R326-N330 PolarHBondContact O-OD1 2.84Å; R326-G452 PolarHBondContact NE-O 3.4Å; R326-G452 PolarHBondContact NH2-O 2.8Å
327V82.1Confident83.9Confident13 Ų1348.7 Ų48.78%0.07928%0.277CS..Hα-helixtrans-59.2-44-179176.60000110.7F322 S324 N330 I331 T573 F577F322-V327 HydrophobicContact CD1-CG1 3.82Å; F322-V327 HydrophobicContact CE1-CG1 4.11Å; F322-V327 HydrophobicContact CG-CG1 4.35Å; S324-V327 PolarHBondContact O-N 3.19Å; V327-N330 PolarHBondContact O-N 3.21Å; V327-I331 HydrophobicContact CG1-CD1 4.14Å; V327-I331 WeakPolarHBondContact O-CG1 3.17Å; V327-I331 PolarHBondContact O-N 2.88Å; V327-T573 HydrophobicContact CG1-CG2 3.84Å; V327-F577 HydrophobicContact CG2-CE2 3.8Å; V327-F577 HydrophobicContact CG2-CZ 3.76Å
328I83.9Confident84.3Confident77 Ų7744.3 Ų44.340%0.39525%0.249SC..Hα-helixtrans-62.7-43.8176.1-57.3171.3000111.6Y312 R326 L332Y312-I328 WeakPolarHBondContact OH-CG1 3.45Å; R326-I328 VanDerWaalsContact C-N 3.29Å; R326-I328 PolarHBondContact O-N 3.38Å; I328-L332 PolarHBondContact O-N 3.24Å
329C84.6Confident84.7Confident5 Ų540 Ų403%0.03423%0.229CC..Hα-helixtrans-67.3-36.4178.4-69.10000113.3T325 R326 T333 R454 L455T325-C329 WeakPolarHBondContact O-CB 3.5Å; T325-C329 PolarHBondContact O-N 3.04Å; T325-C329 PolarHBondContact O-SG 2.92Å; R326-C329 PolarHBondContact O-N 3.4Å; R326-C329 VanDerWaalsContact O-N 3.12Å; C329-T333 VanDerWaalsContact O-CB 3.25Å; C329-T333 WeakPolarHBondContact O-CB 3.23Å; C329-T333 PolarHBondContact O-N 3.03Å; C329-T333 PolarHBondContact O-OG1 3.09Å; C329-R454 WeakPolarHBondContact CB-O 3.47Å; C329-L455 HydrophobicContact CB-CB 4.49Å
330N84.5Confident85.2Confident63 Ų6337.7 Ų37.734%0.33722%0.219SC..Hα-helixtrans-66.2-50.2177.8-81.649.3000110.5R326 V327 L332 T333 D334R326-N330 WeakPolarHBondContact CG-OD1 3.35Å; R326-N330 WeakPolarHBondContact O-CB 3.32Å; R326-N330 PolarHBondContact O-N 3.06Å; R326-N330 PolarHBondContact O-OD1 2.84Å; V327-N330 PolarHBondContact O-N 3.21Å; N330-L332 PolarHBondContact O-N 3.44Å; N330-L332 VanDerWaalsContact O-N 3.09Å; N330-T333 PolarHBondContact O-N 3.36Å; N330-D334 WeakPolarHBondContact CB-OD2 3.29Å; N330-D334 WeakPolarHBondContact O-CB 3.28Å; N330-D334 PolarHBondContact O-N 3.44Å
331I84.3Confident85.9Confident8 Ų833 Ų334%0.04119%0.189CC..Hα-helixtrans-51.7-39.8176.6-70.1167.2000111.8V327 N335 L570 T573V327-I331 HydrophobicContact CG1-CD1 4.14Å; V327-I331 WeakPolarHBondContact O-CG1 3.17Å; V327-I331 PolarHBondContact O-N 2.88Å; I331-N335 WeakPolarHBondContact O-CB 3.06Å; I331-N335 PolarHBondContact O-ND2 3.47Å; I331-L570 HydrophobicContact CD1-CD1 4.43Å; I331-T573 WeakPolarHBondContact CG1-OG1 3.43Å
332L86.8Confident86.6Confident40 Ų4031.1 Ų31.121%0.20917%0.17CC..Hα-helixtrans-81.9-19.5177.8-62.3173.9000114.9I328 N330 L455 G459 M462 L562I328-L332 PolarHBondContact O-N 3.24Å; N330-L332 PolarHBondContact O-N 3.44Å; N330-L332 VanDerWaalsContact O-N 3.09Å; L332-L455 HydrophobicContact CB-CD1 3.85Å; L332-L455 HydrophobicContact CD1-CD1 4.35Å; L332-G459 WeakPolarHBondContact O-CA 3.44Å; L332-M462 HydrophobicContact CB-CE 4.13Å; L332-M462 HydrophobicContact CD2-CE 3.94Å; L332-M462 WeakPolarHBondContact O-CE 3.45Å; L332-L562 HydrophobicContact CD2-CD1 4.48Å
333T85.4Confident87.3Confident20 Ų2031.2 Ų31.212%0.12317%0.17CC..Hα-helixtrans-89.2-51.7179.2-70.80000110.9C329 N330 N335 A336 S456C329-T333 VanDerWaalsContact O-CB 3.25Å; C329-T333 WeakPolarHBondContact O-CB 3.23Å; C329-T333 PolarHBondContact O-N 3.03Å; C329-T333 PolarHBondContact O-OG1 3.09Å; N330-T333 PolarHBondContact O-N 3.36Å; T333-N335 PolarHBondContact O-N 3.13Å; T333-A336 WeakPolarHBondContact O-CB 3.36Å; T333-A336 PolarHBondContact O-N 3.2Å; T333-S456 WeakPolarHBondContact CB-OG 3.44Å; T333-S456 WeakPolarHBondContact CG2-OG 3.38Å; T333-S456 PolarHBondContact OG1-N 2.86Å; T333-S456 PolarHBondContact OG1-OG 3.19Å
334D84.5Confident88.1Confident65 Ų6528 Ų2835%0.34814%0.143SC..Hα-helixtrans-69.1-26.6-171.5-51.1-17.5000110.7N330 F337N330-D334 WeakPolarHBondContact CB-OD2 3.29Å; N330-D334 WeakPolarHBondContact O-CB 3.28Å; N330-D334 PolarHBondContact O-N 3.44Å; D334-F337 WeakPolarHBondContact O-CE1 2.93Å
335N88.1Confident88.6Confident22 Ų2226 Ų2612%0.11813%0.129CC..THydrogen-bonded Turntrans-98.712.6174.7-58.7-89.2000113.4I331 T333 F337 L338 G339 V565 G569I331-N335 WeakPolarHBondContact O-CB 3.06Å; I331-N335 PolarHBondContact O-ND2 3.47Å; T333-N335 PolarHBondContact O-N 3.13Å; N335-F337 PolarHBondContact O-N 3.38Å; N335-L338 WeakPolarHBondContact O-CB 3.2Å; N335-L338 PolarHBondContact O-N 3.27Å; N335-G339 PolarHBondContact O-N 3.37Å; N335-V565 HydrophobicContact CB-CG1 3.69Å; N335-G569 WeakPolarHBondContact ND2-CA 3.33Å
336A90Very high89.1Confident1 Ų123.9 Ų23.91%0.00812%0.117CC..Hα-helixtrans-61.5-44-171.900000113.7T333 G339 I340 M458 M462T333-A336 WeakPolarHBondContact O-CB 3.36Å; T333-A336 PolarHBondContact O-N 3.2Å; A336-G339 PolarHBondContact O-N 2.98Å; A336-I340 WeakPolarHBondContact O-CG1 3.31Å; A336-I340 PolarHBondContact O-N 3.49Å; A336-I340 VanDerWaalsContact O-N 3.13Å; A336-M458 HydrophobicContact CB-CB 3.9Å; A336-M462 HydrophobicContact CB-CB 4.12Å
337F90.7Very high89.7Confident38 Ų3817.3 Ų17.317%0.1679%0.092CC..Hα-helixtrans-65-45.217765.5-85000111D334 N335 G339 I340 I341 A517 V520 F521 V536D334-F337 WeakPolarHBondContact O-CE1 2.93Å; N335-F337 PolarHBondContact O-N 3.38Å; F337-G339 VanDerWaalsContact C-N 3.33Å; F337-G339 PolarHBondContact O-N 3.08Å; F337-I340 PolarHBondContact O-N 2.75Å; F337-I341 HydrophobicContact CD2-CD1 4.29Å; F337-I341 WeakPolarHBondContact O-CD1 3.33Å; F337-I341 VanDerWaalsContact O-CG1 3.28Å; F337-I341 WeakPolarHBondContact O-CG1 3.33Å; F337-I341 PolarHBondContact O-N 3.18Å; F337-I341 VanDerWaalsContact O-N 3.09Å; F337-A517 HydrophobicContact CB-CB 4.26Å; F337-V520 HydrophobicContact CB-CG1 4.18Å; F337-F521 HydrophobicContact CD1-CD2 4.12Å; F337-F521 HydrophobicContact CD2-CD2 4.04Å; F337-F521 HydrophobicContact CE1-CD2 4.28Å; F337-F521 HydrophobicContact CE1-CE2 4.48Å; F337-F521 HydrophobicContact CE2-CD2 4.21Å; F337-F521 HydrophobicContact CE2-CE2 4.35Å; F337-F521 HydrophobicContact CG-CD2 4.01Å; F337-F521 HydrophobicContact CZ-CD2 4.33Å; F337-F521 HydrophobicContact CZ-CE2 4.29Å; F337-V536 HydrophobicContact CD2-CG1 3.87Å; F337-V536 HydrophobicContact CE2-CG1 3.62Å; F337-V536 HydrophobicContact CE2-CG2 4.04Å
338L91.3Very high90.3Very high5 Ų516.7 Ų16.73%0.0269%0.088CC..Hα-helixtrans-56.6-45.1175.1177.861.1000111.6N335 I340 I341 A342 V536 D539 A540 V565 Q568N335-L338 WeakPolarHBondContact O-CB 3.2Å; N335-L338 PolarHBondContact O-N 3.27Å; L338-I340 PolarHBondContact O-N 2.65Å; L338-I341 PolarHBondContact O-N 3.38Å; L338-A342 WeakPolarHBondContact O-CB 3.28Å; L338-A342 PolarHBondContact O-N 2.73Å; L338-V536 HydrophobicContact CD1-CG1 4.23Å; L338-D539 HydrophobicContact CD1-CB 3.93Å; L338-A540 HydrophobicContact CD1-CB 3.9Å; L338-V565 HydrophobicContact CD2-CG1 4.13Å; L338-V565 HydrophobicContact CG-CG1 4.15Å; L338-V565 HydrophobicContact CG-CG2 4.35Å; L338-Q568 HydrophobicContact CD2-CG 4.35Å
339G92.5Very high90.5Very high1 Ų113 Ų131%0.017%0.069CC..Hα-helixtrans-60.9-41.1176.200000113.8N335 A336 F337 A342 V343N335-G339 PolarHBondContact O-N 3.37Å; A336-G339 PolarHBondContact O-N 2.98Å; F337-G339 VanDerWaalsContact C-N 3.33Å; F337-G339 PolarHBondContact O-N 3.08Å; G339-A342 PolarHBondContact O-N 2.94Å; G339-V343 VanDerWaalsContact O-CG2 3.28Å; G339-V343 WeakPolarHBondContact O-CG2 3.41Å; G339-V343 PolarHBondContact O-N 3.26Å; G339-V343 VanDerWaalsContact O-N 3.08Å
340I95.6Very high90.8Very high0 Ų012.8 Ų12.80%07%0.068CC..Hα-helixtrans-64.9-44.9177.4-67.7166.9000110.9A336 F337 L338 V343 G344 L461 M462 V465 L513 L516 A517 V520A336-I340 WeakPolarHBondContact O-CG1 3.31Å; A336-I340 PolarHBondContact O-N 3.49Å; A336-I340 VanDerWaalsContact O-N 3.13Å; F337-I340 PolarHBondContact O-N 2.75Å; L338-I340 PolarHBondContact O-N 2.65Å; I340-V343 PolarHBondContact O-N 3.3Å; I340-G344 PolarHBondContact O-N 3.48Å; I340-L461 HydrophobicContact CD1-CD2 4.47Å; I340-L461 HydrophobicContact CD1-CG 4.27Å; I340-M462 HydrophobicContact CD1-CB 4.39Å; I340-M462 HydrophobicContact CG1-CB 4.02Å; I340-M462 HydrophobicContact CG1-CG 4.3Å; I340-V465 HydrophobicContact CG1-CB 4.32Å; I340-V465 HydrophobicContact CG1-CG1 4.39Å; I340-V465 HydrophobicContact CG1-CG2 4.28Å; I340-V465 HydrophobicContact CG2-CG1 4.31Å; I340-L513 HydrophobicContact CG2-CB 4.19Å; I340-L513 HydrophobicContact CG2-CD2 4.21Å; I340-L513 VanDerWaalsContact CG2-O 3.23Å; I340-L513 WeakPolarHBondContact CG2-O 3.48Å; I340-L516 HydrophobicContact CG2-CB 4.2Å; I340-L516 HydrophobicContact CG2-CD2 4.23Å; I340-L516 HydrophobicContact CG2-CG 4.32Å; I340-A517 HydrophobicContact CB-CB 4.11Å; I340-A517 HydrophobicContact CG2-CB 3.96Å; I340-V520 HydrophobicContact CD1-CG2 3.92Å
341I93.9Very high91Very high2 Ų210.6 Ų10.61%0.016%0.057CC..Hα-helixtrans-62.4-48.4176.8-57.7154.8000110F337 L338 V343 G344 M345 V358 I362 A517 V536 A540F337-I341 HydrophobicContact CD2-CD1 4.29Å; F337-I341 WeakPolarHBondContact O-CD1 3.33Å; F337-I341 VanDerWaalsContact O-CG1 3.28Å; F337-I341 WeakPolarHBondContact O-CG1 3.33Å; F337-I341 PolarHBondContact O-N 3.18Å; F337-I341 VanDerWaalsContact O-N 3.09Å; L338-I341 PolarHBondContact O-N 3.38Å; I341-V343 PolarHBondContact O-N 3.33Å; I341-G344 PolarHBondContact O-N 3.46Å; I341-M345 VanDerWaalsContact O-CB 3.29Å; I341-M345 WeakPolarHBondContact O-CB 3.11Å; I341-M345 PolarHBondContact O-N 3.06Å; I341-V358 HydrophobicContact CG2-CB 3.93Å; I341-V358 HydrophobicContact CG2-CG1 4.41Å; I341-V358 HydrophobicContact CG2-CG2 3.66Å; I341-I362 HydrophobicContact CD1-CD1 3.31Å; I341-I362 HydrophobicContact CG1-CD1 3.97Å; I341-A517 HydrophobicContact CD1-CB 3.99Å; I341-A517 HydrophobicContact CG1-CB 3.46Å; I341-A517 VanDerWaalsContact CG1-CB 3.46Å; I341-V536 HydrophobicContact CD1-CG1 3.39Å; I341-A540 HydrophobicContact CB-CB 4.27Å; I341-A540 HydrophobicContact CG2-CB 3.74Å
342A93.6Very high90.9Very high0 Ų012.1 Ų12.10%08%0.075CC..Hα-helixtrans-58.6-34.4-17900000112.1L338 G339 T346 A540 V544 T561 V565L338-A342 WeakPolarHBondContact O-CB 3.28Å; L338-A342 PolarHBondContact O-N 2.73Å; G339-A342 PolarHBondContact O-N 2.94Å; A342-T346 WeakPolarHBondContact O-CB 3.13Å; A342-T346 PolarHBondContact O-N 3.01Å; A342-T346 PolarHBondContact O-OG1 3.47Å; A342-A540 HydrophobicContact CB-CB 4.32Å; A342-V544 HydrophobicContact CB-CG2 3.8Å; A342-V544 WeakPolarHBondContact O-CG2 3.35Å; A342-T561 HydrophobicContact CB-CG2 3.49Å; A342-T561 VanDerWaalsContact CB-CG2 3.49Å; A342-V565 HydrophobicContact CB-CG2 3.78Å
343V95.8Very high90.7Very high2 Ų210.4 Ų10.41%0.0127%0.067CC..Hα-helixtrans-63.6-47.2172.31730000111.8G339 I340 I341 T346 F347 V465 V466 L513 V558G339-V343 VanDerWaalsContact O-CG2 3.28Å; G339-V343 WeakPolarHBondContact O-CG2 3.41Å; G339-V343 PolarHBondContact O-N 3.26Å; G339-V343 VanDerWaalsContact O-N 3.08Å; I340-V343 PolarHBondContact O-N 3.3Å; I341-V343 PolarHBondContact O-N 3.33Å; V343-T346 WeakPolarHBondContact O-CB 3.44Å; V343-T346 PolarHBondContact O-N 3.46Å; V343-F347 HydrophobicContact CG1-CE2 4.4Å; V343-F347 VanDerWaalsContact O-CD2 3.28Å; V343-F347 WeakPolarHBondContact O-CD2 3.49Å; V343-V465 HydrophobicContact CB-CG1 3.94Å; V343-V465 HydrophobicContact CG1-CG1 3.89Å; V343-V465 HydrophobicContact CG2-CG1 4.13Å; V343-V466 HydrophobicContact CG2-CB 4.36Å; V343-V466 HydrophobicContact CG2-CG2 3.55Å; V343-L513 HydrophobicContact CB-CD1 4.37Å; V343-L513 HydrophobicContact CG1-CD1 3.99Å; V343-V558 HydrophobicContact CB-CG1 4.35Å; V343-V558 HydrophobicContact CG1-CG1 3.92Å; V343-V558 HydrophobicContact CG2-CG1 3.81Å
344G95.2Very high90.8Very high1 Ų110.5 Ų10.51%0.017%0.067CC..Hα-helixtrans-64.4-46.9177.100000112.2I340 I341 T346 F347 V348I340-G344 PolarHBondContact O-N 3.48Å; I341-G344 PolarHBondContact O-N 3.46Å; G344-T346 PolarHBondContact O-N 2.98Å; G344-F347 PolarHBondContact O-N 3.28Å; G344-V348 PolarHBondContact O-N 3.23Å
345M93.4Very high91.1Very high0 Ų07.4 Ų7.40%05%0.05CC..Hα-helixtrans-62-30177.7-167.654.4132.100112.1Y291 I341 F347 V348 I349 D355 I541Y291-M345 HydrophobicContact CE2-CE 4.16Å; Y291-M345 VanDerWaalsContact OH-CE 3.27Å; Y291-M345 WeakPolarHBondContact OH-CE 3.49Å; Y291-M345 WeakPolarHBondContact OH-CG 3.46Å; Y291-M345 PolarHBondContact OH-SD 2.88Å; I341-M345 VanDerWaalsContact O-CB 3.29Å; I341-M345 WeakPolarHBondContact O-CB 3.11Å; I341-M345 PolarHBondContact O-N 3.06Å; M345-F347 VanDerWaalsContact C-N 3.33Å; M345-F347 PolarHBondContact O-N 3.13Å; M345-V348 WeakPolarHBondContact O-CB 3.47Å; M345-V348 PolarHBondContact O-N 2.9Å; M345-V348 HydrophobicContact SD-CB 3.98Å; M345-V348 HydrophobicContact SD-CG1 3.84Å; M345-V348 HydrophobicContact SD-CG2 4.49Å; M345-I349 WeakPolarHBondContact O-CG1 3.24Å; M345-I349 PolarHBondContact O-N 3.28Å; M345-D355 HydrophobicContact CE-CB 4.18Å; M345-D355 WeakPolarHBondContact CE-O 3.13Å; M345-D355 HydrophobicContact SD-CB 3.94Å; M345-I541 HydrophobicContact CE-CD1 3.91Å; M345-I541 HydrophobicContact CE-CG1 3.87Å
346T93.7Very high91.2Very high0 Ų06.4 Ų6.40%04%0.044CC..Hα-helixtrans-57-41.9170-62.20000112.2A342 V343 G344 L350 T549 V558 T561A342-T346 WeakPolarHBondContact O-CB 3.13Å; A342-T346 PolarHBondContact O-N 3.01Å; A342-T346 PolarHBondContact O-OG1 3.47Å; V343-T346 WeakPolarHBondContact O-CB 3.44Å; V343-T346 PolarHBondContact O-N 3.46Å; G344-T346 PolarHBondContact O-N 2.98Å; T346-L350 HydrophobicContact CG2-CD1 3.89Å; T346-L350 HydrophobicContact CG2-CG 4.3Å; T346-L350 VanDerWaalsContact O-CB 3.3Å; T346-L350 WeakPolarHBondContact O-CB 3.5Å; T346-L350 WeakPolarHBondContact O-CG 3.3Å; T346-L350 PolarHBondContact O-N 3.21Å; T346-T549 HydrophobicContact CG2-CG2 4.08Å; T346-V558 HydrophobicContact CG2-CG2 3.8Å; T346-T561 WeakPolarHBondContact OG1-CB 3.2Å; T346-T561 WeakPolarHBondContact OG1-CG2 3.36Å; T346-T561 PolarHBondContact OG1-OG1 3.36Å
347F94.4Very high91.3Very high1 Ų16.3 Ų6.30%0.0044%0.044CC..Hα-helixtrans-70.4-36.2178.1-72.6-84.7000112.7V343 G344 M345 L350 S351 G469 L472 A473 F478 V482 L509 V558V343-F347 HydrophobicContact CG1-CE2 4.4Å; V343-F347 VanDerWaalsContact O-CD2 3.28Å; V343-F347 WeakPolarHBondContact O-CD2 3.49Å; G344-F347 PolarHBondContact O-N 3.28Å; M345-F347 VanDerWaalsContact C-N 3.33Å; M345-F347 PolarHBondContact O-N 3.13Å; F347-L350 PolarHBondContact O-N 2.87Å; F347-S351 PolarHBondContact O-N 3.27Å; F347-G469 WeakPolarHBondContact CZ-O 3.44Å; F347-L472 HydrophobicContact CE1-CB 4.21Å; F347-L472 HydrophobicContact CZ-CB 3.72Å; F347-A473 HydrophobicContact CE1-CB 3.95Å; F347-A473 HydrophobicContact CZ-CB 3.96Å; F347-F478 AromaticContact CD1-CE1 3.87Å; F347-F478 HydrophobicContact CD1-CE1 3.87Å; F347-F478 HydrophobicContact CD1-CZ 4.5Å; F347-F478 HydrophobicContact CE1-CE1 4.07Å; F347-V482 HydrophobicContact CD1-CG1 4.45Å; F347-V482 HydrophobicContact CD1-CG2 4.33Å; F347-V482 VanDerWaalsContact O-CG1 3.31Å; F347-V482 WeakPolarHBondContact O-CG1 3.35Å; F347-L509 HydrophobicContact CB-CD2 4.35Å; F347-L509 HydrophobicContact CD1-CD2 4.28Å; F347-L509 HydrophobicContact CD2-CD2 3.55Å; F347-L509 HydrophobicContact CE2-CD2 3.84Å; F347-L509 HydrophobicContact CG-CD2 3.8Å; F347-L509 HydrophobicContact CZ-CD2 4.31Å; F347-V558 HydrophobicContact CE2-CG2 4.18Å; F347-V558 HydrophobicContact CZ-CG2 4.31Å
348V93.7Very high91.3Very high0 Ų04.5 Ų4.50%04%0.036CC..Hα-helixtrans-57.8-57.7173.21680000109.6G344 M345 L350 S351 G353 I354 D355 I506 Y507 S510G344-V348 PolarHBondContact O-N 3.23Å; M345-V348 WeakPolarHBondContact O-CB 3.47Å; M345-V348 PolarHBondContact O-N 2.9Å; M345-V348 HydrophobicContact SD-CB 3.98Å; M345-V348 HydrophobicContact SD-CG1 3.84Å; M345-V348 HydrophobicContact SD-CG2 4.49Å; V348-L350 VanDerWaalsContact C-N 3.34Å; V348-L350 PolarHBondContact O-N 3.26Å; V348-S351 PolarHBondContact O-N 3.42Å; V348-S351 VanDerWaalsContact O-N 3.14Å; V348-S351 PolarHBondContact O-OG 2.95Å; V348-G353 CarbonylContact C-O 3.38Å; V348-G353 WeakPolarHBondContact CG1-O 3.22Å; V348-G353 CarbonylContact O-C 3.42Å; V348-G353 VanDerWaalsContact O-CA 3.27Å; V348-G353 WeakPolarHBondContact O-CA 3.3Å; V348-G353 PolarHBondContact O-N 2.87Å; V348-I354 VanDerWaalsContact CG1-CA 3.48Å; V348-D355 HydrophobicContact CB-CB 4.39Å; V348-D355 HydrophobicContact CG1-CB 3.74Å; V348-D355 HydrophobicContact CG2-CB 3.93Å; V348-I506 HydrophobicContact CB-CG2 4.3Å; V348-I506 HydrophobicContact CG2-CG2 3.78Å; V348-Y507 HydrophobicContact CG1-CE1 4.03Å; V348-Y507 HydrophobicContact CG2-CD1 4.28Å; V348-Y507 HydrophobicContact CG2-CE1 4.1Å; V348-S510 VanDerWaalsContact CG2-CB 3.47Å; V348-S510 WeakPolarHBondContact CG2-OG 3.3Å
349I89.1Confident91.3Very high0 Ų04.3 Ų4.30%04%0.035CC..Hα-helixtrans-54.3-48.4176.3-64.8-176000112.2Y291 M345 S351 G352 G353 V544 T549 L550 L551 G553Y291-I349 HydrophobicContact CD1-CD1 4.3Å; Y291-I349 HydrophobicContact CE1-CD1 3.24Å; Y291-I349 HydrophobicContact CE1-CG1 3.86Å; Y291-I349 HydrophobicContact CE2-CD1 4.36Å; Y291-I349 HydrophobicContact CE2-CG1 4.06Å; Y291-I349 WeakPolarHBondContact OH-CD1 3.33Å; Y291-I349 WeakPolarHBondContact OH-CG1 3.42Å; M345-I349 WeakPolarHBondContact O-CG1 3.24Å; M345-I349 PolarHBondContact O-N 3.28Å; I349-S351 PolarHBondContact O-N 2.91Å; I349-G352 WeakPolarHBondContact O-CA 3.27Å; I349-G352 PolarHBondContact O-N 3.33Å; I349-G353 WeakPolarHBondContact CA-O 3.34Å; I349-G353 PolarHBondContact N-O 3.35Å; I349-V544 HydrophobicContact CD1-CB 3.83Å; I349-V544 HydrophobicContact CD1-CG1 3.29Å; I349-V544 HydrophobicContact CG1-CG1 4.47Å; I349-T549 HydrophobicContact CB-CG2 4.02Å; I349-T549 HydrophobicContact CD1-CG2 4.31Å; I349-T549 HydrophobicContact CG2-CG2 3.61Å; I349-L550 VanDerWaalsContact CG2-O 3.27Å; I349-L550 WeakPolarHBondContact CG2-O 3.45Å; I349-L551 HydrophobicContact CB-CD2 4.02Å; I349-L551 HydrophobicContact CB-CG 4.43Å; I349-L551 HydrophobicContact CD1-CD1 4.23Å; I349-L551 HydrophobicContact CD1-CD2 3.84Å; I349-L551 HydrophobicContact CD1-CG 4.04Å; I349-L551 HydrophobicContact CG1-CD2 3.57Å; I349-L551 HydrophobicContact CG1-CG 4.21Å; I349-L551 HydrophobicContact CG2-CB 4.36Å; I349-L551 HydrophobicContact CG2-CD2 3.57Å; I349-L551 HydrophobicContact CG2-CG 3.5Å; I349-G553 VanDerWaalsContact O-CA 3.28Å; I349-G553 WeakPolarHBondContact O-CA 3.49Å
350L89.7Confident91.1Very high0 Ų04.2 Ų4.20%03%0.034CC..Hα-helixtrans-59.7-21.3-174.9-79.3176.1000113.1T346 F347 V348 V482 Y483 G486 T549 G554 V555T346-L350 HydrophobicContact CG2-CD1 3.89Å; T346-L350 HydrophobicContact CG2-CG 4.3Å; T346-L350 VanDerWaalsContact O-CB 3.3Å; T346-L350 WeakPolarHBondContact O-CB 3.5Å; T346-L350 WeakPolarHBondContact O-CG 3.3Å; T346-L350 PolarHBondContact O-N 3.21Å; F347-L350 PolarHBondContact O-N 2.87Å; V348-L350 VanDerWaalsContact C-N 3.34Å; V348-L350 PolarHBondContact O-N 3.26Å; L350-V482 HydrophobicContact CB-CG1 3.63Å; L350-Y483 HydrophobicContact CD1-CD1 4.42Å; L350-Y483 HydrophobicContact CD1-CE1 3.76Å; L350-Y483 HydrophobicContact CD1-CE2 4.37Å; L350-Y483 HydrophobicContact CD2-CD1 3.81Å; L350-Y483 HydrophobicContact CD2-CE1 3.38Å; L350-Y483 HydrophobicContact CG-CE1 4.16Å; L350-G486 WeakPolarHBondContact O-CA 3.48Å; L350-T549 HydrophobicContact CD2-CG2 4.19Å; L350-T549 HydrophobicContact CG-CG2 4.18Å; L350-G554 PolarHBondContact O-N 3.47Å; L350-V555 WeakPolarHBondContact CD2-O 3.39Å
351S88.9Confident91.1Very high16 Ų164.3 Ų4.311%0.1124%0.035CC..THydrogen-bonded Turntrans-84.4-2.4172.973.60000115.4F347 V348 I349 G353 G486 I506F347-S351 PolarHBondContact O-N 3.27Å; V348-S351 PolarHBondContact O-N 3.42Å; V348-S351 VanDerWaalsContact O-N 3.14Å; V348-S351 PolarHBondContact O-OG 2.95Å; I349-S351 PolarHBondContact O-N 2.91Å; S351-G353 PolarHBondContact OG-N 3.45Å; S351-G486 VanDerWaalsContact C-CA 3.42Å; S351-G486 WeakPolarHBondContact O-CA 3.38Å; S351-I506 VanDerWaalsContact CB-CD1 3.46Å
352G81.7Confident91.1Very high40 Ų404.3 Ų4.341%0.4124%0.035SC..THydrogen-bonded Turntrans7415.7-162.900000112.5I349I349-G352 WeakPolarHBondContact O-CA 3.27Å; I349-G352 PolarHBondContact O-N 3.33Å
353G83.8Confident91Very high4 Ų44.3 Ų4.34%0.0414%0.035CC..  trans-97.2168.6-179.100000112.5V348 I349 S351 Y507V348-G353 CarbonylContact C-O 3.38Å; V348-G353 WeakPolarHBondContact CG1-O 3.22Å; V348-G353 CarbonylContact O-C 3.42Å; V348-G353 VanDerWaalsContact O-CA 3.27Å; V348-G353 WeakPolarHBondContact O-CA 3.3Å; V348-G353 PolarHBondContact O-N 2.87Å; I349-G353 WeakPolarHBondContact CA-O 3.34Å; I349-G353 PolarHBondContact N-O 3.35Å; S351-G353 PolarHBondContact OG-N 3.45Å; G353-Y507 VanDerWaalsContact CA-OH 3.25Å; G353-Y507 WeakPolarHBondContact CA-OH 3.39Å
354I87.1Confident90.9Very high23 Ų235.4 Ų5.412%0.1184%0.039CC..  trans-152.5123.8-164.5-84.9-176.1000107.7F116 E290 Y291 V292 V348 L356 A409 F410 T413 Y507F116-I354 HydrophobicContact CE1-CD1 3.95Å; E290-I354 WeakPolarHBondContact OE1-CG2 3.37Å; E290-I354 WeakPolarHBondContact OE2-CG2 3.43Å; Y291-I354 HydrophobicContact CD2-CD1 4.01Å; Y291-I354 HydrophobicContact CD2-CG1 3.75Å; Y291-I354 HydrophobicContact CE2-CG1 3.88Å; V292-I354 HydrophobicContact CG2-CD1 4.43Å; V348-I354 VanDerWaalsContact CG1-CA 3.48Å; I354-L356 HydrophobicContact CG2-CD2 3.16Å; I354-A409 HydrophobicContact CB-CB 4.47Å; I354-F410 HydrophobicContact CG2-CB 3.66Å; I354-F410 HydrophobicContact CG2-CD2 3.87Å; I354-F410 HydrophobicContact CG2-CG 4.25Å; I354-T413 PolarHBondContact O-OG1 2.93Å; I354-Y507 PolarHBondContact N-OH 3.06Å
355D91.4Very high90.9Very high0 Ų05.3 Ų5.30%04%0.039CC..  trans-127.490-169.6-171.61.3000113.8M345 V348 S357 T413 Y507 S510M345-D355 HydrophobicContact CE-CB 4.18Å; M345-D355 WeakPolarHBondContact CE-O 3.13Å; M345-D355 HydrophobicContact SD-CB 3.94Å; V348-D355 HydrophobicContact CB-CB 4.39Å; V348-D355 HydrophobicContact CG1-CB 3.74Å; V348-D355 HydrophobicContact CG2-CB 3.93Å; D355-S357 PolarHBondContact O-N 3.1Å; D355-S357 VanDerWaalsContact OD1-CB 3.3Å; D355-S357 WeakPolarHBondContact OD1-CB 3.4Å; D355-S357 PolarHBondContact OD1-N 3.49Å; D355-S357 VanDerWaalsContact OD1-N 3.09Å; D355-S357 PolarHBondContact OD1-OG 2.96Å; D355-T413 HydrophobicContact CB-CG2 4.34Å; D355-T413 WeakPolarHBondContact OD1-CG2 3.24Å; D355-Y507 HydrophobicContact CB-CD1 4.14Å; D355-Y507 HydrophobicContact CB-CE1 3.91Å; D355-S510 WeakPolarHBondContact OD2-CB 3.4Å; D355-S510 PolarHBondContact OD2-OG 3.19Å
356L88.9Confident90.9Very high0 Ų05.5 Ų5.50%04%0.041CC..THydrogen-bonded Turntrans-76.2-7.8-174.8-28.5-150.9000112.7L241 N288 Q289 I354 F410 T413 L414 M417L241-L356 HydrophobicContact CD1-CD1 3.68Å; N288-L356 HydrophobicContact CB-CD1 4.47Å; N288-L356 VanDerWaalsContact ND2-CB 3.26Å; N288-L356 WeakPolarHBondContact ND2-CB 3.39Å; N288-L356 PolarHBondContact ND2-O 3.47Å; Q289-L356 VanDerWaalsContact OE1-CB 3.27Å; I354-L356 HydrophobicContact CG2-CD2 3.16Å; L356-F410 HydrophobicContact CD1-CD2 3.64Å; L356-F410 HydrophobicContact CD1-CE2 3.64Å; L356-F410 HydrophobicContact CD1-CG 4.11Å; L356-F410 HydrophobicContact CD1-CZ 4.12Å; L356-F410 HydrophobicContact CD2-CB 4.48Å; L356-F410 HydrophobicContact CD2-CD2 3.83Å; L356-F410 HydrophobicContact CD2-CE2 4.49Å; L356-F410 HydrophobicContact CD2-CG 4.36Å; L356-F410 HydrophobicContact CG-CD2 4.29Å; L356-T413 WeakPolarHBondContact CG-OG1 3.41Å; L356-T413 VanDerWaalsContact N-CB 3.31Å; L356-T413 PolarHBondContact N-OG1 2.93Å; L356-L414 HydrophobicContact CD1-CB 3.74Å; L356-L414 HydrophobicContact CD1-CD1 4.15Å; L356-L414 HydrophobicContact CD1-CG 4.37Å; L356-L414 HydrophobicContact CG-CB 4.17Å; L356-M417 WeakPolarHBondContact O-CB 3.38Å; L356-M417 WeakPolarHBondContact O-CG 3.49Å
357S92.5Very high90.9Very high0 Ų05.5 Ų5.50%04%0.041CC..THydrogen-bonded Turntrans-75.6-25.3-171.374.10000114.4D355 G359 S360 V361 M398D355-S357 PolarHBondContact O-N 3.1Å; D355-S357 VanDerWaalsContact OD1-CB 3.3Å; D355-S357 WeakPolarHBondContact OD1-CB 3.4Å; D355-S357 PolarHBondContact OD1-N 3.49Å; D355-S357 VanDerWaalsContact OD1-N 3.09Å; D355-S357 PolarHBondContact OD1-OG 2.96Å; S357-G359 VanDerWaalsContact C-N 3.31Å; S357-G359 PolarHBondContact O-N 3Å; S357-G359 VanDerWaalsContact O-N 3.12Å; S357-S360 PolarHBondContact O-N 3.19Å; S357-V361 WeakPolarHBondContact O-CG2 3.36Å; S357-V361 PolarHBondContact O-N 2.75Å; S357-M398 WeakPolarHBondContact OG-CE 3.45Å
358V92.1Very high90.9Very high0 Ų07 Ų70%05%0.047CC..Hα-helixtrans-59.8-34.6-160.3-58.80000114.3I341 V361 I362 A514 D537I341-V358 HydrophobicContact CG2-CB 3.93Å; I341-V358 HydrophobicContact CG2-CG1 4.41Å; I341-V358 HydrophobicContact CG2-CG2 3.66Å; V358-V361 PolarHBondContact O-N 2.72Å; V358-I362 WeakPolarHBondContact O-CD1 3.13Å; V358-I362 WeakPolarHBondContact O-CG1 3.11Å; V358-I362 PolarHBondContact O-N 2.91Å; V358-A514 HydrophobicContact CB-CB 3.72Å; V358-A514 HydrophobicContact CG1-CB 3.85Å; V358-D537 HydrophobicContact CG2-CB 3.56Å
359G89.9Confident90.9Very high0 Ų07 Ų70%05%0.047CC..Hα-helixtrans-65.7-40.917400000113.3S357 I362 A363 R421 G533S357-G359 VanDerWaalsContact C-N 3.31Å; S357-G359 PolarHBondContact O-N 3Å; S357-G359 VanDerWaalsContact O-N 3.12Å; G359-I362 PolarHBondContact O-N 3.21Å; G359-A363 PolarHBondContact O-N 2.89Å; G359-R421 PolarHBondContact O-NH2 3.46Å; G359-R421 VanDerWaalsContact O-NH2 3.1Å; G359-G533 VanDerWaalsContact CA-O 3.28Å; G359-G533 WeakPolarHBondContact CA-O 3.34Å
360S89.8Confident91.1Very high0 Ų07 Ų70%05%0.047CC..Hα-helixtrans-74.5-27.6176-65.70000112.8S357 I362 A363 F364 M417 R421S357-S360 PolarHBondContact O-N 3.19Å; S360-I362 VanDerWaalsContact C-N 3.27Å; S360-I362 PolarHBondContact O-N 2.86Å; S360-A363 PolarHBondContact O-N 2.99Å; S360-F364 WeakPolarHBondContact O-CB 3.47Å; S360-F364 PolarHBondContact O-N 3.01Å; S360-M417 WeakPolarHBondContact CB-O 3.5Å; S360-M417 WeakPolarHBondContact OG-CG 3.34Å; S360-M417 PolarHBondContact OG-O 2.94Å; S360-R421 VanDerWaalsContact CA-NH2 3.35Å; S360-R421 PolarHBondContact OG-NE 3.42Å; S360-R421 VanDerWaalsContact OG-NE 3.09Å; S360-R421 PolarHBondContact OG-NH2 3.28Å
361V94.6Very high91.2Very high2 Ų210 Ų101%0.0126%0.06CC..Hα-helixtrans-63.7-36.5172176.90000110.5S357 V358 T365 L420 T511 A514 T515S357-V361 WeakPolarHBondContact O-CG2 3.36Å; S357-V361 PolarHBondContact O-N 2.75Å; V358-V361 PolarHBondContact O-N 2.72Å; V361-T365 VanDerWaalsContact O-CB 3.23Å; V361-T365 WeakPolarHBondContact O-CB 3.18Å; V361-T365 PolarHBondContact O-N 3.12Å; V361-T365 PolarHBondContact O-OG1 3.06Å; V361-L420 HydrophobicContact CB-CD1 4.36Å; V361-L420 HydrophobicContact CG2-CD1 3.55Å; V361-T511 HydrophobicContact CG1-CG2 3.96Å; V361-T511 HydrophobicContact CG2-CG2 3.71Å; V361-A514 HydrophobicContact CB-CB 4Å; V361-A514 HydrophobicContact CG1-CB 3.82Å; V361-T515 VanDerWaalsContact CG1-OG1 3.22Å; V361-T515 WeakPolarHBondContact CG1-OG1 3.3Å
362I93.4Very high91.4Very high1 Ų19.9 Ų9.91%0.0056%0.059CC..Hα-helixtrans-68.1-46175.3-70.5158.6000111.4I341 V358 G359 S360 T365 G366 A514 A517 F521 A532I341-I362 HydrophobicContact CD1-CD1 3.31Å; I341-I362 HydrophobicContact CG1-CD1 3.97Å; V358-I362 WeakPolarHBondContact O-CD1 3.13Å; V358-I362 WeakPolarHBondContact O-CG1 3.11Å; V358-I362 PolarHBondContact O-N 2.91Å; G359-I362 PolarHBondContact O-N 3.21Å; S360-I362 VanDerWaalsContact C-N 3.27Å; S360-I362 PolarHBondContact O-N 2.86Å; I362-T365 PolarHBondContact O-N 3.06Å; I362-G366 PolarHBondContact O-N 3.39Å; I362-A514 WeakPolarHBondContact CG1-O 3.24Å; I362-A517 HydrophobicContact CD1-CB 4.49Å; I362-F521 HydrophobicContact CG2-CB 4.33Å; I362-F521 HydrophobicContact CG2-CD1 4.19Å; I362-F521 HydrophobicContact CG2-CG 4.29Å; I362-A532 HydrophobicContact CG2-CB 4.24Å
363A91.3Very high92Very high0 Ų08.5 Ų8.50%04%0.042CC..Hα-helixtrans-57-52.1173.800000112.1G359 S360 T365 G366 V367 R421G359-A363 PolarHBondContact O-N 2.89Å; S360-A363 PolarHBondContact O-N 2.99Å; A363-T365 VanDerWaalsContact C-N 3.32Å; A363-T365 PolarHBondContact O-N 3.2Å; A363-G366 PolarHBondContact O-N 3.4Å; A363-V367 WeakPolarHBondContact O-CG2 3.3Å; A363-V367 PolarHBondContact O-N 3.37Å; A363-R421 VanDerWaalsContact CB-NH1 3.35Å
364F94.7Very high92.1Very high25 Ų2510.8 Ų10.811%0.117%0.065CC..Hα-helixtrans-58-46.2177.6176.9-98.2000111.2S360 G366 F368 V387 M390 L420 V423 S424 I427S360-F364 WeakPolarHBondContact O-CB 3.47Å; S360-F364 PolarHBondContact O-N 3.01Å; F364-G366 PolarHBondContact O-N 2.97Å; F364-F368 HydrophobicContact CE1-CB 4.33Å; F364-F368 HydrophobicContact CE1-CG 4.43Å; F364-F368 HydrophobicContact CZ-CB 4.27Å; F364-F368 AromaticContact CZ-CD2 4Å; F364-F368 HydrophobicContact CZ-CD2 4Å; F364-F368 HydrophobicContact CZ-CG 4.28Å; F364-F368 WeakPolarHBondContact O-CB 3.31Å; F364-F368 PolarHBondContact O-N 3.2Å; F364-V387 HydrophobicContact CE1-CG2 4.49Å; F364-M390 HydrophobicContact CE1-CE 4.07Å; F364-M390 HydrophobicContact CZ-CE 3.76Å; F364-L420 HydrophobicContact CB-CD2 4.4Å; F364-L420 HydrophobicContact CD1-CD2 4.45Å; F364-L420 HydrophobicContact CD2-CD2 4.21Å; F364-L420 HydrophobicContact CG-CD2 4.07Å; F364-V423 HydrophobicContact CD2-CG1 3.9Å; F364-V423 HydrophobicContact CE2-CG1 3.7Å; F364-S424 WeakPolarHBondContact CA-OG 3.43Å; F364-S424 WeakPolarHBondContact CB-OG 3.48Å; F364-S424 PolarHBondContact N-OG 2.88Å; F364-S424 VanDerWaalsContact N-OG 3.13Å; F364-I427 HydrophobicContact CD2-CD1 4.23Å; F364-I427 HydrophobicContact CE2-CD1 3.79Å
365T95.3Very high92.1Very high0 Ų014.3 Ų14.30%08%0.084CC..Hα-helixtrans-60.7-46.6178.9-59.30000111.5V361 I362 A363 L369 V387 T515 I519V361-T365 VanDerWaalsContact O-CB 3.23Å; V361-T365 WeakPolarHBondContact O-CB 3.18Å; V361-T365 PolarHBondContact O-N 3.12Å; V361-T365 PolarHBondContact O-OG1 3.06Å; I362-T365 PolarHBondContact O-N 3.06Å; A363-T365 VanDerWaalsContact C-N 3.32Å; A363-T365 PolarHBondContact O-N 3.2Å; T365-L369 HydrophobicContact CG2-CD1 3.7Å; T365-L369 HydrophobicContact CG2-CG 4.35Å; T365-L369 VanDerWaalsContact O-CB 3.29Å; T365-L369 WeakPolarHBondContact O-CB 3.49Å; T365-L369 WeakPolarHBondContact O-CD1 3.27Å; T365-L369 WeakPolarHBondContact O-CG 3.3Å; T365-L369 PolarHBondContact O-N 3.31Å; T365-V387 HydrophobicContact CG2-CG1 4.1Å; T365-V387 HydrophobicContact CG2-CG2 4.04Å; T365-T515 HydrophobicContact CG2-CG2 4.06Å; T365-I519 HydrophobicContact CG2-CG1 4.03Å
366G93.2Very high91.8Very high4 Ų421.6 Ų21.64%0.04112%0.116CC..Hα-helixtrans-62.1-53.5179.200000112.3I362 A363 F364 L369 A370 G528I362-G366 PolarHBondContact O-N 3.39Å; A363-G366 PolarHBondContact O-N 3.4Å; F364-G366 PolarHBondContact O-N 2.97Å; G366-L369 PolarHBondContact O-N 3.49Å; G366-A370 WeakPolarHBondContact O-CB 3.35Å; G366-A370 PolarHBondContact O-N 3.18Å; G366-G528 VanDerWaalsContact C-CA 3.47Å; G366-G528 WeakPolarHBondContact O-CA 3.42Å
367V93Very high91.8Very high0 Ų024.6 Ų24.60%015%0.147CC..Hα-helixtrans-63.9-42.9-179.4177.80000111.4A363 A370 K371 I427 A530A363-V367 WeakPolarHBondContact O-CG2 3.3Å; A363-V367 PolarHBondContact O-N 3.37Å; V367-A370 PolarHBondContact O-N 3.46Å; V367-K371 WeakPolarHBondContact O-CB 3.43Å; V367-K371 PolarHBondContact O-N 2.92Å; V367-I427 HydrophobicContact CG1-CB 3.77Å; V367-I427 HydrophobicContact CG1-CG2 3.6Å; V367-A530 HydrophobicContact CG2-CB 4.33Å
368F94.3Very high91.7Very high31 Ų3127.9 Ų27.914%0.13616%0.164CC..Hα-helixtrans-60.8-48.1176.4179.7-94.9000111.6F364 A370 K371 V372 L386 V387 M390F364-F368 HydrophobicContact CE1-CB 4.33Å; F364-F368 HydrophobicContact CE1-CG 4.43Å; F364-F368 HydrophobicContact CZ-CB 4.27Å; F364-F368 AromaticContact CZ-CD2 4Å; F364-F368 HydrophobicContact CZ-CD2 4Å; F364-F368 HydrophobicContact CZ-CG 4.28Å; F364-F368 WeakPolarHBondContact O-CB 3.31Å; F364-F368 PolarHBondContact O-N 3.2Å; F368-A370 PolarHBondContact O-N 2.82Å; F368-K371 PolarHBondContact O-N 3.32Å; F368-V372 HydrophobicContact CD1-CG2 4.16Å; F368-V372 HydrophobicContact CD2-CG2 4.2Å; F368-V372 HydrophobicContact CE1-CG2 3.9Å; F368-V372 HydrophobicContact CE2-CG2 3.94Å; F368-V372 HydrophobicContact CG-CG2 4.32Å; F368-V372 HydrophobicContact CZ-CG2 3.79Å; F368-V372 VanDerWaalsContact O-CB 3.22Å; F368-V372 WeakPolarHBondContact O-CB 3.46Å; F368-V372 WeakPolarHBondContact O-CG2 3.49Å; F368-V372 PolarHBondContact O-N 3.41Å; F368-L386 HydrophobicContact CE1-CD2 4.26Å; F368-L386 HydrophobicContact CE1-CG 4.37Å; F368-L386 HydrophobicContact CZ-CD2 3.96Å; F368-L386 HydrophobicContact CZ-CG 4.27Å; F368-V387 HydrophobicContact CD1-CB 3.87Å; F368-V387 HydrophobicContact CD1-CG2 3.67Å; F368-V387 HydrophobicContact CE1-CB 3.96Å; F368-V387 HydrophobicContact CE1-CG2 4.16Å; F368-V387 HydrophobicContact CG-CG2 4.4Å; F368-M390 HydrophobicContact CD2-CE 4.47Å; F368-M390 HydrophobicContact CE1-SD 4.1Å; F368-M390 HydrophobicContact CE2-CE 3.94Å; F368-M390 HydrophobicContact CE2-SD 3.98Å; F368-M390 HydrophobicContact CZ-CE 4.18Å; F368-M390 HydrophobicContact CZ-SD 3.58Å; F368-M390 VanDerWaalsContact CZ-SD 3.58Å
369L95.2Very high91.7Very high0 Ų030.1 Ų30.10%018%0.18CC..Hα-helixtrans-62.3-43.4177.4-72.3170.8000111.7T365 G366 K371 V372 I373 A383 F384 V387 I434 I519T365-L369 HydrophobicContact CG2-CD1 3.7Å; T365-L369 HydrophobicContact CG2-CG 4.35Å; T365-L369 VanDerWaalsContact O-CB 3.29Å; T365-L369 WeakPolarHBondContact O-CB 3.49Å; T365-L369 WeakPolarHBondContact O-CD1 3.27Å; T365-L369 WeakPolarHBondContact O-CG 3.3Å; T365-L369 PolarHBondContact O-N 3.31Å; G366-L369 PolarHBondContact O-N 3.49Å; L369-K371 PolarHBondContact O-N 2.72Å; L369-V372 PolarHBondContact O-N 2.94Å; L369-I373 HydrophobicContact CB-CD1 4.17Å; L369-I373 HydrophobicContact CD2-CD1 4.4Å; L369-I373 VanDerWaalsContact O-CB 3.28Å; L369-I373 WeakPolarHBondContact O-CB 3.29Å; L369-I373 WeakPolarHBondContact O-CD1 3.44Å; L369-I373 VanDerWaalsContact O-CG1 3.22Å; L369-I373 WeakPolarHBondContact O-CG1 3.32Å; L369-I373 PolarHBondContact O-N 3.34Å; L369-A383 HydrophobicContact CD2-CB 3.68Å; L369-F384 HydrophobicContact CD1-CD1 4.14Å; L369-F384 HydrophobicContact CD1-CE1 4.12Å; L369-F384 HydrophobicContact CD2-CD1 3.78Å; L369-F384 HydrophobicContact CD2-CE1 4.17Å; L369-V387 HydrophobicContact CD1-CG1 4.36Å; L369-V387 HydrophobicContact CD2-CB 4.46Å; L369-V387 HydrophobicContact CD2-CG1 3.95Å; L369-V387 HydrophobicContact CG-CG1 4.26Å; L369-I434 HydrophobicContact CB-CD1 4.45Å; L369-I519 HydrophobicContact CD1-CB 4.44Å; L369-I519 HydrophobicContact CD1-CG1 3.74Å
370A92.7Very high91.8Very high0 Ų030.1 Ų30.10%018%0.18CC..Hα-helixtrans-61.4-45.3178.200000112G366 V367 F368 G374 I432 I434G366-A370 WeakPolarHBondContact O-CB 3.35Å; G366-A370 PolarHBondContact O-N 3.18Å; V367-A370 PolarHBondContact O-N 3.46Å; F368-A370 PolarHBondContact O-N 2.82Å; A370-G374 WeakPolarHBondContact O-CA 3.29Å; A370-G374 PolarHBondContact O-N 3.16Å; A370-I432 HydrophobicContact CB-CB 3.67Å; A370-I432 HydrophobicContact CB-CG2 3.69Å; A370-I434 HydrophobicContact CB-CD1 3.75Å; A370-I434 HydrophobicContact CB-CG1 3.65Å
371K91.6Very high91.7Very high65 Ų6536.3 Ų36.328%0.28321%0.212SC..Hα-helixtrans-65-42.9176.8-159.568.6169.7166.30112.4V367 F368 L369 D375 F376 I427 I432V367-K371 WeakPolarHBondContact O-CB 3.43Å; V367-K371 PolarHBondContact O-N 2.92Å; F368-K371 PolarHBondContact O-N 3.32Å; L369-K371 PolarHBondContact O-N 2.72Å; K371-D375 WeakPolarHBondContact CD-OD2 3.24Å; K371-D375 WeakPolarHBondContact CE-OD2 3.4Å; K371-D375 IonicContact NZ-OD2 3.39Å; K371-D375 PolarHBondContact NZ-OD2 3.44Å; K371-D375 WeakPolarHBondContact O-CB 3.36Å; K371-D375 PolarHBondContact O-N 3.06Å; K371-F376 HydrophobicContact CG-CE2 4.49Å; K371-F376 PolarHBondContact O-N 3.37Å; K371-I427 HydrophobicContact CB-CG2 4.03Å; K371-I427 HydrophobicContact CD-CG2 4.31Å; K371-I427 HydrophobicContact CG-CG2 3.9Å; K371-I432 HydrophobicContact CD-CD1 4.02Å
372V93.2Very high91.7Very high12 Ų1241.4 Ų41.47%0.07324%0.239CC..Hα-helixtrans-73.1-38.5-176.9167.20000112.4F368 L369 F376 G377 L378 A383F368-V372 HydrophobicContact CD1-CG2 4.16Å; F368-V372 HydrophobicContact CD2-CG2 4.2Å; F368-V372 HydrophobicContact CE1-CG2 3.9Å; F368-V372 HydrophobicContact CE2-CG2 3.94Å; F368-V372 HydrophobicContact CG-CG2 4.32Å; F368-V372 HydrophobicContact CZ-CG2 3.79Å; F368-V372 VanDerWaalsContact O-CB 3.22Å; F368-V372 WeakPolarHBondContact O-CB 3.46Å; F368-V372 WeakPolarHBondContact O-CG2 3.49Å; F368-V372 PolarHBondContact O-N 3.41Å; L369-V372 PolarHBondContact O-N 2.94Å; V372-F376 WeakPolarHBondContact O-CB 3.45Å; V372-G377 PolarHBondContact O-N 3.5Å; V372-L378 HydrophobicContact CG1-CB 3.6Å; V372-L378 HydrophobicContact CG1-CD1 3.75Å; V372-L378 HydrophobicContact CG1-CG 4.32Å; V372-L378 WeakPolarHBondContact O-CB 3.4Å; V372-L378 PolarHBondContact O-N 3.37Å; V372-L378 VanDerWaalsContact O-N 3.08Å; V372-A383 HydrophobicContact CG1-CB 3.99Å
373I93.4Very high91.7Very high12 Ų1241.4 Ų41.46%0.06224%0.239CC..Hα-helixtrans-79.5-41.7178.2-62.1161000110.6L369 G377 P380 A383 I434 H436 Y439L369-I373 HydrophobicContact CB-CD1 4.17Å; L369-I373 HydrophobicContact CD2-CD1 4.4Å; L369-I373 VanDerWaalsContact O-CB 3.28Å; L369-I373 WeakPolarHBondContact O-CB 3.29Å; L369-I373 WeakPolarHBondContact O-CD1 3.44Å; L369-I373 VanDerWaalsContact O-CG1 3.22Å; L369-I373 WeakPolarHBondContact O-CG1 3.32Å; L369-I373 PolarHBondContact O-N 3.34Å; I373-G377 WeakPolarHBondContact O-CA 3.06Å; I373-G377 PolarHBondContact O-N 3.45Å; I373-P380 HydrophobicContact CD1-CB 4.34Å; I373-P380 HydrophobicContact CD1-CG 3.96Å; I373-P380 HydrophobicContact CG1-CG 4.26Å; I373-P380 HydrophobicContact CG2-CG 4.4Å; I373-A383 HydrophobicContact CD1-CB 4.42Å; I373-A383 HydrophobicContact CG1-CB 4.09Å; I373-I434 HydrophobicContact CB-CG2 4.22Å; I373-I434 HydrophobicContact CD1-CG2 3.92Å; I373-I434 HydrophobicContact CG2-CG2 4.01Å; I373-H436 HydrophobicContact CG2-CB 4.05Å; I373-Y439 HydrophobicContact CD1-CE2 3.66Å
374G87.5Confident91.9Very high51 Ų5142.9 Ų42.953%0.52625%0.245SC..Hα-helixtrans-73.3-63.8-178.100000113.5A370A370-G374 WeakPolarHBondContact O-CA 3.29Å; A370-G374 PolarHBondContact O-N 3.16Å
375D85.4Confident92Very high98 Ų9845 Ų4552%0.52426%0.262SS..THydrogen-bonded Turntrans-82.2-38.6-170.1-62.124.7000112.4K371K371-D375 WeakPolarHBondContact CD-OD2 3.24Å; K371-D375 WeakPolarHBondContact CE-OD2 3.4Å; K371-D375 IonicContact NZ-OD2 3.39Å; K371-D375 PolarHBondContact NZ-OD2 3.44Å; K371-D375 WeakPolarHBondContact O-CB 3.36Å; K371-D375 PolarHBondContact O-N 3.06Å
376F86.9Confident92Very high153 Ų15348.9 Ų48.967%0.67128%0.282SS*.SBendtrans-93.3-5.1-178.4-65.5-86.9000113.7K371 V372 L378K371-F376 HydrophobicContact CG-CE2 4.49Å; K371-F376 PolarHBondContact O-N 3.37Å; V372-F376 WeakPolarHBondContact O-CB 3.45Å; F376-L378 PolarHBondContact O-N 2.97Å; F376-L378 VanDerWaalsContact O-N 3.11Å
377G87.4Confident92.1Very high62 Ų6248.7 Ų48.764%0.63928%0.28SS*.  trans61.716.8178.700000115V372 I373 S379V372-G377 PolarHBondContact O-N 3.5Å; I373-G377 WeakPolarHBondContact O-CA 3.06Å; I373-G377 PolarHBondContact O-N 3.45Å; G377-S379 PolarHBondContact O-N 3.47Å
378L91Very high92.3Very high70 Ų7051 Ų5137%0.36629%0.292SS..  trans-73125.5-177.8-93.4162.8000110.2V372 F376 L382V372-L378 HydrophobicContact CG1-CB 3.6Å; V372-L378 HydrophobicContact CG1-CD1 3.75Å; V372-L378 HydrophobicContact CG1-CG 4.32Å; V372-L378 WeakPolarHBondContact O-CB 3.4Å; V372-L378 PolarHBondContact O-N 3.37Å; V372-L378 VanDerWaalsContact O-N 3.08Å; F376-L378 PolarHBondContact O-N 2.97Å; F376-L378 VanDerWaalsContact O-N 3.11Å; L378-L382 HydrophobicContact CD2-CB 4.33Å; L378-L382 HydrophobicContact CD2-CD1 4.03Å
379S92.5Very high92.5Very high47 Ų4754.4 Ų54.433%0.32932%0.315SS..  trans-61.9144.1-176.872.60000111.5G377 L381 L382 A383G377-S379 PolarHBondContact O-N 3.47Å; S379-L381 PolarHBondContact O-N 3.05Å; S379-L382 PolarHBondContact O-N 3.47Å; S379-A383 PolarHBondContact O-N 3.03Å
380P91.1Very high92.5Very high0 Ų057.9 Ų57.90%033%0.332CS..Hα-helixtrans-56-27.1179.3-29.136.6000114.1I373 L382 A383 F384 H436 V438 Y439I373-P380 HydrophobicContact CD1-CB 4.34Å; I373-P380 HydrophobicContact CD1-CG 3.96Å; I373-P380 HydrophobicContact CG1-CG 4.26Å; I373-P380 HydrophobicContact CG2-CG 4.4Å; P380-L382 PolarHBondContact O-N 2.83Å; P380-A383 PolarHBondContact O-N 3.23Å; P380-F384 HydrophobicContact CB-CD2 4.4Å; P380-F384 HydrophobicContact CB-CE1 4.06Å; P380-F384 HydrophobicContact CB-CE2 3.88Å; P380-F384 HydrophobicContact CB-CZ 3.7Å; P380-F384 WeakPolarHBondContact O-CB 3.48Å; P380-F384 WeakPolarHBondContact O-CD2 3.41Å; P380-F384 WeakPolarHBondContact O-CG 3.44Å; P380-F384 PolarHBondContact O-N 3.19Å; P380-H436 WeakPolarHBondContact CD-CE1 3.29Å; P380-V438 HydrophobicContact CB-CG1 4.22Å; P380-V438 HydrophobicContact CG-CB 4.26Å; P380-V438 HydrophobicContact CG-CG1 4.44Å; P380-Y439 HydrophobicContact CB-CE2 4.15Å; P380-Y439 HydrophobicContact CG-CD2 4.08Å; P380-Y439 HydrophobicContact CG-CE2 3.98Å
381L88.9Confident92.7Very high130 Ų13058.2 Ų58.268%0.68134%0.336SS*.Hα-helixtrans-63.3-25174.8-63.1175.1000113.5S379 P385S379-L381 PolarHBondContact O-N 3.05Å; L381-P385 WeakPolarHBondContact O-CD 3.38Å; L381-P385 WeakPolarHBondContact O-CG 3.39Å
382L93.1Very high93Very high109 Ų10957.2 Ų57.257%0.57134%0.336SS*.Hα-helixtrans-98.6-34.9172.8-64175.9000111.9L378 S379 P380 P385 L386L378-L382 HydrophobicContact CD2-CB 4.33Å; L378-L382 HydrophobicContact CD2-CD1 4.03Å; S379-L382 PolarHBondContact O-N 3.47Å; P380-L382 PolarHBondContact O-N 2.83Å; L382-P385 WeakPolarHBondContact O-CD 3.22Å; L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 PolarHBondContact O-N 3.09Å
383A94.7Very high93.2Very high1 Ų159.3 Ų59.31%0.00836%0.355CS..Hα-helixtrans-67.7-40.1-179.700000112.9L369 V372 I373 S379 P380 L386 V387L369-A383 HydrophobicContact CD2-CB 3.68Å; V372-A383 HydrophobicContact CG1-CB 3.99Å; I373-A383 HydrophobicContact CD1-CB 4.42Å; I373-A383 HydrophobicContact CG1-CB 4.09Å; S379-A383 PolarHBondContact O-N 3.03Å; P380-A383 PolarHBondContact O-N 3.23Å; A383-L386 PolarHBondContact O-N 3.07Å; A383-V387 PolarHBondContact O-N 3.46Å
384F95.2Very high93.4Very high30 Ų3060.3 Ų60.313%0.13236%0.359CS..Hα-helixtrans-64.9-48.4179.6-58.9-23.5000113L369 P380 L386 L388 Y439 L442 I519 I523L369-F384 HydrophobicContact CD1-CD1 4.14Å; L369-F384 HydrophobicContact CD1-CE1 4.12Å; L369-F384 HydrophobicContact CD2-CD1 3.78Å; L369-F384 HydrophobicContact CD2-CE1 4.17Å; P380-F384 HydrophobicContact CB-CD2 4.4Å; P380-F384 HydrophobicContact CB-CE1 4.06Å; P380-F384 HydrophobicContact CB-CE2 3.88Å; P380-F384 HydrophobicContact CB-CZ 3.7Å; P380-F384 WeakPolarHBondContact O-CB 3.48Å; P380-F384 WeakPolarHBondContact O-CD2 3.41Å; P380-F384 WeakPolarHBondContact O-CG 3.44Å; P380-F384 PolarHBondContact O-N 3.19Å; F384-L386 VanDerWaalsContact C-N 3.34Å; F384-L386 PolarHBondContact O-N 2.84Å; F384-L388 WeakPolarHBondContact O-CB 3.33Å; F384-L388 WeakPolarHBondContact O-CD1 3.39Å; F384-L388 VanDerWaalsContact O-CG 3.28Å; F384-L388 WeakPolarHBondContact O-CG 3.14Å; F384-L388 PolarHBondContact O-N 2.89Å; F384-L388 VanDerWaalsContact O-N 3.09Å; F384-Y439 AromaticContact CE1-CE2 3.84Å; F384-Y439 HydrophobicContact CE1-CE2 3.84Å; F384-Y439 AromaticContact CE1-CZ 3.99Å; F384-Y439 WeakPolarHBondContact CE1-OH 3.23Å; F384-Y439 HydrophobicContact CZ-CD2 4.41Å; F384-Y439 AromaticContact CZ-CE2 3.6Å; F384-Y439 HydrophobicContact CZ-CE2 3.6Å; F384-L442 HydrophobicContact CE2-CD1 3.93Å; F384-L442 HydrophobicContact CZ-CD1 4.44Å; F384-I519 HydrophobicContact CB-CD1 3.99Å; F384-I519 HydrophobicContact CD1-CD1 4.24Å; F384-I519 HydrophobicContact CD1-CG1 3.96Å; F384-I519 HydrophobicContact CD1-CG2 3.82Å; F384-I519 HydrophobicContact CD2-CG2 4.28Å; F384-I519 HydrophobicContact CE1-CG1 4.49Å; F384-I519 HydrophobicContact CE1-CG2 3.77Å; F384-I519 HydrophobicContact CE2-CG2 4.22Å; F384-I519 HydrophobicContact CG-CD1 4.27Å; F384-I519 HydrophobicContact CG-CG1 4.44Å; F384-I519 HydrophobicContact CG-CG2 4.09Å; F384-I519 HydrophobicContact CZ-CG2 3.97Å; F384-I523 HydrophobicContact CE2-CD1 4.32Å; F384-I523 HydrophobicContact CZ-CD1 3.92Å; F384-I523 HydrophobicContact CZ-CG1 4.3Å
385P96Very high93.8Very high71 Ų7157.9 Ų57.946%0.46133%0.334SS..Hα-helixtrans-61.5-39.2173.9-24.735.7000113.2L381 L382 L388 V389L381-P385 WeakPolarHBondContact O-CD 3.38Å; L381-P385 WeakPolarHBondContact O-CG 3.39Å; L382-P385 WeakPolarHBondContact O-CD 3.22Å; P385-L388 PolarHBondContact O-N 2.74Å; P385-V389 WeakPolarHBondContact O-CG2 3.38Å; P385-V389 PolarHBondContact O-N 3.02Å
386L96.1Very high94.4Very high80 Ų8054.1 Ų54.142%0.41932%0.316SS..Hα-helixtrans-60.8-52.3179.7178.460.8000111.5F368 L382 A383 F384 L388 V389 M390F368-L386 HydrophobicContact CE1-CD2 4.26Å; F368-L386 HydrophobicContact CE1-CG 4.37Å; F368-L386 HydrophobicContact CZ-CD2 3.96Å; F368-L386 HydrophobicContact CZ-CG 4.27Å; L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 PolarHBondContact O-N 3.09Å; A383-L386 PolarHBondContact O-N 3.07Å; F384-L386 VanDerWaalsContact C-N 3.34Å; F384-L386 PolarHBondContact O-N 2.84Å; L386-L388 VanDerWaalsContact C-N 3.34Å; L386-L388 PolarHBondContact O-N 3.4Å; L386-V389 PolarHBondContact O-N 2.86Å; L386-M390 HydrophobicContact CD1-SD 4.43Å; L386-M390 HydrophobicContact CG-SD 4.27Å; L386-M390 WeakPolarHBondContact O-CG 3.44Å; L386-M390 PolarHBondContact O-N 3.23Å; L386-M390 VanDerWaalsContact O-N 3.08Å
387V96Very high94.8Very high0 Ų052.2 Ų52.20%031%0.308CS..Hα-helixtrans-67.1-35.8-179.477.10000111.7F364 T365 F368 L369 A383 V389 M390 G391 T515 I519F364-V387 HydrophobicContact CE1-CG2 4.49Å; T365-V387 HydrophobicContact CG2-CG1 4.1Å; T365-V387 HydrophobicContact CG2-CG2 4.04Å; F368-V387 HydrophobicContact CD1-CB 3.87Å; F368-V387 HydrophobicContact CD1-CG2 3.67Å; F368-V387 HydrophobicContact CE1-CB 3.96Å; F368-V387 HydrophobicContact CE1-CG2 4.16Å; F368-V387 HydrophobicContact CG-CG2 4.4Å; L369-V387 HydrophobicContact CD1-CG1 4.36Å; L369-V387 HydrophobicContact CD2-CB 4.46Å; L369-V387 HydrophobicContact CD2-CG1 3.95Å; L369-V387 HydrophobicContact CG-CG1 4.26Å; A383-V387 PolarHBondContact O-N 3.46Å; V387-V389 VanDerWaalsContact C-N 3.34Å; V387-V389 PolarHBondContact O-N 3Å; V387-M390 PolarHBondContact O-N 3.11Å; V387-G391 PolarHBondContact O-N 2.86Å; V387-T515 HydrophobicContact CB-CG2 4.42Å; V387-T515 HydrophobicContact CG1-CG2 3.92Å; V387-T515 HydrophobicContact CG2-CG2 4.1Å; V387-I519 HydrophobicContact CG1-CD1 3.96Å; V387-I519 HydrophobicContact CG1-CG1 4.12Å
388L96.8Very high95.2Very high50 Ų5049.3 Ų49.326%0.26228%0.278SS..Hα-helixtrans-62.1-37.4173.8-77.5166.8000113F384 P385 L386 C392 T515 L516 I519F384-L388 WeakPolarHBondContact O-CB 3.33Å; F384-L388 WeakPolarHBondContact O-CD1 3.39Å; F384-L388 VanDerWaalsContact O-CG 3.28Å; F384-L388 WeakPolarHBondContact O-CG 3.14Å; F384-L388 PolarHBondContact O-N 2.89Å; F384-L388 VanDerWaalsContact O-N 3.09Å; P385-L388 PolarHBondContact O-N 2.74Å; L386-L388 VanDerWaalsContact C-N 3.34Å; L386-L388 PolarHBondContact O-N 3.4Å; L388-C392 WeakPolarHBondContact O-CB 3.43Å; L388-C392 PolarHBondContact O-N 2.69Å; L388-C392 PolarHBondContact O-SG 2.88Å; L388-T515 HydrophobicContact CD2-CG2 3.91Å; L388-T515 HydrophobicContact CG-CG2 4.27Å; L388-L516 HydrophobicContact CD2-CB 4.12Å; L388-L516 HydrophobicContact CD2-CD1 4.49Å; L388-I519 HydrophobicContact CD1-CD1 3.91Å; L388-I519 HydrophobicContact CD2-CD1 4.08Å; L388-I519 HydrophobicContact CG-CD1 3.71Å
389V97.3Very high95.4Very high101 Ų10146 Ų4661%0.61226%0.261SS*.Hα-helixtrans-67.4-43.1173.6169.10000110.7P385 L386 V387 C392 A393P385-V389 WeakPolarHBondContact O-CG2 3.38Å; P385-V389 PolarHBondContact O-N 3.02Å; L386-V389 PolarHBondContact O-N 2.86Å; V387-V389 VanDerWaalsContact C-N 3.34Å; V387-V389 PolarHBondContact O-N 3Å; V389-C392 PolarHBondContact O-N 3.31Å; V389-A393 VanDerWaalsContact O-CB 3.31Å; V389-A393 WeakPolarHBondContact O-CB 3.11Å; V389-A393 PolarHBondContact O-N 3.17Å
390M96.5Very high95.6Very high73 Ų7346.6 Ų46.636%0.3626%0.26SS..Hα-helixtrans-61.5-44.7176.2-66.5171.268.700112F364 F368 L386 V387 A393 F394F364-M390 HydrophobicContact CE1-CE 4.07Å; F364-M390 HydrophobicContact CZ-CE 3.76Å; F368-M390 HydrophobicContact CD2-CE 4.47Å; F368-M390 HydrophobicContact CE1-SD 4.1Å; F368-M390 HydrophobicContact CE2-CE 3.94Å; F368-M390 HydrophobicContact CE2-SD 3.98Å; F368-M390 HydrophobicContact CZ-CE 4.18Å; F368-M390 HydrophobicContact CZ-SD 3.58Å; F368-M390 VanDerWaalsContact CZ-SD 3.58Å; L386-M390 HydrophobicContact CD1-SD 4.43Å; L386-M390 HydrophobicContact CG-SD 4.27Å; L386-M390 WeakPolarHBondContact O-CG 3.44Å; L386-M390 PolarHBondContact O-N 3.23Å; L386-M390 VanDerWaalsContact O-N 3.08Å; V387-M390 PolarHBondContact O-N 3.11Å; M390-A393 PolarHBondContact O-N 2.79Å; M390-F394 WeakPolarHBondContact O-CB 3.46Å; M390-F394 PolarHBondContact O-N 2.68Å
391G96.5Very high95.8Very high7 Ų748.8 Ų48.87%0.07227%0.271CS..Hα-helixtrans-62-49.2175.600000113V387 A393 F394 G395 T511 T515V387-G391 PolarHBondContact O-N 2.86Å; G391-A393 VanDerWaalsContact C-N 3.29Å; G391-A393 PolarHBondContact O-N 3.12Å; G391-F394 PolarHBondContact O-N 2.61Å; G391-G395 PolarHBondContact O-N 2.89Å; G391-T511 WeakPolarHBondContact O-CB 3.18Å; G391-T511 WeakPolarHBondContact O-CG2 3.22Å; G391-T515 WeakPolarHBondContact CA-OG1 3.49Å
392C97.2Very high95.9Very high44 Ų4443.6 Ų43.630%0.29724%0.244SC..Hα-helixtrans-57.8-40.7174.7-71.60000112.2L388 V389 A396 M508L388-C392 WeakPolarHBondContact O-CB 3.43Å; L388-C392 PolarHBondContact O-N 2.69Å; L388-C392 PolarHBondContact O-SG 2.88Å; V389-C392 PolarHBondContact O-N 3.31Å; C392-A396 WeakPolarHBondContact O-CB 3.28Å; C392-A396 PolarHBondContact O-N 3.34Å; C392-M508 HydrophobicContact CB-CG 4.07Å
393A97.6Very high95.7Very high57 Ų5739.5 Ų39.547%0.47122%0.223SC..Hα-helixtrans-67.6-41.9177.900000112.4V389 M390 G391 A396 F397V389-A393 VanDerWaalsContact O-CB 3.31Å; V389-A393 WeakPolarHBondContact O-CB 3.11Å; V389-A393 PolarHBondContact O-N 3.17Å; M390-A393 PolarHBondContact O-N 2.79Å; G391-A393 VanDerWaalsContact C-N 3.29Å; G391-A393 PolarHBondContact O-N 3.12Å; A393-A396 PolarHBondContact O-N 3.35Å; A393-F397 WeakPolarHBondContact O-CB 3.41Å; A393-F397 PolarHBondContact O-N 2.9Å
394F97.1Very high95.5Very high33 Ų3342.3 Ų42.315%0.14525%0.246CC..Hα-helixtrans-64.4-43.8176.6-171.7-102.6000111.9M390 G391 A396 F397 M398 F419 L420 T511M390-F394 WeakPolarHBondContact O-CB 3.46Å; M390-F394 PolarHBondContact O-N 2.68Å; G391-F394 PolarHBondContact O-N 2.61Å; F394-A396 PolarHBondContact O-N 2.87Å; F394-F397 WeakPolarHBondContact O-CB 3.43Å; F394-F397 PolarHBondContact O-N 3.09Å; F394-M398 HydrophobicContact CD1-CE 3.69Å; F394-M398 HydrophobicContact CD1-CG 4.41Å; F394-M398 HydrophobicContact CD1-SD 4.09Å; F394-M398 HydrophobicContact CE1-CE 3.7Å; F394-M398 HydrophobicContact CE1-CG 4.09Å; F394-M398 HydrophobicContact CE1-SD 3.51Å; F394-M398 VanDerWaalsContact CE1-SD 3.51Å; F394-M398 HydrophobicContact CZ-CG 4.37Å; F394-M398 HydrophobicContact CZ-SD 4.14Å; F394-M398 PolarHBondContact O-N 3.03Å; F394-F419 AromaticContact CE2-CD1 3.7Å; F394-F419 HydrophobicContact CE2-CD1 3.7Å; F394-F419 AromaticContact CE2-CE1 3.96Å; F394-F419 HydrophobicContact CE2-CE1 3.96Å; F394-F419 HydrophobicContact CZ-CD1 4.01Å; F394-L420 HydrophobicContact CD1-CD1 3.6Å; F394-L420 HydrophobicContact CD1-CG 4.25Å; F394-L420 HydrophobicContact CE1-CD1 3.37Å; F394-L420 HydrophobicContact CE1-CG 3.71Å; F394-L420 HydrophobicContact CE2-CD2 4.31Å; F394-L420 HydrophobicContact CE2-CG 4.18Å; F394-L420 HydrophobicContact CG-CD1 4.3Å; F394-L420 HydrophobicContact CZ-CD1 3.9Å; F394-L420 HydrophobicContact CZ-CD2 4.3Å; F394-L420 HydrophobicContact CZ-CG 3.67Å; F394-T511 HydrophobicContact CB-CG2 4.41Å; F394-T511 HydrophobicContact CD1-CG2 4.12Å
395G96.6Very high95.4Very high0 Ų045.7 Ų45.70%027%0.265CS..Hα-helixtrans-61-42.4172.900000113G391 F397 M398 G399 Y507 T511G391-G395 PolarHBondContact O-N 2.89Å; G395-F397 VanDerWaalsContact C-N 3.31Å; G395-F397 PolarHBondContact O-N 3.36Å; G395-M398 PolarHBondContact O-N 3.12Å; G395-G399 PolarHBondContact O-N 2.87Å; G395-Y507 WeakPolarHBondContact CA-O 3.32Å; G395-Y507 CarbonylContact O-C 3.48Å; G395-Y507 WeakPolarHBondContact O-CB 3.32Å; G395-T511 WeakPolarHBondContact CA-OG1 3.46Å
396A97.1Very high94.9Very high18 Ų1849.2 Ų49.215%0.14927%0.273CS..Hα-helixtrans-62.6-37.6174.600000112.5C392 A393 F394 L400 I504 M508C392-A396 WeakPolarHBondContact O-CB 3.28Å; C392-A396 PolarHBondContact O-N 3.34Å; A393-A396 PolarHBondContact O-N 3.35Å; F394-A396 PolarHBondContact O-N 2.87Å; A396-L400 VanDerWaalsContact O-CB 3.31Å; A396-L400 WeakPolarHBondContact O-CB 3.39Å; A396-L400 PolarHBondContact O-N 3.11Å; A396-I504 HydrophobicContact CB-CG2 4.05Å; A396-M508 HydrophobicContact CB-CB 4.2Å; A396-M508 HydrophobicContact CB-CE 3.6Å
397F97.1Very high94.4Very high113 Ų11348.1 Ų48.150%0.49627%0.267SS..Hα-helixtrans-67.6-46.1176.6178.3-111.4000112.1A393 F394 G395 G399 L400 L401A393-F397 WeakPolarHBondContact O-CB 3.41Å; A393-F397 PolarHBondContact O-N 2.9Å; F394-F397 WeakPolarHBondContact O-CB 3.43Å; F394-F397 PolarHBondContact O-N 3.09Å; G395-F397 VanDerWaalsContact C-N 3.31Å; G395-F397 PolarHBondContact O-N 3.36Å; F397-G399 PolarHBondContact O-N 3.08Å; F397-L400 WeakPolarHBondContact O-CB 3.43Å; F397-L400 PolarHBondContact O-N 3.13Å; F397-L400 VanDerWaalsContact O-N 3.16Å; F397-L401 HydrophobicContact CD1-CD1 4.17Å; F397-L401 HydrophobicContact CE1-CD1 3.64Å; F397-L401 HydrophobicContact CE1-CG 4.32Å; F397-L401 HydrophobicContact CE2-CD1 4.44Å; F397-L401 HydrophobicContact CE2-CD2 4.31Å; F397-L401 HydrophobicContact CE2-CG 4.31Å; F397-L401 HydrophobicContact CZ-CD1 3.79Å; F397-L401 HydrophobicContact CZ-CD2 4.23Å; F397-L401 HydrophobicContact CZ-CG 4.14Å; F397-L401 WeakPolarHBondContact O-CG 3.18Å; F397-L401 PolarHBondContact O-N 3.36Å
398M95.5Very high93.7Very high2 Ų251.6 Ų51.61%0.0129%0.289CS..Hα-helixtrans-59.6-47.6173.2-68.1-171.4-65.200111.5S357 F394 G395 L400 L401 I402 I412 T413 T511S357-M398 WeakPolarHBondContact OG-CE 3.45Å; F394-M398 HydrophobicContact CD1-CE 3.69Å; F394-M398 HydrophobicContact CD1-CG 4.41Å; F394-M398 HydrophobicContact CD1-SD 4.09Å; F394-M398 HydrophobicContact CE1-CE 3.7Å; F394-M398 HydrophobicContact CE1-CG 4.09Å; F394-M398 HydrophobicContact CE1-SD 3.51Å; F394-M398 VanDerWaalsContact CE1-SD 3.51Å; F394-M398 HydrophobicContact CZ-CG 4.37Å; F394-M398 HydrophobicContact CZ-SD 4.14Å; F394-M398 PolarHBondContact O-N 3.03Å; G395-M398 PolarHBondContact O-N 3.12Å; M398-L400 PolarHBondContact O-N 3.43Å; M398-L401 PolarHBondContact O-N 2.76Å; M398-L401 VanDerWaalsContact O-N 3.12Å; M398-I402 VanDerWaalsContact O-CG1 3.29Å; M398-I402 WeakPolarHBondContact O-CG1 3.31Å; M398-I402 PolarHBondContact O-N 2.99Å; M398-I412 HydrophobicContact CB-CG2 4.05Å; M398-I412 HydrophobicContact CG-CG2 4.32Å; M398-T413 HydrophobicContact SD-CG2 4.06Å; M398-T511 VanDerWaalsContact CE-OG1 3.28Å; M398-T511 WeakPolarHBondContact CE-OG1 3.22Å
399G94.2Very high93.3Very high0 Ų050 Ų500%028%0.283CS..Hα-helixtrans-61.9-28.5176.300000113.9G395 F397 D403G395-G399 PolarHBondContact O-N 2.87Å; F397-G399 PolarHBondContact O-N 3.08Å; G399-D403 PolarHBondContact O-N 3.32Å
400L96.1Very high92.6Very high59 Ų5946 Ų4631%0.30926%0.258SS..Hα-helixtrans-72.1-45171.9171.963.9000111.4A396 F397 M398 D403 A404 I504A396-L400 VanDerWaalsContact O-CB 3.31Å; A396-L400 WeakPolarHBondContact O-CB 3.39Å; A396-L400 PolarHBondContact O-N 3.11Å; F397-L400 WeakPolarHBondContact O-CB 3.43Å; F397-L400 PolarHBondContact O-N 3.13Å; F397-L400 VanDerWaalsContact O-N 3.16Å; M398-L400 PolarHBondContact O-N 3.43Å; L400-D403 PolarHBondContact O-N 3.32Å; L400-A404 HydrophobicContact CD1-CB 4.47Å; L400-A404 WeakPolarHBondContact O-CB 3.38Å; L400-A404 PolarHBondContact O-N 3.39Å; L400-I504 HydrophobicContact CB-CD1 4.2Å; L400-I504 HydrophobicContact CB-CG1 4.12Å; L400-I504 HydrophobicContact CD1-CD1 4.11Å
401L95.1Very high91.9Very high47 Ų4744.6 Ų44.625%0.24625%0.251CS..Hα-helixtrans-62.4-41.8177.5-69.6178.9000112.1F397 M398 D403 A404 L405 I412F397-L401 HydrophobicContact CD1-CD1 4.17Å; F397-L401 HydrophobicContact CE1-CD1 3.64Å; F397-L401 HydrophobicContact CE1-CG 4.32Å; F397-L401 HydrophobicContact CE2-CD1 4.44Å; F397-L401 HydrophobicContact CE2-CD2 4.31Å; F397-L401 HydrophobicContact CE2-CG 4.31Å; F397-L401 HydrophobicContact CZ-CD1 3.79Å; F397-L401 HydrophobicContact CZ-CD2 4.23Å; F397-L401 HydrophobicContact CZ-CG 4.14Å; F397-L401 WeakPolarHBondContact O-CG 3.18Å; F397-L401 PolarHBondContact O-N 3.36Å; M398-L401 PolarHBondContact O-N 2.76Å; M398-L401 VanDerWaalsContact O-N 3.12Å; L401-D403 PolarHBondContact O-N 3.26Å; L401-A404 PolarHBondContact O-N 3.25Å; L401-L405 HydrophobicContact CB-CD1 4.47Å; L401-L405 HydrophobicContact CD2-CD1 4.07Å; L401-L405 WeakPolarHBondContact O-CB 3.43Å; L401-L405 PolarHBondContact O-N 3.04Å; L401-I412 HydrophobicContact CB-CD1 4.2Å; L401-I412 HydrophobicContact CB-CG1 4.46Å; L401-I412 HydrophobicContact CB-CG2 3.96Å; L401-I412 HydrophobicContact CD1-CG2 4.28Å
402I91.8Very high91.7Very high20 Ų2045 Ų4510%0.10325%0.251CS..Hα-helixtrans-56.6-49.9177.7-68.1165.9000110.8M398 K406 A409 I412 T413 T503 Y507M398-I402 VanDerWaalsContact O-CG1 3.29Å; M398-I402 WeakPolarHBondContact O-CG1 3.31Å; M398-I402 PolarHBondContact O-N 2.99Å; I402-K406 WeakPolarHBondContact O-CA 3.46Å; I402-K406 PolarHBondContact O-N 3.36Å; I402-A409 HydrophobicContact CD1-CB 3.95Å; I402-I412 HydrophobicContact CD1-CB 4.26Å; I402-I412 HydrophobicContact CD1-CG2 4.37Å; I402-I412 HydrophobicContact CG1-CB 3.64Å; I402-I412 HydrophobicContact CG1-CG1 3.69Å; I402-I412 HydrophobicContact CG1-CG2 3.87Å; I402-T413 HydrophobicContact CD1-CG2 4.29Å; I402-T503 HydrophobicContact CB-CG2 4.32Å; I402-T503 HydrophobicContact CG2-CG2 4.07Å; I402-Y507 HydrophobicContact CD1-CD1 4.32Å; I402-Y507 HydrophobicContact CD1-CD2 3.85Å; I402-Y507 HydrophobicContact CD1-CE1 4.01Å; I402-Y507 HydrophobicContact CD1-CE2 3.54Å; I402-Y507 HydrophobicContact CD1-CG 4.27Å
403D89.5Confident91.4Very high24 Ų2442.9 Ų42.913%0.12824%0.237CC..Hα-helixtrans-77.4-36178.1-172.878000113.2G399 L400 L401 K406 R500G399-D403 PolarHBondContact O-N 3.32Å; L400-D403 PolarHBondContact O-N 3.32Å; L401-D403 PolarHBondContact O-N 3.26Å; D403-K406 VanDerWaalsContact O-CD 3.23Å; D403-K406 WeakPolarHBondContact O-CD 3.45Å; D403-K406 WeakPolarHBondContact O-CE 3.33Å; D403-K406 PolarHBondContact O-NZ 3.35Å; D403-K406 IonicContact OD1-NZ 3.2Å; D403-K406 PolarHBondContact OD1-NZ 3.12Å; D403-K406 IonicContact OD2-NZ 3.07Å; D403-K406 PolarHBondContact OD2-NZ 2.98Å; D403-R500 HydrophobicContact CB-CB 4.3Å; D403-R500 HydrophobicContact CB-CG 4.1Å; D403-R500 VanDerWaalsContact OD2-CB 3.22Å; D403-R500 WeakPolarHBondContact OD2-CB 3.27Å; D403-R500 VanDerWaalsContact OD2-CD 3.29Å; D403-R500 WeakPolarHBondContact OD2-CD 3.48Å; D403-R500 WeakPolarHBondContact OD2-CG 3.37Å
404A91.1Very high90.9Very high59 Ų5940.4 Ų40.449%0.48822%0.216SC..Hα-helixtrans-70.8-40.7-17700000112.8L400 L401L400-A404 HydrophobicContact CD1-CB 4.47Å; L400-A404 WeakPolarHBondContact O-CB 3.38Å; L400-A404 PolarHBondContact O-N 3.39Å; L401-A404 PolarHBondContact O-N 3.25Å
405L91.2Very high90.4Very high101 Ų10141.6 Ų41.653%0.52923%0.232SC..Hα-helixtrans-93.5-10.7-177.8-55179.8000113.2L401 I407L401-L405 HydrophobicContact CB-CD1 4.47Å; L401-L405 HydrophobicContact CD2-CD1 4.07Å; L401-L405 WeakPolarHBondContact O-CB 3.43Å; L401-L405 PolarHBondContact O-N 3.04Å; L405-I407 HydrophobicContact CB-CB 4.41Å; L405-I407 HydrophobicContact CB-CD1 3.76Å; L405-I407 HydrophobicContact CB-CG1 3.81Å; L405-I407 HydrophobicContact CD1-CD1 3.88Å; L405-I407 HydrophobicContact CG-CD1 4.48Å; L405-I407 PolarHBondContact O-N 2.98Å
406K85.9Confident90.1Very high145 Ų14541.9 Ų41.963%0.6324%0.235SC*.  trans54.227.1-172.3-54.9-58.7-177-143.90113.8I402 D403I402-K406 WeakPolarHBondContact O-CA 3.46Å; I402-K406 PolarHBondContact O-N 3.36Å; D403-K406 VanDerWaalsContact O-CD 3.23Å; D403-K406 WeakPolarHBondContact O-CD 3.45Å; D403-K406 WeakPolarHBondContact O-CE 3.33Å; D403-K406 PolarHBondContact O-NZ 3.35Å; D403-K406 IonicContact OD1-NZ 3.2Å; D403-K406 PolarHBondContact OD1-NZ 3.12Å; D403-K406 IonicContact OD2-NZ 3.07Å; D403-K406 PolarHBondContact OD2-NZ 2.98Å
407I85.3Confident89.7Confident58 Ų5841 Ų4130%0.29723%0.228SC..  trans-81.5138.4175.1-66.9175000108.8L405 I411 I412L405-I407 HydrophobicContact CB-CB 4.41Å; L405-I407 HydrophobicContact CB-CD1 3.76Å; L405-I407 HydrophobicContact CB-CG1 3.81Å; L405-I407 HydrophobicContact CD1-CD1 3.88Å; L405-I407 HydrophobicContact CG-CD1 4.48Å; L405-I407 PolarHBondContact O-N 2.98Å; I407-I411 HydrophobicContact CG2-CB 3.72Å; I407-I411 HydrophobicContact CG2-CD1 4.34Å; I407-I411 HydrophobicContact CG2-CG2 3.85Å; I407-I412 HydrophobicContact CB-CD1 3.97Å; I407-I412 HydrophobicContact CB-CG1 4.08Å; I407-I412 HydrophobicContact CD1-CD1 4.14Å; I407-I412 HydrophobicContact CG2-CD1 3.78Å; I407-I412 HydrophobicContact CG2-CG1 3.86Å
408P82.6Confident89.1Confident73 Ų7338 Ų3847%0.47422%0.215SC..  trans-50.5138.6174.7-29.334.9000113.3F410 I411 I412P408-F410 VanDerWaalsContact C-N 3.32Å; P408-F410 PolarHBondContact O-N 3.16Å; P408-I411 HydrophobicContact CB-CD1 4.41Å; P408-I411 HydrophobicContact CB-CG1 4.49Å; P408-I411 HydrophobicContact CG-CD1 4.26Å; P408-I411 PolarHBondContact O-N 3.07Å; P408-I412 PolarHBondContact O-N 3.34Å
409A87.2Confident88.9Confident16 Ų1643.8 Ų43.813%0.13224%0.24CC..Hα-helixtrans-49-50.9-176.200000113.3I354 I402 I411 I412 T413 Y507I354-A409 HydrophobicContact CB-CB 4.47Å; I402-A409 HydrophobicContact CD1-CB 3.95Å; A409-I411 VanDerWaalsContact C-N 3.26Å; A409-I411 PolarHBondContact O-N 3.27Å; A409-I411 VanDerWaalsContact O-N 3.17Å; A409-I412 PolarHBondContact O-N 2.9Å; A409-T413 PolarHBondContact O-N 2.79Å; A409-T413 PolarHBondContact O-OG1 3.21Å; A409-Y507 WeakPolarHBondContact CB-OH 3.33Å
410F83Confident88.7Confident17 Ų1744.3 Ų44.38%0.07524%0.243CC..Hα-helixtrans-41.6-46172.6178.7-86.2000114.1F116 L241 I244 I354 L356 P408 L414F116-F410 HydrophobicContact CE2-CE2 4.37Å; F116-F410 HydrophobicContact CZ-CD2 4.1Å; F116-F410 AromaticContact CZ-CE2 3.9Å; F116-F410 HydrophobicContact CZ-CE2 3.9Å; L241-F410 HydrophobicContact CD1-CE2 4.39Å; L241-F410 HydrophobicContact CD1-CZ 4.04Å; L241-F410 HydrophobicContact CD2-CE2 4.21Å; L241-F410 HydrophobicContact CD2-CZ 3.7Å; I244-F410 HydrophobicContact CG2-CE1 4.07Å; I244-F410 HydrophobicContact CG2-CZ 4.28Å; I354-F410 HydrophobicContact CG2-CB 3.66Å; I354-F410 HydrophobicContact CG2-CD2 3.87Å; I354-F410 HydrophobicContact CG2-CG 4.25Å; L356-F410 HydrophobicContact CD1-CD2 3.64Å; L356-F410 HydrophobicContact CD1-CE2 3.64Å; L356-F410 HydrophobicContact CD1-CG 4.11Å; L356-F410 HydrophobicContact CD1-CZ 4.12Å; L356-F410 HydrophobicContact CD2-CB 4.48Å; L356-F410 HydrophobicContact CD2-CD2 3.83Å; L356-F410 HydrophobicContact CD2-CE2 4.49Å; L356-F410 HydrophobicContact CD2-CG 4.36Å; L356-F410 HydrophobicContact CG-CD2 4.29Å; P408-F410 VanDerWaalsContact C-N 3.32Å; P408-F410 PolarHBondContact O-N 3.16Å; F410-L414 HydrophobicContact CE1-CD2 4.21Å; F410-L414 WeakPolarHBondContact O-CB 3.5Å; F410-L414 PolarHBondContact O-N 3.45Å
411I82.2Confident88.1Confident43 Ų4341.6 Ų41.622%0.22123%0.228CC..Hα-helixtrans-73.4-39.8-175.9-60.7175.9000110.7V248 L254 I407 P408 A409 A415V248-I411 HydrophobicContact CG1-CD1 4.09Å; L254-I411 HydrophobicContact CD1-CD1 4.17Å; I407-I411 HydrophobicContact CG2-CB 3.72Å; I407-I411 HydrophobicContact CG2-CD1 4.34Å; I407-I411 HydrophobicContact CG2-CG2 3.85Å; P408-I411 HydrophobicContact CB-CD1 4.41Å; P408-I411 HydrophobicContact CB-CG1 4.49Å; P408-I411 HydrophobicContact CG-CD1 4.26Å; P408-I411 PolarHBondContact O-N 3.07Å; A409-I411 VanDerWaalsContact C-N 3.26Å; A409-I411 PolarHBondContact O-N 3.27Å; A409-I411 VanDerWaalsContact O-N 3.17Å; I411-A415 WeakPolarHBondContact O-CB 3.22Å; I411-A415 PolarHBondContact O-N 2.9Å
412I91.9Very high87.5Confident15 Ų1540.9 Ų40.98%0.07723%0.232CC..Hα-helixtrans-69.9-40.8177.8-61.1-58.6000111.2M398 L401 I402 I407 P408 A409 A415 G416M398-I412 HydrophobicContact CB-CG2 4.05Å; M398-I412 HydrophobicContact CG-CG2 4.32Å; L401-I412 HydrophobicContact CB-CD1 4.2Å; L401-I412 HydrophobicContact CB-CG1 4.46Å; L401-I412 HydrophobicContact CB-CG2 3.96Å; L401-I412 HydrophobicContact CD1-CG2 4.28Å; I402-I412 HydrophobicContact CD1-CB 4.26Å; I402-I412 HydrophobicContact CD1-CG2 4.37Å; I402-I412 HydrophobicContact CG1-CB 3.64Å; I402-I412 HydrophobicContact CG1-CG1 3.69Å; I402-I412 HydrophobicContact CG1-CG2 3.87Å; I407-I412 HydrophobicContact CB-CD1 3.97Å; I407-I412 HydrophobicContact CB-CG1 4.08Å; I407-I412 HydrophobicContact CD1-CD1 4.14Å; I407-I412 HydrophobicContact CG2-CD1 3.78Å; I407-I412 HydrophobicContact CG2-CG1 3.86Å; P408-I412 PolarHBondContact O-N 3.34Å; A409-I412 PolarHBondContact O-N 2.9Å; I412-A415 PolarHBondContact O-N 3.5Å; I412-G416 PolarHBondContact O-N 3.36Å
413T92.1Very high87.4Confident0 Ų041.7 Ų41.70%024%0.238CC..Hα-helixtrans-78.9-25.7-178.558.40000112.2I354 D355 L356 M398 I402 A409 M417 Y507I354-T413 PolarHBondContact O-OG1 2.93Å; D355-T413 HydrophobicContact CB-CG2 4.34Å; D355-T413 WeakPolarHBondContact OD1-CG2 3.24Å; L356-T413 WeakPolarHBondContact CG-OG1 3.41Å; L356-T413 VanDerWaalsContact N-CB 3.31Å; L356-T413 PolarHBondContact N-OG1 2.93Å; M398-T413 HydrophobicContact SD-CG2 4.06Å; I402-T413 HydrophobicContact CD1-CG2 4.29Å; A409-T413 PolarHBondContact O-N 2.79Å; A409-T413 PolarHBondContact O-OG1 3.21Å; T413-M417 WeakPolarHBondContact O-CB 3.35Å; T413-M417 PolarHBondContact O-N 2.95Å; T413-Y507 HydrophobicContact CG2-CD1 4Å; T413-Y507 HydrophobicContact CG2-CE1 3.86Å
414L86.8Confident87.2Confident5 Ų540.5 Ų40.53%0.02623%0.232CC..Hα-helixtrans-65.3-46.1163.8-178.354.8000111.9L241 L356 F410 G416 M417 F418L241-L414 HydrophobicContact CD1-CD1 3.64Å; L241-L414 HydrophobicContact CD1-CD2 4Å; L241-L414 HydrophobicContact CD1-CG 4.41Å; L356-L414 HydrophobicContact CD1-CB 3.74Å; L356-L414 HydrophobicContact CD1-CD1 4.15Å; L356-L414 HydrophobicContact CD1-CG 4.37Å; L356-L414 HydrophobicContact CG-CB 4.17Å; F410-L414 HydrophobicContact CE1-CD2 4.21Å; F410-L414 WeakPolarHBondContact O-CB 3.5Å; F410-L414 PolarHBondContact O-N 3.45Å; L414-G416 VanDerWaalsContact C-N 3.34Å; L414-G416 PolarHBondContact O-N 3.29Å; L414-M417 HydrophobicContact CD1-SD 3.81Å; L414-M417 WeakPolarHBondContact O-CB 3.49Å; L414-M417 PolarHBondContact O-N 2.79Å; L414-F418 HydrophobicContact CD1-CD2 3.76Å; L414-F418 HydrophobicContact CD1-CE2 3.31Å; L414-F418 HydrophobicContact CD1-CZ 3.97Å; L414-F418 HydrophobicContact CD2-CE2 4.27Å; L414-F418 HydrophobicContact CG-CD2 3.94Å; L414-F418 HydrophobicContact CG-CE2 3.64Å; L414-F418 VanDerWaalsContact O-CD2 3.28Å; L414-F418 WeakPolarHBondContact O-CD2 3.34Å; L414-F418 PolarHBondContact O-N 3.38Å
415A87.1Confident86.8Confident58 Ų5838.6 Ų38.648%0.47921%0.212SC..Hα-helixtrans-62.3-41.9174.900000111.7I411 I412 M417 F419I411-A415 WeakPolarHBondContact O-CB 3.22Å; I411-A415 PolarHBondContact O-N 2.9Å; I412-A415 PolarHBondContact O-N 3.5Å; A415-M417 VanDerWaalsContact C-N 3.33Å; A415-F419 VanDerWaalsContact O-CB 3.29Å; A415-F419 WeakPolarHBondContact O-CB 3.31Å; A415-F419 PolarHBondContact O-N 2.87Å
416G90.3Very high86.5Confident7 Ų739.7 Ų39.77%0.07222%0.218CC..Hα-helixtrans-66.1-33.2174.600000113.5I412 L414 L420I412-G416 PolarHBondContact O-N 3.36Å; L414-G416 VanDerWaalsContact C-N 3.34Å; L414-G416 PolarHBondContact O-N 3.29Å; G416-L420 PolarHBondContact O-N 3Å
417M88.5Confident86.5Confident0 Ų035.1 Ų35.10%020%0.2CC..Hα-helixtrans-65.1-50.1173.8169.7-108123.900112.3M287 N288 L356 S360 T413 L414 A415 R421M287-M417 HydrophobicContact CB-CE 3.25Å; M287-M417 HydrophobicContact CB-CG 4.34Å; M287-M417 HydrophobicContact CB-SD 3.68Å; M287-M417 HydrophobicContact CE-CG 3.62Å; M287-M417 HydrophobicContact CE-SD 4.43Å; N288-M417 WeakPolarHBondContact ND2-CG 3.27Å; N288-M417 PolarHBondContact ND2-SD 3.46Å; L356-M417 WeakPolarHBondContact O-CB 3.38Å; L356-M417 WeakPolarHBondContact O-CG 3.49Å; S360-M417 WeakPolarHBondContact CB-O 3.5Å; S360-M417 WeakPolarHBondContact OG-CG 3.34Å; S360-M417 PolarHBondContact OG-O 2.94Å; T413-M417 WeakPolarHBondContact O-CB 3.35Å; T413-M417 PolarHBondContact O-N 2.95Å; L414-M417 HydrophobicContact CD1-SD 3.81Å; L414-M417 WeakPolarHBondContact O-CB 3.49Å; L414-M417 PolarHBondContact O-N 2.79Å; A415-M417 VanDerWaalsContact C-N 3.33Å; M417-R421 HydrophobicContact CE-CB 4.21Å; M417-R421 VanDerWaalsContact O-CB 3.31Å; M417-R421 WeakPolarHBondContact O-CB 3.19Å; M417-R421 PolarHBondContact O-N 3.19Å
418F84.1Confident86.4Confident48 Ų4833.4 Ų33.421%0.21119%0.193CC..Hα-helixtrans-62.4-43.5174.9-75.5-59.7000111.2L245 L414 R421 G422L245-F418 HydrophobicContact CD2-CE2 4.12Å; L414-F418 HydrophobicContact CD1-CD2 3.76Å; L414-F418 HydrophobicContact CD1-CE2 3.31Å; L414-F418 HydrophobicContact CD1-CZ 3.97Å; L414-F418 HydrophobicContact CD2-CE2 4.27Å; L414-F418 HydrophobicContact CG-CD2 3.94Å; L414-F418 HydrophobicContact CG-CE2 3.64Å; L414-F418 VanDerWaalsContact O-CD2 3.28Å; L414-F418 WeakPolarHBondContact O-CD2 3.34Å; L414-F418 PolarHBondContact O-N 3.38Å; F418-R421 PolarHBondContact O-N 2.79Å; F418-G422 PolarHBondContact O-N 2.94Å
419F90.4Very high86.2Confident124 Ų12435.8 Ų35.854%0.54420%0.198SC..Hα-helixtrans-57.2-54176.2177.5-98.1000112.3F394 A415 R421 G422 V423F394-F419 AromaticContact CE2-CD1 3.7Å; F394-F419 HydrophobicContact CE2-CD1 3.7Å; F394-F419 AromaticContact CE2-CE1 3.96Å; F394-F419 HydrophobicContact CE2-CE1 3.96Å; F394-F419 HydrophobicContact CZ-CD1 4.01Å; A415-F419 VanDerWaalsContact O-CB 3.29Å; A415-F419 WeakPolarHBondContact O-CB 3.31Å; A415-F419 PolarHBondContact O-N 2.87Å; F419-R421 VanDerWaalsContact C-N 3.34Å; F419-R421 PolarHBondContact O-N 3.4Å; F419-G422 PolarHBondContact O-N 3.48Å; F419-V423 HydrophobicContact CD1-CG2 4.46Å; F419-V423 HydrophobicContact CE1-CG2 4.11Å; F419-V423 HydrophobicContact CE2-CG2 4.17Å; F419-V423 HydrophobicContact CZ-CG2 3.96Å; F419-V423 WeakPolarHBondContact O-CB 3.39Å; F419-V423 VanDerWaalsContact O-CG2 3.3Å; F419-V423 WeakPolarHBondContact O-CG2 3.06Å; F419-V423 PolarHBondContact O-N 3.46Å
420L90.2Very high86Confident11 Ų1142.5 Ų42.56%0.05823%0.227CC..Hα-helixtrans-68-30.6179.2-75.9-175.8000113.2V361 F364 F394 G416 S424V361-L420 HydrophobicContact CB-CD1 4.36Å; V361-L420 HydrophobicContact CG2-CD1 3.55Å; F364-L420 HydrophobicContact CB-CD2 4.4Å; F364-L420 HydrophobicContact CD1-CD2 4.45Å; F364-L420 HydrophobicContact CD2-CD2 4.21Å; F364-L420 HydrophobicContact CG-CD2 4.07Å; F394-L420 HydrophobicContact CD1-CD1 3.6Å; F394-L420 HydrophobicContact CD1-CG 4.25Å; F394-L420 HydrophobicContact CE1-CD1 3.37Å; F394-L420 HydrophobicContact CE1-CG 3.71Å; F394-L420 HydrophobicContact CE2-CD2 4.31Å; F394-L420 HydrophobicContact CE2-CG 4.18Å; F394-L420 HydrophobicContact CG-CD1 4.3Å; F394-L420 HydrophobicContact CZ-CD1 3.9Å; F394-L420 HydrophobicContact CZ-CD2 4.3Å; F394-L420 HydrophobicContact CZ-CG 3.67Å; G416-L420 PolarHBondContact O-N 3Å; L420-S424 WeakPolarHBondContact O-CB 3.29Å; L420-S424 PolarHBondContact O-N 3.47Å; L420-S424 PolarHBondContact O-OG 3.35Å
421R83.7Confident86.2Confident2 Ų245.1 Ų45.11%0.00825%0.247CC..Hα-helixtrans-65.9-48.1174.8-167.161.160.6168.5-0.5110.6M287 G359 S360 A363 M417 F418 F419 V423 S424 Y425 A530 A532M287-R421 PolarHBondContact SD-NH2 3.42Å; G359-R421 PolarHBondContact O-NH2 3.46Å; G359-R421 VanDerWaalsContact O-NH2 3.1Å; S360-R421 VanDerWaalsContact CA-NH2 3.35Å; S360-R421 PolarHBondContact OG-NE 3.42Å; S360-R421 VanDerWaalsContact OG-NE 3.09Å; S360-R421 PolarHBondContact OG-NH2 3.28Å; A363-R421 VanDerWaalsContact CB-NH1 3.35Å; M417-R421 HydrophobicContact CE-CB 4.21Å; M417-R421 VanDerWaalsContact O-CB 3.31Å; M417-R421 WeakPolarHBondContact O-CB 3.19Å; M417-R421 PolarHBondContact O-N 3.19Å; F418-R421 PolarHBondContact O-N 2.79Å; F419-R421 VanDerWaalsContact C-N 3.34Å; F419-R421 PolarHBondContact O-N 3.4Å; R421-V423 PolarHBondContact O-N 2.82Å; R421-S424 WeakPolarHBondContact O-CB 3.21Å; R421-S424 PolarHBondContact O-N 2.91Å; R421-S424 VanDerWaalsContact O-N 3.12Å; R421-Y425 HydrophobicContact CG-CD2 4.19Å; R421-Y425 HydrophobicContact CG-CE2 3.75Å; R421-Y425 VanDerWaalsContact O-CD2 3.25Å; R421-Y425 WeakPolarHBondContact O-CD2 3.09Å; R421-Y425 PolarHBondContact O-N 3.38Å; R421-Y425 VanDerWaalsContact O-N 3.11Å; R421-A530 WeakPolarHBondContact CD-O 3.49Å; R421-A530 PolarHBondContact NH1-O 2.73Å; R421-A532 PolarHBondContact NH1-O 2.86Å; R421-A532 PolarHBondContact NH2-O 3.19Å
422G82.3Confident86.6Confident32 Ų3244.3 Ų44.333%0.3324%0.243SC..Hα-helixtrans-60.7-43.2174.900000113F418 F419 S424 Y425 L426F418-G422 PolarHBondContact O-N 2.94Å; F419-G422 PolarHBondContact O-N 3.48Å; G422-S424 VanDerWaalsContact C-N 3.29Å; G422-S424 PolarHBondContact O-N 2.81Å; G422-Y425 PolarHBondContact O-N 2.84Å; G422-L426 WeakPolarHBondContact O-CB 3.39Å; G422-L426 PolarHBondContact O-N 3.46Å
423V89.2Confident86.5Confident37 Ų3747.2 Ų47.222%0.22426%0.262CS..Hα-helixtrans-63.9-32.8173.9172.20000112.1F364 F419 R421 I427F364-V423 HydrophobicContact CD2-CG1 3.9Å; F364-V423 HydrophobicContact CE2-CG1 3.7Å; F419-V423 HydrophobicContact CD1-CG2 4.46Å; F419-V423 HydrophobicContact CE1-CG2 4.11Å; F419-V423 HydrophobicContact CE2-CG2 4.17Å; F419-V423 HydrophobicContact CZ-CG2 3.96Å; F419-V423 WeakPolarHBondContact O-CB 3.39Å; F419-V423 VanDerWaalsContact O-CG2 3.3Å; F419-V423 WeakPolarHBondContact O-CG2 3.06Å; F419-V423 PolarHBondContact O-N 3.46Å; R421-V423 PolarHBondContact O-N 2.82Å; V423-I427 HydrophobicContact CG1-CD1 4.18Å; V423-I427 WeakPolarHBondContact O-CD1 3.29Å; V423-I427 WeakPolarHBondContact O-CG1 3.19Å; V423-I427 PolarHBondContact O-N 3.24Å
424S86.7Confident86.5Confident0 Ų047.3 Ų47.30%026%0.263CS..Hα-helixtrans-65.1-49.3175.7-56.70000111.2F364 L420 R421 G422 L426 I427 S428F364-S424 WeakPolarHBondContact CA-OG 3.43Å; F364-S424 WeakPolarHBondContact CB-OG 3.48Å; F364-S424 PolarHBondContact N-OG 2.88Å; F364-S424 VanDerWaalsContact N-OG 3.13Å; L420-S424 WeakPolarHBondContact O-CB 3.29Å; L420-S424 PolarHBondContact O-N 3.47Å; L420-S424 PolarHBondContact O-OG 3.35Å; R421-S424 WeakPolarHBondContact O-CB 3.21Å; R421-S424 PolarHBondContact O-N 2.91Å; R421-S424 VanDerWaalsContact O-N 3.12Å; G422-S424 VanDerWaalsContact C-N 3.29Å; G422-S424 PolarHBondContact O-N 2.81Å; S424-L426 VanDerWaalsContact C-N 3.34Å; S424-L426 PolarHBondContact O-N 3.46Å; S424-I427 PolarHBondContact O-N 3.5Å; S424-I427 VanDerWaalsContact O-N 3.14Å; S424-S428 PolarHBondContact O-N 3.13Å
425Y82.3Confident86.5Confident19 Ų1953.7 Ų53.78%0.07530%0.297CS..Hα-helixtrans-61.4-40.3175.9-72.6-64.9000112.6P284 R421 G422 I427 S428 E429 A530 L531P284-Y425 HydrophobicContact CG-CE1 4.07Å; P284-Y425 HydrophobicContact CG-CE2 4.4Å; P284-Y425 WeakPolarHBondContact O-CE2 3.2Å; P284-Y425 PolarHBondContact O-OH 3.5Å; R421-Y425 HydrophobicContact CG-CD2 4.19Å; R421-Y425 HydrophobicContact CG-CE2 3.75Å; R421-Y425 VanDerWaalsContact O-CD2 3.25Å; R421-Y425 WeakPolarHBondContact O-CD2 3.09Å; R421-Y425 PolarHBondContact O-N 3.38Å; R421-Y425 VanDerWaalsContact O-N 3.11Å; G422-Y425 PolarHBondContact O-N 2.84Å; Y425-I427 PolarHBondContact O-N 2.88Å; Y425-S428 CarbonylContact O-C 3.59Å; Y425-S428 VanDerWaalsContact O-C 3.25Å; Y425-S428 PolarHBondContact O-N 3Å; Y425-S428 VanDerWaalsContact O-N 3.15Å; Y425-E429 HydrophobicContact CD1-CG 4.35Å; Y425-A530 HydrophobicContact CD1-CB 3.38Å; Y425-A530 HydrophobicContact CE1-CB 3.6Å; Y425-A530 HydrophobicContact CG-CB 3.89Å; Y425-L531 VanDerWaalsContact OH-CD2 3.24Å; Y425-L531 WeakPolarHBondContact OH-CD2 3.42Å
426L84.9Confident86.6Confident123 Ų12353.3 Ų53.364%0.64429%0.285SS*.Hα-helixtrans-61-23176.1-177.363.1000113.5F283 G422 S424F283-L426 HydrophobicContact CE2-CD1 4.27Å; F283-L426 HydrophobicContact CZ-CB 4.19Å; F283-L426 HydrophobicContact CZ-CD1 3.77Å; G422-L426 WeakPolarHBondContact O-CB 3.39Å; G422-L426 PolarHBondContact O-N 3.46Å; S424-L426 VanDerWaalsContact C-N 3.34Å; S424-L426 PolarHBondContact O-N 3.46Å
427I85.9Confident86.6Confident50 Ų5057.3 Ų57.326%0.25631%0.31SS..Hα-helixtrans-88.7-40.7173.3-60.5162.1000110.9F364 V367 K371 V423 S424 Y425F364-I427 HydrophobicContact CD2-CD1 4.23Å; F364-I427 HydrophobicContact CE2-CD1 3.79Å; V367-I427 HydrophobicContact CG1-CB 3.77Å; V367-I427 HydrophobicContact CG1-CG2 3.6Å; K371-I427 HydrophobicContact CB-CG2 4.03Å; K371-I427 HydrophobicContact CD-CG2 4.31Å; K371-I427 HydrophobicContact CG-CG2 3.9Å; V423-I427 HydrophobicContact CG1-CD1 4.18Å; V423-I427 WeakPolarHBondContact O-CD1 3.29Å; V423-I427 WeakPolarHBondContact O-CG1 3.19Å; V423-I427 PolarHBondContact O-N 3.24Å; S424-I427 PolarHBondContact O-N 3.5Å; S424-I427 VanDerWaalsContact O-N 3.14Å; Y425-I427 PolarHBondContact O-N 2.88Å
428S83.2Confident86.7Confident21 Ų2159.3 Ų59.315%0.14732%0.322CS..  trans-164.3133.4169.8-158.40000112.9S424 Y425 E430 A530S424-S428 PolarHBondContact O-N 3.13Å; Y425-S428 CarbonylContact O-C 3.59Å; Y425-S428 VanDerWaalsContact O-C 3.25Å; Y425-S428 PolarHBondContact O-N 3Å; Y425-S428 VanDerWaalsContact O-N 3.15Å; S428-E430 PolarHBondContact OG-N 3.38Å; S428-E430 PolarHBondContact OG-O 3.48Å; S428-A530 WeakPolarHBondContact O-CB 3.31Å
429E77.8Confident87Confident123 Ų12357 Ų5758%0.57531%0.312SS*.SBendtrans-79.7-32.7166.7-67.6164.2-136.600112.2Y425Y425-E429 HydrophobicContact CD1-CG 4.35Å
430E82.8Confident86.9Confident158 Ų15854.8 Ų54.874%0.73831%0.306SS*.SBendtrans-84173.5-177.7-63.9-168.516300113S428S428-E430 PolarHBondContact OG-N 3.38Å; S428-E430 PolarHBondContact OG-O 3.48Å
431S88Confident86.8Confident71 Ų7158.4 Ų58.450%0.49733%0.329SS..  trans-92.6111.8174.9-1720000110.9P433S431-P433 WeakPolarHBondContact O-CD 3.31Å
432I89.6Confident87.1Confident26 Ų2660.9 Ų60.913%0.13334%0.342CS..EExtended strand (participates in β ladder)trans-90.4118.3179.3-55.4175.9000109.4A370 K371 A527 G528A370-I432 HydrophobicContact CB-CB 3.67Å; A370-I432 HydrophobicContact CB-CG2 3.69Å; K371-I432 HydrophobicContact CD-CD1 4.02Å; I432-A527 CarbonylContact O-C 3.6Å; I432-A527 WeakPolarHBondContact O-CA 3.35Å; I432-G528 PolarHBondContact N-O 2.86Å; I432-G528 PolarHBondContact O-N 3.38Å
433P91.5Very high87.2Confident76 Ų7661.6 Ų61.649%0.49434%0.342SS..EExtended strand (participates in β ladder)trans-74.7144.1175.830.7-34.4000112.2S431S431-P433 WeakPolarHBondContact O-CD 3.31Å
434I90.5Very high87Confident2 Ų263.1 Ų63.11%0.0135%0.354CS..  trans-109.879.1-176.5-43.9-175000110.4L369 A370 I373 H436 Y439 Q526L369-I434 HydrophobicContact CB-CD1 4.45Å; A370-I434 HydrophobicContact CB-CD1 3.75Å; A370-I434 HydrophobicContact CB-CG1 3.65Å; I373-I434 HydrophobicContact CB-CG2 4.22Å; I373-I434 HydrophobicContact CD1-CG2 3.92Å; I373-I434 HydrophobicContact CG2-CG2 4.01Å; I434-H436 PolarHBondContact O-N 2.92Å; I434-Y439 HydrophobicContact CB-CD1 4.13Å; I434-Y439 HydrophobicContact CB-CE1 3.96Å; I434-Y439 HydrophobicContact CD1-CE1 3.8Å; I434-Y439 HydrophobicContact CG1-CE1 4.44Å; I434-Y439 HydrophobicContact CG2-CD1 4.02Å; I434-Y439 HydrophobicContact CG2-CD2 4.15Å; I434-Y439 HydrophobicContact CG2-CE1 3.78Å; I434-Y439 HydrophobicContact CG2-CE2 3.91Å; I434-Y439 HydrophobicContact CG2-CG 4.23Å; I434-Q526 PolarHBondContact N-O 3.09Å
435N87.3Confident87.1Confident139 Ų13968 Ų6874%0.74338%0.38SS*.  trans-8493.7-180-64.2-41.6000111
436H90.6Very high87.2Confident50 Ų5068.2 Ų68.223%0.23139%0.385CS..  trans-149.3133.3178.6-172.3-85.8000112.2I373 P380 I434 V438 Y439 D440I373-H436 HydrophobicContact CG2-CB 4.05Å; P380-H436 WeakPolarHBondContact CD-CE1 3.29Å; I434-H436 PolarHBondContact O-N 2.92Å; H436-V438 WeakPolarHBondContact ND1-CB 3.29Å; H436-V438 PolarHBondContact ND1-N 2.91Å; H436-V438 PolarHBondContact O-N 2.69Å; H436-Y439 WeakPolarHBondContact O-CA 3.37Å; H436-Y439 WeakPolarHBondContact O-CB 3.48Å; H436-Y439 PolarHBondContact O-N 3.43Å; H436-D440 PolarHBondContact O-N 2.84Å
437P90.3Very high87.1Confident91 Ų9170.4 Ų70.459%0.59139%0.385SS*.Hα-helixtrans-56.3-26.3-172.5-2935.6000116.2D440 T441P437-D440 PolarHBondContact O-N 3.28Å; P437-T441 WeakPolarHBondContact O-CB 3.43Å; P437-T441 PolarHBondContact O-N 3.12Å; P437-T441 PolarHBondContact O-OG1 2.89Å
438V90.7Very high87Confident43 Ų4375.4 Ų75.426%0.26141%0.405SS..Hα-helixtrans-68.5-33.8173.7174.50000112P380 H436 T441 L442P380-V438 HydrophobicContact CB-CG1 4.22Å; P380-V438 HydrophobicContact CG-CB 4.26Å; P380-V438 HydrophobicContact CG-CG1 4.44Å; H436-V438 WeakPolarHBondContact ND1-CB 3.29Å; H436-V438 PolarHBondContact ND1-N 2.91Å; H436-V438 PolarHBondContact O-N 2.69Å; V438-T441 PolarHBondContact O-N 3.48Å; V438-L442 HydrophobicContact CG1-CD1 3.8Å; V438-L442 HydrophobicContact CG1-CG 4.3Å; V438-L442 WeakPolarHBondContact O-CB 3.48Å; V438-L442 VanDerWaalsContact O-CG 3.22Å; V438-L442 WeakPolarHBondContact O-CG 3.27Å; V438-L442 PolarHBondContact O-N 2.93Å
439Y90.5Very high87Confident0 Ų077.1 Ų77.10%041%0.412CS..Hα-helixtrans-65.6-46.1173.2-89.9-122.2000110.5I373 P380 F384 I434 H436 T441 L442 S443 S522 I523I373-Y439 HydrophobicContact CD1-CE2 3.66Å; P380-Y439 HydrophobicContact CB-CE2 4.15Å; P380-Y439 HydrophobicContact CG-CD2 4.08Å; P380-Y439 HydrophobicContact CG-CE2 3.98Å; F384-Y439 AromaticContact CE1-CE2 3.84Å; F384-Y439 HydrophobicContact CE1-CE2 3.84Å; F384-Y439 AromaticContact CE1-CZ 3.99Å; F384-Y439 WeakPolarHBondContact CE1-OH 3.23Å; F384-Y439 HydrophobicContact CZ-CD2 4.41Å; F384-Y439 AromaticContact CZ-CE2 3.6Å; F384-Y439 HydrophobicContact CZ-CE2 3.6Å; I434-Y439 HydrophobicContact CB-CD1 4.13Å; I434-Y439 HydrophobicContact CB-CE1 3.96Å; I434-Y439 HydrophobicContact CD1-CE1 3.8Å; I434-Y439 HydrophobicContact CG1-CE1 4.44Å; I434-Y439 HydrophobicContact CG2-CD1 4.02Å; I434-Y439 HydrophobicContact CG2-CD2 4.15Å; I434-Y439 HydrophobicContact CG2-CE1 3.78Å; I434-Y439 HydrophobicContact CG2-CE2 3.91Å; I434-Y439 HydrophobicContact CG2-CG 4.23Å; H436-Y439 WeakPolarHBondContact O-CA 3.37Å; H436-Y439 WeakPolarHBondContact O-CB 3.48Å; H436-Y439 PolarHBondContact O-N 3.43Å; Y439-T441 VanDerWaalsContact C-N 3.29Å; Y439-T441 PolarHBondContact O-N 2.84Å; Y439-L442 PolarHBondContact O-N 3.37Å; Y439-S443 WeakPolarHBondContact O-CB 3.48Å; Y439-S443 PolarHBondContact O-N 3.36Å; Y439-S443 PolarHBondContact O-OG 2.88Å; Y439-S522 WeakPolarHBondContact CE1-O 3.36Å; Y439-S522 PolarHBondContact OH-OG 2.68Å; Y439-I523 HydrophobicContact CD1-CB 4.24Å; Y439-I523 HydrophobicContact CD1-CG1 3.91Å; Y439-I523 HydrophobicContact CE1-CB 4.28Å; Y439-I523 HydrophobicContact CE1-CG1 3.67Å; Y439-I523 HydrophobicContact CE2-CG1 4.39Å; Y439-I523 HydrophobicContact CG-CG1 4.34Å
440D86.8Confident86.7Confident76 Ų7676.8 Ų76.841%0.40642%0.42SS..Hα-helixtrans-62.8-36.6176.5-52.6-53.1000112.2H436 P437 S443 S444 Q526H436-D440 PolarHBondContact O-N 2.84Å; P437-D440 PolarHBondContact O-N 3.28Å; D440-S443 PolarHBondContact O-OG 2.98Å; D440-S444 VanDerWaalsContact O-CB 3.23Å; D440-S444 WeakPolarHBondContact O-CB 3.49Å; D440-S444 PolarHBondContact O-N 2.87Å; D440-S444 VanDerWaalsContact O-N 3.09Å; D440-S444 PolarHBondContact O-OG 3.5Å; D440-Q526 PolarHBondContact OD1-NE2 3.5Å
441T89.5Confident86.2Confident88 Ų8872.3 Ų72.354%0.5442%0.416SS..Hα-helixtrans-65.8-43.3174.6-570000111.2P437 V438 Y439 S444 L445P437-T441 WeakPolarHBondContact O-CB 3.43Å; P437-T441 PolarHBondContact O-N 3.12Å; P437-T441 PolarHBondContact O-OG1 2.89Å; V438-T441 PolarHBondContact O-N 3.48Å; Y439-T441 VanDerWaalsContact C-N 3.29Å; Y439-T441 PolarHBondContact O-N 2.84Å; T441-S444 PolarHBondContact O-OG 2.98Å; T441-L445 VanDerWaalsContact O-CB 3.27Å; T441-L445 WeakPolarHBondContact O-CB 3.43Å; T441-L445 PolarHBondContact O-N 3.33Å
442L88.9Confident85.6Confident53 Ų5370.7 Ų70.728%0.27741%0.411SS..Hα-helixtrans-75.9-33-178.6-70.7171.1000113.3F384 V438 Y439 I523F384-L442 HydrophobicContact CE2-CD1 3.93Å; F384-L442 HydrophobicContact CZ-CD1 4.44Å; V438-L442 HydrophobicContact CG1-CD1 3.8Å; V438-L442 HydrophobicContact CG1-CG 4.3Å; V438-L442 WeakPolarHBondContact O-CB 3.48Å; V438-L442 VanDerWaalsContact O-CG 3.22Å; V438-L442 WeakPolarHBondContact O-CG 3.27Å; V438-L442 PolarHBondContact O-N 2.93Å; Y439-L442 PolarHBondContact O-N 3.37Å; L442-I523 HydrophobicContact CB-CD1 4.44Å; L442-I523 HydrophobicContact CB-CG2 3.86Å; L442-I523 HydrophobicContact CD1-CD1 3.94Å
443S84.3Confident85Confident48 Ų4869.5 Ų69.534%0.33641%0.405SS..Hα-helixtrans-74.4-36.8176.468.30000112.2Y439 D440Y439-S443 WeakPolarHBondContact O-CB 3.48Å; Y439-S443 PolarHBondContact O-N 3.36Å; Y439-S443 PolarHBondContact O-OG 2.88Å; D440-S443 PolarHBondContact O-OG 2.98Å
444S85.2Confident84.5Confident69 Ų6972 Ų7248%0.48341%0.405SS..Hα-helixtrans-77.4-25178.163.80000114D440 T441 A446 R454D440-S444 VanDerWaalsContact O-CB 3.23Å; D440-S444 WeakPolarHBondContact O-CB 3.49Å; D440-S444 PolarHBondContact O-N 2.87Å; D440-S444 VanDerWaalsContact O-N 3.09Å; D440-S444 PolarHBondContact O-OG 3.5Å; T441-S444 PolarHBondContact O-OG 2.98Å; S444-A446 PolarHBondContact O-N 3.28Å; S444-A446 VanDerWaalsContact O-N 3.15Å; S444-R454 PolarHBondContact O-NH2 2.92Å; S444-R454 VanDerWaalsContact O-NH2 3.09Å
445L88Confident84.2Confident102 Ų10272.6 Ų72.653%0.53441%0.408SS..  trans-63.4109.7179.4-17763.5000111.5T441 A457T441-L445 VanDerWaalsContact O-CB 3.27Å; T441-L445 WeakPolarHBondContact O-CB 3.43Å; T441-L445 PolarHBondContact O-N 3.33Å; L445-A457 HydrophobicContact CB-CB 4.15Å; L445-A457 HydrophobicContact CD2-CB 3.95Å; L445-A457 HydrophobicContact CG-CB 4.02Å; L445-A457 WeakPolarHBondContact O-CB 3.32Å; L445-A457 PolarHBondContact O-N 3.45Å
446A84.1Confident84.2Confident23 Ų2366.5 Ų66.519%0.1938%0.376CS..EExtended strand (participates in β ladder)trans-147.2137.5177.400000111.3S444 K448 R454 L455S444-A446 PolarHBondContact O-N 3.28Å; S444-A446 VanDerWaalsContact O-N 3.15Å; A446-K448 PolarHBondContact O-N 3.01Å; A446-R454 HydrophobicContact CB-CB 4.06Å; A446-L455 CarbonylContact C-O 3.25Å; A446-L455 VanDerWaalsContact CA-O 3.28Å; A446-L455 WeakPolarHBondContact CA-O 3.45Å
447W84.1Confident84Confident169 Ų16965.3 Ų65.364%0.6438%0.375SS*.EExtended strand (participates in β ladder)trans-71111169.4-167.7-10.7000108.6R454 L455 L460W447-R454 WeakPolarHBondContact O-CA 3.03Å; W447-L455 PolarHBondContact N-O 3.46Å; W447-L455 PolarHBondContact O-N 3.37Å; W447-L460 HydrophobicContact CB-CD1 4.27Å; W447-L460 HydrophobicContact CE3-CD1 4.42Å; W447-L460 HydrophobicContact CE3-CD2 4.12Å
448K84.2Confident83.9Confident155 Ų15561.8 Ų61.867%0.67435%0.351SS*.EExtended strand (participates in β ladder)trans-75.1123174.2-62.3177.5-176.6175.10109.1A446 R454A446-K448 PolarHBondContact O-N 3.01Å; K448-R454 HydrophobicContact CG-CG 4.43Å
449I81.5Confident83.8Confident58 Ų5859.7 Ų59.730%0.29734%0.338SS..EExtended strand (participates in β ladder)trans-107.2143.1-179.6-58.1-170.5000108.8T325 G452 G453 L455T325-I449 HydrophobicContact CG2-CG2 4.37Å; I449-G452 PolarHBondContact O-N 3.35Å; I449-G452 VanDerWaalsContact O-N 3.14Å; I449-G453 PolarHBondContact N-O 3.24Å; I449-G453 PolarHBondContact O-N 2.85Å; I449-L455 HydrophobicContact CD1-CB 4.39Å
450P73.4Confident83.8Confident115 Ų11562.7 Ų62.775%0.74735%0.354SS*.THydrogen-bonded Turntrans-47.7144.7171.2-29.836.8000112.9T325 G452T325-P450 WeakPolarHBondContact CB-O 3.42Å; T325-P450 WeakPolarHBondContact CG2-O 3.35Å; T325-P450 PolarHBondContact OG1-O 2.94Å; P450-G452 VanDerWaalsContact C-N 3.33Å
451G72.3Confident84.1Confident64 Ų6462.1 Ų62.166%0.6635%0.35SS*.THydrogen-bonded Turntrans84.60.3-169.100000114.7
452G75.4Confident84.3Confident37 Ų3758 Ų5838%0.38133%0.325SS..THydrogen-bonded Turntrans82.525.117200000114.4R326 I449 P450R326-G452 PolarHBondContact NE-O 3.4Å; R326-G452 PolarHBondContact NH2-O 2.8Å; I449-G452 PolarHBondContact O-N 3.35Å; I449-G452 VanDerWaalsContact O-N 3.14Å; P450-G452 VanDerWaalsContact C-N 3.33Å
453G76.6Confident84.5Confident1 Ų157.9 Ų57.91%0.0132%0.324CS..EExtended strand (participates in β ladder)trans-80.7152.1164.800000112.3T325 I449T325-G453 PolarHBondContact OG1-N 3.1Å; I449-G453 PolarHBondContact N-O 3.24Å; I449-G453 PolarHBondContact O-N 2.85Å
454R81.2Confident85Confident129 Ų12957.7 Ų57.749%0.48733%0.326SS..EExtended strand (participates in β ladder)trans-134102.8177.6-69.8-178.268.2168.8-1.2108.4C329 S444 A446 W447 K448 S456C329-R454 WeakPolarHBondContact CB-O 3.47Å; S444-R454 PolarHBondContact O-NH2 2.92Å; S444-R454 VanDerWaalsContact O-NH2 3.09Å; A446-R454 HydrophobicContact CB-CB 4.06Å; W447-R454 WeakPolarHBondContact O-CA 3.03Å; K448-R454 HydrophobicContact CG-CG 4.43Å; R454-S456 PolarHBondContact O-N 3.37Å
455L83.8Confident85.6Confident14 Ų1454.9 Ų54.97%0.07331%0.306CS..EExtended strand (participates in β ladder)trans-83.1110.9171.7-175.163.6000108C329 L332 A446 W447 I449 L460 L463C329-L455 HydrophobicContact CB-CB 4.49Å; L332-L455 HydrophobicContact CB-CD1 3.85Å; L332-L455 HydrophobicContact CD1-CD1 4.35Å; A446-L455 CarbonylContact C-O 3.25Å; A446-L455 VanDerWaalsContact CA-O 3.28Å; A446-L455 WeakPolarHBondContact CA-O 3.45Å; W447-L455 PolarHBondContact N-O 3.46Å; W447-L455 PolarHBondContact O-N 3.37Å; I449-L455 HydrophobicContact CD1-CB 4.39Å; L455-L460 HydrophobicContact CD2-CD2 3.64Å; L455-L460 HydrophobicContact CD2-CG 3.96Å; L455-L460 HydrophobicContact CG-CD2 4.35Å; L455-L460 HydrophobicContact CG-CG 4.11Å; L455-L463 HydrophobicContact CD2-CD1 4.11Å
456S86.6Confident85.9Confident12 Ų1250.2 Ų50.28%0.08428%0.281CS..EExtended strand (participates in β ladder)trans-61.4159.2-178.759.80000112.9T333 R454 M458 G459 L460T333-S456 WeakPolarHBondContact CB-OG 3.44Å; T333-S456 WeakPolarHBondContact CG2-OG 3.38Å; T333-S456 PolarHBondContact OG1-N 2.86Å; T333-S456 PolarHBondContact OG1-OG 3.19Å; R454-S456 PolarHBondContact O-N 3.37Å; S456-M458 PolarHBondContact O-N 3.49Å; S456-G459 PolarHBondContact O-N 3.2Å; S456-G459 PolarHBondContact OG-N 3.32Å; S456-L460 PolarHBondContact O-N 3.03Å
457A87.1Confident86.4Confident25 Ų2553.7 Ų53.721%0.20730%0.3CS..Hα-helixtrans-55.8-31.8166.900000112L445 L460 L461L445-A457 HydrophobicContact CB-CB 4.15Å; L445-A457 HydrophobicContact CD2-CB 3.95Å; L445-A457 HydrophobicContact CG-CB 4.02Å; L445-A457 WeakPolarHBondContact O-CB 3.32Å; L445-A457 PolarHBondContact O-N 3.45Å; A457-L460 PolarHBondContact O-N 2.69Å; A457-L461 VanDerWaalsContact O-CB 3.29Å; A457-L461 WeakPolarHBondContact O-CB 3.45Å; A457-L461 PolarHBondContact O-N 3.21Å
458M88Confident86.9Confident16 Ų1650.5 Ų50.58%0.07930%0.295CS..Hα-helixtrans-64.9-48.9175.6-55.4167.5-178.400111.7A336 S456 L460 L461 M462 V520 I523 Y524A336-M458 HydrophobicContact CB-CB 3.9Å; S456-M458 PolarHBondContact O-N 3.49Å; M458-L460 PolarHBondContact O-N 2.83Å; M458-L461 PolarHBondContact O-N 2.98Å; M458-M462 PolarHBondContact O-N 2.9Å; M458-V520 HydrophobicContact CB-CG1 3.87Å; M458-V520 HydrophobicContact CG-CG1 3.92Å; M458-V520 HydrophobicContact SD-CG1 4.31Å; M458-I523 HydrophobicContact CE-CB 3.92Å; M458-I523 HydrophobicContact CE-CG2 3.57Å; M458-Y524 HydrophobicContact SD-CD2 4.1Å
459G88Confident87.4Confident0 Ų043.2 Ų43.20%026%0.264CS..Hα-helixtrans-64.7-37.2175.800000112.7L332 S456 M462 L463L332-G459 WeakPolarHBondContact O-CA 3.44Å; S456-G459 PolarHBondContact O-N 3.2Å; S456-G459 PolarHBondContact OG-N 3.32Å; G459-M462 PolarHBondContact O-N 3.44Å; G459-L463 WeakPolarHBondContact O-CG 3.38Å; G459-L463 PolarHBondContact O-N 2.93Å
460L90.9Very high87.9Confident62 Ų6243 Ų4333%0.32526%0.262SS..Hα-helixtrans-64.6-41.6171.8-75.1168.9000112.4W447 L455 S456 A457 M458 L463 A464W447-L460 HydrophobicContact CB-CD1 4.27Å; W447-L460 HydrophobicContact CE3-CD1 4.42Å; W447-L460 HydrophobicContact CE3-CD2 4.12Å; L455-L460 HydrophobicContact CD2-CD2 3.64Å; L455-L460 HydrophobicContact CD2-CG 3.96Å; L455-L460 HydrophobicContact CG-CD2 4.35Å; L455-L460 HydrophobicContact CG-CG 4.11Å; S456-L460 PolarHBondContact O-N 3.03Å; A457-L460 PolarHBondContact O-N 2.69Å; M458-L460 PolarHBondContact O-N 2.83Å; L460-L463 PolarHBondContact O-N 3.14Å; L460-A464 WeakPolarHBondContact O-CB 3.31Å; L460-A464 PolarHBondContact O-N 3.46Å
461L93Very high88.8Confident64 Ų6443.2 Ų43.234%0.33525%0.252SS..Hα-helixtrans-64.4-42.4175.4178.260.1000111.5I340 A457 M458 A464 V465 L516 V520I340-L461 HydrophobicContact CD1-CD2 4.47Å; I340-L461 HydrophobicContact CD1-CG 4.27Å; A457-L461 VanDerWaalsContact O-CB 3.29Å; A457-L461 WeakPolarHBondContact O-CB 3.45Å; A457-L461 PolarHBondContact O-N 3.21Å; M458-L461 PolarHBondContact O-N 2.98Å; L461-A464 PolarHBondContact O-N 3.34Å; L461-V465 HydrophobicContact CD1-CG2 4.41Å; L461-V465 WeakPolarHBondContact O-CB 3.23Å; L461-V465 WeakPolarHBondContact O-CG2 3.25Å; L461-V465 PolarHBondContact O-N 3.01Å; L461-L516 HydrophobicContact CD1-CD2 4.39Å; L461-L516 HydrophobicContact CD2-CD1 4.14Å; L461-L516 HydrophobicContact CD2-CG 4.37Å; L461-V520 HydrophobicContact CD2-CG2 3.65Å
462M93.6Very high89.8Confident1 Ų142.3 Ų42.31%0.00523%0.232CC..Hα-helixtrans-57.6-48.3171.9178.4-153.758.700111.3L332 A336 I340 M458 G459 A464 V465 V466 L562L332-M462 HydrophobicContact CB-CE 4.13Å; L332-M462 HydrophobicContact CD2-CE 3.94Å; L332-M462 WeakPolarHBondContact O-CE 3.45Å; A336-M462 HydrophobicContact CB-CB 4.12Å; I340-M462 HydrophobicContact CD1-CB 4.39Å; I340-M462 HydrophobicContact CG1-CB 4.02Å; I340-M462 HydrophobicContact CG1-CG 4.3Å; M458-M462 PolarHBondContact O-N 2.9Å; G459-M462 PolarHBondContact O-N 3.44Å; M462-A464 VanDerWaalsContact C-N 3.33Å; M462-A464 PolarHBondContact O-N 3.12Å; M462-V465 PolarHBondContact O-N 3.46Å; M462-V466 WeakPolarHBondContact O-CG2 3.32Å; M462-V466 PolarHBondContact O-N 2.92Å; M462-L562 HydrophobicContact CE-CD1 4.2Å; M462-L562 HydrophobicContact SD-CD1 4.44Å
463L93.6Very high90.5Very high51 Ų5140.6 Ų40.627%0.26721%0.214SC..Hα-helixtrans-62-39.3177.3-70.6173.8000112.1L455 G459 L460 V466 V467 L562L455-L463 HydrophobicContact CD2-CD1 4.11Å; G459-L463 WeakPolarHBondContact O-CG 3.38Å; G459-L463 PolarHBondContact O-N 2.93Å; L460-L463 PolarHBondContact O-N 3.14Å; L463-V466 PolarHBondContact O-N 2.94Å; L463-V467 WeakPolarHBondContact O-CG2 3.43Å; L463-V467 PolarHBondContact O-N 3.23Å; L463-L562 HydrophobicContact CD2-CD2 4.22Å
464A95.1Very high90.9Very high44 Ų4444.6 Ų44.636%0.36423%0.232SC..Hα-helixtrans-63.2-44.3174.200000111.9L460 L461 M462 V466 V467 I468L460-A464 WeakPolarHBondContact O-CB 3.31Å; L460-A464 PolarHBondContact O-N 3.46Å; L461-A464 PolarHBondContact O-N 3.34Å; M462-A464 VanDerWaalsContact C-N 3.33Å; M462-A464 PolarHBondContact O-N 3.12Å; A464-V466 VanDerWaalsContact C-N 3.34Å; A464-V466 PolarHBondContact O-N 3.45Å; A464-V467 PolarHBondContact O-N 2.95Å; A464-I468 WeakPolarHBondContact O-CB 3.39Å; A464-I468 WeakPolarHBondContact O-CD1 3.5Å; A464-I468 VanDerWaalsContact O-CG1 3.26Å; A464-I468 WeakPolarHBondContact O-CG1 3.27Å; A464-I468 PolarHBondContact O-N 3.41Å
465V96.3Very high91.3Very high10 Ų1048 Ų486%0.06125%0.245CC..Hα-helixtrans-60.8-41174.2167.90000111.4I340 V343 L461 M462 I468 G469 L513 L516I340-V465 HydrophobicContact CG1-CB 4.32Å; I340-V465 HydrophobicContact CG1-CG1 4.39Å; I340-V465 HydrophobicContact CG1-CG2 4.28Å; I340-V465 HydrophobicContact CG2-CG1 4.31Å; V343-V465 HydrophobicContact CB-CG1 3.94Å; V343-V465 HydrophobicContact CG1-CG1 3.89Å; V343-V465 HydrophobicContact CG2-CG1 4.13Å; L461-V465 HydrophobicContact CD1-CG2 4.41Å; L461-V465 WeakPolarHBondContact O-CB 3.23Å; L461-V465 WeakPolarHBondContact O-CG2 3.25Å; L461-V465 PolarHBondContact O-N 3.01Å; M462-V465 PolarHBondContact O-N 3.46Å; V465-I468 PolarHBondContact O-N 3.21Å; V465-G469 PolarHBondContact O-N 3.04Å; V465-L513 HydrophobicContact CG1-CD1 4.26Å; V465-L513 HydrophobicContact CG1-CD2 3.72Å; V465-L513 HydrophobicContact CG2-CD2 4.23Å; V465-L516 HydrophobicContact CG2-CD2 3.68Å
466V94.3Very high91.7Very high4 Ų448.9 Ų48.92%0.02425%0.251CS..Hα-helixtrans-62.6-45.7174.3169.30000111.4V343 M462 L463 A464 G469 I470 V558 L562V343-V466 HydrophobicContact CG2-CB 4.36Å; V343-V466 HydrophobicContact CG2-CG2 3.55Å; M462-V466 WeakPolarHBondContact O-CG2 3.32Å; M462-V466 PolarHBondContact O-N 2.92Å; L463-V466 PolarHBondContact O-N 2.94Å; A464-V466 VanDerWaalsContact C-N 3.34Å; A464-V466 PolarHBondContact O-N 3.45Å; V466-G469 PolarHBondContact O-N 3.24Å; V466-I470 HydrophobicContact CG1-CD1 3.74Å; V466-I470 HydrophobicContact CG1-CG1 4.36Å; V466-I470 VanDerWaalsContact O-CG1 3.27Å; V466-I470 WeakPolarHBondContact O-CG1 3.49Å; V466-I470 PolarHBondContact O-N 3.27Å; V466-V558 HydrophobicContact CG1-CG1 4.37Å; V466-L562 HydrophobicContact CG1-CB 4.23Å; V466-L562 HydrophobicContact CG1-CD2 4.07Å; V466-L562 HydrophobicContact CG2-CB 4.36Å; V466-L562 HydrophobicContact CG2-CD1 4.39Å
467V95.1Very high91.9Very high97 Ų9758.5 Ų58.559%0.58829%0.285SS*.Hα-helixtrans-62.9-44177.7170.30000111.3L463 A464 I470 F471L463-V467 WeakPolarHBondContact O-CG2 3.43Å; L463-V467 PolarHBondContact O-N 3.23Å; A464-V467 PolarHBondContact O-N 2.95Å; V467-I470 PolarHBondContact O-N 2.84Å; V467-F471 PolarHBondContact O-N 3.1Å
468I95.8Very high92.2Very high102 Ų10258.7 Ų58.752%0.52328%0.282SS..Hα-helixtrans-61.8-44174.7-68.4164.3000110.4A464 V465 F471 L472A464-I468 WeakPolarHBondContact O-CB 3.39Å; A464-I468 WeakPolarHBondContact O-CD1 3.5Å; A464-I468 VanDerWaalsContact O-CG1 3.26Å; A464-I468 WeakPolarHBondContact O-CG1 3.27Å; A464-I468 PolarHBondContact O-N 3.41Å; V465-I468 PolarHBondContact O-N 3.21Å; I468-F471 PolarHBondContact O-N 2.93Å; I468-L472 HydrophobicContact CG2-CD1 3.9Å; I468-L472 HydrophobicContact CG2-CG 4.26Å; I468-L472 WeakPolarHBondContact O-CB 3.21Å; I468-L472 VanDerWaalsContact O-CG 3.32Å; I468-L472 WeakPolarHBondContact O-CG 3.45Å; I468-L472 PolarHBondContact O-N 3.47Å
469G94Very high92.4Very high2 Ų258 Ų582%0.02128%0.278CS..Hα-helixtrans-62.4-42.517600000113.1F347 V465 V466 F471 L472 A473F347-G469 WeakPolarHBondContact CZ-O 3.44Å; V465-G469 PolarHBondContact O-N 3.04Å; V466-G469 PolarHBondContact O-N 3.24Å; G469-F471 VanDerWaalsContact C-N 3.32Å; G469-F471 PolarHBondContact O-N 2.95Å; G469-L472 PolarHBondContact O-N 2.95Å; G469-A473 VanDerWaalsContact O-CB 3.26Å; G469-A473 WeakPolarHBondContact O-CB 3.48Å; G469-A473 PolarHBondContact O-N 2.95Å
470I91.5Very high92.3Very high53 Ų5362.8 Ų62.827%0.27230%0.304SS..Hα-helixtrans-60.7-43174.3-70.3165.4000110.6V466 V467 H474 V558 L559V466-I470 HydrophobicContact CG1-CD1 3.74Å; V466-I470 HydrophobicContact CG1-CG1 4.36Å; V466-I470 VanDerWaalsContact O-CG1 3.27Å; V466-I470 WeakPolarHBondContact O-CG1 3.49Å; V466-I470 PolarHBondContact O-N 3.27Å; V467-I470 PolarHBondContact O-N 2.84Å; I470-H474 WeakPolarHBondContact O-CB 3.47Å; I470-H474 PolarHBondContact O-N 3.31Å; I470-H474 PolarHBondContact O-ND1 2.91Å; I470-V558 HydrophobicContact CG1-CB 3.88Å; I470-V558 HydrophobicContact CG1-CG1 4.11Å; I470-L559 HydrophobicContact CD1-CB 3.91Å; I470-L559 HydrophobicContact CD1-CD1 4.24Å; I470-L559 HydrophobicContact CG1-CB 4.36Å
471F93Very high92.3Very high120 Ų12061.9 Ų61.953%0.52630%0.298SS..Hα-helixtrans-65.7-48.7176.5-178-91.9000112.1V467 I468 G469 A473 H474 R475 T476V467-F471 PolarHBondContact O-N 3.1Å; I468-F471 PolarHBondContact O-N 2.93Å; G469-F471 VanDerWaalsContact C-N 3.32Å; G469-F471 PolarHBondContact O-N 2.95Å; F471-A473 VanDerWaalsContact C-N 3.32Å; F471-A473 PolarHBondContact O-N 3.37Å; F471-H474 PolarHBondContact O-N 3.42Å; F471-R475 HydrophobicContact CD2-CB 3.75Å; F471-R475 HydrophobicContact CD2-CG 3.86Å; F471-R475 HydrophobicContact CE2-CB 3.71Å; F471-R475 HydrophobicContact CE2-CG 4.06Å; F471-R475 HydrophobicContact CG-CB 4.22Å; F471-R475 HydrophobicContact CZ-CB 4.13Å; F471-R475 WeakPolarHBondContact O-CA 3.49Å; F471-R475 WeakPolarHBondContact O-CB 3.49Å; F471-R475 PolarHBondContact O-N 3.39Å; F471-T476 HydrophobicContact CD1-CG2 3.99Å; F471-T476 HydrophobicContact CE1-CG2 3.78Å
472L93.9Very high92.3Very high45 Ų4558.9 Ų58.924%0.23628%0.282CS..Hα-helixtrans-54.6-47.5175.4-76.1173.1000111.2F347 I468 G469 T476 G479 L509F347-L472 HydrophobicContact CE1-CB 4.21Å; F347-L472 HydrophobicContact CZ-CB 3.72Å; I468-L472 HydrophobicContact CG2-CD1 3.9Å; I468-L472 HydrophobicContact CG2-CG 4.26Å; I468-L472 WeakPolarHBondContact O-CB 3.21Å; I468-L472 VanDerWaalsContact O-CG 3.32Å; I468-L472 WeakPolarHBondContact O-CG 3.45Å; I468-L472 PolarHBondContact O-N 3.47Å; G469-L472 PolarHBondContact O-N 2.95Å; L472-T476 HydrophobicContact CD2-CG2 4.22Å; L472-T476 PolarHBondContact O-OG1 3.35Å; L472-G479 WeakPolarHBondContact O-CA 3.44Å; L472-G479 PolarHBondContact O-N 2.87Å; L472-L509 HydrophobicContact CD1-CD1 4.45Å; L472-L509 HydrophobicContact CD1-CD2 4.25Å
473A89.7Confident92Very high0 Ų061 Ų610%029%0.29CS..Hα-helixtrans-67.7-41.5-178.300000113.8F347 G469 F471 G479 Y483 V558F347-A473 HydrophobicContact CE1-CB 3.95Å; F347-A473 HydrophobicContact CZ-CB 3.96Å; G469-A473 VanDerWaalsContact O-CB 3.26Å; G469-A473 WeakPolarHBondContact O-CB 3.48Å; G469-A473 PolarHBondContact O-N 2.95Å; F471-A473 VanDerWaalsContact C-N 3.32Å; F471-A473 PolarHBondContact O-N 3.37Å; A473-G479 WeakPolarHBondContact O-CA 3.34Å; A473-Y483 HydrophobicContact CB-CE2 4.31Å; A473-Y483 WeakPolarHBondContact O-CE2 3.34Å; A473-V558 HydrophobicContact CB-CG2 4.16Å
474H85.5Confident91.5Very high86 Ų8660.2 Ų60.240%0.39829%0.291SS..Hα-helixtrans-109.9-14.5-168.7-58.192.6000115.6I470 F471I470-H474 WeakPolarHBondContact O-CB 3.47Å; I470-H474 PolarHBondContact O-N 3.31Å; I470-H474 PolarHBondContact O-ND1 2.91Å; F471-H474 PolarHBondContact O-N 3.42Å
475R87.8Confident91.2Very high200 Ų20058.9 Ų58.976%0.75528%0.278SS*.Hα-helixtrans-119.6-9.4-175.6-61.7-59.5-170.299.3-1.1114.4F471F471-R475 HydrophobicContact CD2-CB 3.75Å; F471-R475 HydrophobicContact CD2-CG 3.86Å; F471-R475 HydrophobicContact CE2-CB 3.71Å; F471-R475 HydrophobicContact CE2-CG 4.06Å; F471-R475 HydrophobicContact CG-CB 4.22Å; F471-R475 HydrophobicContact CZ-CB 4.13Å; F471-R475 WeakPolarHBondContact O-CA 3.49Å; F471-R475 WeakPolarHBondContact O-CB 3.49Å; F471-R475 PolarHBondContact O-N 3.39Å
476T93.6Very high90.5Very high32 Ų3258.8 Ų58.820%0.19628%0.279CS..SBendtrans-109.7156.3-179.480.70000113.1F471 L472 F478 G479 N480F471-T476 HydrophobicContact CD1-CG2 3.99Å; F471-T476 HydrophobicContact CE1-CG2 3.78Å; L472-T476 HydrophobicContact CD2-CG2 4.22Å; L472-T476 PolarHBondContact O-OG1 3.35Å; T476-F478 PolarHBondContact O-N 2.91Å; T476-F478 PolarHBondContact OG1-N 2.8Å; T476-G479 PolarHBondContact O-N 3.31Å; T476-G479 PolarHBondContact OG1-N 2.9Å; T476-N480 PolarHBondContact O-N 2.9Å
477R91.3Very high89.6Confident215 Ų21561.4 Ų61.481%0.81131%0.307SS*.Hα-helixtrans-59.8-32.2171.9-67.7-175.3179.8-177.20.1112.2N480 Q481R477-N480 PolarHBondContact O-N 3.43Å; R477-Q481 VanDerWaalsContact O-CG 3.24Å; R477-Q481 WeakPolarHBondContact O-CG 3.4Å; R477-Q481 PolarHBondContact O-N 3.43Å
478F93.4Very high88.9Confident29 Ų2960.6 Ų60.613%0.12730%0.299CS..Hα-helixtrans-61.9-51177.4171-111.9000111.3F347 T476 N480 Q481 V482 T502 R505 I506 L509F347-F478 AromaticContact CD1-CE1 3.87Å; F347-F478 HydrophobicContact CD1-CE1 3.87Å; F347-F478 HydrophobicContact CD1-CZ 4.5Å; F347-F478 HydrophobicContact CE1-CE1 4.07Å; T476-F478 PolarHBondContact O-N 2.91Å; T476-F478 PolarHBondContact OG1-N 2.8Å; F478-N480 VanDerWaalsContact C-N 3.33Å; F478-N480 PolarHBondContact O-N 3.14Å; F478-Q481 WeakPolarHBondContact O-CA 3.47Å; F478-Q481 WeakPolarHBondContact O-CB 3.46Å; F478-Q481 PolarHBondContact O-N 3.43Å; F478-V482 HydrophobicContact CD1-CG2 4.41Å; F478-V482 HydrophobicContact CD2-CG2 4.08Å; F478-V482 HydrophobicContact CE1-CG2 4Å; F478-V482 HydrophobicContact CE2-CG2 3.64Å; F478-V482 HydrophobicContact CG-CG2 4.45Å; F478-V482 HydrophobicContact CZ-CG2 3.61Å; F478-V482 WeakPolarHBondContact O-CG2 3.49Å; F478-V482 PolarHBondContact O-N 2.87Å; F478-T502 HydrophobicContact CD2-CG2 4.17Å; F478-T502 HydrophobicContact CE2-CG2 4.02Å; F478-R505 HydrophobicContact CD2-CB 4.15Å; F478-R505 HydrophobicContact CE2-CB 3.55Å; F478-R505 HydrophobicContact CZ-CB 4.18Å; F478-I506 HydrophobicContact CE2-CG1 4.04Å; F478-I506 HydrophobicContact CZ-CG1 3.91Å; F478-L509 HydrophobicContact CE1-CD2 3.86Å; F478-L509 HydrophobicContact CZ-CD2 4.4Å
479G90.2Very high88.3Confident0 Ų057.9 Ų57.90%029%0.292CS..Hα-helixtrans-53.4-48.8176.600000112.7L472 A473 T476 Q481 V482 Y483L472-G479 WeakPolarHBondContact O-CA 3.44Å; L472-G479 PolarHBondContact O-N 2.87Å; A473-G479 WeakPolarHBondContact O-CA 3.34Å; T476-G479 PolarHBondContact O-N 3.31Å; T476-G479 PolarHBondContact OG1-N 2.9Å; G479-Q481 VanDerWaalsContact C-N 3.28Å; G479-Q481 PolarHBondContact O-N 3.25Å; G479-V482 PolarHBondContact O-N 3.44Å; G479-V482 VanDerWaalsContact O-N 3.13Å; G479-Y483 WeakPolarHBondContact O-CD2 3.42Å; G479-Y483 PolarHBondContact O-N 2.79Å
480N86.7Confident87.7Confident102 Ų10262.5 Ų62.555%0.54532%0.32SS..Hα-helixtrans-59.1-36.1176-70-8.7000113.1T476 R477 F478 A484T476-N480 PolarHBondContact O-N 2.9Å; R477-N480 PolarHBondContact O-N 3.43Å; F478-N480 VanDerWaalsContact C-N 3.33Å; F478-N480 PolarHBondContact O-N 3.14Å; N480-A484 WeakPolarHBondContact O-CB 3.3Å; N480-A484 PolarHBondContact O-N 3.18Å
481Q91.2Very high87.1Confident43 Ų4362.9 Ų62.920%0.20133%0.327CS..Hα-helixtrans-69.5-39.9175.5-69.8171.6-31.700112.1R477 F478 G479 A484 I485 I497 T502R477-Q481 VanDerWaalsContact O-CG 3.24Å; R477-Q481 WeakPolarHBondContact O-CG 3.4Å; R477-Q481 PolarHBondContact O-N 3.43Å; F478-Q481 WeakPolarHBondContact O-CA 3.47Å; F478-Q481 WeakPolarHBondContact O-CB 3.46Å; F478-Q481 PolarHBondContact O-N 3.43Å; G479-Q481 VanDerWaalsContact C-N 3.28Å; G479-Q481 PolarHBondContact O-N 3.25Å; Q481-A484 PolarHBondContact O-N 2.89Å; Q481-I485 VanDerWaalsContact O-CG1 3.31Å; Q481-I485 WeakPolarHBondContact O-CG1 3.23Å; Q481-I485 PolarHBondContact O-N 3.47Å; Q481-I497 HydrophobicContact CB-CG2 3.81Å; Q481-I497 HydrophobicContact CG-CD1 4.3Å; Q481-I497 HydrophobicContact CG-CG1 4.22Å; Q481-I497 HydrophobicContact CG-CG2 3.67Å; Q481-T502 HydrophobicContact CB-CG2 3.75Å
482V91.9Very high86.7Confident0 Ų057.4 Ų57.40%030%0.304CS..Hα-helixtrans-60.7-51.7175.51790000110.7F347 L350 F478 G479 A484 I485 G486 T502 I506F347-V482 HydrophobicContact CD1-CG1 4.45Å; F347-V482 HydrophobicContact CD1-CG2 4.33Å; F347-V482 VanDerWaalsContact O-CG1 3.31Å; F347-V482 WeakPolarHBondContact O-CG1 3.35Å; L350-V482 HydrophobicContact CB-CG1 3.63Å; F478-V482 HydrophobicContact CD1-CG2 4.41Å; F478-V482 HydrophobicContact CD2-CG2 4.08Å; F478-V482 HydrophobicContact CE1-CG2 4Å; F478-V482 HydrophobicContact CE2-CG2 3.64Å; F478-V482 HydrophobicContact CG-CG2 4.45Å; F478-V482 HydrophobicContact CZ-CG2 3.61Å; F478-V482 WeakPolarHBondContact O-CG2 3.49Å; F478-V482 PolarHBondContact O-N 2.87Å; G479-V482 PolarHBondContact O-N 3.44Å; G479-V482 VanDerWaalsContact O-N 3.13Å; V482-A484 VanDerWaalsContact C-N 3.31Å; V482-A484 PolarHBondContact O-N 3.37Å; V482-I485 PolarHBondContact O-N 3.25Å; V482-G486 PolarHBondContact O-N 3.1Å; V482-G486 VanDerWaalsContact O-N 3.16Å; V482-T502 HydrophobicContact CG2-CG2 4.04Å; V482-I506 HydrophobicContact CG1-CD1 4.37Å; V482-I506 HydrophobicContact CG1-CG1 4.46Å; V482-I506 HydrophobicContact CG2-CD1 3.99Å; V482-I506 HydrophobicContact CG2-CG1 3.75Å
483Y88.2Confident86.3Confident46 Ų4659.4 Ų59.418%0.1832%0.315CS..Hα-helixtrans-59.9-37.9176.4-75.6-72.8000112.7L350 A473 G479 G487 G556L350-Y483 HydrophobicContact CD1-CD1 4.42Å; L350-Y483 HydrophobicContact CD1-CE1 3.76Å; L350-Y483 HydrophobicContact CD1-CE2 4.37Å; L350-Y483 HydrophobicContact CD2-CD1 3.81Å; L350-Y483 HydrophobicContact CD2-CE1 3.38Å; L350-Y483 HydrophobicContact CG-CE1 4.16Å; A473-Y483 HydrophobicContact CB-CE2 4.31Å; A473-Y483 WeakPolarHBondContact O-CE2 3.34Å; G479-Y483 WeakPolarHBondContact O-CD2 3.42Å; G479-Y483 PolarHBondContact O-N 2.79Å; Y483-G487 PolarHBondContact O-N 3.48Å; Y483-G556 PolarHBondContact OH-O 3.06Å; Y483-G556 VanDerWaalsContact OH-O 3.08Å
484A84.2Confident86.3Confident35 Ų3566.3 Ų66.329%0.28935%0.351SS..Hα-helixtrans-66.4-41.5178.300000112.4N480 Q481 V482 G487 N488 A492 I497N480-A484 WeakPolarHBondContact O-CB 3.3Å; N480-A484 PolarHBondContact O-N 3.18Å; Q481-A484 PolarHBondContact O-N 2.89Å; V482-A484 VanDerWaalsContact C-N 3.31Å; V482-A484 PolarHBondContact O-N 3.37Å; A484-G487 PolarHBondContact O-N 3.42Å; A484-N488 CarbonylContact O-C 3.37Å; A484-N488 PolarHBondContact O-N 3Å; A484-A492 HydrophobicContact CB-CB 4.11Å; A484-I497 HydrophobicContact CB-CD1 3.51Å
485I87.1Confident86.4Confident15 Ų1569.6 Ų69.68%0.07737%0.369CS..Hα-helixtrans-65.6-47.3-180-70.9171.9000111.2Q481 V482 G487 N488 A489 A492 I497 T499 T502Q481-I485 VanDerWaalsContact O-CG1 3.31Å; Q481-I485 WeakPolarHBondContact O-CG1 3.23Å; Q481-I485 PolarHBondContact O-N 3.47Å; V482-I485 PolarHBondContact O-N 3.25Å; I485-G487 PolarHBondContact O-N 2.75Å; I485-N488 CarbonylContact O-C 3.59Å; I485-N488 PolarHBondContact O-N 3.26Å; I485-A489 HydrophobicContact CG2-CB 4.08Å; I485-A489 WeakPolarHBondContact O-CA 3.12Å; I485-A489 PolarHBondContact O-N 2.89Å; I485-A492 HydrophobicContact CG1-CB 4Å; I485-I497 HydrophobicContact CD1-CG2 4.24Å; I485-I497 HydrophobicContact CG1-CG2 4.35Å; I485-T499 HydrophobicContact CD1-CG2 4.3Å; I485-T499 HydrophobicContact CG1-CG2 4.3Å; I485-T502 VanDerWaalsContact CD1-CB 3.46Å; I485-T502 HydrophobicContact CD1-CG2 3.66Å
486G83Confident86.4Confident8 Ų863.3 Ų63.38%0.08237%0.366CS..Hα-helixtrans-72.6-14.3175.800000114.3L350 S351 V482 G553 G554L350-G486 WeakPolarHBondContact O-CA 3.48Å; S351-G486 VanDerWaalsContact C-CA 3.42Å; S351-G486 WeakPolarHBondContact O-CA 3.38Å; V482-G486 PolarHBondContact O-N 3.1Å; V482-G486 VanDerWaalsContact O-N 3.16Å; G486-G553 CarbonylContact O-C 3.57Å; G486-G554 VanDerWaalsContact C-CA 3.47Å; G486-G554 VanDerWaalsContact C-N 3.3Å; G486-G554 PolarHBondContact O-N 3.06Å
487G75.1Confident86.2Confident59 Ų5963.2 Ų63.261%0.60836%0.364SS*.Hα-helixtrans-75.4-53.516800000111.8Y483 A484 I485Y483-G487 PolarHBondContact O-N 3.48Å; A484-G487 PolarHBondContact O-N 3.42Å; I485-G487 PolarHBondContact O-N 2.75Å
488N80.2Confident86.2Confident81 Ų8156 Ų5643%0.43335%0.346SS..Hα-helixtrans-164.7107.2168.2-175.9-39.4000110A484 I485 T490 S491 A492A484-N488 CarbonylContact O-C 3.37Å; A484-N488 PolarHBondContact O-N 3Å; I485-N488 CarbonylContact O-C 3.59Å; I485-N488 PolarHBondContact O-N 3.26Å; N488-T490 VanDerWaalsContact C-N 3.28Å; N488-T490 PolarHBondContact O-N 2.9Å; N488-T490 WeakPolarHBondContact OD1-CA 3.27Å; N488-T490 WeakPolarHBondContact OD1-CB 3.23Å; N488-T490 PolarHBondContact OD1-N 3.5Å; N488-S491 VanDerWaalsContact CG-OG 3.27Å; N488-S491 PolarHBondContact ND2-OG 3.27Å; N488-S491 PolarHBondContact O-N 3.3Å; N488-S491 PolarHBondContact OD1-N 2.88Å; N488-S491 PolarHBondContact OD1-OG 3.02Å; N488-A492 WeakPolarHBondContact O-CB 3.1Å; N488-A492 PolarHBondContact O-N 2.83Å
489A82.9Confident86Confident45 Ų4555.6 Ų55.637%0.37235%0.346SS..Hα-helixtrans-59.6-34.3-177.700000113.8I485 N493I485-A489 HydrophobicContact CG2-CB 4.08Å; I485-A489 WeakPolarHBondContact O-CA 3.12Å; I485-A489 PolarHBondContact O-N 2.89Å; A489-N493 WeakPolarHBondContact O-CB 3.33Å; A489-N493 PolarHBondContact O-N 3.1Å
490T81Confident86Confident99 Ų9962 Ų6261%0.60737%0.37SS*.Hα-helixtrans-69.1-45.9176.9-51.60000110.9N488 A492 N493 L494N488-T490 VanDerWaalsContact C-N 3.28Å; N488-T490 PolarHBondContact O-N 2.9Å; N488-T490 WeakPolarHBondContact OD1-CA 3.27Å; N488-T490 WeakPolarHBondContact OD1-CB 3.23Å; N488-T490 PolarHBondContact OD1-N 3.5Å; T490-A492 VanDerWaalsContact C-N 3.35Å; T490-N493 PolarHBondContact O-N 3.02Å; T490-L494 HydrophobicContact CG2-CD1 4.43Å; T490-L494 WeakPolarHBondContact O-CG 3.37Å; T490-L494 PolarHBondContact O-N 2.84Å
491S78.8Confident86.3Confident60 Ų6059 Ų5942%0.4236%0.358SS..Hα-helixtrans-64.4-39.1174.8-56.50000111.9N488 L494 M495N488-S491 VanDerWaalsContact CG-OG 3.27Å; N488-S491 PolarHBondContact ND2-OG 3.27Å; N488-S491 PolarHBondContact O-N 3.3Å; N488-S491 PolarHBondContact OD1-N 2.88Å; N488-S491 PolarHBondContact OD1-OG 3.02Å; S491-L494 PolarHBondContact O-N 3.19Å; S491-M495 WeakPolarHBondContact O-CB 3.14Å; S491-M495 VanDerWaalsContact O-CG 3.26Å; S491-M495 WeakPolarHBondContact O-CG 3.42Å; S491-M495 PolarHBondContact O-N 2.91Å
492A84.5Confident86.4Confident5 Ų557 Ų574%0.04135%0.348CS..Hα-helixtrans-60.1-45.7174.900000111.5A484 I485 N488 T490 M495 G496 I497A484-A492 HydrophobicContact CB-CB 4.11Å; I485-A492 HydrophobicContact CG1-CB 4Å; N488-A492 WeakPolarHBondContact O-CB 3.1Å; N488-A492 PolarHBondContact O-N 2.83Å; T490-A492 VanDerWaalsContact C-N 3.35Å; A492-M495 CarbonylContact O-C 3.53Å; A492-M495 PolarHBondContact O-N 2.73Å; A492-G496 PolarHBondContact O-N 2.95Å; A492-I497 HydrophobicContact CB-CB 4.22Å; A492-I497 HydrophobicContact CB-CD1 4.09Å; A492-I497 VanDerWaalsContact O-CB 3.25Å; A492-I497 WeakPolarHBondContact O-CB 3.39Å; A492-I497 PolarHBondContact O-N 3.49Å
493N86.4Confident86.5Confident87 Ų8757.9 Ų57.947%0.46535%0.354SS..Hα-helixtrans-61.6-46177.8-164.4-72.3000111.9A489 T490 M495 G496 T499A489-N493 WeakPolarHBondContact O-CB 3.33Å; A489-N493 PolarHBondContact O-N 3.1Å; T490-N493 PolarHBondContact O-N 3.02Å; N493-M495 PolarHBondContact O-N 3.49Å; N493-G496 PolarHBondContact O-N 3.17Å; N493-T499 HydrophobicContact CB-CG2 3.97Å; N493-T499 PolarHBondContact ND2-OG1 3.38Å
494L89.4Confident86.9Confident145 Ų14557.6 Ų57.676%0.75936%0.355SS*.Hα-helixtrans-62.4-27.8175-69.1171.3000113.4T490 S491 G496T490-L494 HydrophobicContact CG2-CD1 4.43Å; T490-L494 WeakPolarHBondContact O-CG 3.37Å; T490-L494 PolarHBondContact O-N 2.84Å; S491-L494 PolarHBondContact O-N 3.19Å; L494-G496 PolarHBondContact O-N 3.27Å
495M88.1Confident87.5Confident156 Ų15661.8 Ų61.877%0.76836%0.363SS*.THydrogen-bonded Turntrans-82.813.8172-67.1-62.8-62.300113.5S491 A492 N493 I497S491-M495 WeakPolarHBondContact O-CB 3.14Å; S491-M495 VanDerWaalsContact O-CG 3.26Å; S491-M495 WeakPolarHBondContact O-CG 3.42Å; S491-M495 PolarHBondContact O-N 2.91Å; A492-M495 CarbonylContact O-C 3.53Å; A492-M495 PolarHBondContact O-N 2.73Å; N493-M495 PolarHBondContact O-N 3.49Å; M495-I497 VanDerWaalsContact C-N 3.35Å; M495-I497 PolarHBondContact O-N 3.28Å
496G87.8Confident87.9Confident68 Ų6861.1 Ų61.170%0.70136%0.36SS*.THydrogen-bonded Turntrans78.411.417700000115A492 N493 L494 S498A492-G496 PolarHBondContact O-N 2.95Å; N493-G496 PolarHBondContact O-N 3.17Å; L494-G496 PolarHBondContact O-N 3.27Å; G496-S498 PolarHBondContact O-N 3.28Å
497I89Confident88.5Confident29 Ų2960.9 Ų60.915%0.14936%0.356CS..  trans-79.6117.2175-60.6172.7000108.9Q481 A484 I485 A492 M495 T499Q481-I497 HydrophobicContact CB-CG2 3.81Å; Q481-I497 HydrophobicContact CG-CD1 4.3Å; Q481-I497 HydrophobicContact CG-CG1 4.22Å; Q481-I497 HydrophobicContact CG-CG2 3.67Å; A484-I497 HydrophobicContact CB-CD1 3.51Å; I485-I497 HydrophobicContact CD1-CG2 4.24Å; I485-I497 HydrophobicContact CG1-CG2 4.35Å; A492-I497 HydrophobicContact CB-CB 4.22Å; A492-I497 HydrophobicContact CB-CD1 4.09Å; A492-I497 VanDerWaalsContact O-CB 3.25Å; A492-I497 WeakPolarHBondContact O-CB 3.39Å; A492-I497 PolarHBondContact O-N 3.49Å; M495-I497 VanDerWaalsContact C-N 3.35Å; M495-I497 PolarHBondContact O-N 3.28Å; I497-T499 VanDerWaalsContact C-N 3.33Å; I497-T499 PolarHBondContact O-N 2.86Å
498S90.9Very high89.6Confident63 Ų6361.5 Ų61.544%0.44135%0.345SS..  trans-70.387176.548.60000111G496 R500 S501 T502G496-S498 PolarHBondContact O-N 3.28Å; S498-R500 VanDerWaalsContact C-N 3.3Å; S498-R500 PolarHBondContact O-N 3.45Å; S498-S501 PolarHBondContact O-N 3.32Å; S498-S501 VanDerWaalsContact O-N 3.08Å; S498-T502 PolarHBondContact O-N 2.68Å; S498-T502 PolarHBondContact O-OG1 3.09Å
499T88.7Confident90.4Very high22 Ų2259.5 Ų59.514%0.13533%0.334CS..Hα-helixtrans-46.7-53.5179.653.40000110.9I485 N493 I497 S501 T502 T503I485-T499 HydrophobicContact CD1-CG2 4.3Å; I485-T499 HydrophobicContact CG1-CG2 4.3Å; N493-T499 HydrophobicContact CB-CG2 3.97Å; N493-T499 PolarHBondContact ND2-OG1 3.38Å; I497-T499 VanDerWaalsContact C-N 3.33Å; I497-T499 PolarHBondContact O-N 2.86Å; T499-S501 PolarHBondContact O-N 3.18Å; T499-T502 PolarHBondContact O-N 3.46Å; T499-T503 PolarHBondContact O-N 3.45Å; T499-T503 PolarHBondContact O-OG1 3.29Å
500R91Very high91Very high133 Ų13357.5 Ų57.550%0.50232%0.317SS..Hα-helixtrans-47.5-52.1175.9-173.6169.9179.9-172.2-0.2114.2D403 S498 T502 I504D403-R500 HydrophobicContact CB-CB 4.3Å; D403-R500 HydrophobicContact CB-CG 4.1Å; D403-R500 VanDerWaalsContact OD2-CB 3.22Å; D403-R500 WeakPolarHBondContact OD2-CB 3.27Å; D403-R500 VanDerWaalsContact OD2-CD 3.29Å; D403-R500 WeakPolarHBondContact OD2-CD 3.48Å; D403-R500 WeakPolarHBondContact OD2-CG 3.37Å; S498-R500 VanDerWaalsContact C-N 3.3Å; S498-R500 PolarHBondContact O-N 3.45Å; R500-T502 VanDerWaalsContact C-N 3.33Å; R500-T502 PolarHBondContact O-N 2.89Å; R500-I504 HydrophobicContact CG-CD1 3.96Å; R500-I504 WeakPolarHBondContact O-CD1 3.28Å; R500-I504 VanDerWaalsContact O-CG1 3.24Å; R500-I504 WeakPolarHBondContact O-CG1 3.44Å; R500-I504 PolarHBondContact O-N 3.27Å
501S93.2Very high91.7Very high41 Ų4152.8 Ų52.829%0.28729%0.288SS..Hα-helixtrans-70.1-33.3-177.4-170.60000111.8S498 T499 R505S498-S501 PolarHBondContact O-N 3.32Å; S498-S501 VanDerWaalsContact O-N 3.08Å; T499-S501 PolarHBondContact O-N 3.18Å; S501-R505 WeakPolarHBondContact O-CD 3.21Å; S501-R505 VanDerWaalsContact O-CG 3.26Å; S501-R505 WeakPolarHBondContact O-CG 3.45Å; S501-R505 PolarHBondContact O-N 2.92Å
502T93.7Very high92.6Very high0 Ų050.3 Ų50.30%027%0.272CS..Hα-helixtrans-70.8-47.1176.9-44.10000110.5F478 Q481 V482 I485 S498 T499 R500 I504 R505 I506F478-T502 HydrophobicContact CD2-CG2 4.17Å; F478-T502 HydrophobicContact CE2-CG2 4.02Å; Q481-T502 HydrophobicContact CB-CG2 3.75Å; V482-T502 HydrophobicContact CG2-CG2 4.04Å; I485-T502 VanDerWaalsContact CD1-CB 3.46Å; I485-T502 HydrophobicContact CD1-CG2 3.66Å; S498-T502 PolarHBondContact O-N 2.68Å; S498-T502 PolarHBondContact O-OG1 3.09Å; T499-T502 PolarHBondContact O-N 3.46Å; R500-T502 VanDerWaalsContact C-N 3.33Å; R500-T502 PolarHBondContact O-N 2.89Å; T502-I504 PolarHBondContact O-N 3.2Å; T502-R505 CarbonylContact O-C 3.31Å; T502-R505 PolarHBondContact O-N 3.01Å; T502-R505 VanDerWaalsContact O-N 3.11Å; T502-I506 HydrophobicContact CG2-CD1 4.02Å; T502-I506 WeakPolarHBondContact O-CD1 3.34Å; T502-I506 VanDerWaalsContact O-CG1 3.29Å; T502-I506 WeakPolarHBondContact O-CG1 3.27Å; T502-I506 PolarHBondContact O-N 2.99Å
503T93.5Very high93.2Very high19 Ų1951.1 Ų51.112%0.11728%0.275CS..Hα-helixtrans-55-50.2174.6-56.40000111.5I402 T499 R505 I506 Y507I402-T503 HydrophobicContact CB-CG2 4.32Å; I402-T503 HydrophobicContact CG2-CG2 4.07Å; T499-T503 PolarHBondContact O-N 3.45Å; T499-T503 PolarHBondContact O-OG1 3.29Å; T503-R505 VanDerWaalsContact C-N 3.27Å; T503-R505 PolarHBondContact O-N 2.89Å; T503-I506 WeakPolarHBondContact O-CB 3.15Å; T503-I506 PolarHBondContact O-N 2.86Å; T503-I506 VanDerWaalsContact O-N 3.13Å; T503-Y507 HydrophobicContact CG2-CD2 4Å; T503-Y507 HydrophobicContact CG2-CE2 3.85Å; T503-Y507 VanDerWaalsContact O-CD2 3.3Å; T503-Y507 WeakPolarHBondContact O-CD2 3.28Å; T503-Y507 PolarHBondContact O-N 2.94Å
504I96.1Very high93.7Very high39 Ų3947 Ų4720%0.225%0.253CS..Hα-helixtrans-56.2-41.9176.7-69.7164.6000111.5A396 L400 R500 T502 M508A396-I504 HydrophobicContact CB-CG2 4.05Å; L400-I504 HydrophobicContact CB-CD1 4.2Å; L400-I504 HydrophobicContact CB-CG1 4.12Å; L400-I504 HydrophobicContact CD1-CD1 4.11Å; R500-I504 HydrophobicContact CG-CD1 3.96Å; R500-I504 WeakPolarHBondContact O-CD1 3.28Å; R500-I504 VanDerWaalsContact O-CG1 3.24Å; R500-I504 WeakPolarHBondContact O-CG1 3.44Å; R500-I504 PolarHBondContact O-N 3.27Å; T502-I504 PolarHBondContact O-N 3.2Å; I504-M508 WeakPolarHBondContact O-CB 3.43Å; I504-M508 PolarHBondContact O-N 3.24Å
505R96.6Very high94.1Very high124 Ų12440.1 Ų40.147%0.46822%0.217SC..Hα-helixtrans-71.7-31.9178.1-72.2169.4-179.4173.81.1113.7F478 S501 T502 T503 L509F478-R505 HydrophobicContact CD2-CB 4.15Å; F478-R505 HydrophobicContact CE2-CB 3.55Å; F478-R505 HydrophobicContact CZ-CB 4.18Å; S501-R505 WeakPolarHBondContact O-CD 3.21Å; S501-R505 VanDerWaalsContact O-CG 3.26Å; S501-R505 WeakPolarHBondContact O-CG 3.45Å; S501-R505 PolarHBondContact O-N 2.92Å; T502-R505 CarbonylContact O-C 3.31Å; T502-R505 PolarHBondContact O-N 3.01Å; T502-R505 VanDerWaalsContact O-N 3.11Å; T503-R505 VanDerWaalsContact C-N 3.27Å; T503-R505 PolarHBondContact O-N 2.89Å; R505-L509 VanDerWaalsContact O-CB 3.28Å; R505-L509 WeakPolarHBondContact O-CB 3.39Å; R505-L509 PolarHBondContact O-N 3.17Å
506I95.8Very high94.5Very high0 Ų034.3 Ų34.30%019%0.189CC..Hα-helixtrans-62.9-53.6175.7-72154000110.2V348 S351 F478 V482 T502 T503 L509 S510V348-I506 HydrophobicContact CB-CG2 4.3Å; V348-I506 HydrophobicContact CG2-CG2 3.78Å; S351-I506 VanDerWaalsContact CB-CD1 3.46Å; F478-I506 HydrophobicContact CE2-CG1 4.04Å; F478-I506 HydrophobicContact CZ-CG1 3.91Å; V482-I506 HydrophobicContact CG1-CD1 4.37Å; V482-I506 HydrophobicContact CG1-CG1 4.46Å; V482-I506 HydrophobicContact CG2-CD1 3.99Å; V482-I506 HydrophobicContact CG2-CG1 3.75Å; T502-I506 HydrophobicContact CG2-CD1 4.02Å; T502-I506 WeakPolarHBondContact O-CD1 3.34Å; T502-I506 VanDerWaalsContact O-CG1 3.29Å; T502-I506 WeakPolarHBondContact O-CG1 3.27Å; T502-I506 PolarHBondContact O-N 2.99Å; T503-I506 WeakPolarHBondContact O-CB 3.15Å; T503-I506 PolarHBondContact O-N 2.86Å; T503-I506 VanDerWaalsContact O-N 3.13Å; I506-L509 PolarHBondContact O-N 2.88Å; I506-S510 PolarHBondContact O-N 2.89Å
507Y96.6Very high94.8Very high3 Ų331 Ų311%0.01216%0.156CC..Hα-helixtrans-73-34.2-178.7-66.4-80.6000112.1V348 G353 I354 D355 G395 I402 A409 T413 T503 L509 S510 T511V348-Y507 HydrophobicContact CG1-CE1 4.03Å; V348-Y507 HydrophobicContact CG2-CD1 4.28Å; V348-Y507 HydrophobicContact CG2-CE1 4.1Å; G353-Y507 VanDerWaalsContact CA-OH 3.25Å; G353-Y507 WeakPolarHBondContact CA-OH 3.39Å; I354-Y507 PolarHBondContact N-OH 3.06Å; D355-Y507 HydrophobicContact CB-CD1 4.14Å; D355-Y507 HydrophobicContact CB-CE1 3.91Å; G395-Y507 WeakPolarHBondContact CA-O 3.32Å; G395-Y507 CarbonylContact O-C 3.48Å; G395-Y507 WeakPolarHBondContact O-CB 3.32Å; I402-Y507 HydrophobicContact CD1-CD1 4.32Å; I402-Y507 HydrophobicContact CD1-CD2 3.85Å; I402-Y507 HydrophobicContact CD1-CE1 4.01Å; I402-Y507 HydrophobicContact CD1-CE2 3.54Å; I402-Y507 HydrophobicContact CD1-CG 4.27Å; A409-Y507 WeakPolarHBondContact CB-OH 3.33Å; T413-Y507 HydrophobicContact CG2-CD1 4Å; T413-Y507 HydrophobicContact CG2-CE1 3.86Å; T503-Y507 HydrophobicContact CG2-CD2 4Å; T503-Y507 HydrophobicContact CG2-CE2 3.85Å; T503-Y507 VanDerWaalsContact O-CD2 3.3Å; T503-Y507 WeakPolarHBondContact O-CD2 3.28Å; T503-Y507 PolarHBondContact O-N 2.94Å; Y507-L509 VanDerWaalsContact C-N 3.32Å; Y507-L509 PolarHBondContact O-N 3.46Å; Y507-S510 PolarHBondContact O-N 3.35Å; Y507-T511 WeakPolarHBondContact O-CB 3.48Å; Y507-T511 PolarHBondContact O-N 3.26Å; Y507-T511 PolarHBondContact O-OG1 2.88Å; Y507-T511 VanDerWaalsContact O-OG1 3.08Å
508M97.2Very high95.1Very high73 Ų7329.7 Ų29.736%0.3615%0.149SC..Hα-helixtrans-54.3-46167.7177.3-172.1-74.600112.1C392 A396 I504 G512C392-M508 HydrophobicContact CB-CG 4.07Å; A396-M508 HydrophobicContact CB-CB 4.2Å; A396-M508 HydrophobicContact CB-CE 3.6Å; I504-M508 WeakPolarHBondContact O-CB 3.43Å; I504-M508 PolarHBondContact O-N 3.24Å; M508-G512 PolarHBondContact O-N 3.41Å
509L97Very high95.3Very high39 Ų3927.1 Ų27.120%0.20413%0.13CC..Hα-helixtrans-68.6-41.2177.8178.861.9000112F347 L472 F478 R505 I506 Y507 L513F347-L509 HydrophobicContact CB-CD2 4.35Å; F347-L509 HydrophobicContact CD1-CD2 4.28Å; F347-L509 HydrophobicContact CD2-CD2 3.55Å; F347-L509 HydrophobicContact CE2-CD2 3.84Å; F347-L509 HydrophobicContact CG-CD2 3.8Å; F347-L509 HydrophobicContact CZ-CD2 4.31Å; L472-L509 HydrophobicContact CD1-CD1 4.45Å; L472-L509 HydrophobicContact CD1-CD2 4.25Å; F478-L509 HydrophobicContact CE1-CD2 3.86Å; F478-L509 HydrophobicContact CZ-CD2 4.4Å; R505-L509 VanDerWaalsContact O-CB 3.28Å; R505-L509 WeakPolarHBondContact O-CB 3.39Å; R505-L509 PolarHBondContact O-N 3.17Å; I506-L509 PolarHBondContact O-N 2.88Å; Y507-L509 VanDerWaalsContact C-N 3.32Å; Y507-L509 PolarHBondContact O-N 3.46Å; L509-L513 HydrophobicContact CD1-CD1 3.86Å; L509-L513 HydrophobicContact CD1-CG 4.11Å; L509-L513 HydrophobicContact CG-CD1 4.16Å; L509-L513 WeakPolarHBondContact O-CB 3.35Å; L509-L513 WeakPolarHBondContact O-CG 3.21Å; L509-L513 PolarHBondContact O-N 2.86Å
510S95.9Very high95.5Very high2 Ų226.3 Ų26.31%0.01413%0.125CC..Hα-helixtrans-60.2-58.1177.7-172.80000111.6V348 D355 I506 Y507 G512 L513 A514V348-S510 VanDerWaalsContact CG2-CB 3.47Å; V348-S510 WeakPolarHBondContact CG2-OG 3.3Å; D355-S510 WeakPolarHBondContact OD2-CB 3.4Å; D355-S510 PolarHBondContact OD2-OG 3.19Å; I506-S510 PolarHBondContact O-N 2.89Å; Y507-S510 PolarHBondContact O-N 3.35Å; S510-G512 VanDerWaalsContact C-N 3.34Å; S510-G512 PolarHBondContact O-N 3.42Å; S510-L513 PolarHBondContact O-N 3.4Å; S510-A514 PolarHBondContact O-N 2.76Å
511T96.5Very high95.5Very high1 Ų121.1 Ų21.11%0.00611%0.106CC..Hα-helixtrans-65.1-37.4-179.6-48.40000111.4V361 G391 F394 G395 M398 Y507 L513 A514 T515V361-T511 HydrophobicContact CG1-CG2 3.96Å; V361-T511 HydrophobicContact CG2-CG2 3.71Å; G391-T511 WeakPolarHBondContact O-CB 3.18Å; G391-T511 WeakPolarHBondContact O-CG2 3.22Å; F394-T511 HydrophobicContact CB-CG2 4.41Å; F394-T511 HydrophobicContact CD1-CG2 4.12Å; G395-T511 WeakPolarHBondContact CA-OG1 3.46Å; M398-T511 VanDerWaalsContact CE-OG1 3.28Å; M398-T511 WeakPolarHBondContact CE-OG1 3.22Å; Y507-T511 WeakPolarHBondContact O-CB 3.48Å; Y507-T511 PolarHBondContact O-N 3.26Å; Y507-T511 PolarHBondContact O-OG1 2.88Å; Y507-T511 VanDerWaalsContact O-OG1 3.08Å; T511-L513 PolarHBondContact O-N 2.96Å; T511-A514 PolarHBondContact O-N 3.15Å; T511-T515 WeakPolarHBondContact O-CB 3.18Å; T511-T515 PolarHBondContact O-N 3.18Å; T511-T515 PolarHBondContact O-OG1 3Å
512G97.4Very high95.5Very high8 Ų819.1 Ų19.18%0.0829%0.092CC..Hα-helixtrans-61.2-39.6173.700000113.5M508 S510 L516M508-G512 PolarHBondContact O-N 3.41Å; S510-G512 VanDerWaalsContact C-N 3.34Å; S510-G512 PolarHBondContact O-N 3.42Å; G512-L516 PolarHBondContact O-N 2.81Å
513L97.1Very high95.4Very high21 Ų2119.8 Ų19.811%0.1110%0.096CC..Hα-helixtrans-74.6-35.6174.1-70.8176.5000112.4I340 V343 V465 L509 S510 T511 T515 L516 A517I340-L513 HydrophobicContact CG2-CB 4.19Å; I340-L513 HydrophobicContact CG2-CD2 4.21Å; I340-L513 VanDerWaalsContact CG2-O 3.23Å; I340-L513 WeakPolarHBondContact CG2-O 3.48Å; V343-L513 HydrophobicContact CB-CD1 4.37Å; V343-L513 HydrophobicContact CG1-CD1 3.99Å; V465-L513 HydrophobicContact CG1-CD1 4.26Å; V465-L513 HydrophobicContact CG1-CD2 3.72Å; V465-L513 HydrophobicContact CG2-CD2 4.23Å; L509-L513 HydrophobicContact CD1-CD1 3.86Å; L509-L513 HydrophobicContact CD1-CG 4.11Å; L509-L513 HydrophobicContact CG-CD1 4.16Å; L509-L513 WeakPolarHBondContact O-CB 3.35Å; L509-L513 WeakPolarHBondContact O-CG 3.21Å; L509-L513 PolarHBondContact O-N 2.86Å; S510-L513 PolarHBondContact O-N 3.4Å; T511-L513 PolarHBondContact O-N 2.96Å; L513-T515 VanDerWaalsContact C-N 3.3Å; L513-T515 PolarHBondContact O-N 2.93Å; L513-L516 HydrophobicContact CD2-CD2 4.1Å; L513-L516 PolarHBondContact O-N 3.17Å; L513-A517 WeakPolarHBondContact O-CB 3.32Å; L513-A517 PolarHBondContact O-N 3.42Å
514A96.2Very high95.1Very high0 Ų024.9 Ų24.90%011%0.114CC..Hα-helixtrans-62.4-37.217100000112.1V358 V361 I362 S510 T511 A517 G518V358-A514 HydrophobicContact CB-CB 3.72Å; V358-A514 HydrophobicContact CG1-CB 3.85Å; V361-A514 HydrophobicContact CB-CB 4Å; V361-A514 HydrophobicContact CG1-CB 3.82Å; I362-A514 WeakPolarHBondContact CG1-O 3.24Å; S510-A514 PolarHBondContact O-N 2.76Å; T511-A514 PolarHBondContact O-N 3.15Å; A514-A517 PolarHBondContact O-N 3.45Å; A514-G518 PolarHBondContact O-N 2.95Å
515T97.3Very high94.8Very high2 Ų225.3 Ų25.31%0.01212%0.118CC..Hα-helixtrans-67.2-40.8171.4-60.40000112V361 T365 V387 L388 G391 T511 L513 A517 G518 I519V361-T515 VanDerWaalsContact CG1-OG1 3.22Å; V361-T515 WeakPolarHBondContact CG1-OG1 3.3Å; T365-T515 HydrophobicContact CG2-CG2 4.06Å; V387-T515 HydrophobicContact CB-CG2 4.42Å; V387-T515 HydrophobicContact CG1-CG2 3.92Å; V387-T515 HydrophobicContact CG2-CG2 4.1Å; L388-T515 HydrophobicContact CD2-CG2 3.91Å; L388-T515 HydrophobicContact CG-CG2 4.27Å; G391-T515 WeakPolarHBondContact CA-OG1 3.49Å; T511-T515 WeakPolarHBondContact O-CB 3.18Å; T511-T515 PolarHBondContact O-N 3.18Å; T511-T515 PolarHBondContact O-OG1 3Å; L513-T515 VanDerWaalsContact C-N 3.3Å; L513-T515 PolarHBondContact O-N 2.93Å; T515-A517 VanDerWaalsContact C-N 3.3Å; T515-A517 PolarHBondContact O-N 3.18Å; T515-G518 WeakPolarHBondContact O-CA 3.42Å; T515-G518 PolarHBondContact O-N 3.43Å; T515-G518 VanDerWaalsContact O-N 3.11Å; T515-I519 PolarHBondContact O-N 3.06Å
516L96.8Very high94.5Very high33 Ų3322.9 Ų22.917%0.17311%0.112CC..Hα-helixtrans-62-39.4173.4-17463.7000111.8I340 L388 L461 V465 G512 L513 G518 I519 V520I340-L516 HydrophobicContact CG2-CB 4.2Å; I340-L516 HydrophobicContact CG2-CD2 4.23Å; I340-L516 HydrophobicContact CG2-CG 4.32Å; L388-L516 HydrophobicContact CD2-CB 4.12Å; L388-L516 HydrophobicContact CD2-CD1 4.49Å; L461-L516 HydrophobicContact CD1-CD2 4.39Å; L461-L516 HydrophobicContact CD2-CD1 4.14Å; L461-L516 HydrophobicContact CD2-CG 4.37Å; V465-L516 HydrophobicContact CG2-CD2 3.68Å; G512-L516 PolarHBondContact O-N 2.81Å; L513-L516 HydrophobicContact CD2-CD2 4.1Å; L513-L516 PolarHBondContact O-N 3.17Å; L516-G518 VanDerWaalsContact C-N 3.34Å; L516-I519 PolarHBondContact O-N 3.07Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.39Å
517A94.9Very high94.3Very high0 Ų023.6 Ų23.60%012%0.118CC..Hα-helixtrans-66-35.1172.300000112.2F337 I340 I341 I362 L513 A514 T515 V520 F521F337-A517 HydrophobicContact CB-CB 4.26Å; I340-A517 HydrophobicContact CB-CB 4.11Å; I340-A517 HydrophobicContact CG2-CB 3.96Å; I341-A517 HydrophobicContact CD1-CB 3.99Å; I341-A517 HydrophobicContact CG1-CB 3.46Å; I341-A517 VanDerWaalsContact CG1-CB 3.46Å; I362-A517 HydrophobicContact CD1-CB 4.49Å; L513-A517 WeakPolarHBondContact O-CB 3.32Å; L513-A517 PolarHBondContact O-N 3.42Å; A514-A517 PolarHBondContact O-N 3.45Å; T515-A517 VanDerWaalsContact C-N 3.3Å; T515-A517 PolarHBondContact O-N 3.18Å; A517-V520 PolarHBondContact O-N 3.28Å; A517-F521 VanDerWaalsContact O-CB 3.27Å; A517-F521 WeakPolarHBondContact O-CB 3.25Å; A517-F521 PolarHBondContact O-N 2.98Å
518G94.3Very high93.9Very high0 Ų023.5 Ų23.50%012%0.118CC..Hα-helixtrans-64.6-40.417300000113.3A514 T515 L516 F521 S522A514-G518 PolarHBondContact O-N 2.95Å; T515-G518 WeakPolarHBondContact O-CA 3.42Å; T515-G518 PolarHBondContact O-N 3.43Å; T515-G518 VanDerWaalsContact O-N 3.11Å; L516-G518 VanDerWaalsContact C-N 3.34Å; G518-F521 PolarHBondContact O-N 3.2Å; G518-S522 WeakPolarHBondContact O-CB 3.24Å; G518-S522 PolarHBondContact O-N 2.95Å
519I95.1Very high93.5Very high9 Ų923.5 Ų23.55%0.04611%0.114CC..Hα-helixtrans-59-53.1170.4-70.5159.9000109.6T365 L369 F384 V387 L388 T515 L516 F521 S522 I523T365-I519 HydrophobicContact CG2-CG1 4.03Å; L369-I519 HydrophobicContact CD1-CB 4.44Å; L369-I519 HydrophobicContact CD1-CG1 3.74Å; F384-I519 HydrophobicContact CB-CD1 3.99Å; F384-I519 HydrophobicContact CD1-CD1 4.24Å; F384-I519 HydrophobicContact CD1-CG1 3.96Å; F384-I519 HydrophobicContact CD1-CG2 3.82Å; F384-I519 HydrophobicContact CD2-CG2 4.28Å; F384-I519 HydrophobicContact CE1-CG1 4.49Å; F384-I519 HydrophobicContact CE1-CG2 3.77Å; F384-I519 HydrophobicContact CE2-CG2 4.22Å; F384-I519 HydrophobicContact CG-CD1 4.27Å; F384-I519 HydrophobicContact CG-CG1 4.44Å; F384-I519 HydrophobicContact CG-CG2 4.09Å; F384-I519 HydrophobicContact CZ-CG2 3.97Å; V387-I519 HydrophobicContact CG1-CD1 3.96Å; V387-I519 HydrophobicContact CG1-CG1 4.12Å; L388-I519 HydrophobicContact CD1-CD1 3.91Å; L388-I519 HydrophobicContact CD2-CD1 4.08Å; L388-I519 HydrophobicContact CG-CD1 3.71Å; T515-I519 PolarHBondContact O-N 3.06Å; L516-I519 PolarHBondContact O-N 3.07Å; I519-F521 VanDerWaalsContact C-N 3.33Å; I519-F521 PolarHBondContact O-N 3.29Å; I519-S522 PolarHBondContact O-N 3.36Å; I519-S522 PolarHBondContact O-OG 3.3Å; I519-I523 HydrophobicContact CG2-CD1 3.77Å; I519-I523 WeakPolarHBondContact O-CG1 3.28Å; I519-I523 PolarHBondContact O-N 2.87Å
520V93.1Very high92.8Very high5 Ų521.7 Ų21.73%0.0311%0.105CC..Hα-helixtrans-56.2-45.8178.3166.50000112F337 I340 M458 L461 L516 A517 I523 Y524F337-V520 HydrophobicContact CB-CG1 4.18Å; I340-V520 HydrophobicContact CD1-CG2 3.92Å; M458-V520 HydrophobicContact CB-CG1 3.87Å; M458-V520 HydrophobicContact CG-CG1 3.92Å; M458-V520 HydrophobicContact SD-CG1 4.31Å; L461-V520 HydrophobicContact CD2-CG2 3.65Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.39Å; A517-V520 PolarHBondContact O-N 3.28Å; V520-I523 PolarHBondContact O-N 2.95Å; V520-Y524 PolarHBondContact O-N 2.92Å
521F91.5Very high92.1Very high24 Ų2426.5 Ų26.511%0.10513%0.13CC..Hα-helixtrans-62.5-44.6178.7-169.4-96.2000111.3F337 I362 A517 G518 I519 I523 Y524 T525 Y529 A532F337-F521 HydrophobicContact CD1-CD2 4.12Å; F337-F521 HydrophobicContact CD2-CD2 4.04Å; F337-F521 HydrophobicContact CE1-CD2 4.28Å; F337-F521 HydrophobicContact CE1-CE2 4.48Å; F337-F521 HydrophobicContact CE2-CD2 4.21Å; F337-F521 HydrophobicContact CE2-CE2 4.35Å; F337-F521 HydrophobicContact CG-CD2 4.01Å; F337-F521 HydrophobicContact CZ-CD2 4.33Å; F337-F521 HydrophobicContact CZ-CE2 4.29Å; I362-F521 HydrophobicContact CG2-CB 4.33Å; I362-F521 HydrophobicContact CG2-CD1 4.19Å; I362-F521 HydrophobicContact CG2-CG 4.29Å; A517-F521 VanDerWaalsContact O-CB 3.27Å; A517-F521 WeakPolarHBondContact O-CB 3.25Å; A517-F521 PolarHBondContact O-N 2.98Å; G518-F521 PolarHBondContact O-N 3.2Å; I519-F521 VanDerWaalsContact C-N 3.33Å; I519-F521 PolarHBondContact O-N 3.29Å; F521-I523 VanDerWaalsContact C-N 3.29Å; F521-I523 PolarHBondContact O-N 3.18Å; F521-Y524 WeakPolarHBondContact O-CB 3.48Å; F521-Y524 PolarHBondContact O-N 3.01Å; F521-Y524 VanDerWaalsContact O-N 3.1Å; F521-T525 HydrophobicContact CD1-CG2 4.03Å; F521-T525 HydrophobicContact CE1-CG2 3.61Å; F521-T525 HydrophobicContact CE2-CG2 4.29Å; F521-T525 HydrophobicContact CZ-CG2 3.76Å; F521-T525 PolarHBondContact O-N 3.47Å; F521-T525 PolarHBondContact O-OG1 3.46Å; F521-Y529 AromaticContact CE1-CE1 3.95Å; F521-Y529 HydrophobicContact CE1-CE1 3.95Å; F521-Y529 WeakPolarHBondContact CZ-OH 3.49Å; F521-A532 HydrophobicContact CD1-CB 4.17Å; F521-A532 HydrophobicContact CE1-CB 3.7Å
522S92.6Very high91.6Very high0 Ų026.5 Ų26.50%013%0.13CC..Hα-helixtrans-62.5-33.4176.877.90000113.3Y439 G518 I519 Q526 A527Y439-S522 WeakPolarHBondContact CE1-O 3.36Å; Y439-S522 PolarHBondContact OH-OG 2.68Å; G518-S522 WeakPolarHBondContact O-CB 3.24Å; G518-S522 PolarHBondContact O-N 2.95Å; I519-S522 PolarHBondContact O-N 3.36Å; I519-S522 PolarHBondContact O-OG 3.3Å; S522-Q526 WeakPolarHBondContact O-CA 3.38Å; S522-Q526 PolarHBondContact O-N 3.47Å; S522-A527 PolarHBondContact O-N 2.9Å
523I91.8Very high90.9Very high13 Ų1326.3 Ų26.37%0.06713%0.128CC..Hα-helixtrans-74.8-31.1176-60.2161.1000110.7F384 Y439 L442 M458 I519 V520 F521F384-I523 HydrophobicContact CE2-CD1 4.32Å; F384-I523 HydrophobicContact CZ-CD1 3.92Å; F384-I523 HydrophobicContact CZ-CG1 4.3Å; Y439-I523 HydrophobicContact CD1-CB 4.24Å; Y439-I523 HydrophobicContact CD1-CG1 3.91Å; Y439-I523 HydrophobicContact CE1-CB 4.28Å; Y439-I523 HydrophobicContact CE1-CG1 3.67Å; Y439-I523 HydrophobicContact CE2-CG1 4.39Å; Y439-I523 HydrophobicContact CG-CG1 4.34Å; L442-I523 HydrophobicContact CB-CD1 4.44Å; L442-I523 HydrophobicContact CB-CG2 3.86Å; L442-I523 HydrophobicContact CD1-CD1 3.94Å; M458-I523 HydrophobicContact CE-CB 3.92Å; M458-I523 HydrophobicContact CE-CG2 3.57Å; I519-I523 HydrophobicContact CG2-CD1 3.77Å; I519-I523 WeakPolarHBondContact O-CG1 3.28Å; I519-I523 PolarHBondContact O-N 2.87Å; V520-I523 PolarHBondContact O-N 2.95Å; F521-I523 VanDerWaalsContact C-N 3.29Å; F521-I523 PolarHBondContact O-N 3.18Å
524Y87.4Confident90.1Very high127 Ų12727.7 Ų27.750%0.49814%0.138SC..Hα-helixtrans-73.1-43.4176.1179-98.1000112.8M458 V520 F521M458-Y524 HydrophobicContact SD-CD2 4.1Å; V520-Y524 PolarHBondContact O-N 2.92Å; F521-Y524 WeakPolarHBondContact O-CB 3.48Å; F521-Y524 PolarHBondContact O-N 3.01Å; F521-Y524 VanDerWaalsContact O-N 3.1Å
525T89.4Confident89.2Confident48 Ų4828.4 Ų28.429%0.29414%0.144SC..Hα-helixtrans-84.2-16.6178.357.10000113.8F521 A527F521-T525 HydrophobicContact CD1-CG2 4.03Å; F521-T525 HydrophobicContact CE1-CG2 3.61Å; F521-T525 HydrophobicContact CE2-CG2 4.29Å; F521-T525 HydrophobicContact CZ-CG2 3.76Å; F521-T525 PolarHBondContact O-N 3.47Å; F521-T525 PolarHBondContact O-OG1 3.46Å; T525-A527 PolarHBondContact O-N 2.73Å; T525-A527 PolarHBondContact OG1-N 3.3Å; T525-A527 PolarHBondContact OG1-O 3.21Å
526Q90.5Very high88.7Confident72 Ų7229.3 Ų29.334%0.33615%0.15SC..SBendtrans51.228.4-165.7-53.1-166.1-89.600113.2I434 D440 S522I434-Q526 PolarHBondContact N-O 3.09Å; D440-Q526 PolarHBondContact OD1-NE2 3.5Å; S522-Q526 WeakPolarHBondContact O-CA 3.38Å; S522-Q526 PolarHBondContact O-N 3.47Å
527A90.8Very high88.2Confident15 Ų1527.7 Ų27.712%0.12414%0.142CC..EExtended strand (participates in β ladder)trans-152.6152.9-175.300000113.2I432 S522 T525I432-A527 CarbonylContact O-C 3.6Å; I432-A527 WeakPolarHBondContact O-CA 3.35Å; S522-A527 PolarHBondContact O-N 2.9Å; T525-A527 PolarHBondContact O-N 2.73Å; T525-A527 PolarHBondContact OG1-N 3.3Å; T525-A527 PolarHBondContact OG1-O 3.21Å
528G89.4Confident87.5Confident1 Ų128.2 Ų28.21%0.0114%0.144CC..EExtended strand (participates in β ladder)trans-118.5125170.700000111.5G366 I432G366-G528 VanDerWaalsContact C-CA 3.47Å; G366-G528 WeakPolarHBondContact O-CA 3.42Å; I432-G528 PolarHBondContact N-O 2.86Å; I432-G528 PolarHBondContact O-N 3.38Å
529Y88.6Confident87.1Confident73 Ų7331 Ų3129%0.28616%0.159SC..  trans-145.2143.8-178.560.9-82.2000111.5F521 L531 A532F521-Y529 AromaticContact CE1-CE1 3.95Å; F521-Y529 HydrophobicContact CE1-CE1 3.95Å; F521-Y529 WeakPolarHBondContact CZ-OH 3.49Å; Y529-L531 HydrophobicContact CD2-CB 3.96Å; Y529-L531 VanDerWaalsContact CE2-C 3.5Å; Y529-L531 HydrophobicContact CE2-CB 4.22Å; Y529-L531 PolarHBondContact O-N 3.14Å; Y529-L531 VanDerWaalsContact O-N 3.11Å; Y529-A532 HydrophobicContact CD1-CB 4.34Å; Y529-A532 HydrophobicContact CD2-CB 4.21Å; Y529-A532 HydrophobicContact CE1-CB 4.06Å; Y529-A532 HydrophobicContact CE2-CB 3.93Å; Y529-A532 VanDerWaalsContact CE2-N 3.31Å; Y529-A532 HydrophobicContact CG-CB 4.4Å; Y529-A532 WeakPolarHBondContact O-CB 3.4Å; Y529-A532 PolarHBondContact O-N 2.86Å
530A82.2Confident86.8Confident1 Ų130.6 Ų30.61%0.00816%0.157CC..THydrogen-bonded Turntrans-69.1-9.8-171.100000114.9V367 R421 Y425 S428V367-A530 HydrophobicContact CG2-CB 4.33Å; R421-A530 WeakPolarHBondContact CD-O 3.49Å; R421-A530 PolarHBondContact NH1-O 2.73Å; Y425-A530 HydrophobicContact CD1-CB 3.38Å; Y425-A530 HydrophobicContact CE1-CB 3.6Å; Y425-A530 HydrophobicContact CG-CB 3.89Å; S428-A530 WeakPolarHBondContact O-CB 3.31Å
531L82.4Confident86.5Confident104 Ų10430.3 Ų30.355%0.54516%0.156SC..THydrogen-bonded Turntrans-95.46.7171.6-77.7168.8000114.2Y425 Y529 V534Y425-L531 VanDerWaalsContact OH-CD2 3.24Å; Y425-L531 WeakPolarHBondContact OH-CD2 3.42Å; Y529-L531 HydrophobicContact CD2-CB 3.96Å; Y529-L531 VanDerWaalsContact CE2-C 3.5Å; Y529-L531 HydrophobicContact CE2-CB 4.22Å; Y529-L531 PolarHBondContact O-N 3.14Å; Y529-L531 VanDerWaalsContact O-N 3.11Å; L531-V534 HydrophobicContact CD2-CG2 4.11Å; L531-V534 VanDerWaalsContact O-CG2 3.22Å; L531-V534 WeakPolarHBondContact O-CG2 3.41Å
532A84.6Confident86Confident1 Ų129.2 Ų29.21%0.00815%0.151CC..THydrogen-bonded Turntrans-65155.4174.500000111.7I362 R421 F521 Y529 V534I362-A532 HydrophobicContact CG2-CB 4.24Å; R421-A532 PolarHBondContact NH1-O 2.86Å; R421-A532 PolarHBondContact NH2-O 3.19Å; F521-A532 HydrophobicContact CD1-CB 4.17Å; F521-A532 HydrophobicContact CE1-CB 3.7Å; Y529-A532 HydrophobicContact CD1-CB 4.34Å; Y529-A532 HydrophobicContact CD2-CB 4.21Å; Y529-A532 HydrophobicContact CE1-CB 4.06Å; Y529-A532 HydrophobicContact CE2-CB 3.93Å; Y529-A532 VanDerWaalsContact CE2-N 3.31Å; Y529-A532 HydrophobicContact CG-CB 4.4Å; Y529-A532 WeakPolarHBondContact O-CB 3.4Å; Y529-A532 PolarHBondContact O-N 2.86Å; A532-V534 PolarHBondContact O-N 2.85Å; A532-V534 VanDerWaalsContact O-N 3.09Å
533G82.8Confident85.8Confident4 Ų429.2 Ų29.24%0.04115%0.151CC..THydrogen-bonded Turntrans68.81.6175.200000116.9G359 G535 V536G359-G533 VanDerWaalsContact CA-O 3.28Å; G359-G533 WeakPolarHBondContact CA-O 3.34Å; G533-G535 PolarHBondContact O-N 3.14Å; G533-G535 VanDerWaalsContact O-N 3.13Å; G533-V536 WeakPolarHBondContact O-CB 3.46Å; G533-V536 PolarHBondContact O-N 2.82Å; G533-V536 VanDerWaalsContact O-N 3.08Å
534V81.7Confident85.6Confident50 Ų5028.6 Ų28.630%0.30315%0.147SC..THydrogen-bonded Turntrans-59.8111.6-179.7171.60000110.6W238 M287 L531 A532 V536W238-V534 HydrophobicContact CZ2-CG1 3.6Å; M287-V534 HydrophobicContact SD-CG2 4.29Å; L531-V534 HydrophobicContact CD2-CG2 4.11Å; L531-V534 VanDerWaalsContact O-CG2 3.22Å; L531-V534 WeakPolarHBondContact O-CG2 3.41Å; A532-V534 PolarHBondContact O-N 2.85Å; A532-V534 VanDerWaalsContact O-N 3.09Å; V534-V536 PolarHBondContact O-N 2.89Å
535G77Confident85.3Confident14 Ų1422.8 Ų22.814%0.14413%0.125CC..THydrogen-bonded Turntrans77.90.1-178.900000115.4G533 D537 L538 D539G533-G535 PolarHBondContact O-N 3.14Å; G533-G535 VanDerWaalsContact O-N 3.13Å; G535-D537 VanDerWaalsContact CA-OD1 3.25Å; G535-D537 WeakPolarHBondContact CA-OD1 3.21Å; G535-D537 PolarHBondContact N-OD1 2.86Å; G535-D537 PolarHBondContact O-N 2.93Å; G535-L538 WeakPolarHBondContact O-CB 3.42Å; G535-L538 PolarHBondContact O-N 3.1Å; G535-L538 VanDerWaalsContact O-N 3.12Å; G535-D539 PolarHBondContact O-N 3.03Å
536V85.8Confident84.9Confident21 Ų2120.6 Ų20.613%0.12711%0.112CC..Hα-helixtrans-68.4-28.4171.2-179.50000110.5F337 L338 I341 G533 V534 D539 A540F337-V536 HydrophobicContact CD2-CG1 3.87Å; F337-V536 HydrophobicContact CE2-CG1 3.62Å; F337-V536 HydrophobicContact CE2-CG2 4.04Å; L338-V536 HydrophobicContact CD1-CG1 4.23Å; I341-V536 HydrophobicContact CD1-CG1 3.39Å; G533-V536 WeakPolarHBondContact O-CB 3.46Å; G533-V536 PolarHBondContact O-N 2.82Å; G533-V536 VanDerWaalsContact O-N 3.08Å; V534-V536 PolarHBondContact O-N 2.89Å; V536-D539 PolarHBondContact O-N 2.76Å; V536-A540 WeakPolarHBondContact O-CB 3.24Å; V536-A540 PolarHBondContact O-N 2.98Å
537D85.9Confident84.7Confident0 Ų017.1 Ų17.10%010%0.096CC..Hα-helixtrans-52.9-56.6163.153.7-84.4000111.8N288 Q289 V358 G535 D539 A540 I541N288-D537 VanDerWaalsContact OD1-CG 3.27Å; N288-D537 PolarHBondContact OD1-OD2 3.19Å; Q289-D537 VanDerWaalsContact CG-OD2 3.31Å; Q289-D537 WeakPolarHBondContact CG-OD2 3.28Å; Q289-D537 VanDerWaalsContact NE2-CB 3.27Å; Q289-D537 VanDerWaalsContact NE2-CG 3.26Å; Q289-D537 PolarHBondContact NE2-OD2 2.86Å; V358-D537 HydrophobicContact CG2-CB 3.56Å; G535-D537 VanDerWaalsContact CA-OD1 3.25Å; G535-D537 WeakPolarHBondContact CA-OD1 3.21Å; G535-D537 PolarHBondContact N-OD1 2.86Å; G535-D537 PolarHBondContact O-N 2.93Å; D537-D539 VanDerWaalsContact C-N 3.29Å; D537-D539 PolarHBondContact O-N 3.48Å; D537-A540 CarbonylContact O-C 3.59Å; D537-A540 WeakPolarHBondContact O-CB 3.48Å; D537-A540 PolarHBondContact O-N 3.48Å; D537-A540 VanDerWaalsContact O-N 3.09Å; D537-I541 WeakPolarHBondContact O-CB 3.35Å; D537-I541 VanDerWaalsContact O-CD1 3.29Å; D537-I541 WeakPolarHBondContact O-CD1 3.47Å; D537-I541 WeakPolarHBondContact O-CG1 3.18Å; D537-I541 PolarHBondContact O-N 3.26Å
538L81.4Confident84.1Confident11 Ų1116.5 Ų16.56%0.0589%0.091CC..Hα-helixtrans-57.5-37.2177.4-98.6-179000113.6L120 M123 W238 Q289 G535 I541 A542L120-L538 HydrophobicContact CD1-CD2 3.79Å; M123-L538 HydrophobicContact CE-CD1 3.39Å; M123-L538 HydrophobicContact CE-CD2 3.69Å; M123-L538 HydrophobicContact CE-CG 4.14Å; M123-L538 HydrophobicContact SD-CD1 3.75Å; M123-L538 HydrophobicContact SD-CD2 4.03Å; W238-L538 HydrophobicContact CH2-CD1 3.83Å; W238-L538 HydrophobicContact CZ3-CD1 3.54Å; W238-L538 HydrophobicContact CZ3-CG 4.45Å; Q289-L538 HydrophobicContact CB-CD2 4.16Å; Q289-L538 HydrophobicContact CB-CG 4.34Å; Q289-L538 HydrophobicContact CG-CD2 3.89Å; Q289-L538 HydrophobicContact CG-CG 3.72Å; G535-L538 WeakPolarHBondContact O-CB 3.42Å; G535-L538 PolarHBondContact O-N 3.1Å; G535-L538 VanDerWaalsContact O-N 3.12Å; L538-I541 HydrophobicContact CD2-CG2 4.12Å; L538-I541 WeakPolarHBondContact O-CB 3.46Å; L538-I541 WeakPolarHBondContact O-CG2 3.38Å; L538-I541 PolarHBondContact O-N 3.41Å; L538-A542 WeakPolarHBondContact O-CB 3.23Å; L538-A542 PolarHBondContact O-N 3.43Å
539D84.4Confident83.7Confident58 Ų5816.5 Ų16.531%0.319%0.09SC..Hα-helixtrans-73.1-37.6175.8-80.20.6000111.6L338 G535 V536 D537 I541 A542 S543 Q568L338-D539 HydrophobicContact CD1-CB 3.93Å; G535-D539 PolarHBondContact O-N 3.03Å; V536-D539 PolarHBondContact O-N 2.76Å; D537-D539 VanDerWaalsContact C-N 3.29Å; D537-D539 PolarHBondContact O-N 3.48Å; D539-I541 VanDerWaalsContact C-N 3.32Å; D539-A542 PolarHBondContact O-N 3.39Å; D539-S543 WeakPolarHBondContact O-CB 3.43Å; D539-S543 PolarHBondContact O-N 3.12Å; D539-S543 PolarHBondContact O-OG 2.86Å; D539-Q568 VanDerWaalsContact CG-NE2 3.3Å; D539-Q568 PolarHBondContact O-OE1 2.78Å; D539-Q568 PolarHBondContact OD2-NE2 2.92Å
540A90.3Very high83.1Confident0 Ų013.1 Ų13.10%08%0.077CC..Hα-helixtrans-64.7-41.4171.400000110.3L338 I341 A342 V536 D537 S543 V544L338-A540 HydrophobicContact CD1-CB 3.9Å; I341-A540 HydrophobicContact CB-CB 4.27Å; I341-A540 HydrophobicContact CG2-CB 3.74Å; A342-A540 HydrophobicContact CB-CB 4.32Å; V536-A540 WeakPolarHBondContact O-CB 3.24Å; V536-A540 PolarHBondContact O-N 2.98Å; D537-A540 CarbonylContact O-C 3.59Å; D537-A540 WeakPolarHBondContact O-CB 3.48Å; D537-A540 PolarHBondContact O-N 3.48Å; D537-A540 VanDerWaalsContact O-N 3.09Å; A540-S543 PolarHBondContact O-N 3.46Å; A540-V544 WeakPolarHBondContact O-CB 3.4Å; A540-V544 WeakPolarHBondContact O-CG2 3.48Å; A540-V544 PolarHBondContact O-N 2.91Å
541I85.2Confident82.5Confident0 Ų013.5 Ų13.50%08%0.079CC..Hα-helixtrans-51.8-54.7170.3-88.9144.9000111.1L120 Q289 E290 Y291 M345 D537 L538 D539 V545L120-I541 HydrophobicContact CD1-CG2 4.37Å; L120-I541 HydrophobicContact CD2-CG2 4.21Å; Q289-I541 HydrophobicContact CG-CD1 3.77Å; E290-I541 HydrophobicContact CG-CD1 3.39Å; E290-I541 HydrophobicContact CG-CG1 3.91Å; E290-I541 HydrophobicContact CG-CG2 4.39Å; Y291-I541 HydrophobicContact CD1-CB 3.86Å; Y291-I541 HydrophobicContact CD1-CG1 3.7Å; Y291-I541 HydrophobicContact CD1-CG2 3.49Å; Y291-I541 VanDerWaalsContact CD1-CG2 3.49Å; Y291-I541 HydrophobicContact CD2-CG1 4.08Å; Y291-I541 VanDerWaalsContact CE1-CA 3.48Å; Y291-I541 HydrophobicContact CE1-CB 3.64Å; Y291-I541 HydrophobicContact CE1-CG1 3.31Å; Y291-I541 HydrophobicContact CE1-CG2 3.83Å; Y291-I541 HydrophobicContact CE2-CD1 4.43Å; Y291-I541 HydrophobicContact CE2-CG1 3.69Å; Y291-I541 HydrophobicContact CG-CG1 4.04Å; Y291-I541 HydrophobicContact CG-CG2 4.04Å; M345-I541 HydrophobicContact CE-CD1 3.91Å; M345-I541 HydrophobicContact CE-CG1 3.87Å; D537-I541 WeakPolarHBondContact O-CB 3.35Å; D537-I541 VanDerWaalsContact O-CD1 3.29Å; D537-I541 WeakPolarHBondContact O-CD1 3.47Å; D537-I541 WeakPolarHBondContact O-CG1 3.18Å; D537-I541 PolarHBondContact O-N 3.26Å; L538-I541 HydrophobicContact CD2-CG2 4.12Å; L538-I541 WeakPolarHBondContact O-CB 3.46Å; L538-I541 WeakPolarHBondContact O-CG2 3.38Å; L538-I541 PolarHBondContact O-N 3.41Å; D539-I541 VanDerWaalsContact C-N 3.32Å; I541-V545 VanDerWaalsContact O-CG2 3.31Å; I541-V545 WeakPolarHBondContact O-CG2 3.09Å; I541-V545 PolarHBondContact O-N 2.85Å; I541-V545 VanDerWaalsContact O-N 3.13Å
542A81Confident81.6Confident0 Ų012 Ų120%08%0.077CC..Hα-helixtrans-65.7-46.2-179.900000111.7L538 D539 V544 V545 I546 I590 L594L538-A542 WeakPolarHBondContact O-CB 3.23Å; L538-A542 PolarHBondContact O-N 3.43Å; D539-A542 PolarHBondContact O-N 3.39Å; A542-V544 PolarHBondContact O-N 3.13Å; A542-V545 WeakPolarHBondContact O-CB 3.27Å; A542-V545 PolarHBondContact O-N 2.79Å; A542-I546 VanDerWaalsContact O-CG1 3.27Å; A542-I546 WeakPolarHBondContact O-CG1 3.24Å; A542-I546 PolarHBondContact O-N 3.29Å; A542-I590 HydrophobicContact CB-CG2 4.46Å; A542-L594 HydrophobicContact CB-CD1 4.15Å
543S88.5Confident81.2Confident0 Ų012 Ų120%08%0.077CC..Hα-helixtrans-59.6-43.5177.8-80.80000112.7D539 A540 V545 I546 G547 G564 V565 Q568D539-S543 WeakPolarHBondContact O-CB 3.43Å; D539-S543 PolarHBondContact O-N 3.12Å; D539-S543 PolarHBondContact O-OG 2.86Å; A540-S543 PolarHBondContact O-N 3.46Å; S543-V545 VanDerWaalsContact C-N 3.34Å; S543-V545 PolarHBondContact O-N 2.87Å; S543-I546 PolarHBondContact O-N 3.09Å; S543-G547 PolarHBondContact O-N 3.06Å; S543-G564 WeakPolarHBondContact O-CA 2.99Å; S543-V565 WeakPolarHBondContact OG-CA 3.3Å; S543-Q568 PolarHBondContact OG-OE1 2.81Å
544V89.1Confident80.8Confident0 Ų012.6 Ų12.60%08%0.083CC..Hα-helixtrans-67.9-35.7177.8-179.10000111.1A342 I349 A540 A542 G547 G548 T549 T561A342-V544 HydrophobicContact CB-CG2 3.8Å; A342-V544 WeakPolarHBondContact O-CG2 3.35Å; I349-V544 HydrophobicContact CD1-CB 3.83Å; I349-V544 HydrophobicContact CD1-CG1 3.29Å; I349-V544 HydrophobicContact CG1-CG1 4.47Å; A540-V544 WeakPolarHBondContact O-CB 3.4Å; A540-V544 WeakPolarHBondContact O-CG2 3.48Å; A540-V544 PolarHBondContact O-N 2.91Å; A542-V544 PolarHBondContact O-N 3.13Å; V544-G547 CarbonylContact O-C 3.49Å; V544-G547 WeakPolarHBondContact O-CA 3.4Å; V544-G547 PolarHBondContact O-N 3.41Å; V544-G548 PolarHBondContact O-N 3.45Å; V544-T549 VanDerWaalsContact CG1-CB 3.46Å; V544-T549 HydrophobicContact CG1-CG2 3.55Å; V544-T549 WeakPolarHBondContact O-CB 3.4Å; V544-T549 PolarHBondContact O-N 2.66Å; V544-T561 HydrophobicContact CB-CG2 4.35Å; V544-T561 HydrophobicContact CG2-CG2 3.57Å
545V80Confident80.6Confident5 Ų511.6 Ų11.63%0.038%0.078CC..Hα-helixtrans-65-50.1172.8170.20000111.8Y291 I541 A542 S543 G547 G548 L551 L594 F597 I598Y291-V545 HydrophobicContact CD1-CG2 3.98Å; Y291-V545 HydrophobicContact CE1-CG2 4.36Å; I541-V545 VanDerWaalsContact O-CG2 3.31Å; I541-V545 WeakPolarHBondContact O-CG2 3.09Å; I541-V545 PolarHBondContact O-N 2.85Å; I541-V545 VanDerWaalsContact O-N 3.13Å; A542-V545 WeakPolarHBondContact O-CB 3.27Å; A542-V545 PolarHBondContact O-N 2.79Å; S543-V545 VanDerWaalsContact C-N 3.34Å; S543-V545 PolarHBondContact O-N 2.87Å; V545-G547 PolarHBondContact O-N 2.92Å; V545-G548 PolarHBondContact O-N 2.87Å; V545-L551 HydrophobicContact CG2-CD1 3.32Å; V545-L594 HydrophobicContact CB-CD2 4.19Å; V545-L594 HydrophobicContact CG1-CD2 3.74Å; V545-F597 WeakPolarHBondContact O-CE1 3.48Å; V545-I598 HydrophobicContact CG1-CD1 4.04Å
546I82.5Confident80.9Confident2 Ų211 Ų111%0.017%0.072CC..Hα-helixtrans-59.8-33175-65162.3000110.1T304 A542 S543 G548 I567 I590 L593 L594 F597T304-I546 HydrophobicContact CG2-CG2 4.48Å; T304-I546 WeakPolarHBondContact CG2-O 3.25Å; T304-I546 PolarHBondContact OG1-O 3.44Å; A542-I546 VanDerWaalsContact O-CG1 3.27Å; A542-I546 WeakPolarHBondContact O-CG1 3.24Å; A542-I546 PolarHBondContact O-N 3.29Å; S543-I546 PolarHBondContact O-N 3.09Å; I546-G548 PolarHBondContact O-N 3.18Å; I546-G548 VanDerWaalsContact O-N 3.12Å; I546-I567 HydrophobicContact CG2-CB 4.42Å; I546-I567 HydrophobicContact CG2-CD1 3.75Å; I546-I590 HydrophobicContact CD1-CG2 4.19Å; I546-L593 HydrophobicContact CD1-CD2 4.23Å; I546-L593 HydrophobicContact CG2-CD2 4.06Å; I546-L594 HydrophobicContact CD1-CD2 4.16Å; I546-L594 HydrophobicContact CD1-CG 4.24Å; I546-L594 HydrophobicContact CG1-CD2 3.68Å; I546-L594 HydrophobicContact CG1-CG 4.18Å; I546-F597 WeakPolarHBondContact O-CZ 3.16Å
547G84.6Confident81Confident0 Ų011 Ų110%07%0.071CC..THydrogen-bonded Turntrans-65.2-2.4170.900000115.8S543 V544 V545 T549 G560S543-G547 PolarHBondContact O-N 3.06Å; V544-G547 CarbonylContact O-C 3.49Å; V544-G547 WeakPolarHBondContact O-CA 3.4Å; V544-G547 PolarHBondContact O-N 3.41Å; V545-G547 PolarHBondContact O-N 2.92Å; G547-T549 VanDerWaalsContact C-N 3.26Å; G547-T549 PolarHBondContact O-N 3.47Å; G547-G560 WeakPolarHBondContact CA-O 3.43Å; G547-G560 CarbonylContact O-C 3.43Å; G547-G560 VanDerWaalsContact O-C 3.31Å; G547-G560 WeakPolarHBondContact O-CA 3.46Å
548G78.4Confident81.2Confident2 Ų211 Ų112%0.0217%0.071CC..THydrogen-bonded Turntrans79.26177.300000114.9V544 V545 I546V544-G548 PolarHBondContact O-N 3.45Å; V545-G548 PolarHBondContact O-N 2.87Å; I546-G548 PolarHBondContact O-N 3.18Å; I546-G548 VanDerWaalsContact O-N 3.12Å
549T81.6Confident81.6Confident1 Ų113.7 Ų13.71%0.0069%0.086CC..  trans-81.9141.3168-63.60000109.3T346 I349 L350 V544 G547 G556 T557T346-T549 HydrophobicContact CG2-CG2 4.08Å; I349-T549 HydrophobicContact CB-CG2 4.02Å; I349-T549 HydrophobicContact CD1-CG2 4.31Å; I349-T549 HydrophobicContact CG2-CG2 3.61Å; L350-T549 HydrophobicContact CD2-CG2 4.19Å; L350-T549 HydrophobicContact CG-CG2 4.18Å; V544-T549 VanDerWaalsContact CG1-CB 3.46Å; V544-T549 HydrophobicContact CG1-CG2 3.55Å; V544-T549 WeakPolarHBondContact O-CB 3.4Å; V544-T549 PolarHBondContact O-N 2.66Å; G547-T549 VanDerWaalsContact C-N 3.26Å; G547-T549 PolarHBondContact O-N 3.47Å; T549-G556 VanDerWaalsContact CA-CA 3.5Å; T549-G556 VanDerWaalsContact OG1-CA 3.24Å; T549-G556 WeakPolarHBondContact OG1-CA 3.21Å; T549-T557 PolarHBondContact OG1-N 3.09Å; T549-T557 PolarHBondContact OG1-O 3.2Å
550L75.1Confident81.8Confident2 Ų211 Ų111%0.017%0.071CC..BIsolated β-bridgetrans-151.9158.8-156.15567.9000113.1V294 I295 I349 G553 V555V294-L550 HydrophobicContact CB-CB 4.27Å; V294-L550 HydrophobicContact CB-CD1 4.01Å; V294-L550 HydrophobicContact CB-CD2 4.2Å; V294-L550 HydrophobicContact CB-CG 4.38Å; V294-L550 HydrophobicContact CG1-CD1 3.53Å; V294-L550 HydrophobicContact CG1-CD2 3.9Å; V294-L550 HydrophobicContact CG1-CG 4.22Å; V294-L550 HydrophobicContact CG2-CB 3.99Å; V294-L550 HydrophobicContact CG2-CD1 3.72Å; V294-L550 HydrophobicContact CG2-CG 4.33Å; I295-L550 VanDerWaalsContact N-CD2 3.35Å; I349-L550 VanDerWaalsContact CG2-O 3.27Å; I349-L550 WeakPolarHBondContact CG2-O 3.45Å; L550-G553 WeakPolarHBondContact O-CA 3.3Å; L550-G553 PolarHBondContact O-N 2.96Å; L550-V555 HydrophobicContact CD1-CB 3.39Å; L550-V555 HydrophobicContact CD1-CG2 3.54Å; L550-V555 VanDerWaalsContact CD1-O 3.29Å; L550-V555 WeakPolarHBondContact CD1-O 3.5Å; L550-V555 HydrophobicContact CD2-CB 4.22Å; L550-V555 HydrophobicContact CG-CB 3.99Å; L550-V555 VanDerWaalsContact CG-O 3.31Å; L550-V555 WeakPolarHBondContact CG-O 3.49Å; L550-V555 PolarHBondContact N-O 3.12Å
551L70.6Confident81.8Confident9 Ų911 Ų115%0.0477%0.071CC..THydrogen-bonded Turn-1264.7-126.6-92.5152.5000116.7Y291 V292 I349 V545 G553Y291-L551 HydrophobicContact CD1-CD1 3.14Å; Y291-L551 HydrophobicContact CD1-CD2 3.67Å; Y291-L551 HydrophobicContact CD1-CG 4.03Å; Y291-L551 HydrophobicContact CD2-CD1 4.4Å; Y291-L551 HydrophobicContact CD2-CD2 3.48Å; Y291-L551 VanDerWaalsContact CD2-CD2 3.48Å; Y291-L551 HydrophobicContact CE1-CD1 3.68Å; Y291-L551 HydrophobicContact CE1-CD2 3.78Å; Y291-L551 HydrophobicContact CE1-CG 4.28Å; Y291-L551 HydrophobicContact CE2-CD2 3.66Å; Y291-L551 HydrophobicContact CG-CD1 3.61Å; Y291-L551 HydrophobicContact CG-CD2 3.55Å; Y291-L551 HydrophobicContact CG-CG 4.23Å; V292-L551 HydrophobicContact CB-CB 3.81Å; V292-L551 HydrophobicContact CB-CD1 4.47Å; V292-L551 HydrophobicContact CG1-CB 3.84Å; V292-L551 HydrophobicContact CG2-CB 3.55Å; V292-L551 HydrophobicContact CG2-CD1 4.35Å; V292-L551 HydrophobicContact CG2-CD2 4.05Å; V292-L551 HydrophobicContact CG2-CG 4.2Å; V292-L551 VanDerWaalsContact N-CD1 3.3Å; I349-L551 HydrophobicContact CB-CD2 4.02Å; I349-L551 HydrophobicContact CB-CG 4.43Å; I349-L551 HydrophobicContact CD1-CD1 4.23Å; I349-L551 HydrophobicContact CD1-CD2 3.84Å; I349-L551 HydrophobicContact CD1-CG 4.04Å; I349-L551 HydrophobicContact CG1-CD2 3.57Å; I349-L551 HydrophobicContact CG1-CG 4.21Å; I349-L551 HydrophobicContact CG2-CB 4.36Å; I349-L551 HydrophobicContact CG2-CD2 3.57Å; I349-L551 HydrophobicContact CG2-CG 3.5Å; V545-L551 HydrophobicContact CG2-CD1 3.32Å; L551-G553 PolarHBondContact O-N 2.86Å
552S64Low82.1Confident71 Ų7112.4 Ų12.450%0.4978%0.078SC..THydrogen-bonded Turntrans-68.2-9.3142.464.20000111.6V294V294-S552 WeakPolarHBondContact CG2-OG 3.48Å
553G75.4Confident82.5Confident2 Ų214.7 Ų14.72%0.0219%0.088CC..THydrogen-bonded Turntrans90.3-175.1-171.300000113.4I349 G486 L550 L551 V555I349-G553 VanDerWaalsContact O-CA 3.28Å; I349-G553 WeakPolarHBondContact O-CA 3.49Å; G486-G553 CarbonylContact O-C 3.57Å; L550-G553 WeakPolarHBondContact O-CA 3.3Å; L550-G553 PolarHBondContact O-N 2.96Å; L551-G553 PolarHBondContact O-N 2.86Å; G553-V555 PolarHBondContact O-N 3.38Å; G553-V555 VanDerWaalsContact O-N 3.1Å
554G74.3Confident82.5Confident16 Ų1614.7 Ų14.717%0.1659%0.088CC..THydrogen-bonded Turntrans76.6-8.5169.600000115.8L350 G486L350-G554 PolarHBondContact O-N 3.47Å; G486-G554 VanDerWaalsContact C-CA 3.47Å; G486-G554 VanDerWaalsContact C-N 3.3Å; G486-G554 PolarHBondContact O-N 3.06Å
555V78.4Confident82.6Confident30 Ų3014.8 Ų14.818%0.1829%0.089CC..BIsolated β-bridgetrans-148.6142.6-179.9-137.60000113.7R297 L350 L550 G553R297-V555 HydrophobicContact CB-CG1 3.39Å; R297-V555 HydrophobicContact CG-CG1 3.45Å; R297-V555 VanDerWaalsContact CG-CG1 3.45Å; L350-V555 WeakPolarHBondContact CD2-O 3.39Å; L550-V555 HydrophobicContact CD1-CB 3.39Å; L550-V555 HydrophobicContact CD1-CG2 3.54Å; L550-V555 VanDerWaalsContact CD1-O 3.29Å; L550-V555 WeakPolarHBondContact CD1-O 3.5Å; L550-V555 HydrophobicContact CD2-CB 4.22Å; L550-V555 HydrophobicContact CG-CB 3.99Å; L550-V555 VanDerWaalsContact CG-O 3.31Å; L550-V555 WeakPolarHBondContact CG-O 3.49Å; L550-V555 PolarHBondContact N-O 3.12Å; G553-V555 PolarHBondContact O-N 3.38Å; G553-V555 VanDerWaalsContact O-N 3.1Å
556G82Confident83.1Confident2 Ų215 Ų152%0.0219%0.091CC..  trans149.9-179.8-175.900000111.1Y483 T549Y483-G556 PolarHBondContact OH-O 3.06Å; Y483-G556 VanDerWaalsContact OH-O 3.08Å; T549-G556 VanDerWaalsContact CA-CA 3.5Å; T549-G556 VanDerWaalsContact OG1-CA 3.24Å; T549-G556 WeakPolarHBondContact OG1-CA 3.21Å
557T88.2Confident83.3Confident20 Ų2015.1 Ų15.112%0.1239%0.092CC..  trans-153.1144.1170.762.90000110.9L301 T549 L559 G560 T561L301-T557 HydrophobicContact CD1-CG2 4.39Å; L301-T557 VanDerWaalsContact CD1-OG1 3.3Å; L301-T557 WeakPolarHBondContact CD1-OG1 3.44Å; T549-T557 PolarHBondContact OG1-N 3.09Å; T549-T557 PolarHBondContact OG1-O 3.2Å; T557-L559 PolarHBondContact O-N 2.83Å; T557-G560 PolarHBondContact O-N 3.45Å; T557-G560 PolarHBondContact OG1-N 3.38Å; T557-T561 PolarHBondContact O-N 2.85Å; T557-T561 VanDerWaalsContact O-N 3.1Å; T557-T561 PolarHBondContact O-OG1 3.13Å
558V91Very high83.2Confident0 Ų015.9 Ų15.90%010%0.096CC..Hα-helixtrans-63.6-30.1174.4-177.10000112.2V343 T346 F347 V466 I470 A473 T561 L562V343-V558 HydrophobicContact CB-CG1 4.35Å; V343-V558 HydrophobicContact CG1-CG1 3.92Å; V343-V558 HydrophobicContact CG2-CG1 3.81Å; T346-V558 HydrophobicContact CG2-CG2 3.8Å; F347-V558 HydrophobicContact CE2-CG2 4.18Å; F347-V558 HydrophobicContact CZ-CG2 4.31Å; V466-V558 HydrophobicContact CG1-CG1 4.37Å; I470-V558 HydrophobicContact CG1-CB 3.88Å; I470-V558 HydrophobicContact CG1-CG1 4.11Å; A473-V558 HydrophobicContact CB-CG2 4.16Å; V558-T561 WeakPolarHBondContact O-CB 3.22Å; V558-T561 PolarHBondContact O-N 2.87Å; V558-L562 PolarHBondContact O-N 3.47Å
559L88.9Confident83.5Confident68 Ų6815.9 Ų15.936%0.35610%0.095SC..Hα-helixtrans-68.5-41.1173.9-178.159.5000111.9L301 I470 T557 T561 L562 F563L301-L559 HydrophobicContact CD1-CB 4.22Å; L301-L559 HydrophobicContact CD1-CD2 4.28Å; L301-L559 HydrophobicContact CD1-CG 4.27Å; I470-L559 HydrophobicContact CD1-CB 3.91Å; I470-L559 HydrophobicContact CD1-CD1 4.24Å; I470-L559 HydrophobicContact CG1-CB 4.36Å; T557-L559 PolarHBondContact O-N 2.83Å; L559-T561 VanDerWaalsContact C-N 3.32Å; L559-T561 PolarHBondContact O-N 2.85Å; L559-L562 PolarHBondContact O-N 3.31Å; L559-F563 HydrophobicContact CD1-CD2 4.39Å; L559-F563 HydrophobicContact CD1-CE2 3.98Å; L559-F563 HydrophobicContact CG-CD2 4.4Å; L559-F563 HydrophobicContact CG-CE2 4.18Å; L559-F563 WeakPolarHBondContact O-CD2 3.24Å; L559-F563 PolarHBondContact O-N 2.96Å
560G88.5Confident83.8Confident0 Ų016.1 Ų16.10%010%0.097CC..Hα-helixtrans-59.9-44.3173.800000111.3G547 T557 L562 F563 G564G547-G560 WeakPolarHBondContact CA-O 3.43Å; G547-G560 CarbonylContact O-C 3.43Å; G547-G560 VanDerWaalsContact O-C 3.31Å; G547-G560 WeakPolarHBondContact O-CA 3.46Å; T557-G560 PolarHBondContact O-N 3.45Å; T557-G560 PolarHBondContact OG1-N 3.38Å; G560-L562 VanDerWaalsContact C-N 3.33Å; G560-L562 PolarHBondContact O-N 3.49Å; G560-F563 CarbonylContact O-C 3.52Å; G560-F563 WeakPolarHBondContact O-CA 3.26Å; G560-F563 PolarHBondContact O-N 3.43Å; G560-G564 PolarHBondContact O-N 3.45Å
561T90.6Very high84.2Confident1 Ų117.4 Ų17.41%0.00610%0.103CC..Hα-helixtrans-53.1-44.8172.8-60.10000113.2A342 T346 V544 T557 V558 L559 F563 G564 V565A342-T561 HydrophobicContact CB-CG2 3.49Å; A342-T561 VanDerWaalsContact CB-CG2 3.49Å; T346-T561 WeakPolarHBondContact OG1-CB 3.2Å; T346-T561 WeakPolarHBondContact OG1-CG2 3.36Å; T346-T561 PolarHBondContact OG1-OG1 3.36Å; V544-T561 HydrophobicContact CB-CG2 4.35Å; V544-T561 HydrophobicContact CG2-CG2 3.57Å; T557-T561 PolarHBondContact O-N 2.85Å; T557-T561 VanDerWaalsContact O-N 3.1Å; T557-T561 PolarHBondContact O-OG1 3.13Å; V558-T561 WeakPolarHBondContact O-CB 3.22Å; V558-T561 PolarHBondContact O-N 2.87Å; L559-T561 VanDerWaalsContact C-N 3.32Å; L559-T561 PolarHBondContact O-N 2.85Å; T561-F563 VanDerWaalsContact C-N 3.3Å; T561-F563 PolarHBondContact O-N 2.9Å; T561-G564 PolarHBondContact O-N 2.78Å; T561-G564 VanDerWaalsContact O-N 3.09Å; T561-V565 WeakPolarHBondContact O-CG2 3.41Å; T561-V565 PolarHBondContact O-N 2.9Å
562L91.8Very high84.8Confident29 Ų2920 Ų2015%0.15212%0.115CC..Hα-helixtrans-58.3-42175172.963.3000111.6L332 M462 L463 V466 V558 L559 G560 V565 A566L332-L562 HydrophobicContact CD2-CD1 4.48Å; M462-L562 HydrophobicContact CE-CD1 4.2Å; M462-L562 HydrophobicContact SD-CD1 4.44Å; L463-L562 HydrophobicContact CD2-CD2 4.22Å; V466-L562 HydrophobicContact CG1-CB 4.23Å; V466-L562 HydrophobicContact CG1-CD2 4.07Å; V466-L562 HydrophobicContact CG2-CB 4.36Å; V466-L562 HydrophobicContact CG2-CD1 4.39Å; V558-L562 PolarHBondContact O-N 3.47Å; L559-L562 PolarHBondContact O-N 3.31Å; G560-L562 VanDerWaalsContact C-N 3.33Å; G560-L562 PolarHBondContact O-N 3.49Å; L562-V565 PolarHBondContact O-N 2.76Å; L562-A566 VanDerWaalsContact O-CB 3.31Å; L562-A566 WeakPolarHBondContact O-CB 3.43Å; L562-A566 PolarHBondContact O-N 2.92Å
563F89.6Confident85.7Confident48 Ų4817.6 Ų17.621%0.21110%0.098CC..Hα-helixtrans-68.1-32.6175.2-77.3-76.9000112.9T304 I305 F308 L559 G560 T561 A566 I567T304-F563 HydrophobicContact CG2-CB 3.66Å; I305-F563 HydrophobicContact CD1-CD2 4.09Å; I305-F563 HydrophobicContact CD1-CE2 3.78Å; I305-F563 HydrophobicContact CD1-CZ 4.29Å; I305-F563 HydrophobicContact CG1-CD1 4.21Å; I305-F563 HydrophobicContact CG1-CD2 3.6Å; I305-F563 HydrophobicContact CG1-CE1 4.23Å; I305-F563 HydrophobicContact CG1-CE2 3.63Å; I305-F563 HydrophobicContact CG1-CG 3.91Å; I305-F563 HydrophobicContact CG1-CZ 3.96Å; F308-F563 HydrophobicContact CB-CD1 4.13Å; F308-F563 AromaticContact CD1-CD1 3.78Å; F308-F563 HydrophobicContact CD1-CD1 3.78Å; F308-F563 AromaticContact CD1-CE1 3.81Å; F308-F563 HydrophobicContact CD1-CE1 3.81Å; F308-F563 HydrophobicContact CE1-CD1 4.38Å; F308-F563 HydrophobicContact CE1-CE1 4.19Å; F308-F563 AromaticContact CG-CD1 3.92Å; F308-F563 HydrophobicContact CG-CD1 3.92Å; F308-F563 HydrophobicContact CG-CE1 4.41Å; L559-F563 HydrophobicContact CD1-CD2 4.39Å; L559-F563 HydrophobicContact CD1-CE2 3.98Å; L559-F563 HydrophobicContact CG-CD2 4.4Å; L559-F563 HydrophobicContact CG-CE2 4.18Å; L559-F563 WeakPolarHBondContact O-CD2 3.24Å; L559-F563 PolarHBondContact O-N 2.96Å; G560-F563 CarbonylContact O-C 3.52Å; G560-F563 WeakPolarHBondContact O-CA 3.26Å; G560-F563 PolarHBondContact O-N 3.43Å; T561-F563 VanDerWaalsContact C-N 3.3Å; T561-F563 PolarHBondContact O-N 2.9Å; F563-A566 PolarHBondContact O-N 3.49Å; F563-I567 WeakPolarHBondContact O-CD1 3.38Å; F563-I567 WeakPolarHBondContact O-CG1 3.29Å; F563-I567 PolarHBondContact O-N 3.45Å
564G88.4Confident86.2Confident0 Ų019.6 Ų19.60%011%0.105CC..Hα-helixtrans-61.9-48.5172.700000112.7S543 G560 T561 A566 I567 Q568S543-G564 WeakPolarHBondContact O-CA 2.99Å; G560-G564 PolarHBondContact O-N 3.45Å; T561-G564 PolarHBondContact O-N 2.78Å; T561-G564 VanDerWaalsContact O-N 3.09Å; G564-A566 VanDerWaalsContact C-N 3.33Å; G564-A566 PolarHBondContact O-N 2.96Å; G564-I567 PolarHBondContact O-N 3.27Å; G564-I567 VanDerWaalsContact O-N 3.17Å; G564-Q568 PolarHBondContact O-N 3.34Å
565V91.1Very high86.5Confident3 Ų319.2 Ų19.22%0.01810%0.099CC..Hα-helixtrans-61-41.3173176.80000111.2N335 L338 A342 S543 T561 L562 I567 Q568 G569N335-V565 HydrophobicContact CB-CG1 3.69Å; L338-V565 HydrophobicContact CD2-CG1 4.13Å; L338-V565 HydrophobicContact CG-CG1 4.15Å; L338-V565 HydrophobicContact CG-CG2 4.35Å; A342-V565 HydrophobicContact CB-CG2 3.78Å; S543-V565 WeakPolarHBondContact OG-CA 3.3Å; T561-V565 WeakPolarHBondContact O-CG2 3.41Å; T561-V565 PolarHBondContact O-N 2.9Å; L562-V565 PolarHBondContact O-N 2.76Å; V565-I567 VanDerWaalsContact C-N 3.3Å; V565-I567 PolarHBondContact O-N 3.05Å; V565-Q568 PolarHBondContact O-N 3.45Å; V565-G569 PolarHBondContact O-N 3.17Å
566A90.3Very high86.6Confident9 Ų923.1 Ų23.17%0.07412%0.118CC..Hα-helixtrans-66.2-29.7176.600000112.9F308 L562 F563 G564 L570F308-A566 HydrophobicContact CD2-CB 4.13Å; F308-A566 HydrophobicContact CE2-CB 3.7Å; F308-A566 HydrophobicContact CZ-CB 4.3Å; L562-A566 VanDerWaalsContact O-CB 3.31Å; L562-A566 WeakPolarHBondContact O-CB 3.43Å; L562-A566 PolarHBondContact O-N 2.92Å; F563-A566 PolarHBondContact O-N 3.49Å; G564-A566 VanDerWaalsContact C-N 3.33Å; G564-A566 PolarHBondContact O-N 2.96Å; A566-L570 WeakPolarHBondContact O-CB 3.4Å; A566-L570 PolarHBondContact O-N 3.48Å
567I86.9Confident86.6Confident5 Ų526.8 Ų26.83%0.02613%0.134CC..Hα-helixtrans-72.5-40.6172.5-66158.5000111.1T304 V307 F308 I546 F563 G564 V565 G569 L570 I571 L593T304-I567 HydrophobicContact CG2-CD1 3.56Å; V307-I567 HydrophobicContact CB-CD1 4.48Å; V307-I567 HydrophobicContact CG1-CD1 3.92Å; F308-I567 HydrophobicContact CB-CD1 4.11Å; F308-I567 HydrophobicContact CB-CG1 3.78Å; F308-I567 HydrophobicContact CD2-CG1 3.79Å; F308-I567 HydrophobicContact CG-CG1 4.28Å; I546-I567 HydrophobicContact CG2-CB 4.42Å; I546-I567 HydrophobicContact CG2-CD1 3.75Å; F563-I567 WeakPolarHBondContact O-CD1 3.38Å; F563-I567 WeakPolarHBondContact O-CG1 3.29Å; F563-I567 PolarHBondContact O-N 3.45Å; G564-I567 PolarHBondContact O-N 3.27Å; G564-I567 VanDerWaalsContact O-N 3.17Å; V565-I567 VanDerWaalsContact C-N 3.3Å; V565-I567 PolarHBondContact O-N 3.05Å; I567-G569 VanDerWaalsContact C-N 3.33Å; I567-G569 PolarHBondContact O-N 2.88Å; I567-L570 WeakPolarHBondContact O-CB 3.46Å; I567-L570 PolarHBondContact O-N 3.31Å; I567-I571 HydrophobicContact CG2-CD1 3.96Å; I567-I571 HydrophobicContact CG2-CG1 4.33Å; I567-I571 WeakPolarHBondContact O-CG1 3.18Å; I567-I571 PolarHBondContact O-N 2.86Å; I567-L593 HydrophobicContact CG2-CD2 3.35Å
568Q82.3Confident86.3Confident16 Ų1627.9 Ų27.98%0.07514%0.139CC..Hα-helixtrans-57.7-47.7172.3172.5163.6-8.800110.9L338 D539 S543 G564 V565 L570 I571 Q572 I590L338-Q568 HydrophobicContact CD2-CG 4.35Å; D539-Q568 VanDerWaalsContact CG-NE2 3.3Å; D539-Q568 PolarHBondContact O-OE1 2.78Å; D539-Q568 PolarHBondContact OD2-NE2 2.92Å; S543-Q568 PolarHBondContact OG-OE1 2.81Å; G564-Q568 PolarHBondContact O-N 3.34Å; V565-Q568 PolarHBondContact O-N 3.45Å; Q568-L570 PolarHBondContact O-N 2.98Å; Q568-I571 PolarHBondContact O-N 3.16Å; Q568-Q572 PolarHBondContact O-N 3.48Å; Q568-Q572 VanDerWaalsContact O-N 3.13Å; Q568-I590 HydrophobicContact CB-CD1 4.47Å; Q568-I590 HydrophobicContact CG-CD1 3.92Å
569G84.9Confident85.7Confident1 Ų131 Ų311%0.0117%0.171CC..Hα-helixtrans-61.5-38.3173.400000113.8N335 V565 I567 T573N335-G569 WeakPolarHBondContact ND2-CA 3.33Å; V565-G569 PolarHBondContact O-N 3.17Å; I567-G569 VanDerWaalsContact C-N 3.33Å; I567-G569 PolarHBondContact O-N 2.88Å; G569-T573 VanDerWaalsContact O-CB 3.3Å; G569-T573 WeakPolarHBondContact O-CB 3.38Å; G569-T573 PolarHBondContact O-N 3.02Å; G569-T573 PolarHBondContact O-OG1 3.07Å
570L87.3Confident85.1Confident7 Ų733.6 Ų33.64%0.03719%0.19CC..Hα-helixtrans-64.4-44.7177.1-179.164.5000112.2F308 Y312 F322 I331 A566 I567 Q568 T573 Y574F308-L570 HydrophobicContact CD2-CD2 3.98Å; F308-L570 HydrophobicContact CE2-CB 4.4Å; F308-L570 HydrophobicContact CE2-CD2 4.13Å; Y312-L570 HydrophobicContact CD2-CD1 3.89Å; Y312-L570 HydrophobicContact CE2-CD1 4.49Å; F322-L570 HydrophobicContact CD1-CD1 4.36Å; F322-L570 HydrophobicContact CE1-CD1 3.84Å; I331-L570 HydrophobicContact CD1-CD1 4.43Å; A566-L570 WeakPolarHBondContact O-CB 3.4Å; A566-L570 PolarHBondContact O-N 3.48Å; I567-L570 WeakPolarHBondContact O-CB 3.46Å; I567-L570 PolarHBondContact O-N 3.31Å; Q568-L570 PolarHBondContact O-N 2.98Å; L570-T573 PolarHBondContact O-N 3.48Å; L570-Y574 PolarHBondContact O-N 3.12Å
571I84.3Confident84.5Confident28 Ų2836.2 Ų36.214%0.14420%0.204CC..Hα-helixtrans-61.7-49.4177.3-68.3167.3000110.3I567 Q568 T573 Y574 I575 T586 A589 I590 L593I567-I571 HydrophobicContact CG2-CD1 3.96Å; I567-I571 HydrophobicContact CG2-CG1 4.33Å; I567-I571 WeakPolarHBondContact O-CG1 3.18Å; I567-I571 PolarHBondContact O-N 2.86Å; Q568-I571 PolarHBondContact O-N 3.16Å; I571-T573 VanDerWaalsContact C-N 3.27Å; I571-T573 PolarHBondContact O-N 3.31Å; I571-Y574 PolarHBondContact O-N 2.89Å; I571-I575 HydrophobicContact CG2-CD1 4.06Å; I571-I575 PolarHBondContact O-N 2.75Å; I571-I575 VanDerWaalsContact O-N 3.15Å; I571-T586 HydrophobicContact CG2-CG2 4.08Å; I571-A589 HydrophobicContact CG2-CB 3.67Å; I571-I590 HydrophobicContact CD1-CG1 3.89Å; I571-L593 HydrophobicContact CD1-CD2 4.04Å
572Q81.7Confident83.9Confident63 Ų6338.3 Ų38.329%0.29422%0.218SC..Hα-helixtrans-60.6-39.5177.6-174.359.76300111.4Q568 N576 T586Q568-Q572 PolarHBondContact O-N 3.48Å; Q568-Q572 VanDerWaalsContact O-N 3.13Å; Q572-N576 PolarHBondContact NE2-OD1 3.31Å; Q572-N576 WeakPolarHBondContact O-CB 3.26Å; Q572-N576 PolarHBondContact O-N 2.96Å; Q572-N576 PolarHBondContact O-ND2 3.46Å; Q572-N576 PolarHBondContact O-OD1 2.88Å; Q572-T586 HydrophobicContact CB-CG2 4.31Å; Q572-T586 PolarHBondContact OE1-OG1 2.92Å
573T84.2Confident82.9Confident22 Ų2239.5 Ų39.514%0.13523%0.23CC..Hα-helixtrans-67.1-39.6177.7-55.60000111.9F322 V327 I331 G569 L570 I571 N576 F577F322-T573 HydrophobicContact CE1-CG2 3.72Å; F322-T573 HydrophobicContact CZ-CG2 3.66Å; V327-T573 HydrophobicContact CG1-CG2 3.84Å; I331-T573 WeakPolarHBondContact CG1-OG1 3.43Å; G569-T573 VanDerWaalsContact O-CB 3.3Å; G569-T573 WeakPolarHBondContact O-CB 3.38Å; G569-T573 PolarHBondContact O-N 3.02Å; G569-T573 PolarHBondContact O-OG1 3.07Å; L570-T573 PolarHBondContact O-N 3.48Å; I571-T573 VanDerWaalsContact C-N 3.27Å; I571-T573 PolarHBondContact O-N 3.31Å; T573-N576 PolarHBondContact O-N 3.32Å; T573-F577 HydrophobicContact CG2-CD2 3.89Å; T573-F577 HydrophobicContact CG2-CE2 4.03Å; T573-F577 WeakPolarHBondContact O-CD2 3.35Å; T573-F577 PolarHBondContact O-N 3.13Å
574Y84.9Confident82.1Confident44 Ų4440.3 Ų40.317%0.17323%0.231CC..Hα-helixtrans-60.7-47.3176.7179.1-88.8000111.6Y314 C315 Q318 F319 L570 I571 N576 F577 D578 L581Y314-Y574 HydrophobicContact CD1-CE2 4.31Å; Y314-Y574 AromaticContact CE1-CE2 3.95Å; Y314-Y574 HydrophobicContact CE1-CE2 3.95Å; C315-Y574 HydrophobicContact CB-CD2 4.39Å; C315-Y574 VanDerWaalsContact SG-CD2 3.6Å; Q318-Y574 HydrophobicContact CB-CE2 4.46Å; Q318-Y574 HydrophobicContact CG-CE2 4.36Å; F319-Y574 HydrophobicContact CD2-CD2 4.23Å; F319-Y574 HydrophobicContact CD2-CE2 4.01Å; F319-Y574 HydrophobicContact CE2-CD2 4.11Å; F319-Y574 AromaticContact CE2-CE2 3.65Å; F319-Y574 HydrophobicContact CE2-CE2 3.65Å; F319-Y574 AromaticContact CE2-CZ 3.98Å; L570-Y574 PolarHBondContact O-N 3.12Å; I571-Y574 PolarHBondContact O-N 2.89Å; Y574-N576 VanDerWaalsContact C-N 3.32Å; Y574-N576 PolarHBondContact O-N 2.98Å; Y574-F577 PolarHBondContact O-N 3.18Å; Y574-F577 VanDerWaalsContact O-N 3.07Å; Y574-D578 HydrophobicContact CE1-CB 4.47Å; Y574-D578 PolarHBondContact O-N 3.37Å; Y574-L581 HydrophobicContact CD1-CD1 4.5Å; Y574-L581 HydrophobicContact CE1-CD1 4.05Å
575I80.3Confident81.5Confident8 Ų845.2 Ų45.24%0.04125%0.25CC..Hα-helixtrans-63.8-39.7178.9-69.1164.3000110.8I571 F577 D578 G579 L581 W585 T586I571-I575 HydrophobicContact CG2-CD1 4.06Å; I571-I575 PolarHBondContact O-N 2.75Å; I571-I575 VanDerWaalsContact O-N 3.15Å; I575-F577 VanDerWaalsContact C-N 3.27Å; I575-F577 PolarHBondContact O-N 3.04Å; I575-D578 PolarHBondContact O-N 3.45Å; I575-G579 PolarHBondContact O-N 3.18Å; I575-G579 VanDerWaalsContact O-N 3.09Å; I575-L581 HydrophobicContact CG1-CB 4.4Å; I575-L581 HydrophobicContact CG1-CD1 4.22Å; I575-L581 HydrophobicContact CG2-CB 4.05Å; I575-L581 WeakPolarHBondContact CG2-O 3.47Å; I575-W585 HydrophobicContact CD1-CB 3.85Å; I575-T586 VanDerWaalsContact CD1-N 3.28Å; I575-T586 WeakPolarHBondContact CD1-OG1 3.46Å
576N81.1Confident80.7Confident111 Ų11145.6 Ų45.659%0.59425%0.252SS*.Hα-helixtrans-65.2-25.7174.1-66.6-1.2000113.7Q572 T573 Y574Q572-N576 PolarHBondContact NE2-OD1 3.31Å; Q572-N576 WeakPolarHBondContact O-CB 3.26Å; Q572-N576 PolarHBondContact O-N 2.96Å; Q572-N576 PolarHBondContact O-ND2 3.46Å; Q572-N576 PolarHBondContact O-OD1 2.88Å; T573-N576 PolarHBondContact O-N 3.32Å; Y574-N576 VanDerWaalsContact C-N 3.32Å; Y574-N576 PolarHBondContact O-N 2.98Å
577F82.2Confident79.8Confident79 Ų7948.6 Ų48.635%0.34626%0.263SS..Hα-helixtrans-85.9-35177.1-102.5-93000113F319 F322 V327 T573 Y574 I575F319-F577 HydrophobicContact CB-CD1 3.98Å; F319-F577 HydrophobicContact CD1-CD1 4.41Å; F319-F577 HydrophobicContact CD2-CB 4.07Å; F319-F577 HydrophobicContact CE2-CB 4.35Å; F319-F577 HydrophobicContact CG-CB 4.19Å; F319-F577 HydrophobicContact CG-CD1 4.17Å; F322-F577 HydrophobicContact CD2-CD1 4.24Å; F322-F577 HydrophobicContact CD2-CD2 4.15Å; F322-F577 HydrophobicContact CD2-CE1 4.34Å; F322-F577 HydrophobicContact CD2-CE2 4.24Å; F322-F577 HydrophobicContact CD2-CG 4.14Å; F322-F577 HydrophobicContact CD2-CZ 4.34Å; F322-F577 HydrophobicContact CE2-CB 3.78Å; F322-F577 HydrophobicContact CE2-CD1 4.03Å; F322-F577 AromaticContact CE2-CD2 3.48Å; F322-F577 HydrophobicContact CE2-CD2 3.48Å; F322-F577 VanDerWaalsContact CE2-CD2 3.48Å; F322-F577 HydrophobicContact CE2-CE1 4.49Å; F322-F577 AromaticContact CE2-CE2 3.99Å; F322-F577 HydrophobicContact CE2-CE2 3.99Å; F322-F577 AromaticContact CE2-CG 3.49Å; F322-F577 HydrophobicContact CE2-CG 3.49Å; F322-F577 VanDerWaalsContact CE2-CG 3.49Å; F322-F577 HydrophobicContact CE2-CZ 4.46Å; F322-F577 HydrophobicContact CZ-CB 4.46Å; F322-F577 AromaticContact CZ-CD2 3.9Å; F322-F577 HydrophobicContact CZ-CD2 3.9Å; F322-F577 HydrophobicContact CZ-CE2 4.42Å; F322-F577 HydrophobicContact CZ-CG 4.28Å; V327-F577 HydrophobicContact CG2-CE2 3.8Å; V327-F577 HydrophobicContact CG2-CZ 3.76Å; T573-F577 HydrophobicContact CG2-CD2 3.89Å; T573-F577 HydrophobicContact CG2-CE2 4.03Å; T573-F577 WeakPolarHBondContact O-CD2 3.35Å; T573-F577 PolarHBondContact O-N 3.13Å; Y574-F577 PolarHBondContact O-N 3.18Å; Y574-F577 VanDerWaalsContact O-N 3.07Å; I575-F577 VanDerWaalsContact C-N 3.27Å; I575-F577 PolarHBondContact O-N 3.04Å
578D83.1Confident79.5Confident43 Ų4349 Ų4923%0.2327%0.265CS..Hα-helixtrans-67.4-47.5176.1178104.1000111.5F319 Y574 I575 T580 L581F319-D578 HydrophobicContact CE2-CB 4.28Å; F319-D578 HydrophobicContact CZ-CB 3.99Å; Y574-D578 HydrophobicContact CE1-CB 4.47Å; Y574-D578 PolarHBondContact O-N 3.37Å; I575-D578 PolarHBondContact O-N 3.45Å; D578-T580 PolarHBondContact O-N 3.02Å; D578-T580 WeakPolarHBondContact OD2-CA 3.42Å; D578-T580 WeakPolarHBondContact OD2-CB 3.5Å; D578-T580 PolarHBondContact OD2-N 3.3Å; D578-T580 PolarHBondContact OD2-OG1 2.96Å; D578-L581 HydrophobicContact CB-CD1 4.41Å; D578-L581 PolarHBondContact OD2-N 3.24Å
579G76.4Confident79.3Confident65 Ų6549.8 Ų49.867%0.6728%0.275SS*.  trans69.1-9.9175.600000115.9I575I575-G579 PolarHBondContact O-N 3.18Å; I575-G579 VanDerWaalsContact O-N 3.09Å
580T78.1Confident78.7Confident124 Ų12450 Ų5076%0.76128%0.275SS*.SBendtrans-92.3-33.2171.378.20000111.3D578D578-T580 PolarHBondContact O-N 3.02Å; D578-T580 WeakPolarHBondContact OD2-CA 3.42Å; D578-T580 WeakPolarHBondContact OD2-CB 3.5Å; D578-T580 PolarHBondContact OD2-N 3.3Å; D578-T580 PolarHBondContact OD2-OG1 2.96Å
581L75.5Confident78Confident54 Ų5449.7 Ų49.728%0.28327%0.274SS..SBendtrans-71126.3169.7-65.7174.2000110.7Y574 I575 D578 W585Y574-L581 HydrophobicContact CD1-CD1 4.5Å; Y574-L581 HydrophobicContact CE1-CD1 4.05Å; I575-L581 HydrophobicContact CG1-CB 4.4Å; I575-L581 HydrophobicContact CG1-CD1 4.22Å; I575-L581 HydrophobicContact CG2-CB 4.05Å; I575-L581 WeakPolarHBondContact CG2-O 3.47Å; D578-L581 HydrophobicContact CB-CD1 4.41Å; D578-L581 PolarHBondContact OD2-N 3.24Å; L581-W585 HydrophobicContact CD2-CD2 4.25Å; L581-W585 HydrophobicContact CD2-CG 4.08Å
582S77Confident77.8Confident45 Ų4552.4 Ų52.432%0.31529%0.288SS..  trans-67.5149.7169.4590000111.5L132 W584 W585L132-S582 WeakPolarHBondContact CD2-OG 3.45Å; S582-W584 PolarHBondContact O-N 3.12Å; S582-W585 WeakPolarHBondContact O-CB 3.37Å; S582-W585 PolarHBondContact O-N 3.49Å
583S71.8Confident77.5Confident55 Ų5550.6 Ų50.639%0.38528%0.281SS..THydrogen-bonded Turntrans-56.9-21178.352.50000114.1W585 T586S583-W585 PolarHBondContact O-N 3.15Å; S583-T586 VanDerWaalsContact O-CB 3.27Å; S583-T586 WeakPolarHBondContact O-CB 3.39Å; S583-T586 PolarHBondContact O-N 3.29Å; S583-T586 PolarHBondContact O-OG1 3.34Å; S583-T586 VanDerWaalsContact O-OG1 3.12Å
584W72.3Confident76.9Confident65 Ų6549.6 Ų49.625%0.24627%0.274CS..Hα-helixtrans-61.7-27.4174-43.1134.6000112.8Q131 L132 S135 S582 T586 K587Q131-W584 HydrophobicContact CB-CB 3.89Å; Q131-W584 HydrophobicContact CB-CD2 3.87Å; Q131-W584 HydrophobicContact CB-CE3 4.18Å; Q131-W584 HydrophobicContact CB-CG 3.72Å; Q131-W584 VanDerWaalsContact CD-CE3 3.43Å; Q131-W584 HydrophobicContact CG-CD2 4.4Å; Q131-W584 HydrophobicContact CG-CE3 4.27Å; L132-W584 HydrophobicContact CD2-CB 4.05Å; L132-W584 HydrophobicContact CG-CB 4.48Å; S135-W584 PolarHBondContact O-NE1 3.15Å; S135-W584 VanDerWaalsContact O-NE1 3.12Å; S582-W584 PolarHBondContact O-N 3.12Å; W584-T586 PolarHBondContact O-N 3.02Å; W584-K587 PolarHBondContact O-N 2.85Å
585W76.7Confident76.5Confident103 Ų10350.1 Ų50.139%0.3928%0.278SS..Hα-helixtrans-61.7-22.5171.7-78.199.2000113.2L132 I575 L581 S582 S583 K587 I588 A589L132-W585 HydrophobicContact CD1-CD2 4.25Å; L132-W585 HydrophobicContact CD1-CH2 4.26Å; L132-W585 HydrophobicContact CD1-CZ2 3.76Å; I575-W585 HydrophobicContact CD1-CB 3.85Å; L581-W585 HydrophobicContact CD2-CD2 4.25Å; L581-W585 HydrophobicContact CD2-CG 4.08Å; S582-W585 WeakPolarHBondContact O-CB 3.37Å; S582-W585 PolarHBondContact O-N 3.49Å; S583-W585 PolarHBondContact O-N 3.15Å; W585-K587 VanDerWaalsContact C-N 3.32Å; W585-K587 PolarHBondContact O-N 3.36Å; W585-I588 HydrophobicContact CE3-CB 4.19Å; W585-I588 HydrophobicContact CE3-CD1 4.22Å; W585-I588 HydrophobicContact CE3-CG2 4.08Å; W585-I588 HydrophobicContact CZ3-CD1 4.46Å; W585-I588 HydrophobicContact CZ3-CG2 4.1Å; W585-I588 PolarHBondContact O-N 3.3Å; W585-A589 VanDerWaalsContact O-CB 3.27Å; W585-A589 WeakPolarHBondContact O-CB 3.31Å; W585-A589 PolarHBondContact O-N 2.93Å
586T72.5Confident76.3Confident10 Ų1054.1 Ų54.16%0.06130%0.298CS..Hα-helixtrans-58.6-46.8176.5-58.50000110.3I571 Q572 I575 S583 W584 A589 I590I571-T586 HydrophobicContact CG2-CG2 4.08Å; Q572-T586 HydrophobicContact CB-CG2 4.31Å; Q572-T586 PolarHBondContact OE1-OG1 2.92Å; I575-T586 VanDerWaalsContact CD1-N 3.28Å; I575-T586 WeakPolarHBondContact CD1-OG1 3.46Å; S583-T586 VanDerWaalsContact O-CB 3.27Å; S583-T586 WeakPolarHBondContact O-CB 3.39Å; S583-T586 PolarHBondContact O-N 3.29Å; S583-T586 PolarHBondContact O-OG1 3.34Å; S583-T586 VanDerWaalsContact O-OG1 3.12Å; W584-T586 PolarHBondContact O-N 3.02Å; T586-A589 PolarHBondContact O-N 3.02Å; T586-I590 HydrophobicContact CG2-CD1 3.74Å; T586-I590 HydrophobicContact CG2-CG1 4.44Å; T586-I590 WeakPolarHBondContact O-CB 3.17Å; T586-I590 VanDerWaalsContact O-CG1 3.24Å; T586-I590 WeakPolarHBondContact O-CG1 3.21Å; T586-I590 PolarHBondContact O-N 3.05Å
587K72.4Confident75.7Confident73 Ų7349.1 Ų49.132%0.31727%0.271SS..Hα-helixtrans-65.9-41.1179-64-175-172.9167.90111.8V124 R127 W584 W585 I590 G591V124-K587 HydrophobicContact CG1-CB 4.44Å; V124-K587 WeakPolarHBondContact CG1-O 3.32Å; V124-K587 WeakPolarHBondContact O-CB 3.31Å; R127-K587 HydrophobicContact CB-CD 4.39Å; W584-K587 PolarHBondContact O-N 2.85Å; W585-K587 VanDerWaalsContact C-N 3.32Å; W585-K587 PolarHBondContact O-N 3.36Å; K587-I590 PolarHBondContact O-N 3.23Å; K587-G591 PolarHBondContact O-N 3.1Å
588I79.6Confident75Confident12 Ų1245.6 Ų45.66%0.06226%0.256CS..Hα-helixtrans-62.6-46.9176.2-59.8-179.5000110.7V129 L132 W585 G591 I592V129-I588 HydrophobicContact CG2-CD1 4.09Å; V129-I588 HydrophobicContact CG2-CG1 4.37Å; L132-I588 HydrophobicContact CD1-CD1 3.3Å; L132-I588 HydrophobicContact CG-CD1 3.76Å; W585-I588 HydrophobicContact CE3-CB 4.19Å; W585-I588 HydrophobicContact CE3-CD1 4.22Å; W585-I588 HydrophobicContact CE3-CG2 4.08Å; W585-I588 HydrophobicContact CZ3-CD1 4.46Å; W585-I588 HydrophobicContact CZ3-CG2 4.1Å; W585-I588 PolarHBondContact O-N 3.3Å; I588-G591 PolarHBondContact O-N 3.26Å; I588-I592 HydrophobicContact CG2-CD1 3.72Å; I588-I592 HydrophobicContact CG2-CG1 4.37Å; I588-I592 WeakPolarHBondContact O-CB 3.31Å; I588-I592 VanDerWaalsContact O-CG1 3.3Å; I588-I592 WeakPolarHBondContact O-CG1 3.32Å; I588-I592 PolarHBondContact O-N 3.35Å
589A79.3Confident74.3Confident34 Ų3445.2 Ų45.228%0.28126%0.258SS..Hα-helixtrans-64-41178.800000112.4I571 W585 T586 L593I571-A589 HydrophobicContact CG2-CB 3.67Å; W585-A589 VanDerWaalsContact O-CB 3.27Å; W585-A589 WeakPolarHBondContact O-CB 3.31Å; W585-A589 PolarHBondContact O-N 2.93Å; T586-A589 PolarHBondContact O-N 3.02Å; A589-L593 VanDerWaalsContact O-CB 3.23Å; A589-L593 WeakPolarHBondContact O-CB 3.35Å; A589-L593 PolarHBondContact O-N 3.27Å
590I72.2Confident74.1Confident4 Ų445.7 Ų45.72%0.02125%0.245CC..Hα-helixtrans-64.3-44.2173.9-68168.5000110.8V124 A542 I546 Q568 I571 T586 K587 L593 L594V124-I590 HydrophobicContact CG1-CB 4.23Å; V124-I590 HydrophobicContact CG1-CG2 3.98Å; A542-I590 HydrophobicContact CB-CG2 4.46Å; I546-I590 HydrophobicContact CD1-CG2 4.19Å; Q568-I590 HydrophobicContact CB-CD1 4.47Å; Q568-I590 HydrophobicContact CG-CD1 3.92Å; I571-I590 HydrophobicContact CD1-CG1 3.89Å; T586-I590 HydrophobicContact CG2-CD1 3.74Å; T586-I590 HydrophobicContact CG2-CG1 4.44Å; T586-I590 WeakPolarHBondContact O-CB 3.17Å; T586-I590 VanDerWaalsContact O-CG1 3.24Å; T586-I590 WeakPolarHBondContact O-CG1 3.21Å; T586-I590 PolarHBondContact O-N 3.05Å; K587-I590 PolarHBondContact O-N 3.23Å; I590-L593 PolarHBondContact O-N 2.95Å; I590-L594 HydrophobicContact CG2-CD1 4.11Å; I590-L594 HydrophobicContact CG2-CG 4.48Å; I590-L594 WeakPolarHBondContact O-CB 3.46Å; I590-L594 WeakPolarHBondContact O-CG 3.32Å; I590-L594 PolarHBondContact O-N 2.89Å
591G71.7Confident73.5Confident1 Ų140.2 Ų40.21%0.0121%0.211CC..Hα-helixtrans-64.1-41.5177.200000113.5K587 I588 L594 F595K587-G591 PolarHBondContact O-N 3.1Å; I588-G591 PolarHBondContact O-N 3.26Å; G591-L594 PolarHBondContact O-N 3.03Å; G591-F595 PolarHBondContact O-N 2.99Å
592I81.3Confident73.1Confident86 Ų8640.9 Ų40.944%0.44121%0.21SC..Hα-helixtrans-64.2-42.1172.4-70.6171.8000110.7I588 F595 I596I588-I592 HydrophobicContact CG2-CD1 3.72Å; I588-I592 HydrophobicContact CG2-CG1 4.37Å; I588-I592 WeakPolarHBondContact O-CB 3.31Å; I588-I592 VanDerWaalsContact O-CG1 3.3Å; I588-I592 WeakPolarHBondContact O-CG1 3.32Å; I588-I592 PolarHBondContact O-N 3.35Å; I592-F595 WeakPolarHBondContact O-CB 3.27Å; I592-F595 PolarHBondContact O-N 3.3Å; I592-I596 HydrophobicContact CG2-CD1 3.77Å; I592-I596 HydrophobicContact CG2-CG1 4.42Å; I592-I596 WeakPolarHBondContact O-CG1 3.32Å; I592-I596 PolarHBondContact O-N 2.91Å
593L75.2Confident72.7Confident25 Ų2540.4 Ų40.413%0.13121%0.212CC..Hα-helixtrans-65.1-43.6178.1-179.766.6000111.9V307 I546 I567 I571 A589 I590 F595 I596 F597V307-L593 HydrophobicContact CG1-CD1 3.91Å; I546-L593 HydrophobicContact CD1-CD2 4.23Å; I546-L593 HydrophobicContact CG2-CD2 4.06Å; I567-L593 HydrophobicContact CG2-CD2 3.35Å; I571-L593 HydrophobicContact CD1-CD2 4.04Å; A589-L593 VanDerWaalsContact O-CB 3.23Å; A589-L593 WeakPolarHBondContact O-CB 3.35Å; A589-L593 PolarHBondContact O-N 3.27Å; I590-L593 PolarHBondContact O-N 2.95Å; L593-F595 VanDerWaalsContact C-N 3.32Å; L593-F595 PolarHBondContact O-N 3.06Å; L593-I596 PolarHBondContact O-N 3.31Å; L593-F597 VanDerWaalsContact O-CB 3.3Å; L593-F597 WeakPolarHBondContact O-CB 3.35Å; L593-F597 PolarHBondContact O-N 2.71Å
594L70.9Confident72.6Confident0 Ų040 Ų400%021%0.205CC..Hα-helixtrans-54-50.6171.6-78.2166000109.9L120 I121 V124 A542 V545 I546 I590 G591 I596 F597 I598L120-L594 HydrophobicContact CD2-CD1 4.28Å; L120-L594 HydrophobicContact CG-CD1 4.46Å; I121-L594 HydrophobicContact CG1-CB 3.92Å; V124-L594 HydrophobicContact CG2-CD1 4.22Å; A542-L594 HydrophobicContact CB-CD1 4.15Å; V545-L594 HydrophobicContact CB-CD2 4.19Å; V545-L594 HydrophobicContact CG1-CD2 3.74Å; I546-L594 HydrophobicContact CD1-CD2 4.16Å; I546-L594 HydrophobicContact CD1-CG 4.24Å; I546-L594 HydrophobicContact CG1-CD2 3.68Å; I546-L594 HydrophobicContact CG1-CG 4.18Å; I590-L594 HydrophobicContact CG2-CD1 4.11Å; I590-L594 HydrophobicContact CG2-CG 4.48Å; I590-L594 WeakPolarHBondContact O-CB 3.46Å; I590-L594 WeakPolarHBondContact O-CG 3.32Å; I590-L594 PolarHBondContact O-N 2.89Å; G591-L594 PolarHBondContact O-N 3.03Å; L594-I596 PolarHBondContact O-N 2.88Å; L594-F597 PolarHBondContact O-N 3.48Å; L594-I598 HydrophobicContact CB-CD1 4.4Å; L594-I598 HydrophobicContact CD2-CD1 4.4Å; L594-I598 WeakPolarHBondContact O-CB 3.49Å; L594-I598 WeakPolarHBondContact O-CD1 3.4Å; L594-I598 PolarHBondContact O-N 2.91Å
595F76.6Confident72.2Confident56 Ų5637 Ų3725%0.24619%0.194CC..Hα-helixtrans-56.7-49.5176.7173-112.9000112.7W103 L107 L111 I121 G591 I592 L593 F597 I598 A599W103-F595 HydrophobicContact CH2-CE1 4.34Å; W103-F595 HydrophobicContact CH2-CE2 4.43Å; W103-F595 HydrophobicContact CH2-CZ 4.25Å; W103-F595 HydrophobicContact CZ2-CD2 4.21Å; W103-F595 HydrophobicContact CZ2-CE2 4.31Å; W103-F595 HydrophobicContact CZ2-CG 4.37Å; L107-F595 HydrophobicContact CD2-CD2 4.08Å; L107-F595 HydrophobicContact CD2-CE2 3.57Å; L111-F595 HydrophobicContact CD1-CE2 4.39Å; I121-F595 HydrophobicContact CD1-CB 4.04Å; I121-F595 HydrophobicContact CD1-CD2 4.28Å; I121-F595 HydrophobicContact CG1-CB 4.26Å; I121-F595 HydrophobicContact CG2-CB 3.84Å; G591-F595 PolarHBondContact O-N 2.99Å; I592-F595 WeakPolarHBondContact O-CB 3.27Å; I592-F595 PolarHBondContact O-N 3.3Å; L593-F595 VanDerWaalsContact C-N 3.32Å; L593-F595 PolarHBondContact O-N 3.06Å; F595-F597 PolarHBondContact O-N 2.94Å; F595-I598 PolarHBondContact O-N 3.41Å; F595-A599 HydrophobicContact CE2-CB 4.28Å; F595-A599 HydrophobicContact CZ-CB 4.44Å; F595-A599 WeakPolarHBondContact O-CB 3.44Å; F595-A599 PolarHBondContact O-N 3.5Å
596I75.7Confident71.8Confident92 Ų9234.7 Ų34.747%0.47219%0.191SC..Hα-helixtrans-59.5-46.7178.6-69.7166.9000110.8I592 L593 L594 L600I592-I596 HydrophobicContact CG2-CD1 3.77Å; I592-I596 HydrophobicContact CG2-CG1 4.42Å; I592-I596 WeakPolarHBondContact O-CG1 3.32Å; I592-I596 PolarHBondContact O-N 2.91Å; L593-I596 PolarHBondContact O-N 3.31Å; L594-I596 PolarHBondContact O-N 2.88Å; I596-L600 WeakPolarHBondContact O-CB 3.44Å; I596-L600 PolarHBondContact O-N 2.91Å
597F68.9Low71.7Confident5 Ų539.6 Ų39.62%0.02222%0.217CC..Hα-helixtrans-65.9-43.7-177.2-170.5-105.6000112.1P300 I303 T304 V545 I546 L593 L594 F595 L600 Q601P300-F597 HydrophobicContact CB-CZ 4.19Å; I303-F597 HydrophobicContact CB-CE2 4.02Å; I303-F597 HydrophobicContact CG2-CD2 3.71Å; I303-F597 HydrophobicContact CG2-CE2 3.56Å; T304-F597 WeakPolarHBondContact OG1-CE2 3.4Å; T304-F597 WeakPolarHBondContact OG1-CZ 3.5Å; V545-F597 WeakPolarHBondContact O-CE1 3.48Å; I546-F597 WeakPolarHBondContact O-CZ 3.16Å; L593-F597 VanDerWaalsContact O-CB 3.3Å; L593-F597 WeakPolarHBondContact O-CB 3.35Å; L593-F597 PolarHBondContact O-N 2.71Å; L594-F597 PolarHBondContact O-N 3.48Å; F595-F597 PolarHBondContact O-N 2.94Å; F597-L600 PolarHBondContact O-N 3.3Å; F597-Q601 WeakPolarHBondContact O-CG 3.49Å; F597-Q601 PolarHBondContact O-N 3.38Å
598I67.3Low71.3Confident5 Ų542.4 Ų42.43%0.02623%0.225CC..Hα-helixtrans-70.8-41.5177.5-77.3145.6000111.7I113 V117 I121 V545 L594 F595 L600 Q601 R602I113-I598 HydrophobicContact CD1-CG2 4.09Å; I113-I598 HydrophobicContact CG1-CG2 4.1Å; I113-I598 HydrophobicContact CG2-CG2 3.76Å; V117-I598 HydrophobicContact CB-CD1 4.28Å; V117-I598 HydrophobicContact CG1-CD1 3.83Å; V117-I598 HydrophobicContact CG1-CG1 4.27Å; V117-I598 HydrophobicContact CG1-CG2 3.95Å; V117-I598 HydrophobicContact CG2-CD1 3.41Å; V117-I598 VanDerWaalsContact CG2-CD1 3.41Å; V117-I598 HydrophobicContact CG2-CG1 4.49Å; I121-I598 HydrophobicContact CD1-CD1 4.17Å; V545-I598 HydrophobicContact CG1-CD1 4.04Å; L594-I598 HydrophobicContact CB-CD1 4.4Å; L594-I598 HydrophobicContact CD2-CD1 4.4Å; L594-I598 WeakPolarHBondContact O-CB 3.49Å; L594-I598 WeakPolarHBondContact O-CD1 3.4Å; L594-I598 PolarHBondContact O-N 2.91Å; F595-I598 PolarHBondContact O-N 3.41Å; I598-L600 VanDerWaalsContact C-N 3.32Å; I598-L600 PolarHBondContact O-N 3.46Å; I598-Q601 PolarHBondContact O-N 3.14Å; I598-R602 VanDerWaalsContact O-CB 3.31Å; I598-R602 WeakPolarHBondContact O-CB 3.45Å; I598-R602 PolarHBondContact O-N 2.71Å
599A69.9Low70.5Confident35 Ų3545.7 Ų45.729%0.28924%0.241SC..Hα-helixtrans-62.3-40.517400000111.5F595 R602 G603F595-A599 HydrophobicContact CE2-CB 4.28Å; F595-A599 HydrophobicContact CZ-CB 4.44Å; F595-A599 WeakPolarHBondContact O-CB 3.44Å; F595-A599 PolarHBondContact O-N 3.5Å; A599-R602 PolarHBondContact O-N 3.46Å; A599-G603 PolarHBondContact O-N 3.31Å
600L70.7Confident69.9Low76 Ų7648.8 Ų48.840%0.39825%0.252SS..Hα-helixtrans-65.4-47.5175.1-178.659.2000111.7I303 I596 F597 I598 R602 G603 L604I303-L600 HydrophobicContact CD1-CD2 4.04Å; I303-L600 HydrophobicContact CD1-CG 4.26Å; I303-L600 HydrophobicContact CG1-CD2 4.37Å; I303-L600 HydrophobicContact CG2-CD2 3.76Å; I596-L600 WeakPolarHBondContact O-CB 3.44Å; I596-L600 PolarHBondContact O-N 2.91Å; F597-L600 PolarHBondContact O-N 3.3Å; I598-L600 VanDerWaalsContact C-N 3.32Å; I598-L600 PolarHBondContact O-N 3.46Å; L600-R602 VanDerWaalsContact C-N 3.29Å; L600-R602 PolarHBondContact O-N 3.16Å; L600-G603 PolarHBondContact O-N 3.47Å; L600-L604 HydrophobicContact CD1-CD1 3.8Å; L600-L604 HydrophobicContact CD1-CG 4.1Å; L600-L604 HydrophobicContact CG-CD1 3.81Å; L600-L604 VanDerWaalsContact O-CB 3.29Å; L600-L604 WeakPolarHBondContact O-CB 3.49Å; L600-L604 WeakPolarHBondContact O-CD1 3.4Å; L600-L604 WeakPolarHBondContact O-CG 3.43Å; L600-L604 PolarHBondContact O-N 3.04Å
601Q66.9Low69.2Low8 Ų858.2 Ų58.24%0.03729%0.288CS..Hα-helixtrans-55.2-45.1172.2-76.9-169.221.200111.5F597 I598 L604 T605F597-Q601 WeakPolarHBondContact O-CG 3.49Å; F597-Q601 PolarHBondContact O-N 3.38Å; I598-Q601 PolarHBondContact O-N 3.14Å; Q601-L604 PolarHBondContact O-N 3.06Å; Q601-T605 WeakPolarHBondContact O-CB 3.44Å; Q601-T605 PolarHBondContact O-N 3.38Å; Q601-T605 PolarHBondContact O-OG1 3.44Å
602R65.9Low68.5Low69 Ų6964 Ų6426%0.2631%0.314SS..Hα-helixtrans-70.2-40.8-177-166.747.9158.1162.5-16.9112.6L111 K112 I598 A599 L600 T605 V606L111-R602 WeakPolarHBondContact O-CG 3.3Å; K112-R602 PolarHBondContact O-NE 3.44Å; K112-R602 PolarHBondContact O-NH2 2.89Å; I598-R602 VanDerWaalsContact O-CB 3.31Å; I598-R602 WeakPolarHBondContact O-CB 3.45Å; I598-R602 PolarHBondContact O-N 2.71Å; A599-R602 PolarHBondContact O-N 3.46Å; L600-R602 VanDerWaalsContact C-N 3.29Å; L600-R602 PolarHBondContact O-N 3.16Å; R602-T605 VanDerWaalsContact O-CB 3.3Å; R602-T605 WeakPolarHBondContact O-CB 3.44Å; R602-T605 PolarHBondContact O-N 2.94Å; R602-V606 WeakPolarHBondContact O-CG2 3.47Å; R602-V606 PolarHBondContact O-N 2.92Å; R602-V606 VanDerWaalsContact O-N 3.13Å
603G69.2Low67.1Low35 Ų3564.3 Ų64.336%0.36132%0.324SS..Hα-helixtrans-62-48.1172.400000112.2A599 L600 T605 V606 L607A599-G603 PolarHBondContact O-N 3.31Å; L600-G603 PolarHBondContact O-N 3.47Å; G603-T605 PolarHBondContact O-N 3.08Å; G603-V606 PolarHBondContact O-N 3.35Å; G603-L607 VanDerWaalsContact O-CG 3.31Å; G603-L607 WeakPolarHBondContact O-CG 3.22Å; G603-L607 PolarHBondContact O-N 3.02Å
604L68.5Low65.8Low46 Ų4666.7 Ų66.724%0.24134%0.343CS..Hα-helixtrans-61.3-30.1176.4-71.7166.7000112.7K296 L299 I303 L600 Q601K296-L604 WeakPolarHBondContact CE-O 3.23Å; K296-L604 PolarHBondContact NZ-O 2.86Å; L299-L604 HydrophobicContact CD2-CD1 3.91Å; I303-L604 HydrophobicContact CD1-CD1 3.67Å; L600-L604 HydrophobicContact CD1-CD1 3.8Å; L600-L604 HydrophobicContact CD1-CG 4.1Å; L600-L604 HydrophobicContact CG-CD1 3.81Å; L600-L604 VanDerWaalsContact O-CB 3.29Å; L600-L604 WeakPolarHBondContact O-CB 3.49Å; L600-L604 WeakPolarHBondContact O-CD1 3.4Å; L600-L604 WeakPolarHBondContact O-CG 3.43Å; L600-L604 PolarHBondContact O-N 3.04Å; Q601-L604 PolarHBondContact O-N 3.06Å
605T64.4Low64.7Low1 Ų172.5 Ų72.51%0.00638%0.38CS..Hα-helixtrans-64.6-59.1172.5-59.90000111.2I295 Q601 R602 G603 L607 W608 E609I295-T605 VanDerWaalsContact CB-OG1 3.3Å; I295-T605 WeakPolarHBondContact CB-OG1 3.33Å; I295-T605 HydrophobicContact CD1-CG2 3.46Å; I295-T605 VanDerWaalsContact CD1-CG2 3.46Å; I295-T605 HydrophobicContact CG2-CG2 4.19Å; I295-T605 WeakPolarHBondContact CG2-OG1 3.24Å; Q601-T605 WeakPolarHBondContact O-CB 3.44Å; Q601-T605 PolarHBondContact O-N 3.38Å; Q601-T605 PolarHBondContact O-OG1 3.44Å; R602-T605 VanDerWaalsContact O-CB 3.3Å; R602-T605 WeakPolarHBondContact O-CB 3.44Å; R602-T605 PolarHBondContact O-N 2.94Å; G603-T605 PolarHBondContact O-N 3.08Å; T605-L607 VanDerWaalsContact C-N 3.27Å; T605-L607 PolarHBondContact O-N 3.18Å; T605-W608 WeakPolarHBondContact O-CA 3.48Å; T605-W608 WeakPolarHBondContact O-CB 3.43Å; T605-W608 PolarHBondContact O-N 3.13Å; T605-E609 HydrophobicContact CG2-CG 4.23Å; T605-E609 WeakPolarHBondContact CG2-OE1 3.37Å; T605-E609 PolarHBondContact O-N 2.89Å
606V69.5Low63.8Low55 Ų5576.2 Ų76.233%0.33341%0.408SS..Hα-helixtrans-61.5-37.2-174.3174.10000111.2R602 G603 W608 E609 N610R602-V606 WeakPolarHBondContact O-CG2 3.47Å; R602-V606 PolarHBondContact O-N 2.92Å; R602-V606 VanDerWaalsContact O-N 3.13Å; G603-V606 PolarHBondContact O-N 3.35Å; V606-W608 PolarHBondContact O-N 3.07Å; V606-E609 PolarHBondContact O-N 3.43Å; V606-N610 WeakPolarHBondContact O-CB 3.47Å; V606-N610 PolarHBondContact O-N 3.09Å; V606-N610 PolarHBondContact O-ND2 3.01Å
607L70.8Confident62.8Low114 Ų11478 Ų7860%0.59742%0.422SS*.Hα-helixtrans-62.8-20.3173.7-70.8171.3000114.2G603 T605 R611G603-L607 VanDerWaalsContact O-CG 3.31Å; G603-L607 WeakPolarHBondContact O-CG 3.22Å; G603-L607 PolarHBondContact O-N 3.02Å; T605-L607 VanDerWaalsContact C-N 3.27Å; T605-L607 PolarHBondContact O-N 3.18Å; L607-R611 WeakPolarHBondContact O-CG 3.49Å
608W62.3Low61.8Low131 Ų13189 Ų8950%0.49646%0.464SS..Hα-helixtrans-95.2-42177.6-17264.6000112.2T605 V606 N610 R611 Q612T605-W608 WeakPolarHBondContact O-CA 3.48Å; T605-W608 WeakPolarHBondContact O-CB 3.43Å; T605-W608 PolarHBondContact O-N 3.13Å; V606-W608 PolarHBondContact O-N 3.07Å; W608-N610 VanDerWaalsContact C-N 3.27Å; W608-N610 PolarHBondContact O-N 2.96Å; W608-R611 PolarHBondContact O-N 3.18Å; W608-Q612 VanDerWaalsContact CZ2-NE2 3.3Å; W608-Q612 PolarHBondContact O-N 2.94Å
609E63.8Low61.2Low82 Ų8294.7 Ų94.738%0.38350%0.499SS..Hα-helixtrans-53.6-45.8169.7-66.9173.9166.400110.7T605 V606 R611 Q612 S613T605-E609 HydrophobicContact CG2-CG 4.23Å; T605-E609 WeakPolarHBondContact CG2-OE1 3.37Å; T605-E609 PolarHBondContact O-N 2.89Å; V606-E609 PolarHBondContact O-N 3.43Å; E609-R611 VanDerWaalsContact C-N 3.32Å; E609-R611 PolarHBondContact O-N 3.41Å; E609-Q612 PolarHBondContact O-N 3.31Å; E609-S613 WeakPolarHBondContact O-CB 3.36Å; E609-S613 PolarHBondContact O-N 3.3Å; E609-S613 PolarHBondContact O-OG 3.3Å
610N66.5Low60.3Low98 Ų9899.7 Ų99.752%0.52452%0.521SS..Hα-helixtrans-62.7-34.1176.3-71.8-8.7000113.1V606 W608 S613V606-N610 WeakPolarHBondContact O-CB 3.47Å; V606-N610 PolarHBondContact O-N 3.09Å; V606-N610 PolarHBondContact O-ND2 3.01Å; W608-N610 VanDerWaalsContact C-N 3.27Å; W608-N610 PolarHBondContact O-N 2.96Å; N610-S613 PolarHBondContact O-N 2.84Å
611R58.1Low59.7Low203 Ų203103.9 Ų103.977%0.76654%0.542SS*.Hα-helixtrans-74.1-33.5177.4-78.7-178.4179-149.80.9112.9L607 W608 E609 S613 S614L607-R611 WeakPolarHBondContact O-CG 3.49Å; W608-R611 PolarHBondContact O-N 3.18Å; E609-R611 VanDerWaalsContact C-N 3.32Å; E609-R611 PolarHBondContact O-N 3.41Å; R611-S613 VanDerWaalsContact C-N 3.3Å; R611-S614 PolarHBondContact O-OG 3.12Å
612Q55.5Low59Low123 Ų123106.7 Ų106.758%0.57557%0.566SS**Hα-helixtrans-76.4-19.5173.4-70.6-177.2-39.300112.8W608 E609 S614W608-Q612 VanDerWaalsContact CZ2-NE2 3.3Å; W608-Q612 PolarHBondContact O-N 2.94Å; E609-Q612 PolarHBondContact O-N 3.31Å; Q612-S614 VanDerWaalsContact C-N 3.32Å
613S53.1Low58.1Low91 Ų91112.4 Ų112.464%0.63660%0.596SS**THydrogen-bonded Turntrans-81.9-5176.6-56.50000114E609 N610 R611E609-S613 WeakPolarHBondContact O-CB 3.36Å; E609-S613 PolarHBondContact O-N 3.3Å; E609-S613 PolarHBondContact O-OG 3.3Å; N610-S613 PolarHBondContact O-N 2.84Å; R611-S613 VanDerWaalsContact C-N 3.3Å
614S47Very low56.8Low75 Ų75126 Ų12652%0.52464%0.636SS.*SBendtrans-62.4132.6172.2-64.80000110.4R611 Q612 V616R611-S614 PolarHBondContact O-OG 3.12Å; Q612-S614 VanDerWaalsContact C-N 3.32Å; S614-V616 PolarHBondContact O-N 2.69Å
615P49.5Very low56.3Low122 Ų122130 Ų13079%0.79266%0.656SS**  trans-62.7128.2179.726.1-33.8000110.2T617P615-T617 PolarHBondContact O-N 3.23Å
616V56.2Low55.8Low135 Ų135136.8 Ų136.882%0.81869%0.69SS**  trans-60.5113173.4178.60000108.2S614 R618S614-V616 PolarHBondContact O-N 2.69Å; V616-R618 PolarHBondContact O-N 3.06Å
617T55.1Low55.1Low128 Ų128141.3 Ų141.379%0.78571%0.71SS**  trans-59.9105.4172.280000108.3P615 V619P615-T617 PolarHBondContact O-N 3.23Å; T617-V619 PolarHBondContact O-N 3.27Å
618R47.7Very low54.1Low236 Ų236142.9 Ų142.989%0.89172%0.717SS**  trans-63.1104.2173.5-67.4-171-174.4-169.83.5108.1V616 N620V616-R618 PolarHBondContact O-N 3.06Å; R618-N620 PolarHBondContact O-N 2.98Å; R618-N620 VanDerWaalsContact O-N 3.11Å
619V55.8Low53.6Low126 Ų126143.7 Ų143.776%0.76473%0.731SS**  trans-59.7115.4166.41790000106.6T617 I621T617-V619 PolarHBondContact O-N 3.27Å; V619-I621 HydrophobicContact CG1-CG1 4.47Å; V619-I621 WeakPolarHBondContact O-CG1 3.36Å; V619-I621 PolarHBondContact O-N 2.64Å; V619-I621 VanDerWaalsContact O-N 3.1Å
620N49.7Very low53Low139 Ų139147.8 Ų147.874%0.74375%0.754SS**  trans-82.192.2-172.4-165.919.8000109.7R618 A622R618-N620 PolarHBondContact O-N 2.98Å; R618-N620 VanDerWaalsContact O-N 3.11Å; N620-A622 PolarHBondContact O-N 2.87Å
621I57.5Low52Low164 Ų164151.4 Ų151.484%0.84177%0.77SS**  trans-78.160.3-176.5-41.4-178.2000110.2V619V619-I621 HydrophobicContact CG1-CG1 4.47Å; V619-I621 WeakPolarHBondContact O-CG1 3.36Å; V619-I621 PolarHBondContact O-N 2.64Å; V619-I621 VanDerWaalsContact O-N 3.1Å
622A53Low51.5Low67 Ų67147.4 Ų147.455%0.55477%0.771SS**  trans-131.327.8-170.700000112.9N620N620-A622 PolarHBondContact O-N 2.87Å
623Q47.1Very low51.2Low189 Ų189149.4 Ų149.488%0.88379%0.787SS**  trans-141.940.8-179.1-68.5-165.4-44.700113.2
624R42.7Very low51Low321 Ų321154.7 Ų154.7100%1.21180%0.801SS**  trans-146.70163.7-75.9-163.6175.1-169-2.6109.7

Retrieved 624 of 624 residues in 603.8 ms (Link to these results)

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