A0A3Q0KD37_SCHMA Loading...

Rhomboid-like protein

AlphaFold DB , UniProt , Accession A0A3Q0KD37, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 397 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
1M46.4Very low69Low43 Ų4377.4 Ų77.421%0.21243%0.427CS..  0139.50-68.5166.8158.400110.8S6 L74 E78 K289M1-S6 WeakPolarHBondContact SD-CB 3.49Å; M1-S6 PolarHBondContact SD-OG 3.07Å; M1-S6 VanDerWaalsContact SD-OG 3.38Å; M1-L74 HydrophobicContact CE-CD2 4.46Å; M1-E78 HydrophobicContact CE-CG 3.32Å; M1-E78 HydrophobicContact CG-CG 4.34Å; M1-E78 HydrophobicContact SD-CG 4.02Å; M1-K289 PolarHBondContact O-NZ 2.8Å
2S50.7Low70.2Confident71 Ų7181 Ų8150%0.49743%0.431SS..  trans-67.8135.8144.765.30000105.4T4 R5S2-T4 PolarHBondContact O-N 3.36Å; S2-R5 PolarHBondContact O-N 3.3Å; S2-R5 VanDerWaalsContact O-N 3.09Å
3S59.9Low71.4Confident100 Ų10075.4 Ų75.470%0.69940%0.401SS*.Hα-helixtrans-48.5-32.7-179.251.80000112.2S7S3-S7 PolarHBondContact O-N 3.4Å; S3-S7 PolarHBondContact O-OG 3.34Å
4T66.7Low72.6Confident82 Ų8273.6 Ų73.650%0.50339%0.392SS..Hα-helixtrans-63.9-40.8179.5-360000115.2S2 S7 N8S2-T4 PolarHBondContact O-N 3.36Å; T4-S7 WeakPolarHBondContact CA-OG 3.21Å; T4-S7 PolarHBondContact O-OG 3.49Å; T4-N8 WeakPolarHBondContact O-CB 3.46Å; T4-N8 PolarHBondContact O-N 2.98Å; T4-N8 PolarHBondContact O-ND2 2.75Å; T4-N8 PolarHBondContact O-OD1 2.92Å
5R64Low73.5Confident112 Ų11280.9 Ų80.942%0.42342%0.419SS..Hα-helixtrans-70-43.9179.7176177164.6153.5-3.8110.7S2 S7 N8 L9 D77S2-R5 PolarHBondContact O-N 3.3Å; S2-R5 VanDerWaalsContact O-N 3.09Å; R5-S7 VanDerWaalsContact C-N 3.28Å; R5-S7 PolarHBondContact O-N 3Å; R5-N8 PolarHBondContact O-N 2.9Å; R5-L9 WeakPolarHBondContact O-CB 3.42Å; R5-L9 PolarHBondContact O-N 3.3Å; R5-D77 IonicContact CZ-OD1 2.79Å; R5-D77 IonicContact CZ-OD2 2.71Å; R5-D77 IonicContact NE-OD2 2.64Å; R5-D77 PolarHBondContact NE-OD2 3.09Å; R5-D77 IonicContact NH2-OD1 3.13Å; R5-D77 PolarHBondContact NH2-OD1 3.41Å; R5-D77 IonicContact NH2-OD2 3.1Å; R5-D77 PolarHBondContact NH2-OD2 3.44Å
6S69.2Low74Confident29 Ų2983 Ų8320%0.20342%0.424CS..Hα-helixtrans-61-40.9177.8-166.10000111M1 R10M1-S6 WeakPolarHBondContact SD-CB 3.49Å; M1-S6 PolarHBondContact SD-OG 3.07Å; M1-S6 VanDerWaalsContact SD-OG 3.38Å; S6-R10 VanDerWaalsContact O-CB 3.24Å; S6-R10 WeakPolarHBondContact O-CB 3.48Å; S6-R10 PolarHBondContact O-N 3.45Å
7S76.6Confident74.7Confident54 Ų5481.2 Ų81.238%0.37841%0.412SS..Hα-helixtrans-65.1-46.4176.668.10000111.3S3 T4 R5 L9 R10 T11S3-S7 PolarHBondContact O-N 3.4Å; S3-S7 PolarHBondContact O-OG 3.34Å; T4-S7 WeakPolarHBondContact CA-OG 3.21Å; T4-S7 PolarHBondContact O-OG 3.49Å; R5-S7 VanDerWaalsContact C-N 3.28Å; R5-S7 PolarHBondContact O-N 3Å; S7-L9 PolarHBondContact O-N 2.91Å; S7-R10 PolarHBondContact O-N 3.27Å; S7-T11 WeakPolarHBondContact O-CB 3.4Å; S7-T11 PolarHBondContact O-N 2.95Å; S7-T11 PolarHBondContact O-OG1 3.43Å
8N79Confident75.3Confident102 Ų10281.8 Ų81.855%0.54541%0.412SS..Hα-helixtrans-63.5-42.5-179.9-70.8-8.8000112.2T4 R5 T11 Y12T4-N8 WeakPolarHBondContact O-CB 3.46Å; T4-N8 PolarHBondContact O-N 2.98Å; T4-N8 PolarHBondContact O-ND2 2.75Å; T4-N8 PolarHBondContact O-OD1 2.92Å; R5-N8 PolarHBondContact O-N 2.9Å; N8-T11 PolarHBondContact O-N 3.19Å; N8-Y12 WeakPolarHBondContact O-CB 3.28Å; N8-Y12 PolarHBondContact O-N 3.09Å
9L76.9Confident76Confident40 Ų4081.1 Ų81.121%0.20941%0.413CS..Hα-helixtrans-63.6-45.8175.7-178.559.1000110.6R5 S7 T11 Y12 L13 L74 D77R5-L9 WeakPolarHBondContact O-CB 3.42Å; R5-L9 PolarHBondContact O-N 3.3Å; S7-L9 PolarHBondContact O-N 2.91Å; L9-T11 PolarHBondContact O-N 3.38Å; L9-Y12 PolarHBondContact O-N 2.79Å; L9-L13 HydrophobicContact CD1-CD1 4.24Å; L9-L13 HydrophobicContact CD1-CG 4.23Å; L9-L13 HydrophobicContact CG-CD1 4.01Å; L9-L13 HydrophobicContact CG-CG 4.42Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.32Å; L9-L13 PolarHBondContact O-N 2.6Å; L9-L74 HydrophobicContact CD2-CD2 3.84Å; L9-L74 HydrophobicContact CG-CD2 4.23Å; L9-D77 HydrophobicContact CD2-CB 4.05Å
10R83.1Confident76.4Confident129 Ų12979.3 Ų79.349%0.48741%0.407SS..Hα-helixtrans-58.3-49175.2-178.1173.4-176.5174.16.3111.8S6 S7 Y12 L13 D14 L70S6-R10 VanDerWaalsContact O-CB 3.24Å; S6-R10 WeakPolarHBondContact O-CB 3.48Å; S6-R10 PolarHBondContact O-N 3.45Å; S7-R10 PolarHBondContact O-N 3.27Å; R10-Y12 VanDerWaalsContact C-N 3.28Å; R10-Y12 PolarHBondContact O-N 3.39Å; R10-L13 PolarHBondContact O-N 2.95Å; R10-D14 WeakPolarHBondContact O-CB 3.43Å; R10-D14 PolarHBondContact O-N 3.18Å; R10-L70 HydrophobicContact CG-CD1 4.37Å; R10-L70 HydrophobicContact CG-CD2 4.17Å
11T86.4Confident76.9Confident89 Ų8976.1 Ų76.155%0.54639%0.39SS..Hα-helixtrans-59.4-39.1177.1-57.60000112.3S7 N8 L9 K15S7-T11 WeakPolarHBondContact O-CB 3.4Å; S7-T11 PolarHBondContact O-N 2.95Å; S7-T11 PolarHBondContact O-OG1 3.43Å; N8-T11 PolarHBondContact O-N 3.19Å; L9-T11 PolarHBondContact O-N 3.38Å; T11-K15 WeakPolarHBondContact O-CB 3.47Å; T11-K15 PolarHBondContact O-N 3.16Å
12Y83.8Confident78.8Confident121 Ų12178 Ų7848%0.47540%0.401SS..Hα-helixtrans-66.5-44.7175.4173.7-98.3000112.1N8 L9 R10 D14 K15 K16N8-Y12 WeakPolarHBondContact O-CB 3.28Å; N8-Y12 PolarHBondContact O-N 3.09Å; L9-Y12 PolarHBondContact O-N 2.79Å; R10-Y12 VanDerWaalsContact C-N 3.28Å; R10-Y12 PolarHBondContact O-N 3.39Å; Y12-D14 VanDerWaalsContact C-N 3.35Å; Y12-K15 PolarHBondContact O-N 3.39Å; Y12-K16 HydrophobicContact CE1-CD 4.01Å; Y12-K16 HydrophobicContact CE2-CD 4.22Å; Y12-K16 VanDerWaalsContact O-CB 3.32Å; Y12-K16 WeakPolarHBondContact O-CB 3.49Å; Y12-K16 PolarHBondContact O-N 2.78Å; Y12-K16 VanDerWaalsContact OH-CD 3.3Å; Y12-K16 WeakPolarHBondContact OH-CD 3.48Å; Y12-K16 PolarHBondContact OH-NZ 3.24Å
13L85.7Confident80.4Confident8 Ų881.8 Ų81.84%0.04241%0.411CS..Hα-helixtrans-63.2-42.5176.7-67.9172.7000111L9 R10 K15 K16 F17 Y66 L70 V73L9-L13 HydrophobicContact CD1-CD1 4.24Å; L9-L13 HydrophobicContact CD1-CG 4.23Å; L9-L13 HydrophobicContact CG-CD1 4.01Å; L9-L13 HydrophobicContact CG-CG 4.42Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.32Å; L9-L13 PolarHBondContact O-N 2.6Å; R10-L13 PolarHBondContact O-N 2.95Å; L13-K15 VanDerWaalsContact C-N 3.33Å; L13-K15 PolarHBondContact O-N 3.23Å; L13-K16 PolarHBondContact O-N 2.71Å; L13-F17 HydrophobicContact CD2-CD2 3.67Å; L13-F17 HydrophobicContact CD2-CE2 3.76Å; L13-F17 WeakPolarHBondContact O-CB 3.21Å; L13-F17 PolarHBondContact O-N 2.98Å; L13-Y66 PolarHBondContact O-OH 3.32Å; L13-L70 HydrophobicContact CB-CD1 4.05Å; L13-L70 HydrophobicContact CD1-CD1 3.58Å; L13-L70 HydrophobicContact CG-CD1 4.47Å; L13-V73 HydrophobicContact CD1-CB 4.33Å; L13-V73 HydrophobicContact CD1-CG1 3.72Å; L13-V73 HydrophobicContact CD2-CG1 4.32Å
14D87.7Confident81.5Confident51 Ų5179.3 Ų79.327%0.27339%0.386SS..Hα-helixtrans-60.3-43.5176.8-70.5-20.6000111R10 Y12 K18 Y66R10-D14 WeakPolarHBondContact O-CB 3.43Å; R10-D14 PolarHBondContact O-N 3.18Å; Y12-D14 VanDerWaalsContact C-N 3.35Å; D14-K18 WeakPolarHBondContact O-CB 3.49Å; D14-Y66 WeakPolarHBondContact CA-OH 3.34Å; D14-Y66 PolarHBondContact N-OH 3Å; D14-Y66 WeakPolarHBondContact OD1-CE1 3.27Å; D14-Y66 VanDerWaalsContact OD1-CZ 3.3Å; D14-Y66 PolarHBondContact OD1-OH 3.28Å
15K86.1Confident81.6Confident182 Ų18279.3 Ų79.379%0.79139%0.389SS*.Hα-helixtrans-70.1-34.8179.5-172.4175179.1178.60112.9T11 Y12 L13T11-K15 WeakPolarHBondContact O-CB 3.47Å; T11-K15 PolarHBondContact O-N 3.16Å; Y12-K15 PolarHBondContact O-N 3.39Å; L13-K15 VanDerWaalsContact C-N 3.33Å; L13-K15 PolarHBondContact O-N 3.23Å
16K82.4Confident81.9Confident115 Ų11580 Ų8050%0.541%0.407SS..Hα-helixtrans-94.7-42.8-169.8-170.1172-174178.90113.7Y12 L13Y12-K16 HydrophobicContact CE1-CD 4.01Å; Y12-K16 HydrophobicContact CE2-CD 4.22Å; Y12-K16 VanDerWaalsContact O-CB 3.32Å; Y12-K16 WeakPolarHBondContact O-CB 3.49Å; Y12-K16 PolarHBondContact O-N 2.78Å; Y12-K16 VanDerWaalsContact OH-CD 3.3Å; Y12-K16 WeakPolarHBondContact OH-CD 3.48Å; Y12-K16 PolarHBondContact OH-NZ 3.24Å; L13-K16 PolarHBondContact O-N 2.71Å
17F84.8Confident81.9Confident52 Ų5284.1 Ų84.123%0.22842%0.421CS..THydrogen-bonded Turntrans-102.4-35.8-171.4-71.4-84000112.7L13 P19 T20 F21 L39 Y66 F69L13-F17 HydrophobicContact CD2-CD2 3.67Å; L13-F17 HydrophobicContact CD2-CE2 3.76Å; L13-F17 WeakPolarHBondContact O-CB 3.21Å; L13-F17 PolarHBondContact O-N 2.98Å; F17-P19 VanDerWaalsContact C-CD 3.47Å; F17-P19 VanDerWaalsContact C-N 3.34Å; F17-T20 WeakPolarHBondContact O-CA 3.41Å; F17-T20 VanDerWaalsContact O-CB 3.29Å; F17-T20 WeakPolarHBondContact O-CB 3.16Å; F17-T20 PolarHBondContact O-N 2.92Å; F17-F21 HydrophobicContact CB-CD2 4.44Å; F17-F21 HydrophobicContact CB-CE2 4.39Å; F17-F21 WeakPolarHBondContact O-CD2 3.32Å; F17-F21 PolarHBondContact O-N 2.9Å; F17-L39 HydrophobicContact CE1-CD2 4.37Å; F17-Y66 HydrophobicContact CB-CE2 4.05Å; F17-F69 HydrophobicContact CB-CE1 4.07Å; F17-F69 HydrophobicContact CD1-CE1 4.11Å; F17-F69 HydrophobicContact CD1-CZ 4.09Å; F17-F69 HydrophobicContact CD2-CE1 4.26Å; F17-F69 HydrophobicContact CE1-CZ 4.23Å; F17-F69 AromaticContact CG-CE1 3.89Å; F17-F69 HydrophobicContact CG-CE1 3.89Å; F17-F69 HydrophobicContact CG-CZ 4.27Å
18K85.8Confident81.9Confident93 Ų9388.4 Ų88.440%0.40444%0.44SS..Hα-helixtrans-52.3-43.9-178.4-164178.2177.7178.10113.8D14 T20 F21 D22 Y66D14-K18 WeakPolarHBondContact O-CB 3.49Å; K18-T20 PolarHBondContact O-N 3.5Å; K18-T20 VanDerWaalsContact O-N 3.13Å; K18-F21 PolarHBondContact O-N 3.2Å; K18-D22 PolarHBondContact O-N 3.49Å; K18-Y66 HydrophobicContact CB-CD2 4.44Å; K18-Y66 HydrophobicContact CB-CE1 4.23Å; K18-Y66 HydrophobicContact CB-CE2 4.12Å; K18-Y66 HydrophobicContact CD-CD1 4.49Å; K18-Y66 HydrophobicContact CD-CE1 4.29Å; K18-Y66 HydrophobicContact CG-CD1 4.18Å; K18-Y66 HydrophobicContact CG-CE1 4.19Å; K18-Y66 HydrophobicContact CG-CG 4.41Å
19P88.3Confident82.1Confident68 Ų6883.9 Ų83.944%0.44242%0.417SS..Hα-helixtrans-61-26.9176.7-23.834.9000114.1F17 Q23F17-P19 VanDerWaalsContact C-CD 3.47Å; F17-P19 VanDerWaalsContact C-N 3.34Å; P19-Q23 WeakPolarHBondContact O-CG 3.32Å
20T85.2Confident82.7Confident45 Ų4582 Ų8228%0.27641%0.407SS..Hα-helixtrans-74.9-41.8175.7-53.40000110.4F17 K18 Q23 Y24 I30 L38F17-T20 WeakPolarHBondContact O-CA 3.41Å; F17-T20 VanDerWaalsContact O-CB 3.29Å; F17-T20 WeakPolarHBondContact O-CB 3.16Å; F17-T20 PolarHBondContact O-N 2.92Å; K18-T20 PolarHBondContact O-N 3.5Å; K18-T20 VanDerWaalsContact O-N 3.13Å; T20-Q23 PolarHBondContact O-N 2.91Å; T20-Y24 WeakPolarHBondContact O-CD2 3.26Å; T20-I30 HydrophobicContact CG2-CD1 4.34Å; T20-L38 HydrophobicContact CG2-CD1 3.99Å
21F86.6Confident83Confident12 Ų1276.9 Ų76.95%0.05339%0.39CS..Hα-helixtrans-66.5-37.1174.2-78.9-100.1000112F17 K18 Q23 Y24 S25 I30 L35 I64 Y66 F69F17-F21 HydrophobicContact CB-CD2 4.44Å; F17-F21 HydrophobicContact CB-CE2 4.39Å; F17-F21 WeakPolarHBondContact O-CD2 3.32Å; F17-F21 PolarHBondContact O-N 2.9Å; K18-F21 PolarHBondContact O-N 3.2Å; F21-Q23 PolarHBondContact O-N 3.39Å; F21-Y24 CarbonylContact O-C 3.57Å; F21-Y24 WeakPolarHBondContact O-CA 3.33Å; F21-Y24 PolarHBondContact O-N 3.06Å; F21-S25 PolarHBondContact O-N 3.46Å; F21-I30 HydrophobicContact CB-CD1 4.36Å; F21-I30 HydrophobicContact CD1-CB 4.47Å; F21-I30 HydrophobicContact CD1-CD1 3.63Å; F21-I30 HydrophobicContact CD1-CG1 3.65Å; F21-I30 HydrophobicContact CD2-CD1 3.78Å; F21-I30 HydrophobicContact CE1-CB 4.33Å; F21-I30 HydrophobicContact CE1-CD1 3.75Å; F21-I30 HydrophobicContact CE1-CG1 3.91Å; F21-I30 HydrophobicContact CE2-CD1 3.91Å; F21-I30 HydrophobicContact CG-CD1 3.65Å; F21-I30 HydrophobicContact CG-CG1 4.06Å; F21-I30 HydrophobicContact CZ-CD1 3.89Å; F21-L35 HydrophobicContact CE2-CD1 4.47Å; F21-L35 HydrophobicContact CZ-CD1 4.05Å; F21-L35 HydrophobicContact CZ-CD2 4.27Å; F21-I64 HydrophobicContact CE1-CG2 4.28Å; F21-I64 WeakPolarHBondContact CE1-O 3.28Å; F21-Y66 HydrophobicContact CB-CD2 4.25Å; F21-Y66 HydrophobicContact CB-CG 4.44Å; F21-Y66 HydrophobicContact CD1-CD2 4.45Å; F21-Y66 AromaticContact CD2-CD2 3.66Å; F21-Y66 HydrophobicContact CD2-CD2 3.66Å; F21-Y66 HydrophobicContact CD2-CE2 4.47Å; F21-Y66 HydrophobicContact CE2-CD2 4.08Å; F21-Y66 AromaticContact CG-CD2 3.87Å; F21-Y66 HydrophobicContact CG-CD2 3.87Å; F21-Y66 HydrophobicContact CG-CG 4.34Å; F21-F69 HydrophobicContact CE1-CB 4.04Å; F21-F69 HydrophobicContact CE2-CB 4.35Å; F21-F69 AromaticContact CE2-CD1 3.85Å; F21-F69 HydrophobicContact CE2-CD1 3.85Å; F21-F69 HydrophobicContact CE2-CE1 4.29Å; F21-F69 HydrophobicContact CE2-CG 4Å; F21-F69 HydrophobicContact CZ-CB 3.57Å; F21-F69 AromaticContact CZ-CD1 3.9Å; F21-F69 HydrophobicContact CZ-CD1 3.9Å; F21-F69 HydrophobicContact CZ-CD2 4.07Å; F21-F69 AromaticContact CZ-CG 3.57Å; F21-F69 HydrophobicContact CZ-CG 3.57Å
22D85.3Confident83Confident84 Ų8473.3 Ų73.345%0.44937%0.368SS..Hα-helixtrans-62.3-28.1178.6-66.8-23000112.5K18 Y24 S25K18-D22 PolarHBondContact O-N 3.49Å; D22-Y24 PolarHBondContact O-N 3.48Å; D22-S25 WeakPolarHBondContact O-CB 3.48Å; D22-S25 PolarHBondContact O-N 2.89Å; D22-S25 VanDerWaalsContact O-N 3.13Å; D22-S25 PolarHBondContact O-OG 2.99Å
23Q85.3Confident83.1Confident150 Ų15071.1 Ų71.170%0.70137%0.37SS*.THydrogen-bonded Turntrans-64.6-24.4172.7-69.6174.211.800112.7P19 T20 F21P19-Q23 WeakPolarHBondContact O-CG 3.32Å; T20-Q23 PolarHBondContact O-N 2.91Å; F21-Q23 PolarHBondContact O-N 3.39Å
24Y82.8Confident83.2Confident48 Ų4872 Ų7219%0.18838%0.375CS..THydrogen-bonded Turntrans-101.58.5177.1-67.3-98.9000112.5T20 F21 D22 T26 K27 I30 D34T20-Y24 WeakPolarHBondContact O-CD2 3.26Å; F21-Y24 CarbonylContact O-C 3.57Å; F21-Y24 WeakPolarHBondContact O-CA 3.33Å; F21-Y24 PolarHBondContact O-N 3.06Å; D22-Y24 PolarHBondContact O-N 3.48Å; Y24-T26 PolarHBondContact O-N 3.42Å; Y24-K27 PolarHBondContact O-N 3.27Å; Y24-I30 HydrophobicContact CD1-CG1 4.49Å; Y24-I30 HydrophobicContact CD2-CD1 4.08Å; Y24-I30 HydrophobicContact CD2-CG1 3.7Å; Y24-I30 HydrophobicContact CE1-CG2 4.47Å; Y24-I30 HydrophobicContact CE2-CD1 4.41Å; Y24-I30 HydrophobicContact CE2-CG1 4.33Å; Y24-I30 HydrophobicContact CG-CB 4.42Å; Y24-I30 HydrophobicContact CG-CG1 3.79Å; Y24-D34 WeakPolarHBondContact CE1-OD2 3.35Å; Y24-D34 PolarHBondContact OH-OD2 3.35Å
25S68.1Low83.1Confident81 Ų8169.8 Ų69.857%0.56636%0.363SS*.G310 helixtrans-55.3-23.7-18057.10000114.3F21 D22 K27F21-S25 PolarHBondContact O-N 3.46Å; D22-S25 WeakPolarHBondContact O-CB 3.48Å; D22-S25 PolarHBondContact O-N 2.89Å; D22-S25 VanDerWaalsContact O-N 3.13Å; D22-S25 PolarHBondContact O-OG 2.99Å; S25-K27 PolarHBondContact O-N 3.03Å
26T70.6Confident83.1Confident128 Ų12862.7 Ų62.779%0.78533%0.332SS*.G310 helixtrans-71.3-12.4175.453.40000114.2Y24Y24-T26 PolarHBondContact O-N 3.42Å
27K68.8Low83.3Confident115 Ų11563.8 Ų63.850%0.533%0.333SS..G310 helixtrans-115.715.8-178.3-64.2-173.4177.1-178.40113.1Y24 S25 G29Y24-K27 PolarHBondContact O-N 3.27Å; S25-K27 PolarHBondContact O-N 3.03Å; K27-G29 PolarHBondContact O-N 3.43Å
28D77.8Confident83.2Confident144 Ų14464.7 Ų64.777%0.7734%0.34SS*.THydrogen-bonded Turntrans59.2-6.2-173.4-60.4-38.7000115.7
29G83.7Confident82.9Confident6 Ų661.2 Ų61.26%0.06233%0.326CS..SBendtrans177.7173.7178.800000113.1K27 I64K27-G29 PolarHBondContact O-N 3.43Å; G29-I64 WeakPolarHBondContact CA-O 3.3Å
30I87.9Confident82.3Confident0 Ų059.8 Ų59.80%032%0.324CS..EExtended strand (participates in β ladder)trans-82.9128.6173.3-59.2-176.6000108.4T20 F21 Y24 L32 D34 L35 L38 I64T20-I30 HydrophobicContact CG2-CD1 4.34Å; F21-I30 HydrophobicContact CB-CD1 4.36Å; F21-I30 HydrophobicContact CD1-CB 4.47Å; F21-I30 HydrophobicContact CD1-CD1 3.63Å; F21-I30 HydrophobicContact CD1-CG1 3.65Å; F21-I30 HydrophobicContact CD2-CD1 3.78Å; F21-I30 HydrophobicContact CE1-CB 4.33Å; F21-I30 HydrophobicContact CE1-CD1 3.75Å; F21-I30 HydrophobicContact CE1-CG1 3.91Å; F21-I30 HydrophobicContact CE2-CD1 3.91Å; F21-I30 HydrophobicContact CG-CD1 3.65Å; F21-I30 HydrophobicContact CG-CG1 4.06Å; F21-I30 HydrophobicContact CZ-CD1 3.89Å; Y24-I30 HydrophobicContact CD1-CG1 4.49Å; Y24-I30 HydrophobicContact CD2-CD1 4.08Å; Y24-I30 HydrophobicContact CD2-CG1 3.7Å; Y24-I30 HydrophobicContact CE1-CG2 4.47Å; Y24-I30 HydrophobicContact CE2-CD1 4.41Å; Y24-I30 HydrophobicContact CE2-CG1 4.33Å; Y24-I30 HydrophobicContact CG-CB 4.42Å; Y24-I30 HydrophobicContact CG-CG1 3.79Å; I30-L32 PolarHBondContact O-N 2.95Å; I30-D34 HydrophobicContact CG2-CB 3.84Å; I30-L35 HydrophobicContact CD1-CD1 4.38Å; I30-L35 HydrophobicContact CG2-CB 3.91Å; I30-L38 HydrophobicContact CD1-CD1 4.49Å; I30-I64 PolarHBondContact N-O 2.86Å; I30-I64 PolarHBondContact O-N 3.4Å
31P89Confident82Confident23 Ų2366.1 Ų66.115%0.14935%0.347CS..EExtended strand (participates in β ladder)trans-54.2135.6170.8-24.934000111.8S33 D34 L35 L63P31-S33 PolarHBondContact O-N 3.27Å; P31-S33 VanDerWaalsContact O-N 3.12Å; P31-D34 HydrophobicContact CB-CB 4.27Å; P31-D34 WeakPolarHBondContact O-CA 3.38Å; P31-D34 WeakPolarHBondContact O-CB 3.45Å; P31-D34 PolarHBondContact O-N 3.23Å; P31-L35 PolarHBondContact O-N 3.01Å; P31-L63 HydrophobicContact CB-CD2 4.43Å; P31-L63 HydrophobicContact CG-CD2 4.07Å
32L86.8Confident81.5Confident13 Ų1367.8 Ų67.87%0.06836%0.361CS..Hα-helixtrans-53.1-38.4-176.1-179.2136.7000112.9I30 L35 K36 V53 D57 Q62 I64I30-L32 PolarHBondContact O-N 2.95Å; L32-L35 PolarHBondContact O-N 3.5Å; L32-K36 HydrophobicContact CD2-CD 3.95Å; L32-K36 VanDerWaalsContact CD2-CE 3.43Å; L32-K36 WeakPolarHBondContact O-CG 3.3Å; L32-K36 PolarHBondContact O-N 3.24Å; L32-V53 HydrophobicContact CD1-CG1 4Å; L32-V53 HydrophobicContact CG-CG1 3.74Å; L32-D57 HydrophobicContact CD1-CB 4.08Å; L32-Q62 WeakPolarHBondContact CB-O 3.35Å; L32-Q62 PolarHBondContact N-O 2.97Å; L32-I64 HydrophobicContact CD1-CD1 4.23Å; L32-I64 HydrophobicContact CG-CD1 4.5Å
33S86.8Confident81.1Confident75 Ų7572.1 Ų72.152%0.52438%0.384SS..Hα-helixtrans-65.2-37.517556.20000113.6P31 R37P31-S33 PolarHBondContact O-N 3.27Å; P31-S33 VanDerWaalsContact O-N 3.12Å; S33-R37 WeakPolarHBondContact O-CB 3.32Å; S33-R37 PolarHBondContact O-N 3.29Å; S33-R37 VanDerWaalsContact O-N 3.1Å
34D87.1Confident80.4Confident27 Ų2768.6 Ų68.614%0.14437%0.369CS..Hα-helixtrans-71.2-41.9176.8-77.8-0.1000110.8Y24 I30 P31 R37 L38Y24-D34 WeakPolarHBondContact CE1-OD2 3.35Å; Y24-D34 PolarHBondContact OH-OD2 3.35Å; I30-D34 HydrophobicContact CG2-CB 3.84Å; P31-D34 HydrophobicContact CB-CB 4.27Å; P31-D34 WeakPolarHBondContact O-CA 3.38Å; P31-D34 WeakPolarHBondContact O-CB 3.45Å; P31-D34 PolarHBondContact O-N 3.23Å; D34-R37 PolarHBondContact O-N 3.45Å; D34-R37 IonicContact OD1-CZ 3.16Å; D34-R37 IonicContact OD1-NH1 3.71Å; D34-R37 PolarHBondContact OD1-NH1 3.22Å; D34-R37 IonicContact OD1-NH2 3.8Å; D34-R37 PolarHBondContact OD1-NH2 3.02Å; D34-R37 IonicContact OD2-NH2 3.74Å; D34-L38 VanDerWaalsContact O-CG 3.32Å; D34-L38 WeakPolarHBondContact O-CG 3.17Å; D34-L38 PolarHBondContact O-N 3.01Å
35L85.9Confident80.4Confident5 Ų570 Ų703%0.02638%0.384CS..Hα-helixtrans-65.3-43.4177-172.360.4000111.7F21 I30 P31 L32 R37 L38 L39 V53 I64 F69F21-L35 HydrophobicContact CE2-CD1 4.47Å; F21-L35 HydrophobicContact CZ-CD1 4.05Å; F21-L35 HydrophobicContact CZ-CD2 4.27Å; I30-L35 HydrophobicContact CD1-CD1 4.38Å; I30-L35 HydrophobicContact CG2-CB 3.91Å; P31-L35 PolarHBondContact O-N 3.01Å; L32-L35 PolarHBondContact O-N 3.5Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.06Å; L35-L38 PolarHBondContact O-N 3.35Å; L35-L39 HydrophobicContact CD1-CD1 4.16Å; L35-L39 HydrophobicContact CD1-CG 4.21Å; L35-L39 HydrophobicContact CG-CD1 4.01Å; L35-L39 HydrophobicContact CG-CG 4.44Å; L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 WeakPolarHBondContact O-CG 3.42Å; L35-L39 PolarHBondContact O-N 3.03Å; L35-V53 HydrophobicContact CD2-CG1 4.24Å; L35-V53 HydrophobicContact CD2-CG2 4.32Å; L35-V53 HydrophobicContact CG-CG2 4.32Å; L35-I64 HydrophobicContact CD2-CB 4.07Å; L35-I64 HydrophobicContact CD2-CD1 3.67Å; L35-I64 HydrophobicContact CD2-CG1 4.49Å; L35-I64 HydrophobicContact CD2-CG2 3.97Å; L35-F69 HydrophobicContact CD2-CD2 4.21Å
36K86.8Confident81.1Confident32 Ų3273.2 Ų73.214%0.13939%0.39CS..Hα-helixtrans-57.7-42.4172.7-74.4179.5-178.6-176.10111.6L32 G40 H50 V53 D54L32-K36 HydrophobicContact CD2-CD 3.95Å; L32-K36 VanDerWaalsContact CD2-CE 3.43Å; L32-K36 WeakPolarHBondContact O-CG 3.3Å; L32-K36 PolarHBondContact O-N 3.24Å; K36-G40 WeakPolarHBondContact O-CA 3.4Å; K36-G40 PolarHBondContact O-N 3.36Å; K36-H50 PolarHBondContact NZ-ND1 2.99Å; K36-V53 HydrophobicContact CG-CB 4Å; K36-V53 HydrophobicContact CG-CG1 3.88Å; K36-V53 HydrophobicContact CG-CG2 4.09Å; K36-D54 WeakPolarHBondContact CE-OD1 3.23Å; K36-D54 IonicContact NZ-OD1 3.55Å; K36-D54 PolarHBondContact NZ-OD1 2.82Å; K36-D54 IonicContact NZ-OD2 2.8Å; K36-D54 PolarHBondContact NZ-OD2 3.29Å
37R86Confident81.7Confident139 Ų13971 Ų7153%0.52538%0.38SS..Hα-helixtrans-66.4-37.9177-173.8174.466.4-110.50.9112.6S33 D34 L35S33-R37 WeakPolarHBondContact O-CB 3.32Å; S33-R37 PolarHBondContact O-N 3.29Å; S33-R37 VanDerWaalsContact O-N 3.1Å; D34-R37 PolarHBondContact O-N 3.45Å; D34-R37 IonicContact OD1-CZ 3.16Å; D34-R37 IonicContact OD1-NH1 3.71Å; D34-R37 PolarHBondContact OD1-NH1 3.22Å; D34-R37 IonicContact OD1-NH2 3.8Å; D34-R37 PolarHBondContact OD1-NH2 3.02Å; D34-R37 IonicContact OD2-NH2 3.74Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.06Å
38L83.5Confident82.3Confident70 Ų7070.9 Ų70.937%0.36638%0.38SS..Hα-helixtrans-67.9-45.2176.8-73.8170.7000111.6T20 I30 D34 L35T20-L38 HydrophobicContact CG2-CD1 3.99Å; I30-L38 HydrophobicContact CD1-CD1 4.49Å; D34-L38 VanDerWaalsContact O-CG 3.32Å; D34-L38 WeakPolarHBondContact O-CG 3.17Å; D34-L38 PolarHBondContact O-N 3.01Å; L35-L38 PolarHBondContact O-N 3.35Å
39L78.6Confident82.4Confident21 Ų2164.1 Ų64.111%0.1134%0.344CS..Hα-helixtrans-76.1-28.5179.3-67.9175.9000112.9F17 L35 K41 S42 V49 V53 F69F17-L39 HydrophobicContact CE1-CD2 4.37Å; L35-L39 HydrophobicContact CD1-CD1 4.16Å; L35-L39 HydrophobicContact CD1-CG 4.21Å; L35-L39 HydrophobicContact CG-CD1 4.01Å; L35-L39 HydrophobicContact CG-CG 4.44Å; L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 WeakPolarHBondContact O-CG 3.42Å; L35-L39 PolarHBondContact O-N 3.03Å; L39-K41 PolarHBondContact O-N 3.09Å; L39-S42 WeakPolarHBondContact O-CB 3.48Å; L39-S42 PolarHBondContact O-N 2.79Å; L39-S42 PolarHBondContact O-OG 3.26Å; L39-V49 HydrophobicContact CB-CG1 3.61Å; L39-V49 HydrophobicContact CB-CG2 4.36Å; L39-V49 HydrophobicContact CD1-CG1 4.41Å; L39-V53 HydrophobicContact CD1-CG2 3.72Å; L39-F69 HydrophobicContact CD1-CE2 4.31Å
40G76.8Confident82.5Confident38 Ų3868 Ų6839%0.39236%0.36SS..THydrogen-bonded Turntrans-65.5-17.2175.500000113.8K36 S42K36-G40 WeakPolarHBondContact O-CA 3.4Å; K36-G40 PolarHBondContact O-N 3.36Å; G40-S42 PolarHBondContact O-N 3.08Å
41K78.5Confident82.4Confident177 Ų17773 Ų7377%0.7739%0.387SS*.THydrogen-bonded Turntrans-75.9-4.3169.5-68.1-178.8179.3-177.30113.6L39L39-K41 PolarHBondContact O-N 3.09Å
42S74.6Confident82Confident48 Ų4873.4 Ų73.434%0.33639%0.387SS..SBendtrans-89.3170.9176.575.10000111.7L39 G40 L44L39-S42 WeakPolarHBondContact O-CB 3.48Å; L39-S42 PolarHBondContact O-N 2.79Å; L39-S42 PolarHBondContact O-OG 3.26Å; G40-S42 PolarHBondContact O-N 3.08Å; S42-L44 PolarHBondContact O-N 3.33Å; S42-L44 WeakPolarHBondContact OG-CB 3.41Å; S42-L44 PolarHBondContact OG-N 3.28Å
43D77.1Confident81.9Confident175 Ų17572.9 Ų72.994%0.93639%0.385SS*.SBendtrans-72.68176.4-56.1-42.3000113.8
44L71.8Confident81.9Confident76 Ų7672.8 Ų72.840%0.39838%0.379SS..SBendtrans-80.4135.4179.7-68.2172.6000110.8S42 E46 V49S42-L44 PolarHBondContact O-N 3.33Å; S42-L44 WeakPolarHBondContact OG-CB 3.41Å; S42-L44 PolarHBondContact OG-N 3.28Å; L44-E46 PolarHBondContact O-N 2.89Å; L44-V49 HydrophobicContact CB-CG2 3.72Å; L44-V49 HydrophobicContact CD1-CG2 4.47Å
45P82.1Confident81.8Confident77 Ų7774.5 Ų74.550%0.539%0.393SS..  trans-55.1136.8173-24.532.8000111.8S47 K48 V49P45-S47 VanDerWaalsContact C-N 3.26Å; P45-S47 PolarHBondContact O-N 2.88Å; P45-K48 HydrophobicContact CB-CB 4.44Å; P45-K48 WeakPolarHBondContact O-CA 3.49Å; P45-K48 WeakPolarHBondContact O-CB 2.85Å; P45-K48 PolarHBondContact O-N 3.17Å; P45-V49 PolarHBondContact O-N 2.98Å; P45-V49 VanDerWaalsContact O-N 3.09Å
46E82.5Confident81.8Confident148 Ų14874.4 Ų74.469%0.69239%0.393SS*.Hα-helixtrans-53.6-41.6-177.3-74.2-171.5159.200112.7L44 K48 V49 H50L44-E46 PolarHBondContact O-N 2.89Å; E46-K48 PolarHBondContact O-N 3.42Å; E46-V49 PolarHBondContact O-N 3.43Å; E46-H50 PolarHBondContact O-CD2 2.98Å; E46-H50 VanDerWaalsContact O-CD2 3.28Å; E46-H50 PolarHBondContact O-N 3.46Å
47S84.7Confident81.8Confident83 Ų8373.8 Ų73.858%0.5839%0.391SS*.Hα-helixtrans-59.1-35.7177.459.20000112.9P45 N51P45-S47 VanDerWaalsContact C-N 3.26Å; P45-S47 PolarHBondContact O-N 2.88Å; S47-N51 PolarHBondContact O-N 3.48Å; S47-N51 VanDerWaalsContact O-N 3.08Å; S47-N51 PolarHBondContact O-ND2 2.86Å
48K80.1Confident81.6Confident111 Ų11172.9 Ų72.948%0.48339%0.393SS..Hα-helixtrans-75.7-38178.6-165.5175-177.3-175.50111.4P45 E46 L52P45-K48 HydrophobicContact CB-CB 4.44Å; P45-K48 WeakPolarHBondContact O-CA 3.49Å; P45-K48 WeakPolarHBondContact O-CB 2.85Å; P45-K48 PolarHBondContact O-N 3.17Å; E46-K48 PolarHBondContact O-N 3.42Å; K48-L52 VanDerWaalsContact O-CB 3.23Å; K48-L52 WeakPolarHBondContact O-CB 3.4Å; K48-L52 PolarHBondContact O-N 2.92Å
49V81.2Confident81.7Confident3 Ų374.2 Ų74.22%0.01840%0.4CS..Hα-helixtrans-60.9-47.2172.7175.50000110L39 L44 P45 E46 L52 V53L39-V49 HydrophobicContact CB-CG1 3.61Å; L39-V49 HydrophobicContact CB-CG2 4.36Å; L39-V49 HydrophobicContact CD1-CG1 4.41Å; L44-V49 HydrophobicContact CB-CG2 3.72Å; L44-V49 HydrophobicContact CD1-CG2 4.47Å; P45-V49 PolarHBondContact O-N 2.98Å; P45-V49 VanDerWaalsContact O-N 3.09Å; E46-V49 PolarHBondContact O-N 3.43Å; V49-L52 PolarHBondContact O-N 3.24Å; V49-V53 HydrophobicContact CG1-CG2 4.24Å; V49-V53 WeakPolarHBondContact O-CB 3.4Å; V49-V53 WeakPolarHBondContact O-CG2 3.5Å; V49-V53 PolarHBondContact O-N 3.34Å
50H85.7Confident82Confident86 Ų8675.6 Ų75.640%0.39842%0.42SS..Hα-helixtrans-57.4-55.5177.4-88.6-109.7000111.7K36 E46 L52 V53 D54K36-H50 PolarHBondContact NZ-ND1 2.99Å; E46-H50 PolarHBondContact O-CD2 2.98Å; E46-H50 VanDerWaalsContact O-CD2 3.28Å; E46-H50 PolarHBondContact O-N 3.46Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.25Å; H50-V53 PolarHBondContact O-N 2.76Å; H50-D54 VanDerWaalsContact O-CB 3.31Å; H50-D54 WeakPolarHBondContact O-CB 3.42Å; H50-D54 PolarHBondContact O-N 3.36Å; H50-D54 VanDerWaalsContact O-OD2 3.08Å
51N85Confident82.5Confident106 Ų10677 Ų7757%0.56742%0.418SS*.Hα-helixtrans-59.4-40.2-179.3-68.2-14.6000112.7S47 S55S47-N51 PolarHBondContact O-N 3.48Å; S47-N51 VanDerWaalsContact O-N 3.08Å; S47-N51 PolarHBondContact O-ND2 2.86Å; N51-S55 VanDerWaalsContact O-CB 3.24Å; N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 3.38Å; N51-S55 PolarHBondContact O-OG 3.4Å
52L81.5Confident82.9Confident31 Ų3173.9 Ų73.916%0.16241%0.406CS..Hα-helixtrans-63.5-47.4179.2-18071.9000111.4K48 V49 H50 S55 A56 Q72 E76K48-L52 VanDerWaalsContact O-CB 3.23Å; K48-L52 WeakPolarHBondContact O-CB 3.4Å; K48-L52 PolarHBondContact O-N 2.92Å; V49-L52 PolarHBondContact O-N 3.24Å; H50-L52 VanDerWaalsContact C-N 3.3Å; H50-L52 PolarHBondContact O-N 3.25Å; L52-S55 PolarHBondContact O-N 3.1Å; L52-A56 PolarHBondContact O-N 2.97Å; L52-Q72 HydrophobicContact CD1-CG 3.86Å; L52-E76 HydrophobicContact CD1-CB 4.32Å; L52-E76 HydrophobicContact CD1-CG 3.61Å
53V84.7Confident83.5Confident3 Ų374 Ų742%0.01840%0.403CS..Hα-helixtrans-71.2-43-177.5177.90000110.7L32 L35 K36 L39 V49 H50 S55 A56 D57 I64L32-V53 HydrophobicContact CD1-CG1 4Å; L32-V53 HydrophobicContact CG-CG1 3.74Å; L35-V53 HydrophobicContact CD2-CG1 4.24Å; L35-V53 HydrophobicContact CD2-CG2 4.32Å; L35-V53 HydrophobicContact CG-CG2 4.32Å; K36-V53 HydrophobicContact CG-CB 4Å; K36-V53 HydrophobicContact CG-CG1 3.88Å; K36-V53 HydrophobicContact CG-CG2 4.09Å; L39-V53 HydrophobicContact CD1-CG2 3.72Å; V49-V53 HydrophobicContact CG1-CG2 4.24Å; V49-V53 WeakPolarHBondContact O-CB 3.4Å; V49-V53 WeakPolarHBondContact O-CG2 3.5Å; V49-V53 PolarHBondContact O-N 3.34Å; H50-V53 PolarHBondContact O-N 2.76Å; V53-S55 PolarHBondContact O-N 2.7Å; V53-A56 WeakPolarHBondContact O-CB 3.34Å; V53-A56 PolarHBondContact O-N 2.87Å; V53-D57 PolarHBondContact O-N 2.88Å; V53-I64 HydrophobicContact CB-CD1 4.43Å; V53-I64 HydrophobicContact CG1-CD1 3.31Å
54D86.6Confident84Confident73 Ų7365.7 Ų65.739%0.3936%0.358SS..Hα-helixtrans-65.2-30177.7-66.6-28.9000111.9K36 H50 A56K36-D54 WeakPolarHBondContact CE-OD1 3.23Å; K36-D54 IonicContact NZ-OD1 3.55Å; K36-D54 PolarHBondContact NZ-OD1 2.82Å; K36-D54 IonicContact NZ-OD2 2.8Å; K36-D54 PolarHBondContact NZ-OD2 3.29Å; H50-D54 VanDerWaalsContact O-CB 3.31Å; H50-D54 WeakPolarHBondContact O-CB 3.42Å; H50-D54 PolarHBondContact O-N 3.36Å; H50-D54 VanDerWaalsContact O-OD2 3.08Å; D54-A56 VanDerWaalsContact C-N 3.34Å
55S85.1Confident84.9Confident63 Ų6364.1 Ų64.144%0.44135%0.352SS..THydrogen-bonded Turntrans-79.7-15.7174.2-56.20000113.5N51 L52 V53 Q72N51-S55 VanDerWaalsContact O-CB 3.24Å; N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 3.38Å; N51-S55 PolarHBondContact O-OG 3.4Å; L52-S55 PolarHBondContact O-N 3.1Å; V53-S55 PolarHBondContact O-N 2.7Å; S55-Q72 VanDerWaalsContact CB-NE2 3.34Å
56A85.2Confident85.1Confident3 Ų361.7 Ų61.73%0.02533%0.333CS..THydrogen-bonded Turntrans-82.9-27.3178.500000112.6L52 V53 D54 E58 I64 Q72L52-A56 PolarHBondContact O-N 2.97Å; V53-A56 WeakPolarHBondContact O-CB 3.34Å; V53-A56 PolarHBondContact O-N 2.87Å; D54-A56 VanDerWaalsContact C-N 3.34Å; A56-E58 PolarHBondContact O-N 2.8Å; A56-I64 HydrophobicContact CB-CD1 4.2Å; A56-I64 HydrophobicContact CB-CG2 4.36Å; A56-Q72 HydrophobicContact CB-CB 3.8Å; A56-Q72 HydrophobicContact CB-CG 3.89Å
57D87.5Confident85.3Confident19 Ų1960 Ų6010%0.10233%0.328CS..  trans-74.772.1177.3-173.913.8000110.1L32 V53 D59 G60 N61 Q62 I64L32-D57 HydrophobicContact CD1-CB 4.08Å; V53-D57 PolarHBondContact O-N 2.88Å; D57-D59 VanDerWaalsContact C-N 3.34Å; D57-G60 VanDerWaalsContact OD1-CA 3.23Å; D57-G60 WeakPolarHBondContact OD1-CA 3.21Å; D57-G60 PolarHBondContact OD1-N 3.36Å; D57-N61 PolarHBondContact OD1-N 2.84Å; D57-N61 VanDerWaalsContact OD1-N 3.08Å; D57-N61 PolarHBondContact OD1-OD1 3.48Å; D57-Q62 PolarHBondContact OD1-N 3.27Å; D57-Q62 WeakPolarHBondContact OD2-CA 3.21Å; D57-Q62 PolarHBondContact OD2-N 3.01Å; D57-Q62 VanDerWaalsContact OD2-N 3.15Å; D57-Q62 PolarHBondContact OD2-NE2 3.39Å; D57-I64 HydrophobicContact CB-CG1 4.38Å
58E80.2Confident85.4Confident120 Ų12057.3 Ų57.356%0.56131%0.307SS*.SBendtrans-68.3-30.8-175.7-76.5-172.1178.200112.7A56 K71A56-E58 PolarHBondContact O-N 2.8Å; E58-K71 WeakPolarHBondContact OE1-CE 3.42Å; E58-K71 IonicContact OE1-NZ 3.36Å; E58-K71 PolarHBondContact OE1-NZ 3.45Å; E58-K71 IonicContact OE2-NZ 3.65Å; E58-K71 PolarHBondContact OE2-NZ 2.99Å
59D85.1Confident85.8Confident97 Ų9752.5 Ų52.552%0.51929%0.286SS..SBendtrans-93.5-10.8-179.375.4-5.1000113.7D57 N61D57-D59 VanDerWaalsContact C-N 3.34Å; D59-N61 VanDerWaalsContact C-N 3.33Å; D59-N61 VanDerWaalsContact CG-CG 3.43Å; D59-N61 VanDerWaalsContact CG-ND2 3.27Å; D59-N61 WeakPolarHBondContact OD1-CB 3.33Å; D59-N61 PolarHBondContact OD1-N 3.41Å; D59-N61 PolarHBondContact OD1-ND2 2.84Å; D59-N61 VanDerWaalsContact OD1-ND2 3.08Å; D59-N61 PolarHBondContact OD1-OD1 2.84Å; D59-N61 VanDerWaalsContact OD1-OD1 3.12Å; D59-N61 VanDerWaalsContact OD2-CG 3.31Å; D59-N61 PolarHBondContact OD2-ND2 3.48Å
60G85Confident86Confident51 Ų5152.8 Ų52.853%0.52629%0.287SS..  trans75.917.8175.600000114D57 Q62D57-G60 VanDerWaalsContact OD1-CA 3.23Å; D57-G60 WeakPolarHBondContact OD1-CA 3.21Å; D57-G60 PolarHBondContact OD1-N 3.36Å; G60-Q62 VanDerWaalsContact C-N 3.28Å; G60-Q62 PolarHBondContact O-N 3.2Å
61N87.9Confident86Confident68 Ų6854 Ų5436%0.36429%0.291SS..SBendtrans-82.4-2.4-176.171.811.9000113.3D57 D59 L63D57-N61 PolarHBondContact OD1-N 2.84Å; D57-N61 VanDerWaalsContact OD1-N 3.08Å; D57-N61 PolarHBondContact OD1-OD1 3.48Å; D59-N61 VanDerWaalsContact C-N 3.33Å; D59-N61 VanDerWaalsContact CG-CG 3.43Å; D59-N61 VanDerWaalsContact CG-ND2 3.27Å; D59-N61 WeakPolarHBondContact OD1-CB 3.33Å; D59-N61 PolarHBondContact OD1-N 3.41Å; D59-N61 PolarHBondContact OD1-ND2 2.84Å; D59-N61 VanDerWaalsContact OD1-ND2 3.08Å; D59-N61 PolarHBondContact OD1-OD1 2.84Å; D59-N61 VanDerWaalsContact OD1-OD1 3.12Å; D59-N61 VanDerWaalsContact OD2-CG 3.31Å; D59-N61 PolarHBondContact OD2-ND2 3.48Å; N61-L63 PolarHBondContact O-N 2.85Å; N61-L63 VanDerWaalsContact OD1-CA 3.27Å; N61-L63 WeakPolarHBondContact OD1-CA 3.42Å; N61-L63 WeakPolarHBondContact OD1-CB 3.48Å; N61-L63 PolarHBondContact OD1-N 3.32Å; N61-L63 PolarHBondContact OD1-O 3.4Å
62Q87.4Confident86.1Confident110 Ų11050 Ų5051%0.51427%0.269SS..SBendtrans63.417.4-175.8-57.4-72.9-73.500114.8L32 D57 G60L32-Q62 WeakPolarHBondContact CB-O 3.35Å; L32-Q62 PolarHBondContact N-O 2.97Å; D57-Q62 PolarHBondContact OD1-N 3.27Å; D57-Q62 WeakPolarHBondContact OD2-CA 3.21Å; D57-Q62 PolarHBondContact OD2-N 3.01Å; D57-Q62 VanDerWaalsContact OD2-N 3.15Å; D57-Q62 PolarHBondContact OD2-NE2 3.39Å; G60-Q62 VanDerWaalsContact C-N 3.28Å; G60-Q62 PolarHBondContact O-N 3.2Å
63L88.1Confident86.2Confident51 Ų5150 Ų5027%0.26727%0.27SS..EExtended strand (participates in β ladder)trans-129.3114.9179.3-68.9164.4000108.8P31 N61P31-L63 HydrophobicContact CB-CD2 4.43Å; P31-L63 HydrophobicContact CG-CD2 4.07Å; N61-L63 PolarHBondContact O-N 2.85Å; N61-L63 VanDerWaalsContact OD1-CA 3.27Å; N61-L63 WeakPolarHBondContact OD1-CA 3.42Å; N61-L63 WeakPolarHBondContact OD1-CB 3.48Å; N61-L63 PolarHBondContact OD1-N 3.32Å; N61-L63 PolarHBondContact OD1-O 3.4Å
64I87.5Confident86.1Confident0 Ų051.3 Ų51.30%028%0.277CS..EExtended strand (participates in β ladder)trans-96.1119.4-177.7-66164.6000108.9F21 G29 I30 L32 L35 V53 A56 D57 E68 F69F21-I64 HydrophobicContact CE1-CG2 4.28Å; F21-I64 WeakPolarHBondContact CE1-O 3.28Å; G29-I64 WeakPolarHBondContact CA-O 3.3Å; I30-I64 PolarHBondContact N-O 2.86Å; I30-I64 PolarHBondContact O-N 3.4Å; L32-I64 HydrophobicContact CD1-CD1 4.23Å; L32-I64 HydrophobicContact CG-CD1 4.5Å; L35-I64 HydrophobicContact CD2-CB 4.07Å; L35-I64 HydrophobicContact CD2-CD1 3.67Å; L35-I64 HydrophobicContact CD2-CG1 4.49Å; L35-I64 HydrophobicContact CD2-CG2 3.97Å; V53-I64 HydrophobicContact CB-CD1 4.43Å; V53-I64 HydrophobicContact CG1-CD1 3.31Å; A56-I64 HydrophobicContact CB-CD1 4.2Å; A56-I64 HydrophobicContact CB-CG2 4.36Å; D57-I64 HydrophobicContact CB-CG1 4.38Å; I64-E68 HydrophobicContact CG2-CB 4.24Å; I64-F69 HydrophobicContact CG2-CB 3.9Å
65T88.8Confident85.8Confident43 Ų4350.2 Ų50.226%0.26428%0.275SS..  trans-71.7158.3170.165.50000110.4D67 E68 F69T65-D67 PolarHBondContact O-N 2.82Å; T65-E68 WeakPolarHBondContact CB-OE2 3.48Å; T65-E68 WeakPolarHBondContact CG2-OE2 3.42Å; T65-E68 PolarHBondContact N-OE2 3.39Å; T65-E68 PolarHBondContact O-N 2.97Å; T65-E68 WeakPolarHBondContact OG1-CB 3.48Å; T65-E68 VanDerWaalsContact OG1-CD 3.27Å; T65-E68 VanDerWaalsContact OG1-CG 3.24Å; T65-E68 WeakPolarHBondContact OG1-CG 3.3Å; T65-E68 PolarHBondContact OG1-N 3.22Å; T65-E68 VanDerWaalsContact OG1-N 3.12Å; T65-E68 PolarHBondContact OG1-OE2 2.77Å; T65-F69 PolarHBondContact O-N 3.42Å
66Y87.1Confident85.6Confident27 Ų2750.3 Ų50.311%0.10627%0.269CS..Hα-helixtrans-61.6-33.9174.6-180-109.4000111.9L13 D14 F17 K18 F21 F69 L70L13-Y66 PolarHBondContact O-OH 3.32Å; D14-Y66 WeakPolarHBondContact CA-OH 3.34Å; D14-Y66 PolarHBondContact N-OH 3Å; D14-Y66 WeakPolarHBondContact OD1-CE1 3.27Å; D14-Y66 VanDerWaalsContact OD1-CZ 3.3Å; D14-Y66 PolarHBondContact OD1-OH 3.28Å; F17-Y66 HydrophobicContact CB-CE2 4.05Å; K18-Y66 HydrophobicContact CB-CD2 4.44Å; K18-Y66 HydrophobicContact CB-CE1 4.23Å; K18-Y66 HydrophobicContact CB-CE2 4.12Å; K18-Y66 HydrophobicContact CD-CD1 4.49Å; K18-Y66 HydrophobicContact CD-CE1 4.29Å; K18-Y66 HydrophobicContact CG-CD1 4.18Å; K18-Y66 HydrophobicContact CG-CE1 4.19Å; K18-Y66 HydrophobicContact CG-CG 4.41Å; F21-Y66 HydrophobicContact CB-CD2 4.25Å; F21-Y66 HydrophobicContact CB-CG 4.44Å; F21-Y66 HydrophobicContact CD1-CD2 4.45Å; F21-Y66 AromaticContact CD2-CD2 3.66Å; F21-Y66 HydrophobicContact CD2-CD2 3.66Å; F21-Y66 HydrophobicContact CD2-CE2 4.47Å; F21-Y66 HydrophobicContact CE2-CD2 4.08Å; F21-Y66 AromaticContact CG-CD2 3.87Å; F21-Y66 HydrophobicContact CG-CD2 3.87Å; F21-Y66 HydrophobicContact CG-CG 4.34Å; Y66-F69 HydrophobicContact CD2-CD1 4.4Å; Y66-F69 HydrophobicContact CE2-CD1 4.33Å; Y66-L70 HydrophobicContact CE1-CD2 4.35Å; Y66-L70 VanDerWaalsContact O-CB 3.23Å; Y66-L70 WeakPolarHBondContact O-CB 3.38Å; Y66-L70 PolarHBondContact O-N 2.87Å
67D87.1Confident85.1Confident111 Ų11151.7 Ų51.759%0.59428%0.276SS*.Hα-helixtrans-69.2-41.2179.7-73-41000112.1T65 L70 K71T65-D67 PolarHBondContact O-N 2.82Å; D67-L70 PolarHBondContact O-N 3.17Å; D67-K71 VanDerWaalsContact O-CB 3.28Å; D67-K71 WeakPolarHBondContact O-CB 3.44Å; D67-K71 PolarHBondContact O-N 3.33Å
68E87.3Confident84.5Confident28 Ų2855.2 Ų55.213%0.13129%0.292CS..Hα-helixtrans-63.2-46.6172.8-76163.1146.800111.8I64 T65 L70 K71 Q72I64-E68 HydrophobicContact CG2-CB 4.24Å; T65-E68 WeakPolarHBondContact CB-OE2 3.48Å; T65-E68 WeakPolarHBondContact CG2-OE2 3.42Å; T65-E68 PolarHBondContact N-OE2 3.39Å; T65-E68 PolarHBondContact O-N 2.97Å; T65-E68 WeakPolarHBondContact OG1-CB 3.48Å; T65-E68 VanDerWaalsContact OG1-CD 3.27Å; T65-E68 VanDerWaalsContact OG1-CG 3.24Å; T65-E68 WeakPolarHBondContact OG1-CG 3.3Å; T65-E68 PolarHBondContact OG1-N 3.22Å; T65-E68 VanDerWaalsContact OG1-N 3.12Å; T65-E68 PolarHBondContact OG1-OE2 2.77Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.23Å; E68-K71 PolarHBondContact O-N 2.59Å; E68-Q72 WeakPolarHBondContact O-CB 3.45Å; E68-Q72 PolarHBondContact O-N 2.81Å
69F87.4Confident84.2Confident9 Ų950 Ų504%0.03927%0.271CS..Hα-helixtrans-57.6-47.1174.8174.2-102.6000111.4F17 F21 L35 L39 I64 T65 Y66 Q72 V73F17-F69 HydrophobicContact CB-CE1 4.07Å; F17-F69 HydrophobicContact CD1-CE1 4.11Å; F17-F69 HydrophobicContact CD1-CZ 4.09Å; F17-F69 HydrophobicContact CD2-CE1 4.26Å; F17-F69 HydrophobicContact CE1-CZ 4.23Å; F17-F69 AromaticContact CG-CE1 3.89Å; F17-F69 HydrophobicContact CG-CE1 3.89Å; F17-F69 HydrophobicContact CG-CZ 4.27Å; F21-F69 HydrophobicContact CE1-CB 4.04Å; F21-F69 HydrophobicContact CE2-CB 4.35Å; F21-F69 AromaticContact CE2-CD1 3.85Å; F21-F69 HydrophobicContact CE2-CD1 3.85Å; F21-F69 HydrophobicContact CE2-CE1 4.29Å; F21-F69 HydrophobicContact CE2-CG 4Å; F21-F69 HydrophobicContact CZ-CB 3.57Å; F21-F69 AromaticContact CZ-CD1 3.9Å; F21-F69 HydrophobicContact CZ-CD1 3.9Å; F21-F69 HydrophobicContact CZ-CD2 4.07Å; F21-F69 AromaticContact CZ-CG 3.57Å; F21-F69 HydrophobicContact CZ-CG 3.57Å; L35-F69 HydrophobicContact CD2-CD2 4.21Å; L39-F69 HydrophobicContact CD1-CE2 4.31Å; I64-F69 HydrophobicContact CG2-CB 3.9Å; T65-F69 PolarHBondContact O-N 3.42Å; Y66-F69 HydrophobicContact CD2-CD1 4.4Å; Y66-F69 HydrophobicContact CE2-CD1 4.33Å; F69-Q72 PolarHBondContact O-N 2.96Å; F69-V73 HydrophobicContact CD1-CG2 4.41Å; F69-V73 HydrophobicContact CD2-CG2 4.14Å; F69-V73 HydrophobicContact CE1-CG2 4.02Å; F69-V73 HydrophobicContact CE2-CG2 3.73Å; F69-V73 HydrophobicContact CG-CG2 4.47Å; F69-V73 HydrophobicContact CZ-CG2 3.67Å; F69-V73 WeakPolarHBondContact O-CB 3.29Å; F69-V73 VanDerWaalsContact O-CG2 3.29Å; F69-V73 WeakPolarHBondContact O-CG2 3.45Å; F69-V73 PolarHBondContact O-N 3.17Å
70L86.7Confident83.5Confident9 Ų948 Ų485%0.04726%0.262CS..Hα-helixtrans-61.6-46.2178.6-178.265.6000110.9R10 L13 Y66 D67 E68 Q72 V73 L74R10-L70 HydrophobicContact CG-CD1 4.37Å; R10-L70 HydrophobicContact CG-CD2 4.17Å; L13-L70 HydrophobicContact CB-CD1 4.05Å; L13-L70 HydrophobicContact CD1-CD1 3.58Å; L13-L70 HydrophobicContact CG-CD1 4.47Å; Y66-L70 HydrophobicContact CE1-CD2 4.35Å; Y66-L70 VanDerWaalsContact O-CB 3.23Å; Y66-L70 WeakPolarHBondContact O-CB 3.38Å; Y66-L70 PolarHBondContact O-N 2.87Å; D67-L70 PolarHBondContact O-N 3.17Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.23Å; L70-Q72 VanDerWaalsContact C-N 3.34Å; L70-Q72 PolarHBondContact O-N 3.5Å; L70-V73 PolarHBondContact O-N 3.13Å; L70-L74 HydrophobicContact CD1-CD1 4.12Å; L70-L74 HydrophobicContact CD1-CG 4.28Å; L70-L74 HydrophobicContact CG-CD1 3.99Å; L70-L74 HydrophobicContact CG-CG 4.49Å; L70-L74 WeakPolarHBondContact O-CB 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.43Å; L70-L74 PolarHBondContact O-N 2.87Å
71K85.6Confident82.7Confident111 Ų11147 Ų4748%0.48325%0.245SC..Hα-helixtrans-58.6-45.3177.9-172.4-174.2179.9-165.60111.4E58 D67 E68 L74 S75E58-K71 WeakPolarHBondContact OE1-CE 3.42Å; E58-K71 IonicContact OE1-NZ 3.36Å; E58-K71 PolarHBondContact OE1-NZ 3.45Å; E58-K71 IonicContact OE2-NZ 3.65Å; E58-K71 PolarHBondContact OE2-NZ 2.99Å; D67-K71 VanDerWaalsContact O-CB 3.28Å; D67-K71 WeakPolarHBondContact O-CB 3.44Å; D67-K71 PolarHBondContact O-N 3.33Å; E68-K71 PolarHBondContact O-N 2.59Å; K71-L74 PolarHBondContact O-N 2.83Å; K71-S75 WeakPolarHBondContact O-CB 3.35Å; K71-S75 PolarHBondContact O-N 3.3Å
72Q85.7Confident81.7Confident23 Ų2351.5 Ų51.511%0.10726%0.256CS..Hα-helixtrans-71.6-37.9-178.9-174.757.911.900113.2L52 S55 A56 E68 F69 L70 S75 E76L52-Q72 HydrophobicContact CD1-CG 3.86Å; S55-Q72 VanDerWaalsContact CB-NE2 3.34Å; A56-Q72 HydrophobicContact CB-CB 3.8Å; A56-Q72 HydrophobicContact CB-CG 3.89Å; E68-Q72 WeakPolarHBondContact O-CB 3.45Å; E68-Q72 PolarHBondContact O-N 2.81Å; F69-Q72 PolarHBondContact O-N 2.96Å; L70-Q72 VanDerWaalsContact C-N 3.34Å; L70-Q72 PolarHBondContact O-N 3.5Å; Q72-S75 PolarHBondContact O-N 3.41Å; Q72-S75 PolarHBondContact O-OG 3.04Å; Q72-S75 PolarHBondContact OE1-OG 3.23Å; Q72-E76 WeakPolarHBondContact O-CB 3.38Å; Q72-E76 PolarHBondContact O-N 3.13Å
73V84.4Confident80.8Confident30 Ų3054.3 Ų54.318%0.18226%0.262CS..Hα-helixtrans-66.1-41.2174.9171.80000111.1L13 F69 L70 E76 D77L13-V73 HydrophobicContact CD1-CB 4.33Å; L13-V73 HydrophobicContact CD1-CG1 3.72Å; L13-V73 HydrophobicContact CD2-CG1 4.32Å; F69-V73 HydrophobicContact CD1-CG2 4.41Å; F69-V73 HydrophobicContact CD2-CG2 4.14Å; F69-V73 HydrophobicContact CE1-CG2 4.02Å; F69-V73 HydrophobicContact CE2-CG2 3.73Å; F69-V73 HydrophobicContact CG-CG2 4.47Å; F69-V73 HydrophobicContact CZ-CG2 3.67Å; F69-V73 WeakPolarHBondContact O-CB 3.29Å; F69-V73 VanDerWaalsContact O-CG2 3.29Å; F69-V73 WeakPolarHBondContact O-CG2 3.45Å; F69-V73 PolarHBondContact O-N 3.17Å; L70-V73 PolarHBondContact O-N 3.13Å; V73-E76 PolarHBondContact O-N 2.72Å; V73-D77 PolarHBondContact O-N 2.95Å
74L81.9Confident79.5Confident32 Ų3257.1 Ų57.117%0.16828%0.277CS..Hα-helixtrans-65.9-39.7176.8-68.8175.4000111.6M1 L9 L70 K71 D77 E78M1-L74 HydrophobicContact CE-CD2 4.46Å; L9-L74 HydrophobicContact CD2-CD2 3.84Å; L9-L74 HydrophobicContact CG-CD2 4.23Å; L70-L74 HydrophobicContact CD1-CD1 4.12Å; L70-L74 HydrophobicContact CD1-CG 4.28Å; L70-L74 HydrophobicContact CG-CD1 3.99Å; L70-L74 HydrophobicContact CG-CG 4.49Å; L70-L74 WeakPolarHBondContact O-CB 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.43Å; L70-L74 PolarHBondContact O-N 2.87Å; K71-L74 PolarHBondContact O-N 2.83Å; L74-D77 PolarHBondContact O-N 3.36Å; L74-E78 WeakPolarHBondContact O-CG 3.12Å; L74-E78 PolarHBondContact O-N 2.85Å
75S81.1Confident78.4Confident49 Ų4961.2 Ų61.234%0.34329%0.292SS..Hα-helixtrans-64.4-40.4177.477.90000112.1K71 Q72 E78 G79K71-S75 WeakPolarHBondContact O-CB 3.35Å; K71-S75 PolarHBondContact O-N 3.3Å; Q72-S75 PolarHBondContact O-N 3.41Å; Q72-S75 PolarHBondContact O-OG 3.04Å; Q72-S75 PolarHBondContact OE1-OG 3.23Å; S75-E78 PolarHBondContact O-N 2.9Å; S75-G79 PolarHBondContact O-N 2.99Å
76E80Confident77.2Confident65 Ų6563.4 Ų63.430%0.30430%0.301SS..Hα-helixtrans-70.5-37176.3-78.6-72.5160.800113.3L52 Q72 V73 E78 G79 T80L52-E76 HydrophobicContact CD1-CB 4.32Å; L52-E76 HydrophobicContact CD1-CG 3.61Å; Q72-E76 WeakPolarHBondContact O-CB 3.38Å; Q72-E76 PolarHBondContact O-N 3.13Å; V73-E76 PolarHBondContact O-N 2.72Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-G79 PolarHBondContact O-N 3.46Å; E76-T80 VanDerWaalsContact O-CB 3.3Å; E76-T80 WeakPolarHBondContact O-CB 3.5Å; E76-T80 PolarHBondContact O-N 2.89Å; E76-T80 PolarHBondContact O-OG1 2.97Å
77D76.3Confident75.9Confident33 Ų3368.3 Ų68.318%0.17633%0.325CS..Hα-helixtrans-61.5-44.3171.4-173.764.2000110.5R5 L9 V73 L74 T80 L81R5-D77 IonicContact CZ-OD1 2.79Å; R5-D77 IonicContact CZ-OD2 2.71Å; R5-D77 IonicContact NE-OD2 2.64Å; R5-D77 PolarHBondContact NE-OD2 3.09Å; R5-D77 IonicContact NH2-OD1 3.13Å; R5-D77 PolarHBondContact NH2-OD1 3.41Å; R5-D77 IonicContact NH2-OD2 3.1Å; R5-D77 PolarHBondContact NH2-OD2 3.44Å; L9-D77 HydrophobicContact CD2-CB 4.05Å; V73-D77 PolarHBondContact O-N 2.95Å; L74-D77 PolarHBondContact O-N 3.36Å; D77-T80 PolarHBondContact O-N 2.95Å; D77-L81 VanDerWaalsContact O-CB 3.3Å; D77-L81 WeakPolarHBondContact O-CB 3.43Å; D77-L81 WeakPolarHBondContact O-CG 3.42Å; D77-L81 PolarHBondContact O-N 2.83Å; D77-L81 WeakPolarHBondContact OD2-CD1 3.28Å
78E74.1Confident74.7Confident92 Ų9267.2 Ų67.243%0.4332%0.315SS..Hα-helixtrans-62.9-44.5175.3-74.7-158.9139.800112.7M1 L74 S75 E76 L81 R82M1-E78 HydrophobicContact CE-CG 3.32Å; M1-E78 HydrophobicContact CG-CG 4.34Å; M1-E78 HydrophobicContact SD-CG 4.02Å; L74-E78 WeakPolarHBondContact O-CG 3.12Å; L74-E78 PolarHBondContact O-N 2.85Å; S75-E78 PolarHBondContact O-N 2.9Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E78-L81 WeakPolarHBondContact O-CB 3.46Å; E78-L81 PolarHBondContact O-N 3.27Å; E78-R82 WeakPolarHBondContact O-CB 3.49Å; E78-R82 PolarHBondContact O-N 3.43Å
79G73.3Confident73.5Confident12 Ų1269.2 Ų69.212%0.12432%0.321CS..Hα-helixtrans-60.2-44.8175.900000112.1S75 E76 R82 R83S75-G79 PolarHBondContact O-N 2.99Å; E76-G79 PolarHBondContact O-N 3.46Å; G79-R82 WeakPolarHBondContact O-CB 3.39Å; G79-R82 PolarHBondContact O-N 3.33Å; G79-R83 WeakPolarHBondContact O-CG 3.04Å; G79-R83 PolarHBondContact O-N 3.03Å
80T71.8Confident72.3Confident54 Ų5473.1 Ų73.133%0.33135%0.346SS..Hα-helixtrans-64.1-46.6177.2-60.50000111.1E76 D77 R82 R83 L84E76-T80 VanDerWaalsContact O-CB 3.3Å; E76-T80 WeakPolarHBondContact O-CB 3.5Å; E76-T80 PolarHBondContact O-N 2.89Å; E76-T80 PolarHBondContact O-OG1 2.97Å; D77-T80 PolarHBondContact O-N 2.95Å; T80-R82 VanDerWaalsContact C-N 3.31Å; T80-R82 PolarHBondContact O-N 3.46Å; T80-R83 PolarHBondContact O-N 3.3Å; T80-L84 HydrophobicContact CG2-CD1 4.06Å; T80-L84 HydrophobicContact CG2-CG 4.38Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 WeakPolarHBondContact O-CG 2.89Å; T80-L84 PolarHBondContact O-N 3.18Å
81L67.4Low71Confident31 Ų3177.2 Ų77.216%0.16237%0.367CS..Hα-helixtrans-56.4-44.5173.6-89.6162.7000112D77 E78 R83 L84 R85D77-L81 VanDerWaalsContact O-CB 3.3Å; D77-L81 WeakPolarHBondContact O-CB 3.43Å; D77-L81 WeakPolarHBondContact O-CG 3.42Å; D77-L81 PolarHBondContact O-N 2.83Å; D77-L81 WeakPolarHBondContact OD2-CD1 3.28Å; E78-L81 WeakPolarHBondContact O-CB 3.46Å; E78-L81 PolarHBondContact O-N 3.27Å; L81-R83 PolarHBondContact O-N 2.79Å; L81-L84 PolarHBondContact O-N 2.82Å; L81-R85 WeakPolarHBondContact O-CB 3.21Å; L81-R85 VanDerWaalsContact O-CG 3.3Å; L81-R85 WeakPolarHBondContact O-CG 3.39Å; L81-R85 PolarHBondContact O-N 3.37Å
82R67.2Low69.9Low162 Ų16273 Ų7361%0.61135%0.35SS*.Hα-helixtrans-60.8-45.3177.5-171.6176.771.3-141.53.2111E78 G79 T80 R85 I86E78-R82 WeakPolarHBondContact O-CB 3.49Å; E78-R82 PolarHBondContact O-N 3.43Å; G79-R82 WeakPolarHBondContact O-CB 3.39Å; G79-R82 PolarHBondContact O-N 3.33Å; T80-R82 VanDerWaalsContact C-N 3.31Å; T80-R82 PolarHBondContact O-N 3.46Å; R82-R85 PolarHBondContact O-N 3.07Å; R82-I86 HydrophobicContact CG-CD1 4.2Å; R82-I86 VanDerWaalsContact O-CG1 3.28Å; R82-I86 WeakPolarHBondContact O-CG1 3.41Å; R82-I86 PolarHBondContact O-N 3.18Å
83R68.2Low68.9Low168 Ų16879.6 Ų79.663%0.63437%0.374SS*.Hα-helixtrans-62.9-44.3175.6-69.4179.6-165.8162.48111.9G79 T80 L81 R85 I86 H87G79-R83 WeakPolarHBondContact O-CG 3.04Å; G79-R83 PolarHBondContact O-N 3.03Å; T80-R83 PolarHBondContact O-N 3.3Å; L81-R83 PolarHBondContact O-N 2.79Å; R83-R85 PolarHBondContact O-N 2.64Å; R83-I86 PolarHBondContact O-N 2.93Å; R83-H87 WeakPolarHBondContact O-CB 3.44Å; R83-H87 PolarHBondContact O-N 3.21Å
84L60.2Low67.8Low110 Ų11080.1 Ų80.158%0.57638%0.381SS*.Hα-helixtrans-61.6-42.2177.2-73.1172.4000111.7T80 L81 H87 K88T80-L84 HydrophobicContact CG2-CD1 4.06Å; T80-L84 HydrophobicContact CG2-CG 4.38Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 WeakPolarHBondContact O-CG 2.89Å; T80-L84 PolarHBondContact O-N 3.18Å; L81-L84 PolarHBondContact O-N 2.82Å; L84-H87 PolarHBondContact O-N 3.3Å; L84-K88 VanDerWaalsContact O-CB 3.3Å; L84-K88 WeakPolarHBondContact O-CB 3.24Å; L84-K88 PolarHBondContact O-N 2.84Å
85R66.2Low66.8Low87 Ų8781 Ų8133%0.32839%0.388SS..Hα-helixtrans-61.9-46.3174.3-73.8177.4-176-151.4-6.4111.5L81 R82 R83 H87 K88 R89 D130L81-R85 WeakPolarHBondContact O-CB 3.21Å; L81-R85 VanDerWaalsContact O-CG 3.3Å; L81-R85 WeakPolarHBondContact O-CG 3.39Å; L81-R85 PolarHBondContact O-N 3.37Å; R82-R85 PolarHBondContact O-N 3.07Å; R83-R85 PolarHBondContact O-N 2.64Å; R85-H87 PolarHBondContact O-N 2.68Å; R85-K88 PolarHBondContact O-N 3.35Å; R85-R89 VanDerWaalsContact O-CG 3.27Å; R85-R89 WeakPolarHBondContact O-CG 3.22Å; R85-R89 PolarHBondContact O-N 3.42Å; R85-D130 IonicContact NH1-OD2 2.87Å
86I62.3Low65.9Low88 Ų8880 Ų8045%0.45138%0.379SS..Hα-helixtrans-59.9-47.1175.8-68164.8000110.3R82 R83 R89 V90R82-I86 HydrophobicContact CG-CD1 4.2Å; R82-I86 VanDerWaalsContact O-CG1 3.28Å; R82-I86 WeakPolarHBondContact O-CG1 3.41Å; R82-I86 PolarHBondContact O-N 3.18Å; R83-I86 PolarHBondContact O-N 2.93Å; I86-R89 WeakPolarHBondContact O-CB 3.42Å; I86-R89 PolarHBondContact O-N 3.49Å; I86-V90 HydrophobicContact CG2-CG2 4.41Å; I86-V90 WeakPolarHBondContact O-CG2 3.43Å; I86-V90 PolarHBondContact O-N 3.06Å
87H59.2Low65.2Low130 Ų13081 Ų8160%0.60240%0.398SS*.Hα-helixtrans-64.2-44-179-165.578.6000112R83 L84 R85 R89 V90 L91R83-H87 WeakPolarHBondContact O-CB 3.44Å; R83-H87 PolarHBondContact O-N 3.21Å; L84-H87 PolarHBondContact O-N 3.3Å; R85-H87 PolarHBondContact O-N 2.68Å; H87-R89 VanDerWaalsContact C-N 3.26Å; H87-R89 PolarHBondContact O-N 3.01Å; H87-V90 PolarHBondContact O-N 3.23Å; H87-L91 WeakPolarHBondContact O-CB 3.43Å; H87-L91 PolarHBondContact O-N 3.12Å
88K63.1Low64.8Low89 Ų8986.3 Ų86.339%0.38743%0.425SS..Hα-helixtrans-56-41173-170.1-171.4176.9-153.90111.4L84 R85 L91 N92 D128L84-K88 VanDerWaalsContact O-CB 3.3Å; L84-K88 WeakPolarHBondContact O-CB 3.24Å; L84-K88 PolarHBondContact O-N 2.84Å; R85-K88 PolarHBondContact O-N 3.35Å; K88-L91 PolarHBondContact O-N 2.86Å; K88-N92 VanDerWaalsContact O-CB 3.28Å; K88-N92 WeakPolarHBondContact O-CB 3.38Å; K88-N92 PolarHBondContact O-N 3.5Å; K88-N92 PolarHBondContact O-ND2 2.86Å; K88-D128 IonicContact NZ-OD1 3.95Å
89R62.4Low64.7Low70 Ų7083.6 Ų83.626%0.26442%0.418SS..Hα-helixtrans-66.6-46.3175.7-70.6171.1-165.8174.39.3113.3R85 I86 H87 L91 N92 R93 D128 D130 Q134R85-R89 VanDerWaalsContact O-CG 3.27Å; R85-R89 WeakPolarHBondContact O-CG 3.22Å; R85-R89 PolarHBondContact O-N 3.42Å; I86-R89 WeakPolarHBondContact O-CB 3.42Å; I86-R89 PolarHBondContact O-N 3.49Å; H87-R89 VanDerWaalsContact C-N 3.26Å; H87-R89 PolarHBondContact O-N 3.01Å; R89-L91 VanDerWaalsContact C-N 3.27Å; R89-L91 PolarHBondContact O-N 3.39Å; R89-N92 PolarHBondContact O-N 2.99Å; R89-R93 WeakPolarHBondContact O-CB 3.5Å; R89-R93 PolarHBondContact O-N 3.39Å; R89-D128 HydrophobicContact CG-CB 4.39Å; R89-D128 WeakPolarHBondContact CG-OD2 3.31Å; R89-D130 IonicContact NH2-OD2 3.59Å; R89-D130 PolarHBondContact NH2-OD2 2.93Å; R89-Q134 VanDerWaalsContact CZ-CD 3.42Å
90V61Low64.7Low91 Ų9185.4 Ų85.455%0.55243%0.427SS*.Hα-helixtrans-59.9-44.4177.1175.80000109.6I86 H87 R93 A94I86-V90 HydrophobicContact CG2-CG2 4.41Å; I86-V90 WeakPolarHBondContact O-CG2 3.43Å; I86-V90 PolarHBondContact O-N 3.06Å; H87-V90 PolarHBondContact O-N 3.23Å; V90-R93 PolarHBondContact O-N 3.45Å; V90-A94 WeakPolarHBondContact O-CB 3.3Å; V90-A94 PolarHBondContact O-N 3.41Å
91L60.9Low64.8Low95 Ų9588.1 Ų88.150%0.49744%0.44SS..Hα-helixtrans-61.9-47.9175.5-175.864.8000111.5H87 K88 R89 R93 A94 V95H87-L91 WeakPolarHBondContact O-CB 3.43Å; H87-L91 PolarHBondContact O-N 3.12Å; K88-L91 PolarHBondContact O-N 2.86Å; R89-L91 VanDerWaalsContact C-N 3.27Å; R89-L91 PolarHBondContact O-N 3.39Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 2.91Å; L91-A94 WeakPolarHBondContact O-CB 3.21Å; L91-A94 PolarHBondContact O-N 2.98Å; L91-A94 VanDerWaalsContact O-N 3.16Å; L91-V95 HydrophobicContact CD1-CG2 4.37Å; L91-V95 HydrophobicContact CG-CG2 4.4Å; L91-V95 WeakPolarHBondContact O-CB 3.28Å; L91-V95 VanDerWaalsContact O-CG2 3.28Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 3.48Å
92N62.4Low65.1Low21 Ų2190.5 Ų90.511%0.11246%0.458CS..Hα-helixtrans-59.5-42.3177.9-80.3-21.4000112.3K88 R89 V95 L96 D128K88-N92 VanDerWaalsContact O-CB 3.28Å; K88-N92 WeakPolarHBondContact O-CB 3.38Å; K88-N92 PolarHBondContact O-N 3.5Å; K88-N92 PolarHBondContact O-ND2 2.86Å; R89-N92 PolarHBondContact O-N 2.99Å; N92-V95 PolarHBondContact O-N 3.05Å; N92-L96 WeakPolarHBondContact O-CB 3.49Å; N92-L96 WeakPolarHBondContact O-CG 3.5Å; N92-L96 PolarHBondContact O-N 2.87Å; N92-D128 VanDerWaalsContact ND2-CG 3.27Å; N92-D128 PolarHBondContact ND2-OD2 3.31Å
93R63.9Low65Low163 Ų16383 Ų8362%0.61543%0.431SS*.Hα-helixtrans-66.3-40.4174.6-77.2-174.8171.7-175.8-1.6112.2R89 V90 L91 L96 A97R89-R93 WeakPolarHBondContact O-CB 3.5Å; R89-R93 PolarHBondContact O-N 3.39Å; V90-R93 PolarHBondContact O-N 3.45Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 2.91Å; R93-L96 PolarHBondContact O-N 2.86Å; R93-A97 WeakPolarHBondContact O-CB 3.46Å; R93-A97 PolarHBondContact O-N 3.42Å
94A60.9Low65Low40 Ų4078.4 Ų78.433%0.33141%0.414SS..Hα-helixtrans-63.6-44.3175.100000111.3V90 L91 A97 I98V90-A94 WeakPolarHBondContact O-CB 3.3Å; V90-A94 PolarHBondContact O-N 3.41Å; L91-A94 WeakPolarHBondContact O-CB 3.21Å; L91-A94 PolarHBondContact O-N 2.98Å; L91-A94 VanDerWaalsContact O-N 3.16Å; A94-A97 PolarHBondContact O-N 2.89Å; A94-I98 WeakPolarHBondContact O-CB 3.39Å; A94-I98 WeakPolarHBondContact O-CD1 3.2Å; A94-I98 WeakPolarHBondContact O-CG1 3.5Å; A94-I98 PolarHBondContact O-N 2.88Å
95V61.1Low65.5Low51 Ų5179.8 Ų79.831%0.30942%0.417SS..Hα-helixtrans-62-44.3175.9172.10000110.9L91 N92 A97 I98 A99L91-V95 HydrophobicContact CD1-CG2 4.37Å; L91-V95 HydrophobicContact CG-CG2 4.4Å; L91-V95 WeakPolarHBondContact O-CB 3.28Å; L91-V95 VanDerWaalsContact O-CG2 3.28Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 3.48Å; N92-V95 PolarHBondContact O-N 3.05Å; V95-A97 VanDerWaalsContact C-N 3.28Å; V95-A97 PolarHBondContact O-N 3.41Å; V95-I98 PolarHBondContact O-N 2.94Å; V95-A99 CarbonylContact O-C 3.26Å; V95-A99 VanDerWaalsContact O-C 3.26Å; V95-A99 WeakPolarHBondContact O-CA 3.37Å; V95-A99 PolarHBondContact O-N 2.86Å
96L62.7Low65.6Low29 Ų2980.2 Ų80.215%0.15242%0.423CS..Hα-helixtrans-62.9-33.8175.1-79173.5000113.2N92 R93 P100 R104 W124N92-L96 WeakPolarHBondContact O-CB 3.49Å; N92-L96 WeakPolarHBondContact O-CG 3.5Å; N92-L96 PolarHBondContact O-N 2.87Å; R93-L96 PolarHBondContact O-N 2.86Å; L96-P100 WeakPolarHBondContact O-CA 3.44Å; L96-P100 WeakPolarHBondContact O-CB 3.07Å; L96-R104 HydrophobicContact CD2-CG 4.15Å; L96-W124 WeakPolarHBondContact CD1-O 3.3Å
97A64.5Low65.8Low85 Ų8576.6 Ų76.670%0.70240%0.404SS*.Hα-helixtrans-73.6-35.7177.200000112.5R93 A94 V95R93-A97 WeakPolarHBondContact O-CB 3.46Å; R93-A97 PolarHBondContact O-N 3.42Å; A94-A97 PolarHBondContact O-N 2.89Å; V95-A97 VanDerWaalsContact C-N 3.28Å; V95-A97 PolarHBondContact O-N 3.41Å
98I69Low66.2Low145 Ų14577.2 Ų77.274%0.74440%0.401SS*.Hα-helixtrans-86.1-44-176.9-64.9165000111.7A94 V95A94-I98 WeakPolarHBondContact O-CB 3.39Å; A94-I98 WeakPolarHBondContact O-CD1 3.2Å; A94-I98 WeakPolarHBondContact O-CG1 3.5Å; A94-I98 PolarHBondContact O-N 2.88Å; V95-I98 PolarHBondContact O-N 2.94Å
99A72Confident66.5Low35 Ų3575.1 Ų75.129%0.28940%0.4SS..  trans-142.576.8-172.800000109.9V95 D101 C102 G103V95-A99 CarbonylContact O-C 3.26Å; V95-A99 VanDerWaalsContact O-C 3.26Å; V95-A99 WeakPolarHBondContact O-CA 3.37Å; V95-A99 PolarHBondContact O-N 2.86Å; A99-D101 VanDerWaalsContact C-N 3.28Å; A99-D101 PolarHBondContact O-N 3.2Å; A99-C102 HydrophobicContact CB-CB 4.19Å; A99-C102 PolarHBondContact O-N 3.03Å; A99-G103 PolarHBondContact O-N 3.48Å
100P72.4Confident66.7Low49 Ų4974.3 Ų74.332%0.31840%0.403SS..Hα-helixtrans-60.5-35.6-172.523.4-34.2000112.7L96 R104L96-P100 WeakPolarHBondContact O-CA 3.44Å; L96-P100 WeakPolarHBondContact O-CB 3.07Å; P100-R104 VanDerWaalsContact O-CB 3.32Å; P100-R104 WeakPolarHBondContact O-CB 3.44Å; P100-R104 WeakPolarHBondContact O-CG 3.42Å; P100-R104 PolarHBondContact O-N 2.84Å; P100-R104 PolarHBondContact O-NE 3.19Å
101D74.4Confident66.8Low111 Ų11170.5 Ų70.559%0.59438%0.381SS*.Hα-helixtrans-68.1-47-179.5-62.8-39000112.4A99 G103 R104 E105A99-D101 VanDerWaalsContact C-N 3.28Å; A99-D101 PolarHBondContact O-N 3.2Å; D101-G103 PolarHBondContact O-N 2.98Å; D101-R104 PolarHBondContact O-N 3.21Å; D101-R104 IonicContact OD1-CZ 3.63Å; D101-R104 IonicContact OD1-NE 2.74Å; D101-R104 IonicContact OD1-NH2 2.71Å; D101-R104 PolarHBondContact OD1-NH2 3.42Å; D101-E105 WeakPolarHBondContact O-CB 3.23Å; D101-E105 PolarHBondContact O-N 2.96Å
102C73Confident67.2Low81 Ų8170 Ų7055%0.54738%0.381SS..Hα-helixtrans-63.3-42.2175.4-58.80000111.8A99 R104 E105 H106A99-C102 HydrophobicContact CB-CB 4.19Å; A99-C102 PolarHBondContact O-N 3.03Å; C102-R104 VanDerWaalsContact C-N 3.35Å; C102-R104 PolarHBondContact O-N 3.43Å; C102-E105 PolarHBondContact O-N 2.99Å; C102-H106 PolarHBondContact O-N 2.95Å
103G66.3Low67.4Low4 Ų475.7 Ų75.74%0.04141%0.412CS..Hα-helixtrans-60.8-43.517600000112.2A99 D101 H106 Q107A99-G103 PolarHBondContact O-N 3.48Å; D101-G103 PolarHBondContact O-N 2.98Å; G103-H106 PolarHBondContact O-N 3.43Å; G103-Q107 VanDerWaalsContact O-CG 3.26Å; G103-Q107 WeakPolarHBondContact O-CG 3.18Å; G103-Q107 PolarHBondContact O-N 2.93Å
104R67.1Low67.4Low73 Ų7371.5 Ų71.528%0.27541%0.408SS..Hα-helixtrans-65.4-41176.3-75.2-169.1-79.6-1062.7112.5L96 P100 D101 C102 Q107 R108 W124L96-R104 HydrophobicContact CD2-CG 4.15Å; P100-R104 VanDerWaalsContact O-CB 3.32Å; P100-R104 WeakPolarHBondContact O-CB 3.44Å; P100-R104 WeakPolarHBondContact O-CG 3.42Å; P100-R104 PolarHBondContact O-N 2.84Å; P100-R104 PolarHBondContact O-NE 3.19Å; D101-R104 PolarHBondContact O-N 3.21Å; D101-R104 IonicContact OD1-CZ 3.63Å; D101-R104 IonicContact OD1-NE 2.74Å; D101-R104 IonicContact OD1-NH2 2.71Å; D101-R104 PolarHBondContact OD1-NH2 3.42Å; C102-R104 VanDerWaalsContact C-N 3.35Å; C102-R104 PolarHBondContact O-N 3.43Å; R104-Q107 PolarHBondContact O-N 3.45Å; R104-R108 WeakPolarHBondContact O-CG 3.47Å; R104-R108 PolarHBondContact O-N 3.37Å; R104-W124 HydrophobicContact CB-CD2 4.36Å; R104-W124 HydrophobicContact CB-CE3 3.92Å; R104-W124 HydrophobicContact CB-CH2 4.29Å; R104-W124 HydrophobicContact CB-CZ3 3.84Å; R104-W124 VanDerWaalsContact CD-CD2 3.48Å; R104-W124 HydrophobicContact CG-CD2 3.54Å; R104-W124 HydrophobicContact CG-CE3 3.42Å; R104-W124 VanDerWaalsContact CG-CE3 3.42Å; R104-W124 HydrophobicContact CG-CG 4.03Å; R104-W124 HydrophobicContact CG-CH2 4.47Å; R104-W124 HydrophobicContact CG-CZ3 3.89Å
105E70.4Confident67.6Low139 Ų13972.7 Ų72.765%0.6542%0.424SS*.Hα-helixtrans-63.1-45.3176.8-173.1175.2-171.900111.7D101 C102 Q107 R108 A109D101-E105 WeakPolarHBondContact O-CB 3.23Å; D101-E105 PolarHBondContact O-N 2.96Å; C102-E105 PolarHBondContact O-N 2.99Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 3.06Å; E105-R108 PolarHBondContact O-N 3.4Å; E105-A109 PolarHBondContact O-N 2.85Å
106H68.4Low67.8Low96 Ų9672 Ų7244%0.44442%0.416SS..Hα-helixtrans-58.6-45.7174.9-179.471.6000111.9C102 G103 R108 A109 V110C102-H106 PolarHBondContact O-N 2.95Å; G103-H106 PolarHBondContact O-N 3.43Å; H106-R108 PolarHBondContact O-N 3.39Å; H106-A109 PolarHBondContact O-N 2.96Å; H106-V110 WeakPolarHBondContact O-CG2 3.21Å; H106-V110 PolarHBondContact O-N 3.05Å
107Q66.6Low67.8Low11 Ų1173.3 Ų73.35%0.05142%0.423CS..Hα-helixtrans-61.9-42.3178.3-74.3171.9-14.700112.2G103 R104 E105 V110 A111 I119 W124 A127G103-Q107 VanDerWaalsContact O-CG 3.26Å; G103-Q107 WeakPolarHBondContact O-CG 3.18Å; G103-Q107 PolarHBondContact O-N 2.93Å; R104-Q107 PolarHBondContact O-N 3.45Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 3.06Å; Q107-V110 PolarHBondContact O-N 3.09Å; Q107-A111 PolarHBondContact O-N 3.03Å; Q107-I119 HydrophobicContact CB-CD1 3.82Å; Q107-I119 WeakPolarHBondContact O-CD1 3.27Å; Q107-W124 HydrophobicContact CB-CZ3 4.21Å; Q107-A127 HydrophobicContact CB-CB 3.98Å; Q107-A127 HydrophobicContact CG-CB 3.75Å
108R67.3Low67.7Low143 Ų14370.8 Ų70.854%0.5440%0.402SS..Hα-helixtrans-59.5-47.2173-71.7174.1-176.3-179.70.6111.7R104 E105 H106 V110 A111 V112 W124R104-R108 WeakPolarHBondContact O-CG 3.47Å; R104-R108 PolarHBondContact O-N 3.37Å; E105-R108 PolarHBondContact O-N 3.4Å; H106-R108 PolarHBondContact O-N 3.39Å; R108-V110 VanDerWaalsContact C-N 3.33Å; R108-V110 PolarHBondContact O-N 3.38Å; R108-A111 PolarHBondContact O-N 2.97Å; R108-V112 WeakPolarHBondContact O-CG2 3.24Å; R108-V112 PolarHBondContact O-N 3.33Å; R108-W124 HydrophobicContact CG-CH2 3.6Å; R108-W124 HydrophobicContact CG-CZ3 4.13Å
109A69.1Low67.3Low45 Ų4564.8 Ų64.837%0.37237%0.372SS..Hα-helixtrans-61.2-41.7179.800000112.1E105 H106 V112 N113E105-A109 PolarHBondContact O-N 2.85Å; H106-A109 PolarHBondContact O-N 2.96Å; A109-V112 PolarHBondContact O-N 2.89Å; A109-N113 WeakPolarHBondContact O-CB 3.29Å; A109-N113 PolarHBondContact O-N 3.34Å; A109-N113 PolarHBondContact O-ND2 3Å
110V66.6Low66.6Low53 Ų5364.4 Ų64.432%0.32137%0.365SS..Hα-helixtrans-64.8-41.2176.8172.30000111.9H106 Q107 R108 S114H106-V110 WeakPolarHBondContact O-CG2 3.21Å; H106-V110 PolarHBondContact O-N 3.05Å; Q107-V110 PolarHBondContact O-N 3.09Å; R108-V110 VanDerWaalsContact C-N 3.33Å; R108-V110 PolarHBondContact O-N 3.38Å; V110-S114 WeakPolarHBondContact O-CB 3.44Å; V110-S114 PolarHBondContact O-N 3.48Å; V110-S114 VanDerWaalsContact O-N 3.09Å; V110-S114 PolarHBondContact O-OG 3.29Å
111A64.5Low65.4Low11 Ų1163.9 Ų63.99%0.09137%0.369CS..Hα-helixtrans-62.3-48.8176.800000111.7Q107 R108 N113 S114 G115 Y116 I119Q107-A111 PolarHBondContact O-N 3.03Å; R108-A111 PolarHBondContact O-N 2.97Å; A111-N113 PolarHBondContact O-N 3.36Å; A111-S114 CarbonylContact O-C 3.57Å; A111-S114 WeakPolarHBondContact O-CA 3.49Å; A111-S114 WeakPolarHBondContact O-CB 3.41Å; A111-S114 PolarHBondContact O-N 3.44Å; A111-G115 PolarHBondContact O-N 3.05Å; A111-Y116 CarbonylContact C-O 3.3Å; A111-Y116 VanDerWaalsContact C-O 3.3Å; A111-Y116 PolarHBondContact O-N 3.42Å; A111-I119 HydrophobicContact CB-CD1 4.05Å; A111-I119 HydrophobicContact CB-CG1 3.72Å
112V69Low64.1Low84 Ų8468.1 Ų68.151%0.50938%0.378SS..Hα-helixtrans-59.6-45.5177.4173.30000111.6R108 A109 S114 G115 Y116R108-V112 WeakPolarHBondContact O-CG2 3.24Å; R108-V112 PolarHBondContact O-N 3.33Å; A109-V112 PolarHBondContact O-N 2.89Å; V112-S114 PolarHBondContact O-N 3.31Å; V112-G115 PolarHBondContact O-N 2.82Å; V112-Y116 WeakPolarHBondContact CA-O 3.39Å; V112-Y116 PolarHBondContact N-O 2.8Å
113N66.2Low63Low142 Ų14265.3 Ų65.376%0.75936%0.357SS*.Hα-helixtrans-64.5-22.9177-72.2-19000113.2A109 A111 G115A109-N113 WeakPolarHBondContact O-CB 3.29Å; A109-N113 PolarHBondContact O-N 3.34Å; A109-N113 PolarHBondContact O-ND2 3Å; A111-N113 PolarHBondContact O-N 3.36Å; N113-G115 VanDerWaalsContact C-N 3.32Å
114S64Low61.9Low74 Ų7467.3 Ų67.352%0.51736%0.363SS..THydrogen-bonded Turntrans-89.23.6177.2-55.40000113V110 A111 V112V110-S114 WeakPolarHBondContact O-CB 3.44Å; V110-S114 PolarHBondContact O-N 3.48Å; V110-S114 VanDerWaalsContact O-N 3.09Å; V110-S114 PolarHBondContact O-OG 3.29Å; A111-S114 CarbonylContact O-C 3.57Å; A111-S114 WeakPolarHBondContact O-CA 3.49Å; A111-S114 WeakPolarHBondContact O-CB 3.41Å; A111-S114 PolarHBondContact O-N 3.44Å; V112-S114 PolarHBondContact O-N 3.31Å
115G65.4Low61Low66 Ų6666.4 Ų66.468%0.6838%0.377SS*.THydrogen-bonded Turntrans93.82.7179.500000115.3A111 V112 N113A111-G115 PolarHBondContact O-N 3.05Å; V112-G115 PolarHBondContact O-N 2.82Å; N113-G115 VanDerWaalsContact C-N 3.32Å
116Y65.3Low60Low37 Ų3761.3 Ų61.315%0.14535%0.353CS..  trans-101.2141.1-178.7-59.7-81.3000111.7A111 V112 K354 E356A111-Y116 CarbonylContact C-O 3.3Å; A111-Y116 VanDerWaalsContact C-O 3.3Å; A111-Y116 PolarHBondContact O-N 3.42Å; V112-Y116 WeakPolarHBondContact CA-O 3.39Å; V112-Y116 PolarHBondContact N-O 2.8Å; Y116-K354 HydrophobicContact CD1-CB 3.49Å; Y116-K354 VanDerWaalsContact CD1-CB 3.49Å; Y116-K354 HydrophobicContact CD1-CD 3.83Å; Y116-K354 HydrophobicContact CD1-CG 4.29Å; Y116-K354 HydrophobicContact CD2-CD 3.58Å; Y116-K354 HydrophobicContact CE1-CB 3.77Å; Y116-K354 HydrophobicContact CE1-CD 3.62Å; Y116-K354 HydrophobicContact CE1-CG 4.38Å; Y116-K354 HydrophobicContact CE2-CD 3.35Å; Y116-K354 HydrophobicContact CG-CB 3.9Å; Y116-K354 HydrophobicContact CG-CD 3.79Å; Y116-K354 HydrophobicContact CG-CG 4.36Å; Y116-E356 HydrophobicContact CD1-CG 4.38Å
117D62.4Low59Low55 Ų5557.9 Ų57.929%0.29434%0.341SS..SBendtrans-79.5-31.9-173.2-61.1-71.6000113.9V355 E356 K357D117-V355 PolarHBondContact N-O 2.96Å; D117-E356 WeakPolarHBondContact OD2-CA 3.48Å; D117-K357 VanDerWaalsContact CG-CG 3.43Å; D117-K357 WeakPolarHBondContact OD1-CE 3.34Å; D117-K357 WeakPolarHBondContact OD1-CG 3.43Å; D117-K357 IonicContact OD1-NZ 2.7Å; D117-K357 WeakPolarHBondContact OD2-CG 3.27Å; D117-K357 PolarHBondContact OD2-N 2.69Å
118A63.4Low58.2Low32 Ų3258.8 Ų58.826%0.26435%0.346SS..BIsolated β-bridgetrans-158.6161.9-179.700000112.4V355A118-V355 PolarHBondContact N-O 3.37Å; A118-V355 PolarHBondContact O-N 3.45Å
119I60.1Low57.7Low19 Ų1952.8 Ų52.810%0.09733%0.326CS..  trans-99.3141.4165.5-54.8179.8000107.3Q107 A111 G121 A127Q107-I119 HydrophobicContact CB-CD1 3.82Å; Q107-I119 WeakPolarHBondContact O-CD1 3.27Å; A111-I119 HydrophobicContact CB-CD1 4.05Å; A111-I119 HydrophobicContact CB-CG1 3.72Å; I119-G121 PolarHBondContact O-N 3.09Å; I119-A127 HydrophobicContact CD1-CB 3.64Å; I119-A127 HydrophobicContact CG2-CB 4.07Å
120D56Low57.1Low27 Ų2752.4 Ų52.414%0.14432%0.318CS..  trans-56.2110.5172.3176.710.9000110Y122 N123 N352D120-Y122 PolarHBondContact O-N 3.38Å; D120-Y122 VanDerWaalsContact O-N 3.09Å; D120-Y122 PolarHBondContact OD1-N 2.88Å; D120-N123 PolarHBondContact O-N 3.22Å; D120-N123 PolarHBondContact OD2-ND2 3.19Å; D120-N352 WeakPolarHBondContact CB-O 3.39Å
121G47.2Very low56.8Low39 Ų3951 Ų5140%0.40231%0.308SS..THydrogen-bonded Turntrans-66.2-9-175.900000114.1I119 N123 W124I119-G121 PolarHBondContact O-N 3.09Å; G121-N123 VanDerWaalsContact C-N 3.3Å; G121-W124 VanDerWaalsContact CA-NE1 3.35Å; G121-W124 PolarHBondContact O-NE1 2.94Å
122Y48.5Very low56.6Low200 Ų20050.6 Ų50.678%0.78430%0.304SS*.THydrogen-bonded Turntrans-80.7-9.2169.9-75.6-84.2000113.3D120D120-Y122 PolarHBondContact O-N 3.38Å; D120-Y122 VanDerWaalsContact O-N 3.09Å; D120-Y122 PolarHBondContact OD1-N 2.88Å
123N48.4Very low55.9Low22 Ų2248 Ų4812%0.11829%0.288CS..  trans-121.229.8-174.4-60.8-42.7000114.1D120 G121 G125 E126 R351D120-N123 PolarHBondContact O-N 3.22Å; D120-N123 PolarHBondContact OD2-ND2 3.19Å; G121-N123 VanDerWaalsContact C-N 3.3Å; N123-G125 PolarHBondContact O-N 3.15Å; N123-E126 PolarHBondContact O-N 3.46Å; N123-R351 WeakPolarHBondContact OD1-CD 3.15Å; N123-R351 PolarHBondContact OD1-NH1 3.48Å
124W44.7Very low55.7Low45 Ų4543.4 Ų43.417%0.1726%0.261CS..G310 helixtrans-53.3-22.2-177.6-71.4108.8000115.2L96 R104 Q107 R108 G121 E126L96-W124 WeakPolarHBondContact CD1-O 3.3Å; R104-W124 HydrophobicContact CB-CD2 4.36Å; R104-W124 HydrophobicContact CB-CE3 3.92Å; R104-W124 HydrophobicContact CB-CH2 4.29Å; R104-W124 HydrophobicContact CB-CZ3 3.84Å; R104-W124 VanDerWaalsContact CD-CD2 3.48Å; R104-W124 HydrophobicContact CG-CD2 3.54Å; R104-W124 HydrophobicContact CG-CE3 3.42Å; R104-W124 VanDerWaalsContact CG-CE3 3.42Å; R104-W124 HydrophobicContact CG-CG 4.03Å; R104-W124 HydrophobicContact CG-CH2 4.47Å; R104-W124 HydrophobicContact CG-CZ3 3.89Å; Q107-W124 HydrophobicContact CB-CZ3 4.21Å; R108-W124 HydrophobicContact CG-CH2 3.6Å; R108-W124 HydrophobicContact CG-CZ3 4.13Å; G121-W124 VanDerWaalsContact CA-NE1 3.35Å; G121-W124 PolarHBondContact O-NE1 2.94Å; W124-E126 PolarHBondContact O-N 2.7Å
125G47.8Very low55.5Low54 Ų5439.9 Ų39.956%0.55724%0.237SC*.G310 helixtrans-68.3-10.5172.700000115.5N123N123-G125 PolarHBondContact O-N 3.15Å
126E48.8Very low55.1Low33 Ų3338.9 Ų38.915%0.15421%0.213CC..G310 helixtrans-131.713.3-168.3-92.5162.9-165.100114.2N123 W124 D128 V129 R351N123-E126 PolarHBondContact O-N 3.46Å; W124-E126 PolarHBondContact O-N 2.7Å; E126-D128 PolarHBondContact O-N 3.3Å; E126-V129 HydrophobicContact CB-CG2 4.1Å; E126-V129 HydrophobicContact CG-CG2 4.37Å; E126-V129 WeakPolarHBondContact O-CG2 3.43Å; E126-V129 PolarHBondContact O-N 3.46Å; E126-R351 IonicContact OE2-CZ 3.91Å; E126-R351 IonicContact OE2-NH1 2.76Å; E126-R351 PolarHBondContact OE2-NH1 3.11Å; E126-R351 IonicContact OE2-NH2 3.55Å
127A47.3Very low55Low24 Ų2439.7 Ų39.720%0.19822%0.22CC..THydrogen-bonded Turntrans-623.9-18000000116.5Q107 I119Q107-A127 HydrophobicContact CB-CB 3.98Å; Q107-A127 HydrophobicContact CG-CB 3.75Å; I119-A127 HydrophobicContact CD1-CB 3.64Å; I119-A127 HydrophobicContact CG2-CB 4.07Å
128D50.2Low54.8Low29 Ų2941 Ų4116%0.15523%0.232CC..THydrogen-bonded Turntrans-114.826.9177.1-154.223.2000111.8K88 R89 N92 E126 D130 Q134K88-D128 IonicContact NZ-OD1 3.95Å; R89-D128 HydrophobicContact CG-CB 4.39Å; R89-D128 WeakPolarHBondContact CG-OD2 3.31Å; N92-D128 VanDerWaalsContact ND2-CG 3.27Å; N92-D128 PolarHBondContact ND2-OD2 3.31Å; E126-D128 PolarHBondContact O-N 3.3Å; D128-D130 PolarHBondContact O-N 3.17Å; D128-Q134 PolarHBondContact O-OE1 3.43Å
129V57.2Low54.8Low17 Ų1748.8 Ų48.810%0.10325%0.254CS..  trans-75.3100.7177.3166.90000109.6E126 N131 Q134 L353E126-V129 HydrophobicContact CB-CG2 4.1Å; E126-V129 HydrophobicContact CG-CG2 4.37Å; E126-V129 WeakPolarHBondContact O-CG2 3.43Å; E126-V129 PolarHBondContact O-N 3.46Å; V129-N131 WeakPolarHBondContact CG1-O 3.28Å; V129-Q134 HydrophobicContact CB-CB 4.22Å; V129-Q134 HydrophobicContact CG1-CB 3.94Å; V129-Q134 HydrophobicContact CG2-CB 3.82Å; V129-L353 HydrophobicContact CG1-CD1 4Å
130D57.3Low55.3Low38 Ų3850.5 Ų50.520%0.20327%0.267CS..SBendtrans-73.7-31.2175.4-57.6-54.7000111.9R85 R89 D128R85-D130 IonicContact NH1-OD2 2.87Å; R89-D130 IonicContact NH2-OD2 3.59Å; R89-D130 PolarHBondContact NH2-OD2 2.93Å; D128-D130 PolarHBondContact O-N 3.17Å
131N59.8Low56.5Low24 Ų2452.8 Ų52.813%0.12828%0.283CS..SBendtrans-141157.5-178.471.6-11.5000111.3V129 I133 Q134 N293V129-N131 WeakPolarHBondContact CG1-O 3.28Å; N131-I133 PolarHBondContact O-N 2.76Å; N131-I133 VanDerWaalsContact O-N 3.09Å; N131-Q134 PolarHBondContact O-N 3.48Å; N131-Q134 WeakPolarHBondContact OD1-CG 3.39Å; N131-Q134 PolarHBondContact OD1-N 3.03Å; N131-Q134 PolarHBondContact OD1-NE2 2.69Å; N131-N293 PolarHBondContact ND2-ND2 3.49Å; N131-N293 PolarHBondContact ND2-OD1 3.12Å
132Y59.2Low58.5Low2 Ų252.9 Ų52.91%0.00828%0.276CS..G310 helixtrans-59.5-30.5-170.9-167.2-98.6000114Q134 A135 Y136 V228 H229 T275 N279 I282 M283 L353Y132-Q134 PolarHBondContact O-N 3.16Å; Y132-A135 WeakPolarHBondContact O-CB 3.4Å; Y132-A135 PolarHBondContact O-N 3.28Å; Y132-A135 VanDerWaalsContact O-N 3.16Å; Y132-Y136 AromaticContact CD1-CE2 3.83Å; Y132-Y136 HydrophobicContact CD1-CE2 3.83Å; Y132-Y136 AromaticContact CE1-CE2 3.89Å; Y132-Y136 HydrophobicContact CE1-CE2 3.89Å; Y132-V228 HydrophobicContact CE1-CB 4.39Å; Y132-V228 HydrophobicContact CE1-CG1 4Å; Y132-V228 HydrophobicContact CE1-CG2 3.8Å; Y132-V228 HydrophobicContact CE2-CG1 4.3Å; Y132-V228 WeakPolarHBondContact OH-CG1 3.2Å; Y132-H229 PolarHBondContact OH-CE1 3.35Å; Y132-H229 VanDerWaalsContact OH-CE1 3.23Å; Y132-H229 PolarHBondContact OH-NE2 3.43Å; Y132-T275 HydrophobicContact CE2-CG2 4.07Å; Y132-T275 WeakPolarHBondContact OH-CG2 3.24Å; Y132-N279 HydrophobicContact CD2-CB 4.05Å; Y132-N279 HydrophobicContact CE2-CB 3.98Å; Y132-I282 PolarHBondContact N-O 2.69Å; Y132-M283 HydrophobicContact CD1-CG 4.02Å; Y132-M283 HydrophobicContact CD2-CG 3.56Å; Y132-M283 HydrophobicContact CD2-SD 4.33Å; Y132-M283 HydrophobicContact CE2-CG 4.16Å; Y132-M283 HydrophobicContact CE2-SD 4.35Å; Y132-M283 HydrophobicContact CG-CG 3.5Å; Y132-M283 VanDerWaalsContact CG-CG 3.5Å; Y132-L353 HydrophobicContact CD2-CD1 3.7Å; Y132-L353 HydrophobicContact CE2-CD1 4.12Å
133I54.6Low60.6Low30 Ų3046.4 Ų46.415%0.15426%0.255CS..G310 helixtrans-57.8-35.6173.9-60.7174.8000112N131 A135 Y136 D290 L292 N293N131-I133 PolarHBondContact O-N 2.76Å; N131-I133 VanDerWaalsContact O-N 3.09Å; I133-A135 PolarHBondContact O-N 2.93Å; I133-Y136 WeakPolarHBondContact O-CA 3.09Å; I133-Y136 WeakPolarHBondContact O-CB 3.37Å; I133-Y136 PolarHBondContact O-N 2.73Å; I133-D290 WeakPolarHBondContact CD1-OD1 3.33Å; I133-L292 HydrophobicContact CD1-CB 3.62Å; I133-L292 HydrophobicContact CG1-CB 4.25Å; I133-N293 VanDerWaalsContact CD1-CA 3.49Å; I133-N293 HydrophobicContact CD1-CB 3.71Å; I133-N293 WeakPolarHBondContact CD1-OD1 3.42Å; I133-N293 HydrophobicContact CG1-CB 4.4Å; I133-N293 WeakPolarHBondContact CG1-OD1 3.4Å
134Q61.4Low63Low45 Ų4547 Ų4721%0.2126%0.256CS..G310 helixtrans-65.9-13.9-176-72160.746.700112.8R89 D128 V129 N131 Y132R89-Q134 VanDerWaalsContact CZ-CD 3.42Å; D128-Q134 PolarHBondContact O-OE1 3.43Å; V129-Q134 HydrophobicContact CB-CB 4.22Å; V129-Q134 HydrophobicContact CG1-CB 3.94Å; V129-Q134 HydrophobicContact CG2-CB 3.82Å; N131-Q134 PolarHBondContact O-N 3.48Å; N131-Q134 WeakPolarHBondContact OD1-CG 3.39Å; N131-Q134 PolarHBondContact OD1-N 3.03Å; N131-Q134 PolarHBondContact OD1-NE2 2.69Å; Y132-Q134 PolarHBondContact O-N 3.16Å
135A60Low65.5Low0 Ų044.8 Ų44.80%025%0.248CC..G310 helixtrans-83-12.8168.200000113.2Y132 I133 D137 V228 R351 L353Y132-A135 WeakPolarHBondContact O-CB 3.4Å; Y132-A135 PolarHBondContact O-N 3.28Å; Y132-A135 VanDerWaalsContact O-N 3.16Å; I133-A135 PolarHBondContact O-N 2.93Å; A135-D137 PolarHBondContact O-N 2.91Å; A135-D137 VanDerWaalsContact O-N 3.15Å; A135-V228 HydrophobicContact CB-CG1 3.94Å; A135-R351 PolarHBondContact O-NH2 3.06Å; A135-L353 HydrophobicContact CB-CD1 4.01Å; A135-L353 HydrophobicContact CB-CD2 3.87Å
136Y58.7Low67.9Low45 Ų4544.4 Ų44.418%0.17624%0.236CC..  trans-69.2107.6168.2-75.4-120.9000108Y132 I133 I227 V228 S296 R301Y132-Y136 AromaticContact CD1-CE2 3.83Å; Y132-Y136 HydrophobicContact CD1-CE2 3.83Å; Y132-Y136 AromaticContact CE1-CE2 3.89Å; Y132-Y136 HydrophobicContact CE1-CE2 3.89Å; I133-Y136 WeakPolarHBondContact O-CA 3.09Å; I133-Y136 WeakPolarHBondContact O-CB 3.37Å; I133-Y136 PolarHBondContact O-N 2.73Å; Y136-I227 HydrophobicContact CD1-CB 3.94Å; Y136-I227 HydrophobicContact CD1-CG2 3.28Å; Y136-I227 HydrophobicContact CE1-CB 4.24Å; Y136-I227 HydrophobicContact CE1-CG2 4.07Å; Y136-I227 HydrophobicContact CG-CG2 3.86Å; Y136-V228 HydrophobicContact CD1-CG2 4.17Å; Y136-V228 HydrophobicContact CD2-CG2 3.32Å; Y136-V228 HydrophobicContact CE1-CG2 3.93Å; Y136-V228 HydrophobicContact CE2-CG2 3.08Å; Y136-V228 HydrophobicContact CG-CG2 3.87Å; Y136-S296 VanDerWaalsContact CE2-OG 3.26Å; Y136-S296 WeakPolarHBondContact CE2-OG 3.22Å; Y136-S296 WeakPolarHBondContact OH-CB 3.32Å; Y136-S296 PolarHBondContact OH-OG 2.94Å; Y136-R301 PolarHBondContact OH-NH2 3.27Å
137D61.4Low70.2Confident54 Ų5448 Ų4829%0.28926%0.255SS..  trans-134.4113.5171.6173.722.7000107.4A135 R139 I227 K230A135-D137 PolarHBondContact O-N 2.91Å; A135-D137 VanDerWaalsContact O-N 3.15Å; D137-R139 PolarHBondContact O-N 3.27Å; D137-R139 VanDerWaalsContact OD1-CB 3.3Å; D137-R139 WeakPolarHBondContact OD1-CB 3.45Å; D137-R139 WeakPolarHBondContact OD1-CG 3.39Å; D137-R139 PolarHBondContact OD1-N 2.86Å; D137-R139 VanDerWaalsContact OD1-N 3.08Å; D137-I227 PolarHBondContact N-O 2.87Å; D137-K230 PolarHBondContact O-NZ 3.35Å; D137-K230 VanDerWaalsContact O-NZ 3.15Å; D137-K230 IonicContact OD2-NZ 2.7Å; D137-K230 PolarHBondContact OD2-NZ 3.5Å
138C58.7Low72.7Confident81 Ų8147.6 Ų47.655%0.54725%0.25SC..  trans-67.419.3174.4-60.20000112.7P140 P141C138-P140 CarbonylContact C-O 3.56Å; C138-P140 VanDerWaalsContact C-O 3.27Å; C138-P140 CarbonylContact O-C 3.18Å; C138-P141 VanDerWaalsContact O-CA 3.24Å; C138-P141 WeakPolarHBondContact O-CA 3.18Å
139R63.7Low75Confident197 Ų19746.7 Ų46.774%0.74325%0.245SC*.SBendtrans-122.2111.7173.8-58.6-179.5178.1-174.2-0.5109.4D137 K230D137-R139 PolarHBondContact O-N 3.27Å; D137-R139 VanDerWaalsContact OD1-CB 3.3Å; D137-R139 WeakPolarHBondContact OD1-CB 3.45Å; D137-R139 WeakPolarHBondContact OD1-CG 3.39Å; D137-R139 PolarHBondContact OD1-N 2.86Å; D137-R139 VanDerWaalsContact OD1-N 3.08Å; R139-K230 PolarHBondContact O-NZ 3.35Å
140P69.7Low76.9Confident55 Ų5551.1 Ų51.136%0.35727%0.267SS..SBendcis-62.4155.5-13.228.6-36.7000112.3C138 I143 F231C138-P140 CarbonylContact C-O 3.56Å; C138-P140 VanDerWaalsContact C-O 3.27Å; C138-P140 CarbonylContact O-C 3.18Å; P140-I143 HydrophobicContact CB-CD1 4.28Å; P140-F231 HydrophobicContact CB-CD1 4.33Å; P140-F231 HydrophobicContact CB-CE1 4.39Å; P140-F231 HydrophobicContact CG-CD1 3.71Å; P140-F231 HydrophobicContact CG-CE1 3.84Å
141P82.3Confident78.9Confident74 Ų7451 Ų5148%0.48127%0.271SS..PPolyproline II helixtrans-61.7162.3172.927.6-35.3000110.3C138 I143C138-P141 VanDerWaalsContact O-CA 3.24Å; C138-P141 WeakPolarHBondContact O-CA 3.18Å; P141-I143 HydrophobicContact CG-CG1 4.47Å; P141-I143 WeakPolarHBondContact O-CG1 3.39Å; P141-I143 PolarHBondContact O-N 3.12Å
142P88.4Confident80.7Confident41 Ų4149.8 Ų49.827%0.26627%0.265SS..PPolyproline II helixtrans-60.2123.8169.926.4-33.2000109.7P146 L223 E226 I227P142-P146 HydrophobicContact CB-CG 4.49Å; P142-L223 HydrophobicContact CB-CD2 3.69Å; P142-L223 HydrophobicContact CG-CD2 4.1Å; P142-E226 VanDerWaalsContact CA-CD 3.42Å; P142-E226 VanDerWaalsContact CA-OE1 3.31Å; P142-E226 WeakPolarHBondContact CA-OE1 3.4Å; P142-E226 HydrophobicContact CB-CB 4.31Å; P142-E226 HydrophobicContact CB-CG 3.77Å; P142-I227 HydrophobicContact CG-CG1 4.44Å
143I94Very high82.6Confident65 Ų6552.9 Ų52.933%0.33328%0.281SS..  trans-120.4-48.1-176.4-70.9157000109.9P140 P141 L147 E226 F231P140-I143 HydrophobicContact CB-CD1 4.28Å; P141-I143 HydrophobicContact CG-CG1 4.47Å; P141-I143 WeakPolarHBondContact O-CG1 3.39Å; P141-I143 PolarHBondContact O-N 3.12Å; I143-L147 HydrophobicContact CG2-CD1 3.51Å; I143-L147 HydrophobicContact CG2-CG 4.31Å; I143-L147 VanDerWaalsContact O-CB 3.27Å; I143-L147 WeakPolarHBondContact O-CB 3.4Å; I143-L147 WeakPolarHBondContact O-CG 3.47Å; I143-L147 PolarHBondContact O-N 2.83Å; I143-L147 VanDerWaalsContact O-N 3.12Å; I143-E226 PolarHBondContact N-OE1 2.74Å; I143-F231 HydrophobicContact CB-CB 4.18Å; I143-F231 HydrophobicContact CB-CG 4.3Å; I143-F231 HydrophobicContact CD1-CD1 4.11Å; I143-F231 HydrophobicContact CD1-CE1 4.32Å; I143-F231 HydrophobicContact CD1-CG 4.49Å
144F97.5Very high84.6Confident33 Ų3354 Ų5415%0.14530%0.295CS..Hα-helixtrans-66.8-52.2-170.1177.4-93.8000112L147 I148 E226 F231 Y238 L239F144-L147 PolarHBondContact O-N 2.86Å; F144-I148 HydrophobicContact CD1-CG2 4.38Å; F144-I148 HydrophobicContact CE1-CB 4.4Å; F144-I148 HydrophobicContact CE1-CG2 3.98Å; F144-I148 HydrophobicContact CZ-CB 4.32Å; F144-I148 HydrophobicContact CZ-CG2 4.38Å; F144-I148 WeakPolarHBondContact O-CG2 3.25Å; F144-I148 PolarHBondContact O-N 2.85Å; F144-E226 PolarHBondContact N-OE1 3.06Å; F144-F231 HydrophobicContact CB-CB 4.01Å; F144-Y238 AromaticContact CE1-CD1 3.76Å; F144-Y238 HydrophobicContact CE1-CD1 3.76Å; F144-Y238 AromaticContact CE1-CG 3.74Å; F144-Y238 HydrophobicContact CE1-CG 3.74Å; F144-Y238 AromaticContact CZ-CD1 3.64Å; F144-Y238 HydrophobicContact CZ-CD1 3.64Å; F144-Y238 HydrophobicContact CZ-CE1 4.39Å; F144-Y238 HydrophobicContact CZ-CG 4.06Å; F144-L239 HydrophobicContact CE2-CD1 4.16Å; F144-L239 HydrophobicContact CE2-CD2 4.49Å; F144-L239 HydrophobicContact CE2-CG 4.23Å; F144-L239 HydrophobicContact CZ-CD1 4.45Å; F144-L239 HydrophobicContact CZ-CD2 4.22Å; F144-L239 HydrophobicContact CZ-CG 4.03Å
145I97.8Very high86.3Confident0 Ų053.5 Ų53.50%030%0.295CS..Hα-helixtrans-63.8-48.4-176.5-64.5-68000111.6L147 I148 T149 Q218 L223 E226 V234 L268I145-L147 VanDerWaalsContact C-N 3.31Å; I145-L147 PolarHBondContact O-N 3.25Å; I145-I148 WeakPolarHBondContact O-CG2 3.44Å; I145-I148 PolarHBondContact O-N 2.92Å; I145-T149 WeakPolarHBondContact O-CB 3.49Å; I145-T149 PolarHBondContact O-N 3.22Å; I145-T149 PolarHBondContact O-OG1 3.3Å; I145-Q218 HydrophobicContact CG2-CB 4.36Å; I145-Q218 VanDerWaalsContact CG2-O 3.28Å; I145-Q218 WeakPolarHBondContact CG2-O 3.3Å; I145-L223 HydrophobicContact CB-CD2 4.05Å; I145-L223 HydrophobicContact CG2-CD2 3.99Å; I145-L223 HydrophobicContact CG2-CG 4.07Å; I145-E226 WeakPolarHBondContact CB-OE2 3.14Å; I145-E226 WeakPolarHBondContact CG1-OE2 3.27Å; I145-E226 PolarHBondContact N-OE2 3.28Å; I145-V234 HydrophobicContact CD1-CG1 4.12Å; I145-V234 HydrophobicContact CG1-CG1 4.21Å; I145-L268 HydrophobicContact CD1-CD1 4.08Å
146P97.4Very high88Confident46 Ų4654.7 Ų54.730%0.29930%0.3SS..Hα-helixtrans-56.7-43.3173.9-26.535.7000113.2P142 I150 L223P142-P146 HydrophobicContact CB-CG 4.49Å; P146-I150 WeakPolarHBondContact O-CB 3.19Å; P146-I150 WeakPolarHBondContact O-CD1 3.37Å; P146-I150 WeakPolarHBondContact O-CG1 3.16Å; P146-I150 PolarHBondContact O-N 2.73Å; P146-L223 HydrophobicContact CG-CD2 3.98Å
147L98.1Very high89.7Confident107 Ų10757 Ų5756%0.5631%0.314SS*.Hα-helixtrans-66.7-45-178.9-74.5178.5000112.7I143 F144 I145 I150 A151I143-L147 HydrophobicContact CG2-CD1 3.51Å; I143-L147 HydrophobicContact CG2-CG 4.31Å; I143-L147 VanDerWaalsContact O-CB 3.27Å; I143-L147 WeakPolarHBondContact O-CB 3.4Å; I143-L147 WeakPolarHBondContact O-CG 3.47Å; I143-L147 PolarHBondContact O-N 2.83Å; I143-L147 VanDerWaalsContact O-N 3.12Å; F144-L147 PolarHBondContact O-N 2.86Å; I145-L147 VanDerWaalsContact C-N 3.31Å; I145-L147 PolarHBondContact O-N 3.25Å; L147-I150 PolarHBondContact O-N 3.09Å; L147-A151 WeakPolarHBondContact O-CB 3.23Å; L147-A151 PolarHBondContact O-N 3.41Å
148I98.4Very high91.3Very high16 Ų1661 Ų618%0.08233%0.326CS..Hα-helixtrans-67.8-41-179.1-16664000111.1F144 I145 I150 A151 E152 M202 F203 Y238F144-I148 HydrophobicContact CD1-CG2 4.38Å; F144-I148 HydrophobicContact CE1-CB 4.4Å; F144-I148 HydrophobicContact CE1-CG2 3.98Å; F144-I148 HydrophobicContact CZ-CB 4.32Å; F144-I148 HydrophobicContact CZ-CG2 4.38Å; F144-I148 WeakPolarHBondContact O-CG2 3.25Å; F144-I148 PolarHBondContact O-N 2.85Å; I145-I148 WeakPolarHBondContact O-CG2 3.44Å; I145-I148 PolarHBondContact O-N 2.92Å; I148-I150 PolarHBondContact O-N 3.43Å; I148-A151 PolarHBondContact O-N 3.1Å; I148-E152 WeakPolarHBondContact O-CG 3.33Å; I148-E152 PolarHBondContact O-N 3.12Å; I148-M202 HydrophobicContact CD1-CE 3.9Å; I148-M202 HydrophobicContact CD1-SD 4.35Å; I148-F203 HydrophobicContact CD1-CE1 3.78Å; I148-F203 HydrophobicContact CD1-CZ 3.89Å; I148-Y238 HydrophobicContact CG1-CE1 3.87Å
149T98.5Very high92.8Very high11 Ų1158.2 Ų58.27%0.06731%0.305CS..Hα-helixtrans-62.5-43.4175.5-570000111.5I145 A151 E152 I153 C215 Q218 V219I145-T149 WeakPolarHBondContact O-CB 3.49Å; I145-T149 PolarHBondContact O-N 3.22Å; I145-T149 PolarHBondContact O-OG1 3.3Å; T149-A151 VanDerWaalsContact C-N 3.35Å; T149-A151 PolarHBondContact O-N 3.27Å; T149-E152 PolarHBondContact O-N 3.32Å; T149-I153 HydrophobicContact CG2-CD1 4.09Å; T149-I153 WeakPolarHBondContact O-CG1 3.33Å; T149-I153 PolarHBondContact O-N 3.48Å; T149-C215 HydrophobicContact CG2-CB 3.98Å; T149-Q218 PolarHBondContact OG1-OE1 3.06Å; T149-V219 HydrophobicContact CG2-CG2 4.22Å
150I98.5Very high94Very high110 Ų11050.9 Ų50.956%0.56428%0.282SS*.Hα-helixtrans-62.4-42.8175.3-71.4165.8000110.9P146 L147 I148 E152 I153 A154P146-I150 WeakPolarHBondContact O-CB 3.19Å; P146-I150 WeakPolarHBondContact O-CD1 3.37Å; P146-I150 WeakPolarHBondContact O-CG1 3.16Å; P146-I150 PolarHBondContact O-N 2.73Å; L147-I150 PolarHBondContact O-N 3.09Å; I148-I150 PolarHBondContact O-N 3.43Å; I150-E152 PolarHBondContact O-N 2.89Å; I150-I153 PolarHBondContact O-N 3.48Å; I150-A154 WeakPolarHBondContact O-CB 3.38Å; I150-A154 PolarHBondContact O-N 2.98Å
151A98.5Very high95Very high34 Ų3452.2 Ų52.228%0.28129%0.289SS..Hα-helixtrans-62.7-41.7178.700000111.9L147 I148 T149 A154 V155 F203L147-A151 WeakPolarHBondContact O-CB 3.23Å; L147-A151 PolarHBondContact O-N 3.41Å; I148-A151 PolarHBondContact O-N 3.1Å; T149-A151 VanDerWaalsContact C-N 3.35Å; T149-A151 PolarHBondContact O-N 3.27Å; A151-A154 PolarHBondContact O-N 3.32Å; A151-V155 WeakPolarHBondContact O-CB 3.41Å; A151-V155 VanDerWaalsContact O-CG2 3.28Å; A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 3.33Å; A151-F203 HydrophobicContact CB-CE1 3.78Å
152E98.4Very high95.1Very high0 Ų051 Ų510%028%0.279CS..Hα-helixtrans-62.7-44.2175.3-71.8174.3-164.300112.4I148 T149 I150 V155 F156 F203 H205 L211 Q218 Y238 A261I148-E152 WeakPolarHBondContact O-CG 3.33Å; I148-E152 PolarHBondContact O-N 3.12Å; T149-E152 PolarHBondContact O-N 3.32Å; I150-E152 PolarHBondContact O-N 2.89Å; E152-V155 PolarHBondContact O-N 2.95Å; E152-F156 WeakPolarHBondContact O-CB 2.93Å; E152-F156 PolarHBondContact O-N 3.48Å; E152-F203 HydrophobicContact CG-CD1 3.75Å; E152-F203 HydrophobicContact CG-CE1 4.17Å; E152-H205 IonicContact OE2-CE1 3.12Å; E152-L211 HydrophobicContact CB-CD1 4.28Å; E152-Q218 PolarHBondContact OE1-NE2 3.33Å; E152-Q218 PolarHBondContact OE2-NE2 3.11Å; E152-Q218 PolarHBondContact OE2-OE1 2.72Å; E152-Y238 PolarHBondContact OE1-OH 3.36Å; E152-A261 VanDerWaalsContact OE1-CB 3.3Å; E152-A261 WeakPolarHBondContact OE1-CB 3.2Å; E152-A261 WeakPolarHBondContact OE2-CB 3.2Å
153I98.2Very high94.7Very high66 Ų6649.8 Ų49.834%0.33827%0.27SS..Hα-helixtrans-62.9-45.1175.5-66.8166.6000110.8T149 I150 F156 I157 L211T149-I153 HydrophobicContact CG2-CD1 4.09Å; T149-I153 WeakPolarHBondContact O-CG1 3.33Å; T149-I153 PolarHBondContact O-N 3.48Å; I150-I153 PolarHBondContact O-N 3.48Å; I153-F156 PolarHBondContact O-N 3.4Å; I153-I157 HydrophobicContact CG2-CD1 3.82Å; I153-I157 HydrophobicContact CG2-CG1 4.45Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.16Å; I153-L211 HydrophobicContact CG1-CD2 4.33Å
154A98Very high93.6Very high54 Ų5450 Ų5045%0.44628%0.277SS..Hα-helixtrans-63.2-44.1-179.700000112I150 A151 I157 Y158I150-A154 WeakPolarHBondContact O-CB 3.38Å; I150-A154 PolarHBondContact O-N 2.98Å; A151-A154 PolarHBondContact O-N 3.32Å; A154-I157 PolarHBondContact O-N 2.96Å; A154-Y158 WeakPolarHBondContact O-CB 3.33Å; A154-Y158 PolarHBondContact O-N 3.47Å
155V96.7Very high92.3Very high35 Ų3554.4 Ų54.421%0.21230%0.302CS..Hα-helixtrans-65.3-40.4176.3174.20000110.8A151 E152 Y158 Y159 L185 F203A151-V155 WeakPolarHBondContact O-CB 3.41Å; A151-V155 VanDerWaalsContact O-CG2 3.28Å; A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 3.33Å; E152-V155 PolarHBondContact O-N 2.95Å; V155-Y158 WeakPolarHBondContact O-CB 3.26Å; V155-Y158 PolarHBondContact O-N 3.27Å; V155-Y159 HydrophobicContact CG1-CD2 3.6Å; V155-Y159 HydrophobicContact CG1-CE2 3.46Å; V155-Y159 VanDerWaalsContact CG1-CE2 3.46Å; V155-Y159 WeakPolarHBondContact O-CD2 3.04Å; V155-Y159 PolarHBondContact O-N 2.99Å; V155-L185 HydrophobicContact CG1-CD1 4Å; V155-F203 HydrophobicContact CB-CB 4.18Å; V155-F203 HydrophobicContact CG1-CB 3.85Å; V155-F203 HydrophobicContact CG2-CB 4.33Å; V155-F203 HydrophobicContact CG2-CD1 4.25Å; V155-F203 HydrophobicContact CG2-CG 4.4Å
156F95.5Very high90.9Very high24 Ų2458.7 Ų58.711%0.10532%0.321CS..Hα-helixtrans-60.5-48175.1-176.1-96.8000112.1E152 I153 Y158 Y159 V160 V173 H205 L211E152-F156 WeakPolarHBondContact O-CB 2.93Å; E152-F156 PolarHBondContact O-N 3.48Å; I153-F156 PolarHBondContact O-N 3.4Å; F156-Y158 VanDerWaalsContact C-N 3.32Å; F156-Y158 PolarHBondContact O-N 3.31Å; F156-Y159 PolarHBondContact O-N 3.38Å; F156-V160 HydrophobicContact CD1-CG2 3.88Å; F156-V160 HydrophobicContact CE1-CG2 3.62Å; F156-V160 HydrophobicContact CZ-CG2 4.06Å; F156-V160 VanDerWaalsContact O-CG2 3.31Å; F156-V160 WeakPolarHBondContact O-CG2 3.17Å; F156-V160 PolarHBondContact O-N 3.05Å; F156-V173 HydrophobicContact CE1-CG1 4.36Å; F156-V173 HydrophobicContact CE2-CG1 4.18Å; F156-V173 HydrophobicContact CZ-CG1 3.58Å; F156-H205 HydrophobicContact CD2-CB 3.92Å; F156-H205 HydrophobicContact CE2-CB 4.09Å; F156-L211 HydrophobicContact CB-CD2 3.77Å; F156-L211 HydrophobicContact CD1-CD2 3.6Å; F156-L211 HydrophobicContact CD2-CB 4.49Å; F156-L211 HydrophobicContact CD2-CD2 4.12Å; F156-L211 HydrophobicContact CE1-CD2 4.16Å; F156-L211 HydrophobicContact CG-CD2 3.57Å
157I94.6Very high89.1Confident95 Ų9563 Ų6349%0.48735%0.348SS..Hα-helixtrans-59.3-44.5176.4-68.6168.2000110.7I153 A154 Y159 V160 V161I153-I157 HydrophobicContact CG2-CD1 3.82Å; I153-I157 HydrophobicContact CG2-CG1 4.45Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.16Å; A154-I157 PolarHBondContact O-N 2.96Å; I157-Y159 VanDerWaalsContact C-N 3.3Å; I157-Y159 PolarHBondContact O-N 3.32Å; I157-V160 PolarHBondContact O-N 3.08Å; I157-V161 HydrophobicContact CG2-CG2 4.35Å; I157-V161 WeakPolarHBondContact O-CG2 3.3Å; I157-V161 PolarHBondContact O-N 3.1Å
158Y93.6Very high87.3Confident136 Ų13661.9 Ų61.953%0.53336%0.363SS..Hα-helixtrans-56.1-44.9176169-97.5000112.1A154 V155 F156 V161 T162A154-Y158 WeakPolarHBondContact O-CB 3.33Å; A154-Y158 PolarHBondContact O-N 3.47Å; V155-Y158 WeakPolarHBondContact O-CB 3.26Å; V155-Y158 PolarHBondContact O-N 3.27Å; F156-Y158 VanDerWaalsContact C-N 3.32Å; F156-Y158 PolarHBondContact O-N 3.31Å; Y158-V161 PolarHBondContact O-N 2.86Å; Y158-T162 WeakPolarHBondContact CE2-OG1 3.5Å; Y158-T162 VanDerWaalsContact O-CB 3.27Å; Y158-T162 WeakPolarHBondContact O-CB 3.46Å; Y158-T162 PolarHBondContact O-N 3.02Å; Y158-T162 PolarHBondContact O-OG1 3.17Å
159Y90.7Very high85.5Confident24 Ų2462.9 Ų62.99%0.09437%0.371CS..Hα-helixtrans-68.6-40.7177.5-81.6-65.7000112.7V155 F156 I157 V161 T162 Y163 P180 S183 L185 I204V155-Y159 HydrophobicContact CG1-CD2 3.6Å; V155-Y159 HydrophobicContact CG1-CE2 3.46Å; V155-Y159 VanDerWaalsContact CG1-CE2 3.46Å; V155-Y159 WeakPolarHBondContact O-CD2 3.04Å; V155-Y159 PolarHBondContact O-N 2.99Å; F156-Y159 PolarHBondContact O-N 3.38Å; I157-Y159 VanDerWaalsContact C-N 3.3Å; I157-Y159 PolarHBondContact O-N 3.32Å; Y159-V161 VanDerWaalsContact C-N 3.34Å; Y159-V161 PolarHBondContact O-N 3.5Å; Y159-T162 PolarHBondContact O-N 3.15Å; Y159-Y163 AromaticContact CD1-CD2 3.59Å; Y159-Y163 HydrophobicContact CD1-CD2 3.59Å; Y159-Y163 AromaticContact CD1-CE2 3.35Å; Y159-Y163 HydrophobicContact CD1-CE2 3.35Å; Y159-Y163 HydrophobicContact CE1-CD2 4.28Å; Y159-Y163 AromaticContact CE1-CE2 3.58Å; Y159-Y163 HydrophobicContact CE1-CE2 3.58Å; Y159-Y163 VanDerWaalsContact O-CB 3.31Å; Y159-Y163 WeakPolarHBondContact O-CB 3.18Å; Y159-Y163 PolarHBondContact O-N 2.87Å; Y159-P180 HydrophobicContact CD1-CB 3.62Å; Y159-P180 HydrophobicContact CD1-CG 3.81Å; Y159-P180 HydrophobicContact CD2-CG 4.23Å; Y159-P180 HydrophobicContact CE1-CB 4.05Å; Y159-P180 HydrophobicContact CE1-CG 4.27Å; Y159-P180 HydrophobicContact CG-CB 4.12Å; Y159-P180 HydrophobicContact CG-CG 3.83Å; Y159-S183 PolarHBondContact OH-OG 2.99Å; Y159-L185 HydrophobicContact CE2-CD1 4.2Å; Y159-I204 HydrophobicContact CD2-CD1 3.79Å; Y159-I204 HydrophobicContact CE2-CD1 3.29Å
160V90.1Very high83.4Confident43 Ų4367.9 Ų67.926%0.26141%0.407SS..Hα-helixtrans-56.3-50.1174.3170.90000110.2F156 I157 S164 V173F156-V160 HydrophobicContact CD1-CG2 3.88Å; F156-V160 HydrophobicContact CE1-CG2 3.62Å; F156-V160 HydrophobicContact CZ-CG2 4.06Å; F156-V160 VanDerWaalsContact O-CG2 3.31Å; F156-V160 WeakPolarHBondContact O-CG2 3.17Å; F156-V160 PolarHBondContact O-N 3.05Å; I157-V160 PolarHBondContact O-N 3.08Å; V160-S164 WeakPolarHBondContact O-CB 3.36Å; V160-S164 PolarHBondContact O-N 3.02Å; V160-S164 PolarHBondContact O-OG 2.79Å; V160-V173 HydrophobicContact CG2-CB 4.01Å; V160-V173 HydrophobicContact CG2-CG1 3.95Å; V160-V173 HydrophobicContact CG2-CG2 3.86Å
161V89.5Confident81.7Confident83 Ų8364.6 Ų64.650%0.50339%0.394SS..Hα-helixtrans-67.9-42.3-178.7175.20000111.9I157 Y158 Y159 N165I157-V161 HydrophobicContact CG2-CG2 4.35Å; I157-V161 WeakPolarHBondContact O-CG2 3.3Å; I157-V161 PolarHBondContact O-N 3.1Å; Y158-V161 PolarHBondContact O-N 2.86Å; Y159-V161 VanDerWaalsContact C-N 3.34Å; Y159-V161 PolarHBondContact O-N 3.5Å; V161-N165 PolarHBondContact O-ND2 2.74Å
162T85.6Confident80.7Confident47 Ų4768.8 Ų68.829%0.28841%0.41SS..Hα-helixtrans-77.7-40.1-173.8-53.30000112.6Y158 Y159Y158-T162 WeakPolarHBondContact CE2-OG1 3.5Å; Y158-T162 VanDerWaalsContact O-CB 3.27Å; Y158-T162 WeakPolarHBondContact O-CB 3.46Å; Y158-T162 PolarHBondContact O-N 3.02Å; Y158-T162 PolarHBondContact O-OG1 3.17Å; Y159-T162 PolarHBondContact O-N 3.15Å
163Y78.8Confident80.1Confident17 Ų1770.3 Ų70.37%0.06742%0.419CS..Hα-helixtrans-80.6-32.1-177.4-85.1-113.2000112.8Y159 N165 K166 P180Y159-Y163 AromaticContact CD1-CD2 3.59Å; Y159-Y163 HydrophobicContact CD1-CD2 3.59Å; Y159-Y163 AromaticContact CD1-CE2 3.35Å; Y159-Y163 HydrophobicContact CD1-CE2 3.35Å; Y159-Y163 HydrophobicContact CE1-CD2 4.28Å; Y159-Y163 AromaticContact CE1-CE2 3.58Å; Y159-Y163 HydrophobicContact CE1-CE2 3.58Å; Y159-Y163 VanDerWaalsContact O-CB 3.31Å; Y159-Y163 WeakPolarHBondContact O-CB 3.18Å; Y159-Y163 PolarHBondContact O-N 2.87Å; Y163-N165 PolarHBondContact O-N 3.08Å; Y163-N165 VanDerWaalsContact O-N 3.11Å; Y163-K166 HydrophobicContact CD1-CD 4.41Å; Y163-K166 PolarHBondContact O-N 2.72Å; Y163-K166 VanDerWaalsContact O-N 3.07Å; Y163-P180 HydrophobicContact CD1-CB 4.17Å; Y163-P180 HydrophobicContact CD2-CB 4.23Å; Y163-P180 HydrophobicContact CE1-CB 3.84Å; Y163-P180 HydrophobicContact CE2-CB 3.92Å; Y163-P180 HydrophobicContact CG-CB 4.34Å
164S72Confident79.6Confident68 Ų6869.8 Ų69.848%0.47642%0.419SS..Hα-helixtrans-61.4-21.3174.4-57.40000112.7V160V160-S164 WeakPolarHBondContact O-CB 3.36Å; V160-S164 PolarHBondContact O-N 3.02Å; V160-S164 PolarHBondContact O-OG 2.79Å
165N69.6Low79Confident126 Ų12668.4 Ų68.467%0.67441%0.408SS*.THydrogen-bonded Turntrans-94.8-3.6178.7-71.2-40.5000114.2V161 Y163V161-N165 PolarHBondContact O-ND2 2.74Å; Y163-N165 PolarHBondContact O-N 3.08Å; Y163-N165 VanDerWaalsContact O-N 3.11Å
166K68.3Low78.4Confident91 Ų9170.6 Ų70.640%0.39643%0.425SS..SBendtrans-80.2123.3-179.3-80.5-174.9177.6178.70111.2Y163 G168 S169Y163-K166 HydrophobicContact CD1-CD 4.41Å; Y163-K166 PolarHBondContact O-N 2.72Å; Y163-K166 VanDerWaalsContact O-N 3.07Å; K166-G168 PolarHBondContact O-N 3.08Å; K166-S169 PolarHBondContact O-N 2.59Å
167P59.8Low77.9Confident135 Ų13572.1 Ų72.188%0.87744%0.438SS*.THydrogen-bonded Turntrans-59.9130172.3-4.111.7000110.4S169P167-S169 VanDerWaalsContact C-N 3.32Å; P167-S169 PolarHBondContact O-N 2.75Å
168G61Low77.5Confident85 Ų8568.1 Ų68.188%0.87642%0.421SS*.THydrogen-bonded Turntrans84.7-7.6179.800000115.6K166 S170K166-G168 PolarHBondContact O-N 3.08Å; G168-S170 PolarHBondContact O-N 3.36Å
169S60.4Low77.2Confident36 Ų3662.5 Ų62.525%0.25240%0.401SS..  trans-79.499.3169.5-1690000109.2K166 P167 S171K166-S169 PolarHBondContact O-N 2.59Å; P167-S169 VanDerWaalsContact C-N 3.32Å; P167-S169 PolarHBondContact O-N 2.75Å; S169-S171 PolarHBondContact O-N 2.89Å; S169-S171 PolarHBondContact OG-OG 2.86Å
170S54.7Low77.1Confident116 Ų11661.8 Ų61.881%0.81140%0.399SS*.  trans-73.47.9169.545.70000112.9G168 I172G168-S170 PolarHBondContact O-N 3.36Å; S170-I172 PolarHBondContact O-N 3.29Å
171S62Low77Confident41 Ų4163.2 Ų63.229%0.28740%0.404SS..  trans-84.355.3-177.5-43.40000111.4S169 V173S169-S171 PolarHBondContact O-N 2.89Å; S169-S171 PolarHBondContact OG-OG 2.86Å; S171-V173 PolarHBondContact O-N 3.15Å; S171-V173 VanDerWaalsContact O-N 3.16Å
172I77.2Confident76.8Confident123 Ų12364.8 Ų64.863%0.63141%0.41SS*.  trans-56124.9166-63175.8000106.9S170 T174S170-I172 PolarHBondContact O-N 3.29Å; I172-T174 WeakPolarHBondContact O-CG2 3.48Å; I172-T174 PolarHBondContact O-N 2.73Å
173V85.2Confident77.1Confident31 Ų3162.7 Ų62.719%0.18840%0.397CS..  trans-70.2119.9176.7-177.90000108.6F156 V160 S171F156-V173 HydrophobicContact CE1-CG1 4.36Å; F156-V173 HydrophobicContact CE2-CG1 4.18Å; F156-V173 HydrophobicContact CZ-CG1 3.58Å; V160-V173 HydrophobicContact CG2-CB 4.01Å; V160-V173 HydrophobicContact CG2-CG1 3.95Å; V160-V173 HydrophobicContact CG2-CG2 3.86Å; S171-V173 PolarHBondContact O-N 3.15Å; S171-V173 VanDerWaalsContact O-N 3.16Å
174T87.7Confident77.8Confident55 Ų5567.3 Ų67.334%0.33742%0.422SS..  trans-115.2-169.3179.4780000110.9I172 S176 S177 G207 Y208I172-T174 WeakPolarHBondContact O-CG2 3.48Å; I172-T174 PolarHBondContact O-N 2.73Å; T174-S176 VanDerWaalsContact C-N 3.29Å; T174-S176 PolarHBondContact O-N 2.9Å; T174-S176 PolarHBondContact OG1-N 2.7Å; T174-S177 PolarHBondContact N-O 3.15Å; T174-S177 PolarHBondContact OG1-N 2.7Å; T174-S177 PolarHBondContact OG1-O 3.49Å; T174-S177 PolarHBondContact OG1-OG 3.11Å; T174-G207 WeakPolarHBondContact O-CA 3.18Å; T174-Y208 VanDerWaalsContact C-CD1 3.49Å; T174-Y208 WeakPolarHBondContact O-CD1 3.39Å; T174-Y208 PolarHBondContact O-N 3.11Å; T174-Y208 VanDerWaalsContact O-N 3.13Å
175A87Confident79Confident25 Ų2565.7 Ų65.721%0.20741%0.408CS..SBendtrans-57.5-43.9173.600000112.3G207 Y208 V209A175-G207 CarbonylContact O-C 3.58Å; A175-Y208 HydrophobicContact CB-CE1 3.91Å; A175-Y208 HydrophobicContact CB-CE2 3.71Å; A175-Y208 VanDerWaalsContact CB-OH 3.27Å; A175-Y208 WeakPolarHBondContact CB-OH 3.32Å; A175-Y208 PolarHBondContact O-N 2.81Å; A175-V209 HydrophobicContact CB-CG2 3.96Å; A175-V209 VanDerWaalsContact O-CB 3.27Å; A175-V209 WeakPolarHBondContact O-CB 3.17Å; A175-V209 WeakPolarHBondContact O-CG2 3.4Å; A175-V209 PolarHBondContact O-N 3.19Å
176S84Confident80.2Confident81 Ų8159.8 Ų59.857%0.56638%0.376SS*.SBendtrans-127.62.3-164.2-49.50000113.2T174T174-S176 VanDerWaalsContact C-N 3.29Å; T174-S176 PolarHBondContact O-N 2.9Å; T174-S176 PolarHBondContact OG1-N 2.7Å
177S84.6Confident81.4Confident56 Ų5655.4 Ų55.439%0.39236%0.357SS..  trans-144.1166.1-179.870.30000111.9T174 N206 G207T174-S177 PolarHBondContact N-O 3.15Å; T174-S177 PolarHBondContact OG1-N 2.7Å; T174-S177 PolarHBondContact OG1-O 3.49Å; T174-S177 PolarHBondContact OG1-OG 3.11Å; S177-N206 WeakPolarHBondContact CA-OD1 3.24Å; S177-G207 WeakPolarHBondContact O-CA 3.42Å
178G85.2Confident83Confident12 Ų1250 Ų5012%0.12432%0.32CS..  trans115.343.5175.400000114.2N206G178-N206 PolarHBondContact N-OD1 3.05Å
179V87.4Confident84.4Confident18 Ų1846.3 Ų46.311%0.10928%0.281CS..  trans-71130.4173.7-171.80000110.3I181 I186 I204 N206 A259V179-I181 VanDerWaalsContact C-N 3.3Å; V179-I181 HydrophobicContact CB-CG2 4.27Å; V179-I181 HydrophobicContact CG1-CG2 4.3Å; V179-I181 PolarHBondContact O-N 3.23Å; V179-I186 HydrophobicContact CG1-CD1 3.8Å; V179-I204 HydrophobicContact CG1-CG2 3.9Å; V179-N206 HydrophobicContact CG2-CB 3.38Å; V179-N206 WeakPolarHBondContact CG2-OD1 3.24Å; V179-A259 HydrophobicContact CG1-CB 4.27Å
180P89.1Confident85.7Confident8 Ų846.9 Ų46.95%0.05228%0.283CS..  trans-75.180.1169.132.4-36.2000110.5Y159 Y163 D182 S183 I204Y159-P180 HydrophobicContact CD1-CB 3.62Å; Y159-P180 HydrophobicContact CD1-CG 3.81Å; Y159-P180 HydrophobicContact CD2-CG 4.23Å; Y159-P180 HydrophobicContact CE1-CB 4.05Å; Y159-P180 HydrophobicContact CE1-CG 4.27Å; Y159-P180 HydrophobicContact CG-CB 4.12Å; Y159-P180 HydrophobicContact CG-CG 3.83Å; Y163-P180 HydrophobicContact CD1-CB 4.17Å; Y163-P180 HydrophobicContact CD2-CB 4.23Å; Y163-P180 HydrophobicContact CE1-CB 3.84Å; Y163-P180 HydrophobicContact CE2-CB 3.92Å; Y163-P180 HydrophobicContact CG-CB 4.34Å; P180-D182 PolarHBondContact O-N 3.26Å; P180-D182 VanDerWaalsContact O-N 3.17Å; P180-S183 WeakPolarHBondContact O-CB 3.25Å; P180-S183 PolarHBondContact O-N 2.7Å; P180-I204 HydrophobicContact CG-CD1 4.12Å; P180-I204 HydrophobicContact CG-CG2 3.75Å
181I86.9Confident87.4Confident74 Ų7445.1 Ų45.138%0.37926%0.261SS..THydrogen-bonded Turntrans-59.4-27.5-175.160.8173.1000114.1V179 S183 L257V179-I181 VanDerWaalsContact C-N 3.3Å; V179-I181 HydrophobicContact CB-CG2 4.27Å; V179-I181 HydrophobicContact CG1-CG2 4.3Å; V179-I181 PolarHBondContact O-N 3.23Å; I181-S183 VanDerWaalsContact C-N 3.25Å; I181-S183 PolarHBondContact O-N 3.08Å; I181-L257 HydrophobicContact CB-CD1 4.1Å; I181-L257 HydrophobicContact CG2-CD1 4.01Å
182D86Confident88.8Confident116 Ų11644.4 Ų44.462%0.6225%0.252SS*.THydrogen-bonded Turntrans-853.3178.2-51.7-46000113.3P180P180-D182 PolarHBondContact O-N 3.26Å; P180-D182 VanDerWaalsContact O-N 3.17Å
183S91.4Very high89.5Confident2 Ų245.8 Ų45.81%0.01426%0.255CS..  trans-58.3141.9-178.2171.20000111.9Y159 P180 I181 L185 I186 R197 I204Y159-S183 PolarHBondContact OH-OG 2.99Å; P180-S183 WeakPolarHBondContact O-CB 3.25Å; P180-S183 PolarHBondContact O-N 2.7Å; I181-S183 VanDerWaalsContact C-N 3.25Å; I181-S183 PolarHBondContact O-N 3.08Å; S183-L185 PolarHBondContact O-N 2.95Å; S183-L185 WeakPolarHBondContact OG-CB 3.18Å; S183-L185 PolarHBondContact OG-N 3.14Å; S183-I186 VanDerWaalsContact O-CG2 3.3Å; S183-I186 WeakPolarHBondContact O-CG2 3.4Å; S183-R197 PolarHBondContact O-NH1 3.47Å; S183-I204 WeakPolarHBondContact OG-CD1 3.48Å
184I94.4Very high89.9Confident115 Ų11545.7 Ų45.759%0.5925%0.253SS*.SBendtrans-69.8-14.7170.263.7169.1000113.1W196 R197I184-W196 PolarHBondContact O-NE1 3.42Å; I184-R197 VanDerWaalsContact O-CZ 3.31Å; I184-R197 PolarHBondContact O-NH1 3.32Å
185L96.8Very high90.3Very high34 Ų3446.3 Ų46.318%0.17826%0.263CS..SBendtrans-94.7-24.7-176.3-54.5-179.5000112.9V155 Y159 S183 T200 Y201 F203 I204V155-L185 HydrophobicContact CG1-CD1 4Å; Y159-L185 HydrophobicContact CE2-CD1 4.2Å; S183-L185 PolarHBondContact O-N 2.95Å; S183-L185 WeakPolarHBondContact OG-CB 3.18Å; S183-L185 PolarHBondContact OG-N 3.14Å; L185-T200 WeakPolarHBondContact CA-OG1 3.5Å; L185-T200 HydrophobicContact CD2-CG2 3.99Å; L185-T200 CarbonylContact O-C 3.27Å; L185-T200 PolarHBondContact O-OG1 3.26Å; L185-Y201 WeakPolarHBondContact O-CA 3.38Å; L185-Y201 PolarHBondContact O-N 3.11Å; L185-F203 HydrophobicContact CD1-CB 4.19Å; L185-I204 HydrophobicContact CB-CD1 3.96Å; L185-I204 HydrophobicContact CB-CG1 3.91Å; L185-I204 HydrophobicContact CD1-CD1 4.27Å
186I94.7Very high90.8Very high1 Ų151.4 Ų51.41%0.00528%0.277CS..SBendtrans-64146-179.9-160.5173.3000110.8V179 S183 N188 R197 I204 L257 L258 A259V179-I186 HydrophobicContact CG1-CD1 3.8Å; S183-I186 VanDerWaalsContact O-CG2 3.3Å; S183-I186 WeakPolarHBondContact O-CG2 3.4Å; I186-N188 PolarHBondContact O-N 2.75Å; I186-R197 VanDerWaalsContact O-CD 3.27Å; I186-R197 WeakPolarHBondContact O-CD 3.24Å; I186-R197 WeakPolarHBondContact O-CG 3.4Å; I186-R197 PolarHBondContact O-NH1 3.06Å; I186-I204 HydrophobicContact CB-CG1 4.35Å; I186-I204 HydrophobicContact CG1-CG2 4.47Å; I186-L257 HydrophobicContact CD1-CB 4.03Å; I186-L257 HydrophobicContact CD1-CD1 4.21Å; I186-L258 WeakPolarHBondContact CG1-O 3.17Å; I186-A259 HydrophobicContact CD1-CB 4.41Å; I186-A259 HydrophobicContact CG1-CB 4.31Å
187Y94.5Very high91.5Very high0 Ų047.9 Ų47.90%025%0.252CS..BIsolated β-bridgetrans-72.1123.8169.8173.1-98.1000110.2P189 R192 R197 F198 H249 S250 L257 L258Y187-P189 HydrophobicContact CE1-CG 4Å; Y187-R192 PolarHBondContact OH-NE 3.48Å; Y187-R197 HydrophobicContact CD2-CB 4.43Å; Y187-F198 HydrophobicContact CD2-CD1 4.39Å; Y187-F198 HydrophobicContact CD2-CE1 4.41Å; Y187-F198 HydrophobicContact CD2-CG 4.48Å; Y187-F198 HydrophobicContact CE2-CD1 4.05Å; Y187-F198 HydrophobicContact CE2-CD2 4.35Å; Y187-F198 AromaticContact CE2-CE1 3.63Å; Y187-F198 HydrophobicContact CE2-CE1 3.63Å; Y187-F198 AromaticContact CE2-CE2 3.97Å; Y187-F198 HydrophobicContact CE2-CE2 3.97Å; Y187-F198 HydrophobicContact CE2-CG 4.4Å; Y187-F198 AromaticContact CE2-CZ 3.6Å; Y187-F198 HydrophobicContact CE2-CZ 3.6Å; Y187-H249 AromaticContact CE1-CD2 3.97Å; Y187-S250 WeakPolarHBondContact OH-CB 3.27Å; Y187-L257 WeakPolarHBondContact O-CA 3.4Å; Y187-L257 WeakPolarHBondContact O-CD2 3.43Å; Y187-L258 HydrophobicContact CD1-CB 3.78Å; Y187-L258 HydrophobicContact CG-CB 4.17Å; Y187-L258 PolarHBondContact N-O 3.43Å; Y187-L258 PolarHBondContact O-N 3.24Å
188N92.2Very high92.1Very high21 Ų2146.3 Ų46.311%0.11224%0.238CC..  trans-122.3115.9179.9-169.3-27.3000110.7I186 T190 K191 L257I186-N188 PolarHBondContact O-N 2.75Å; N188-T190 PolarHBondContact O-N 2.74Å; N188-T190 VanDerWaalsContact O-N 3.15Å; N188-T190 PolarHBondContact OD1-N 2.98Å; N188-T190 PolarHBondContact OD1-OG1 2.8Å; N188-K191 HydrophobicContact CB-CB 4.28Å; N188-K191 HydrophobicContact CB-CG 4.45Å; N188-K191 CarbonylContact O-C 3.51Å; N188-K191 PolarHBondContact O-N 3.41Å; N188-L257 HydrophobicContact CB-CD2 4.06Å
189P90.1Very high92.7Very high7 Ų748.5 Ų48.55%0.04525%0.247CC..G310 helixtrans-56-27.8177.6-26.934.3000115.2Y187 K191 R192 P254 V256Y187-P189 HydrophobicContact CE1-CG 4Å; P189-K191 PolarHBondContact O-N 3.41Å; P189-R192 VanDerWaalsContact CB-NH1 3.33Å; P189-R192 WeakPolarHBondContact O-CG 3.48Å; P189-R192 PolarHBondContact O-NH1 2.77Å; P189-P254 VanDerWaalsContact CB-O 3.29Å; P189-P254 WeakPolarHBondContact CB-O 3.07Å; P189-V256 WeakPolarHBondContact CD-O 3.4Å; P189-V256 WeakPolarHBondContact CG-O 3.3Å
190T88.6Confident93.2Very high49 Ų4948.7 Ų48.730%0.30125%0.248SC..G310 helixtrans-78.2-11.8177.8700000112.6N188 S393N188-T190 PolarHBondContact O-N 2.74Å; N188-T190 VanDerWaalsContact O-N 3.15Å; N188-T190 PolarHBondContact OD1-N 2.98Å; N188-T190 PolarHBondContact OD1-OG1 2.8Å; T190-S393 VanDerWaalsContact CG2-O 3.29Å; T190-S393 WeakPolarHBondContact CG2-O 3.46Å
191K91.3Very high93.6Very high79 Ų7948.3 Ų48.334%0.34325%0.245SC..G310 helixtrans-123.537.2-176-57.7-174.9171.7-166.60112.4N188 P189 H193 E194N188-K191 HydrophobicContact CB-CB 4.28Å; N188-K191 HydrophobicContact CB-CG 4.45Å; N188-K191 CarbonylContact O-C 3.51Å; N188-K191 PolarHBondContact O-N 3.41Å; P189-K191 PolarHBondContact O-N 3.41Å; K191-H193 PolarHBondContact O-N 3.16Å; K191-H193 VanDerWaalsContact O-N 3.09Å; K191-E194 HydrophobicContact CB-CB 4.39Å; K191-E194 HydrophobicContact CB-CG 4.09Å; K191-E194 VanDerWaalsContact O-CB 3.27Å; K191-E194 WeakPolarHBondContact O-CB 3.3Å; K191-E194 PolarHBondContact O-N 3.16Å
192R90.7Very high94.1Very high26 Ų2645.1 Ų45.110%0.09823%0.229CC..THydrogen-bonded Turntrans-56.2-24.2178.5-76.8172.516695.3-2.3114.9Y187 P189 E194 F198 S250 P254 N381 C390Y187-R192 PolarHBondContact OH-NE 3.48Å; P189-R192 VanDerWaalsContact CB-NH1 3.33Å; P189-R192 WeakPolarHBondContact O-CG 3.48Å; P189-R192 PolarHBondContact O-NH1 2.77Å; R192-E194 PolarHBondContact O-N 3.46Å; R192-F198 HydrophobicContact CG-CZ 4.44Å; R192-F198 WeakPolarHBondContact O-CE2 3.25Å; R192-S250 PolarHBondContact NH2-O 3.35Å; R192-S250 VanDerWaalsContact NH2-O 3.13Å; R192-P254 PolarHBondContact NH1-O 2.91Å; R192-P254 VanDerWaalsContact NH1-O 3.15Å; R192-P254 VanDerWaalsContact NH2-C 3.35Å; R192-P254 VanDerWaalsContact NH2-CB 3.27Å; R192-P254 PolarHBondContact NH2-O 2.85Å; R192-N381 VanDerWaalsContact CD-OD1 3.28Å; R192-N381 WeakPolarHBondContact CD-OD1 3.49Å; R192-N381 PolarHBondContact NE-OD1 2.86Å; R192-C390 VanDerWaalsContact CZ-SG 3.54Å
193H91.1Very high94.7Very high151 Ų15141.4 Ų41.470%0.69921%0.207SC*.THydrogen-bonded Turntrans-69.9-20.5174.865.1-86.2000112.8K191 A195K191-H193 PolarHBondContact O-N 3.16Å; K191-H193 VanDerWaalsContact O-N 3.09Å; H193-A195 VanDerWaalsContact C-N 3.26Å; H193-A195 PolarHBondContact O-N 3.45Å
194E94.9Very high94.9Very high29 Ų2941.3 Ų41.314%0.13621%0.207CC..  trans-79.172.8174.5-62.9-170.5-17100109.9K191 R192 W196 R197K191-E194 HydrophobicContact CB-CB 4.39Å; K191-E194 HydrophobicContact CB-CG 4.09Å; K191-E194 VanDerWaalsContact O-CB 3.27Å; K191-E194 WeakPolarHBondContact O-CB 3.3Å; K191-E194 PolarHBondContact O-N 3.16Å; R192-E194 PolarHBondContact O-N 3.46Å; E194-W196 HydrophobicContact CB-CD2 4.1Å; E194-W196 HydrophobicContact CB-CE3 4.07Å; E194-W196 HydrophobicContact CB-CH2 3.43Å; E194-W196 VanDerWaalsContact CB-CH2 3.43Å; E194-W196 HydrophobicContact CB-CZ2 3.44Å; E194-W196 VanDerWaalsContact CB-CZ2 3.44Å; E194-W196 HydrophobicContact CB-CZ3 3.74Å; E194-W196 VanDerWaalsContact CD-CZ2 3.43Å; E194-W196 HydrophobicContact CG-CH2 3.35Å; E194-W196 HydrophobicContact CG-CZ2 3.56Å; E194-W196 HydrophobicContact CG-CZ3 4.03Å; E194-W196 PolarHBondContact O-N 3.27Å; E194-W196 WeakPolarHBondContact OE2-CZ2 3.37Å; E194-R197 HydrophobicContact CB-CG 4.11Å; E194-R197 VanDerWaalsContact O-CB 3.28Å; E194-R197 WeakPolarHBondContact O-CB 3.43Å; E194-R197 WeakPolarHBondContact O-CG 3.44Å; E194-R197 PolarHBondContact O-N 3.34Å; E194-R197 IonicContact OE2-CZ 3.69Å; E194-R197 IonicContact OE2-NE 2.77Å; E194-R197 PolarHBondContact OE2-NE 2.93Å; E194-R197 IonicContact OE2-NH2 3.39Å; E194-R197 PolarHBondContact OE2-NH2 2.98Å
195A95.9Very high94.9Very high68 Ų6836 Ų3656%0.56218%0.179SC*.THydrogen-bonded Turntrans-54.3-28.4-16800000115H193 R197 F198H193-A195 VanDerWaalsContact C-N 3.26Å; H193-A195 PolarHBondContact O-N 3.45Å; A195-R197 PolarHBondContact O-N 2.96Å; A195-F198 WeakPolarHBondContact O-CB 3.35Å; A195-F198 PolarHBondContact O-N 3.44Å; A195-F198 VanDerWaalsContact O-N 3.17Å
196W98Very high94.5Very high132 Ų13235.5 Ų35.550%0.518%0.177SC..THydrogen-bonded Turntrans-60-27.4176.763.488.6000112.7I184 E194 F198 L199 T200I184-W196 PolarHBondContact O-NE1 3.42Å; E194-W196 HydrophobicContact CB-CD2 4.1Å; E194-W196 HydrophobicContact CB-CE3 4.07Å; E194-W196 HydrophobicContact CB-CH2 3.43Å; E194-W196 VanDerWaalsContact CB-CH2 3.43Å; E194-W196 HydrophobicContact CB-CZ2 3.44Å; E194-W196 VanDerWaalsContact CB-CZ2 3.44Å; E194-W196 HydrophobicContact CB-CZ3 3.74Å; E194-W196 VanDerWaalsContact CD-CZ2 3.43Å; E194-W196 HydrophobicContact CG-CH2 3.35Å; E194-W196 HydrophobicContact CG-CZ2 3.56Å; E194-W196 HydrophobicContact CG-CZ3 4.03Å; E194-W196 PolarHBondContact O-N 3.27Å; E194-W196 WeakPolarHBondContact OE2-CZ2 3.37Å; W196-F198 PolarHBondContact O-N 3.21Å; W196-L199 WeakPolarHBondContact O-CA 3.25Å; W196-L199 PolarHBondContact O-N 2.82Å; W196-T200 HydrophobicContact CB-CG2 4.29Å; W196-T200 WeakPolarHBondContact O-CG2 3.5Å; W196-T200 PolarHBondContact O-N 2.88Å; W196-T200 PolarHBondContact O-OG1 2.93Å; W196-T200 VanDerWaalsContact O-OG1 3.1Å
197R97.4Very high94.3Very high8 Ų835.5 Ų35.53%0.0318%0.177CC..Hα-helixtrans-62.7-22.9178.5-70.5-171.4-176.9-84.4-7.6113.9S183 I184 I186 Y187 E194 A195 L199 T200S183-R197 PolarHBondContact O-NH1 3.47Å; I184-R197 VanDerWaalsContact O-CZ 3.31Å; I184-R197 PolarHBondContact O-NH1 3.32Å; I186-R197 VanDerWaalsContact O-CD 3.27Å; I186-R197 WeakPolarHBondContact O-CD 3.24Å; I186-R197 WeakPolarHBondContact O-CG 3.4Å; I186-R197 PolarHBondContact O-NH1 3.06Å; Y187-R197 HydrophobicContact CD2-CB 4.43Å; E194-R197 HydrophobicContact CB-CG 4.11Å; E194-R197 VanDerWaalsContact O-CB 3.28Å; E194-R197 WeakPolarHBondContact O-CB 3.43Å; E194-R197 WeakPolarHBondContact O-CG 3.44Å; E194-R197 PolarHBondContact O-N 3.34Å; E194-R197 IonicContact OE2-CZ 3.69Å; E194-R197 IonicContact OE2-NE 2.77Å; E194-R197 PolarHBondContact OE2-NE 2.93Å; E194-R197 IonicContact OE2-NH2 3.39Å; E194-R197 PolarHBondContact OE2-NH2 2.98Å; A195-R197 PolarHBondContact O-N 2.96Å; R197-L199 PolarHBondContact O-N 3.32Å; R197-T200 WeakPolarHBondContact CA-OG1 3.36Å
198F97.5Very high94.2Very high22 Ų2241.8 Ų41.810%0.09620%0.202CC..Hα-helixtrans-71.6-12.5172.2-71.6-95000112.9Y187 R192 A195 W196 Y201 S246 L247 N381Y187-F198 HydrophobicContact CD2-CD1 4.39Å; Y187-F198 HydrophobicContact CD2-CE1 4.41Å; Y187-F198 HydrophobicContact CD2-CG 4.48Å; Y187-F198 HydrophobicContact CE2-CD1 4.05Å; Y187-F198 HydrophobicContact CE2-CD2 4.35Å; Y187-F198 AromaticContact CE2-CE1 3.63Å; Y187-F198 HydrophobicContact CE2-CE1 3.63Å; Y187-F198 AromaticContact CE2-CE2 3.97Å; Y187-F198 HydrophobicContact CE2-CE2 3.97Å; Y187-F198 HydrophobicContact CE2-CG 4.4Å; Y187-F198 AromaticContact CE2-CZ 3.6Å; Y187-F198 HydrophobicContact CE2-CZ 3.6Å; R192-F198 HydrophobicContact CG-CZ 4.44Å; R192-F198 WeakPolarHBondContact O-CE2 3.25Å; A195-F198 WeakPolarHBondContact O-CB 3.35Å; A195-F198 PolarHBondContact O-N 3.44Å; A195-F198 VanDerWaalsContact O-N 3.17Å; W196-F198 PolarHBondContact O-N 3.21Å; F198-Y201 WeakPolarHBondContact O-CD1 3.31Å; F198-Y201 VanDerWaalsContact O-CE1 3.26Å; F198-Y201 WeakPolarHBondContact O-CE1 3.41Å; F198-S246 WeakPolarHBondContact CA-OG 2.82Å; F198-S246 WeakPolarHBondContact CB-OG 3.19Å; F198-S246 WeakPolarHBondContact CD1-OG 3.28Å; F198-S246 WeakPolarHBondContact O-CB 3.23Å; F198-S246 PolarHBondContact O-OG 3.26Å; F198-L247 HydrophobicContact CD1-CD2 4.01Å; F198-L247 HydrophobicContact CD1-CG 4.37Å; F198-L247 HydrophobicContact CE1-CD2 3.94Å; F198-N381 HydrophobicContact CZ-CB 4.43Å
199L98.3Very high94.2Very high59 Ų5942.9 Ų42.931%0.30921%0.209SC..Hα-helixtrans-114-47.3177.2-179.664.5000111.8W196 R197 Y201 M202 L239 V242 I243W196-L199 WeakPolarHBondContact O-CA 3.25Å; W196-L199 PolarHBondContact O-N 2.82Å; R197-L199 PolarHBondContact O-N 3.32Å; L199-Y201 PolarHBondContact O-N 3.36Å; L199-Y201 VanDerWaalsContact O-N 3.16Å; L199-M202 HydrophobicContact CD1-CE 4.19Å; L199-M202 HydrophobicContact CD1-SD 4.3Å; L199-M202 HydrophobicContact CG-CE 4.26Å; L199-M202 VanDerWaalsContact O-CG 3.29Å; L199-M202 WeakPolarHBondContact O-CG 3.17Å; L199-M202 PolarHBondContact O-N 3.22Å; L199-L239 HydrophobicContact CD1-CD2 4.02Å; L199-V242 HydrophobicContact CD1-CB 4.37Å; L199-V242 HydrophobicContact CD1-CG1 3.99Å; L199-V242 WeakPolarHBondContact O-CG1 3.35Å; L199-I243 HydrophobicContact CB-CG1 4.45Å; L199-I243 HydrophobicContact CD1-CD1 4.36Å; L199-I243 HydrophobicContact CD1-CG1 4.08Å
200T98.3Very high94.3Very high22 Ų2244.3 Ų44.314%0.13522%0.215CC..Hα-helixtrans-69.7-16.1-169.6550000114.4L185 W196 R197 M202 F203L185-T200 WeakPolarHBondContact CA-OG1 3.5Å; L185-T200 HydrophobicContact CD2-CG2 3.99Å; L185-T200 CarbonylContact O-C 3.27Å; L185-T200 PolarHBondContact O-OG1 3.26Å; W196-T200 HydrophobicContact CB-CG2 4.29Å; W196-T200 WeakPolarHBondContact O-CG2 3.5Å; W196-T200 PolarHBondContact O-N 2.88Å; W196-T200 PolarHBondContact O-OG1 2.93Å; W196-T200 VanDerWaalsContact O-OG1 3.1Å; R197-T200 WeakPolarHBondContact CA-OG1 3.36Å; T200-M202 PolarHBondContact O-N 3.23Å; T200-M202 VanDerWaalsContact O-N 3.09Å; T200-F203 WeakPolarHBondContact O-CD2 3.34Å; T200-F203 PolarHBondContact O-N 2.99Å; T200-F203 VanDerWaalsContact O-N 3.09Å
201Y97.1Very high94.6Very high0 Ų042.7 Ų42.70%020%0.204CC..G310 helixtrans-60.4-22.2-179.780.2-88.5000112.8L185 F198 L199 F203 I204 V242 S246 L258 G260L185-Y201 WeakPolarHBondContact O-CA 3.38Å; L185-Y201 PolarHBondContact O-N 3.11Å; F198-Y201 WeakPolarHBondContact O-CD1 3.31Å; F198-Y201 VanDerWaalsContact O-CE1 3.26Å; F198-Y201 WeakPolarHBondContact O-CE1 3.41Å; L199-Y201 PolarHBondContact O-N 3.36Å; L199-Y201 VanDerWaalsContact O-N 3.16Å; Y201-F203 PolarHBondContact O-N 3.38Å; Y201-F203 VanDerWaalsContact O-N 3.16Å; Y201-I204 PolarHBondContact O-N 3Å; Y201-V242 HydrophobicContact CD1-CG1 4.14Å; Y201-V242 HydrophobicContact CE1-CB 4.49Å; Y201-V242 HydrophobicContact CE1-CG1 3.32Å; Y201-V242 WeakPolarHBondContact CE1-O 3.38Å; Y201-V242 PolarHBondContact OH-O 2.88Å; Y201-S246 VanDerWaalsContact CE1-CB 3.46Å; Y201-L258 WeakPolarHBondContact CB-O 3.42Å; Y201-L258 HydrophobicContact CD1-CD2 4.33Å; Y201-L258 HydrophobicContact CD2-CD1 4.48Å; Y201-L258 HydrophobicContact CD2-CD2 3.74Å; Y201-L258 HydrophobicContact CD2-CG 3.57Å; Y201-L258 HydrophobicContact CE1-CD2 4.14Å; Y201-L258 HydrophobicContact CE2-CD1 4.29Å; Y201-L258 HydrophobicContact CE2-CD2 3.49Å; Y201-L258 VanDerWaalsContact CE2-CD2 3.49Å; Y201-L258 HydrophobicContact CE2-CG 3.66Å; Y201-L258 HydrophobicContact CG-CD2 4.15Å; Y201-L258 HydrophobicContact CG-CG 4.2Å; Y201-G260 WeakPolarHBondContact CD2-O 3.37Å; Y201-G260 WeakPolarHBondContact CE2-O 3.39Å; Y201-G260 PolarHBondContact O-N 3.47Å
202M97.8Very high94.8Very high6 Ų641.5 Ų41.53%0.0321%0.209CC..G310 helixtrans-57.2-25.7175.569.3-171.9174.800113.2I148 L199 T200 H205 Y238 L239 V242 A261I148-M202 HydrophobicContact CD1-CE 3.9Å; I148-M202 HydrophobicContact CD1-SD 4.35Å; L199-M202 HydrophobicContact CD1-CE 4.19Å; L199-M202 HydrophobicContact CD1-SD 4.3Å; L199-M202 HydrophobicContact CG-CE 4.26Å; L199-M202 VanDerWaalsContact O-CG 3.29Å; L199-M202 WeakPolarHBondContact O-CG 3.17Å; L199-M202 PolarHBondContact O-N 3.22Å; T200-M202 PolarHBondContact O-N 3.23Å; T200-M202 VanDerWaalsContact O-N 3.09Å; M202-H205 PolarHBondContact O-CE1 2.89Å; M202-Y238 HydrophobicContact SD-CE1 4.04Å; M202-L239 HydrophobicContact CE-CD2 4.03Å; M202-L239 HydrophobicContact SD-CD2 4.29Å; M202-V242 HydrophobicContact CB-CG1 4.03Å; M202-V242 HydrophobicContact CB-CG2 4.21Å; M202-V242 HydrophobicContact CG-CG1 4.44Å; M202-V242 HydrophobicContact SD-CB 4.48Å; M202-V242 HydrophobicContact SD-CG1 4.05Å; M202-V242 HydrophobicContact SD-CG2 3.97Å; M202-A261 HydrophobicContact CB-CB 4.29Å; M202-A261 WeakPolarHBondContact O-CB 3.45Å; M202-A261 PolarHBondContact O-N 3.44Å
203F97.9Very high95Very high38 Ų3843.9 Ų43.917%0.16722%0.22CC..G310 helixtrans-82.9-11.7179.2-63.2-66.7000114.3I148 A151 E152 V155 L185 T200 Y201I148-F203 HydrophobicContact CD1-CE1 3.78Å; I148-F203 HydrophobicContact CD1-CZ 3.89Å; A151-F203 HydrophobicContact CB-CE1 3.78Å; E152-F203 HydrophobicContact CG-CD1 3.75Å; E152-F203 HydrophobicContact CG-CE1 4.17Å; V155-F203 HydrophobicContact CB-CB 4.18Å; V155-F203 HydrophobicContact CG1-CB 3.85Å; V155-F203 HydrophobicContact CG2-CB 4.33Å; V155-F203 HydrophobicContact CG2-CD1 4.25Å; V155-F203 HydrophobicContact CG2-CG 4.4Å; L185-F203 HydrophobicContact CD1-CB 4.19Å; T200-F203 WeakPolarHBondContact O-CD2 3.34Å; T200-F203 PolarHBondContact O-N 2.99Å; T200-F203 VanDerWaalsContact O-N 3.09Å; Y201-F203 PolarHBondContact O-N 3.38Å; Y201-F203 VanDerWaalsContact O-N 3.16Å
204I95.7Very high95.2Very high1 Ų136.7 Ų36.71%0.00519%0.187CC..  trans-98.5131.8-176.9-57-53.8000109.6Y159 V179 P180 S183 L185 I186 Y201 A259 G260Y159-I204 HydrophobicContact CD2-CD1 3.79Å; Y159-I204 HydrophobicContact CE2-CD1 3.29Å; V179-I204 HydrophobicContact CG1-CG2 3.9Å; P180-I204 HydrophobicContact CG-CD1 4.12Å; P180-I204 HydrophobicContact CG-CG2 3.75Å; S183-I204 WeakPolarHBondContact OG-CD1 3.48Å; L185-I204 HydrophobicContact CB-CD1 3.96Å; L185-I204 HydrophobicContact CB-CG1 3.91Å; L185-I204 HydrophobicContact CD1-CD1 4.27Å; I186-I204 HydrophobicContact CB-CG1 4.35Å; I186-I204 HydrophobicContact CG1-CG2 4.47Å; Y201-I204 PolarHBondContact O-N 3Å; I204-A259 HydrophobicContact CB-CB 3.98Å; I204-A259 HydrophobicContact CG2-CB 3.72Å; I204-A259 CarbonylContact O-C 3.16Å; I204-G260 WeakPolarHBondContact O-CA 3.45Å; I204-G260 PolarHBondContact O-N 3.44Å
205H93.6Very high95.3Very high3 Ų336.1 Ų36.11%0.01419%0.186CC..  trans-129.5158.9-178.5-67.884.9000111.9E152 F156 M202 L211 A261E152-H205 IonicContact OE2-CE1 3.12Å; F156-H205 HydrophobicContact CD2-CB 3.92Å; F156-H205 HydrophobicContact CE2-CB 4.09Å; M202-H205 PolarHBondContact O-CE1 2.89Å; H205-L211 HydrophobicContact CB-CB 4.12Å; H205-A261 PolarHBondContact NE2-N 2.97Å
206N89.9Confident95.3Very high24 Ų2436.8 Ų36.813%0.12818%0.18CC..SBendtrans-107.882.7-177.7-172.118.5000110.1S177 G178 V179 H210S177-N206 WeakPolarHBondContact CA-OD1 3.24Å; G178-N206 PolarHBondContact N-OD1 3.05Å; V179-N206 HydrophobicContact CG2-CB 3.38Å; V179-N206 WeakPolarHBondContact CG2-OD1 3.24Å; N206-H210 PolarHBondContact N-ND1 3.1Å; N206-H210 VanDerWaalsContact N-ND1 3.11Å; N206-H210 VanDerWaalsContact O-CB 3.27Å; N206-H210 WeakPolarHBondContact O-CB 3.23Å
207G90.2Very high95.3Very high0 Ų030.6 Ų30.60%016%0.156CC..Hα-helixtrans78.2167.3-172.900000113.6T174 A175 S177 H210 L211T174-G207 WeakPolarHBondContact O-CA 3.18Å; A175-G207 CarbonylContact O-C 3.58Å; S177-G207 WeakPolarHBondContact O-CA 3.42Å; G207-H210 PolarHBondContact O-N 3.31Å; G207-L211 PolarHBondContact O-N 3Å
208Y92.6Very high95.3Very high133 Ų13330.2 Ų30.252%0.52216%0.155SC..Hα-helixtrans-74.6-24.4-172.957.4-105.5000113.7T174 A175 L211 A212T174-Y208 VanDerWaalsContact C-CD1 3.49Å; T174-Y208 WeakPolarHBondContact O-CD1 3.39Å; T174-Y208 PolarHBondContact O-N 3.11Å; T174-Y208 VanDerWaalsContact O-N 3.13Å; A175-Y208 HydrophobicContact CB-CE1 3.91Å; A175-Y208 HydrophobicContact CB-CE2 3.71Å; A175-Y208 VanDerWaalsContact CB-OH 3.27Å; A175-Y208 WeakPolarHBondContact CB-OH 3.32Å; A175-Y208 PolarHBondContact O-N 2.81Å; Y208-L211 PolarHBondContact O-N 3.11Å; Y208-A212 VanDerWaalsContact O-CB 3.3Å; Y208-A212 WeakPolarHBondContact O-CB 3.36Å; Y208-A212 PolarHBondContact O-N 3.45Å
209V92.1Very high95.2Very high43 Ų4332.1 Ų32.126%0.26117%0.169SC..Hα-helixtrans-67.5-41.2175.1176.10000110.1A175 L211 A212 F213 L315A175-V209 HydrophobicContact CB-CG2 3.96Å; A175-V209 VanDerWaalsContact O-CB 3.27Å; A175-V209 WeakPolarHBondContact O-CB 3.17Å; A175-V209 WeakPolarHBondContact O-CG2 3.4Å; A175-V209 PolarHBondContact O-N 3.19Å; V209-L211 PolarHBondContact O-N 2.74Å; V209-A212 PolarHBondContact O-N 2.95Å; V209-F213 HydrophobicContact CG1-CD2 3.83Å; V209-F213 HydrophobicContact CG1-CE2 3.96Å; V209-F213 WeakPolarHBondContact O-CD2 3.39Å; V209-F213 PolarHBondContact O-N 3.05Å; V209-L315 HydrophobicContact CG1-CD2 4.15Å
210H91.9Very high95Very high38 Ų3831.5 Ų31.518%0.17617%0.167CC..Hα-helixtrans-61.8-44.1176.6-176.7-158.7000111.3N206 G207 N214N206-H210 PolarHBondContact N-ND1 3.1Å; N206-H210 VanDerWaalsContact N-ND1 3.11Å; N206-H210 VanDerWaalsContact O-CB 3.27Å; N206-H210 WeakPolarHBondContact O-CB 3.23Å; G207-H210 PolarHBondContact O-N 3.31Å; H210-N214 PolarHBondContact CD2-ND2 3Å; H210-N214 PolarHBondContact NE2-ND2 3.19Å; H210-N214 VanDerWaalsContact NE2-ND2 3.16Å; H210-N214 PolarHBondContact O-N 3.49Å; H210-N214 PolarHBondContact O-ND2 3.05Å
211L95.3Very high94.8Very high14 Ų1430.5 Ų30.57%0.07316%0.161CC..Hα-helixtrans-61.9-46.4173.8177.468.1000111.8E152 I153 F156 H205 G207 Y208 V209 F213 N214 C215E152-L211 HydrophobicContact CB-CD1 4.28Å; I153-L211 HydrophobicContact CG1-CD2 4.33Å; F156-L211 HydrophobicContact CB-CD2 3.77Å; F156-L211 HydrophobicContact CD1-CD2 3.6Å; F156-L211 HydrophobicContact CD2-CB 4.49Å; F156-L211 HydrophobicContact CD2-CD2 4.12Å; F156-L211 HydrophobicContact CE1-CD2 4.16Å; F156-L211 HydrophobicContact CG-CD2 3.57Å; H205-L211 HydrophobicContact CB-CB 4.12Å; G207-L211 PolarHBondContact O-N 3Å; Y208-L211 PolarHBondContact O-N 3.11Å; V209-L211 PolarHBondContact O-N 2.74Å; L211-F213 PolarHBondContact O-N 2.73Å; L211-N214 PolarHBondContact O-N 3.3Å; L211-C215 WeakPolarHBondContact O-CB 3.16Å; L211-C215 PolarHBondContact O-N 2.95Å; L211-C215 PolarHBondContact O-SG 3.44Å
212A95.3Very high94.7Very high55 Ų5530.5 Ų30.546%0.45516%0.161SC..Hα-helixtrans-60.2-42.5-176.300000112.5Y208 V209 C215 L216Y208-A212 VanDerWaalsContact O-CB 3.3Å; Y208-A212 WeakPolarHBondContact O-CB 3.36Å; Y208-A212 PolarHBondContact O-N 3.45Å; V209-A212 PolarHBondContact O-N 2.95Å; A212-C215 PolarHBondContact O-N 3.49Å; A212-L216 VanDerWaalsContact O-CB 3.31Å; A212-L216 WeakPolarHBondContact O-CB 3.42Å; A212-L216 PolarHBondContact O-N 3.28Å
213F93.7Very high94.5Very high75 Ų7532.5 Ų32.533%0.32917%0.171SC..Hα-helixtrans-67.8-38.7176.6-89.9-86.7000112.8V209 L211 L216 L217 L315V209-F213 HydrophobicContact CG1-CD2 3.83Å; V209-F213 HydrophobicContact CG1-CE2 3.96Å; V209-F213 WeakPolarHBondContact O-CD2 3.39Å; V209-F213 PolarHBondContact O-N 3.05Å; L211-F213 PolarHBondContact O-N 2.73Å; F213-L216 PolarHBondContact O-N 2.97Å; F213-L217 WeakPolarHBondContact O-CB 3.33Å; F213-L217 WeakPolarHBondContact O-CG 3.21Å; F213-L217 PolarHBondContact O-N 3.47Å; F213-L315 HydrophobicContact CD2-CD2 3.75Å; F213-L315 HydrophobicContact CE2-CD2 3.66Å; F213-L315 HydrophobicContact CG-CD2 4.3Å; F213-L315 HydrophobicContact CZ-CD2 4.15Å
214N95.7Very high94.1Very high0 Ų031.9 Ų31.90%017%0.169CC..Hα-helixtrans-62.7-46.8173.3-82.2-81.3000111.5H210 L211 L216 L217 Q218 A261 S262 C265H210-N214 PolarHBondContact CD2-ND2 3Å; H210-N214 PolarHBondContact NE2-ND2 3.19Å; H210-N214 VanDerWaalsContact NE2-ND2 3.16Å; H210-N214 PolarHBondContact O-N 3.49Å; H210-N214 PolarHBondContact O-ND2 3.05Å; L211-N214 PolarHBondContact O-N 3.3Å; N214-L216 VanDerWaalsContact C-N 3.34Å; N214-L216 PolarHBondContact O-N 3.02Å; N214-L217 PolarHBondContact O-N 3.47Å; N214-Q218 WeakPolarHBondContact O-CB 3.46Å; N214-Q218 VanDerWaalsContact O-CG 3.26Å; N214-Q218 WeakPolarHBondContact O-CG 3.26Å; N214-Q218 PolarHBondContact O-N 3.32Å; N214-A261 HydrophobicContact CB-CB 4.15Å; N214-S262 VanDerWaalsContact OD1-CA 3.29Å; N214-S262 WeakPolarHBondContact OD1-CA 3.2Å; N214-S262 PolarHBondContact OD1-N 3.49Å; N214-C265 PolarHBondContact OD1-SG 2.96Å
215C97.6Very high94Very high17 Ų1731.9 Ų31.912%0.11517%0.169CC..Hα-helixtrans-60.7-43.2176.2-66.50000111.6T149 L211 A212 Q218 V219T149-C215 HydrophobicContact CG2-CB 3.98Å; L211-C215 WeakPolarHBondContact O-CB 3.16Å; L211-C215 PolarHBondContact O-N 2.95Å; L211-C215 PolarHBondContact O-SG 3.44Å; A212-C215 PolarHBondContact O-N 3.49Å; C215-Q218 PolarHBondContact O-N 3.39Å; C215-V219 WeakPolarHBondContact O-CB 3.48Å; C215-V219 VanDerWaalsContact O-CG2 3.25Å; C215-V219 WeakPolarHBondContact O-CG2 3.23Å; C215-V219 PolarHBondContact O-N 3.13Å
216L96Very high93.9Very high82 Ų8231.9 Ų31.943%0.42917%0.169SC..Hα-helixtrans-60.7-49177.3178.866.1000111.3A212 F213 N214 V219 V220 L308A212-L216 VanDerWaalsContact O-CB 3.31Å; A212-L216 WeakPolarHBondContact O-CB 3.42Å; A212-L216 PolarHBondContact O-N 3.28Å; F213-L216 PolarHBondContact O-N 2.97Å; N214-L216 VanDerWaalsContact C-N 3.34Å; N214-L216 PolarHBondContact O-N 3.02Å; L216-V219 PolarHBondContact O-N 3.39Å; L216-V220 HydrophobicContact CD1-CG2 3.81Å; L216-V220 HydrophobicContact CG-CG2 4.45Å; L216-V220 WeakPolarHBondContact O-CB 3.46Å; L216-V220 VanDerWaalsContact O-CG2 3.29Å; L216-V220 WeakPolarHBondContact O-CG2 3.38Å; L216-V220 PolarHBondContact O-N 3.46Å; L216-L308 HydrophobicContact CD2-CD2 4.45Å
217L96.4Very high93.7Very high2 Ų232.4 Ų32.41%0.0117%0.172CC..Hα-helixtrans-59.9-47177.2-78.4168.5000111.6F213 N214 L221 C265 I269 L308 D312F213-L217 WeakPolarHBondContact O-CB 3.33Å; F213-L217 WeakPolarHBondContact O-CG 3.21Å; F213-L217 PolarHBondContact O-N 3.47Å; N214-L217 PolarHBondContact O-N 3.47Å; L217-L221 HydrophobicContact CD2-CD1 3.83Å; L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 PolarHBondContact O-N 2.91Å; L217-C265 HydrophobicContact CB-CB 4.05Å; L217-C265 HydrophobicContact CD1-CB 4.04Å; L217-I269 HydrophobicContact CD2-CD1 4.34Å; L217-L308 HydrophobicContact CD2-CB 3.55Å; L217-L308 HydrophobicContact CD2-CD1 4.44Å; L217-D312 HydrophobicContact CD1-CB 4.02Å
218Q97.3Very high93.3Very high0 Ų032.5 Ų32.50%017%0.172CC..Iπ-helixtrans-60.7-50.5177.5-74.1167.81600112I145 T149 E152 N214 C215 G222 Y238 A261I145-Q218 HydrophobicContact CG2-CB 4.36Å; I145-Q218 VanDerWaalsContact CG2-O 3.28Å; I145-Q218 WeakPolarHBondContact CG2-O 3.3Å; T149-Q218 PolarHBondContact OG1-OE1 3.06Å; E152-Q218 PolarHBondContact OE1-NE2 3.33Å; E152-Q218 PolarHBondContact OE2-NE2 3.11Å; E152-Q218 PolarHBondContact OE2-OE1 2.72Å; N214-Q218 WeakPolarHBondContact O-CB 3.46Å; N214-Q218 VanDerWaalsContact O-CG 3.26Å; N214-Q218 WeakPolarHBondContact O-CG 3.26Å; N214-Q218 PolarHBondContact O-N 3.32Å; C215-Q218 PolarHBondContact O-N 3.39Å; Q218-G222 WeakPolarHBondContact O-CA 3.29Å; Q218-G222 PolarHBondContact O-N 3.32Å; Q218-Y238 HydrophobicContact CG-CE2 4.08Å; Q218-Y238 PolarHBondContact NE2-OH 3.39Å; Q218-A261 VanDerWaalsContact NE2-CB 3.34Å
219V96Very high93Very high63 Ų6326.2 Ų26.238%0.38215%0.148SC..Iπ-helixtrans-66-47.3-176.61700000110.5T149 C215 L216 L223T149-V219 HydrophobicContact CG2-CG2 4.22Å; C215-V219 WeakPolarHBondContact O-CB 3.48Å; C215-V219 VanDerWaalsContact O-CG2 3.25Å; C215-V219 WeakPolarHBondContact O-CG2 3.23Å; C215-V219 PolarHBondContact O-N 3.13Å; L216-V219 PolarHBondContact O-N 3.39Å; V219-L223 HydrophobicContact CG1-CD1 3.77Å; V219-L223 WeakPolarHBondContact O-CB 3.43Å; V219-L223 WeakPolarHBondContact O-CD1 3.33Å; V219-L223 WeakPolarHBondContact O-CG 3.15Å; V219-L223 PolarHBondContact O-N 3.27Å
220V93.8Very high92.7Very high45 Ų4525.3 Ų25.327%0.27314%0.141SC..Iπ-helixtrans-70.5-52-177176.50000111.1L216 L224 L308L216-V220 HydrophobicContact CD1-CG2 3.81Å; L216-V220 HydrophobicContact CG-CG2 4.45Å; L216-V220 WeakPolarHBondContact O-CB 3.46Å; L216-V220 VanDerWaalsContact O-CG2 3.29Å; L216-V220 WeakPolarHBondContact O-CG2 3.38Å; L216-V220 PolarHBondContact O-N 3.46Å; V220-L224 VanDerWaalsContact O-CD1 3.31Å; V220-L224 WeakPolarHBondContact O-CD1 3.38Å; V220-L224 WeakPolarHBondContact O-CG 3.4Å; V220-L308 HydrophobicContact CB-CD1 4.16Å; V220-L308 HydrophobicContact CG1-CD1 3.75Å
221L95.2Very high92.7Very high2 Ų227 Ų271%0.0115%0.147CC..Iπ-helixtrans-83.2-42.3-174.5-60.4178000111.8L217 L225 L268 I269 H272 L304 L308L217-L221 HydrophobicContact CD2-CD1 3.83Å; L217-L221 WeakPolarHBondContact O-CB 3.4Å; L217-L221 PolarHBondContact O-N 2.91Å; L221-L225 PolarHBondContact O-N 2.88Å; L221-L268 HydrophobicContact CB-CB 4.35Å; L221-I269 HydrophobicContact CD1-CD1 4.35Å; L221-I269 HydrophobicContact CD1-CG1 3.45Å; L221-I269 VanDerWaalsContact CD1-CG1 3.45Å; L221-H272 WeakPolarHBondContact CA-NE2 3.47Å; L221-H272 WeakPolarHBondContact CB-NE2 3.22Å; L221-H272 PolarHBondContact O-NE2 3.24Å; L221-L304 HydrophobicContact CD2-CB 4.32Å; L221-L308 HydrophobicContact CD2-CD1 4.11Å; L221-L308 HydrophobicContact CG-CD1 4.16Å
222G95.6Very high92.6Very high0 Ų032 Ų320%017%0.165CC..Iπ-helixtrans-64.9-47.2-177.900000112.6Q218 L224 L225 E226Q218-G222 WeakPolarHBondContact O-CA 3.29Å; Q218-G222 PolarHBondContact O-N 3.32Å; G222-L224 VanDerWaalsContact C-N 3.32Å; G222-L224 PolarHBondContact O-N 2.82Å; G222-L225 PolarHBondContact O-N 3.46Å; G222-L225 VanDerWaalsContact O-N 3.11Å; G222-E226 VanDerWaalsContact O-CB 3.31Å; G222-E226 WeakPolarHBondContact O-CB 3.25Å; G222-E226 PolarHBondContact O-N 3.2Å
223L92.5Very high92.6Very high47 Ų4730.5 Ų30.525%0.24615%0.148CC..Hα-helixtrans-63-39.5179.5-65.9177.6000112P142 I145 P146 V219 L225 E226 I227P142-L223 HydrophobicContact CB-CD2 3.69Å; P142-L223 HydrophobicContact CG-CD2 4.1Å; I145-L223 HydrophobicContact CB-CD2 4.05Å; I145-L223 HydrophobicContact CG2-CD2 3.99Å; I145-L223 HydrophobicContact CG2-CG 4.07Å; P146-L223 HydrophobicContact CG-CD2 3.98Å; V219-L223 HydrophobicContact CG1-CD1 3.77Å; V219-L223 WeakPolarHBondContact O-CB 3.43Å; V219-L223 WeakPolarHBondContact O-CD1 3.33Å; V219-L223 WeakPolarHBondContact O-CG 3.15Å; V219-L223 PolarHBondContact O-N 3.27Å; L223-L225 VanDerWaalsContact C-N 3.26Å; L223-L225 PolarHBondContact O-N 3.42Å; L223-E226 PolarHBondContact O-N 3.47Å; L223-E226 VanDerWaalsContact O-N 3.14Å; L223-I227 WeakPolarHBondContact O-CD1 3.22Å; L223-I227 VanDerWaalsContact O-CG1 3.23Å; L223-I227 WeakPolarHBondContact O-CG1 3.31Å; L223-I227 PolarHBondContact O-N 3.39Å
224L90.6Very high92.7Very high25 Ų2527 Ų2713%0.13113%0.133CC..Hα-helixtrans-63-30.8175.9-72.8177.3000113V220 G222 I295 R301 L304V220-L224 VanDerWaalsContact O-CD1 3.31Å; V220-L224 WeakPolarHBondContact O-CD1 3.38Å; V220-L224 WeakPolarHBondContact O-CG 3.4Å; G222-L224 VanDerWaalsContact C-N 3.32Å; G222-L224 PolarHBondContact O-N 2.82Å; L224-I295 HydrophobicContact CD1-CG2 4.46Å; L224-I295 HydrophobicContact CD2-CG2 3.88Å; L224-R301 PolarHBondContact O-NH2 3.43Å; L224-R301 VanDerWaalsContact O-NH2 3.1Å; L224-L304 HydrophobicContact CD1-CD1 4Å
225L91.9Very high92.8Very high1 Ų127.2 Ų27.21%0.00514%0.135CC..Hα-helixtrans-78.3-39.9171.1-73169.2000111.2L221 G222 L223 V228 H229 V234 L268 A271 H272 L350L221-L225 PolarHBondContact O-N 2.88Å; G222-L225 PolarHBondContact O-N 3.46Å; G222-L225 VanDerWaalsContact O-N 3.11Å; L223-L225 VanDerWaalsContact C-N 3.26Å; L223-L225 PolarHBondContact O-N 3.42Å; L225-V228 CarbonylContact O-C 3.56Å; L225-V228 PolarHBondContact O-N 3.28Å; L225-H229 PolarHBondContact O-CD2 2.88Å; L225-H229 VanDerWaalsContact O-CD2 3.26Å; L225-H229 PolarHBondContact O-N 3Å; L225-V234 HydrophobicContact CB-CG1 4.37Å; L225-V234 HydrophobicContact CB-CG2 3.73Å; L225-L268 HydrophobicContact CD1-CB 4.28Å; L225-L268 HydrophobicContact CD1-CD2 3.96Å; L225-A271 HydrophobicContact CD1-CB 4.05Å; L225-H272 WeakPolarHBondContact CG-NE2 3.31Å; L225-L350 HydrophobicContact CD2-CD1 4.01Å
226E91.4Very high92.8Very high3 Ų330.1 Ų30.11%0.01415%0.149CC..Hα-helixtrans-70.7-39-171.2-176.8164.8-169.300112.9P142 I143 F144 I145 G222 L223 V228 K230 F231 V234P142-E226 VanDerWaalsContact CA-CD 3.42Å; P142-E226 VanDerWaalsContact CA-OE1 3.31Å; P142-E226 WeakPolarHBondContact CA-OE1 3.4Å; P142-E226 HydrophobicContact CB-CB 4.31Å; P142-E226 HydrophobicContact CB-CG 3.77Å; I143-E226 PolarHBondContact N-OE1 2.74Å; F144-E226 PolarHBondContact N-OE1 3.06Å; I145-E226 WeakPolarHBondContact CB-OE2 3.14Å; I145-E226 WeakPolarHBondContact CG1-OE2 3.27Å; I145-E226 PolarHBondContact N-OE2 3.28Å; G222-E226 VanDerWaalsContact O-CB 3.31Å; G222-E226 WeakPolarHBondContact O-CB 3.25Å; G222-E226 PolarHBondContact O-N 3.2Å; L223-E226 PolarHBondContact O-N 3.47Å; L223-E226 VanDerWaalsContact O-N 3.14Å; E226-V228 PolarHBondContact O-N 2.94Å; E226-K230 WeakPolarHBondContact O-CA 3.43Å; E226-K230 PolarHBondContact O-N 2.91Å; E226-F231 HydrophobicContact CG-CB 4.17Å; E226-F231 WeakPolarHBondContact OE1-CA 3.15Å; E226-F231 WeakPolarHBondContact OE1-CB 3.18Å; E226-V234 HydrophobicContact CB-CB 4.5Å; E226-V234 HydrophobicContact CB-CG2 4.2Å
227I86.5Confident92.9Very high36 Ų3626.3 Ų26.319%0.18513%0.129CC..Hα-helixtrans-63-27176.2-61.3160.8000111Y136 D137 P142 L223Y136-I227 HydrophobicContact CD1-CB 3.94Å; Y136-I227 HydrophobicContact CD1-CG2 3.28Å; Y136-I227 HydrophobicContact CE1-CB 4.24Å; Y136-I227 HydrophobicContact CE1-CG2 4.07Å; Y136-I227 HydrophobicContact CG-CG2 3.86Å; D137-I227 PolarHBondContact N-O 2.87Å; P142-I227 HydrophobicContact CG-CG1 4.44Å; L223-I227 WeakPolarHBondContact O-CD1 3.22Å; L223-I227 VanDerWaalsContact O-CG1 3.23Å; L223-I227 WeakPolarHBondContact O-CG1 3.31Å; L223-I227 PolarHBondContact O-N 3.39Å
228V81.9Confident93Very high1 Ų126.2 Ų26.21%0.00613%0.128CC..Hα-helixtrans-92.2-62.2176.3-171.50000110.8Y132 A135 Y136 L225 E226 K230 R351Y132-V228 HydrophobicContact CE1-CB 4.39Å; Y132-V228 HydrophobicContact CE1-CG1 4Å; Y132-V228 HydrophobicContact CE1-CG2 3.8Å; Y132-V228 HydrophobicContact CE2-CG1 4.3Å; Y132-V228 WeakPolarHBondContact OH-CG1 3.2Å; A135-V228 HydrophobicContact CB-CG1 3.94Å; Y136-V228 HydrophobicContact CD1-CG2 4.17Å; Y136-V228 HydrophobicContact CD2-CG2 3.32Å; Y136-V228 HydrophobicContact CE1-CG2 3.93Å; Y136-V228 HydrophobicContact CE2-CG2 3.08Å; Y136-V228 HydrophobicContact CG-CG2 3.87Å; L225-V228 CarbonylContact O-C 3.56Å; L225-V228 PolarHBondContact O-N 3.28Å; E226-V228 PolarHBondContact O-N 2.94Å; V228-K230 VanDerWaalsContact C-N 3.32Å; V228-K230 PolarHBondContact O-N 2.9Å; V228-R351 PolarHBondContact O-NE 3.46Å; V228-R351 PolarHBondContact O-NH2 2.92Å
229H85.7Confident93.1Very high1 Ų128.9 Ų28.91%0.00514%0.142CC..Hα-helixtrans-86.30.1-169.4-52.4-69.2000114.6Y132 L225 R233 V234 T275 L350 R351Y132-H229 PolarHBondContact OH-CE1 3.35Å; Y132-H229 VanDerWaalsContact OH-CE1 3.23Å; Y132-H229 PolarHBondContact OH-NE2 3.43Å; L225-H229 PolarHBondContact O-CD2 2.88Å; L225-H229 VanDerWaalsContact O-CD2 3.26Å; L225-H229 PolarHBondContact O-N 3Å; H229-R233 HydrophobicContact CB-CB 4.3Å; H229-R233 WeakPolarHBondContact O-CB 3.4Å; H229-R233 WeakPolarHBondContact O-CD 3.31Å; H229-R233 WeakPolarHBondContact O-CG 3.02Å; H229-V234 HydrophobicContact CB-CG2 4.2Å; H229-T275 PolarHBondContact NE2-OG1 3.49Å; H229-L350 HydrophobicContact CB-CB 4.48Å; H229-L350 HydrophobicContact CB-CD2 3.75Å; H229-R351 HydrophobicContact CB-CG 4.39Å; H229-R351 PolarHBondContact ND1-N 3.4Å; H229-R351 VanDerWaalsContact ND1-N 3.15Å
230K86.3Confident93.2Very high25 Ų2528.3 Ų28.311%0.10914%0.137CC..  trans71.9154.3-176.1-41.5-57.3-172.9171.30113D137 R139 E226 V228 W232 R233 V234D137-K230 PolarHBondContact O-NZ 3.35Å; D137-K230 VanDerWaalsContact O-NZ 3.15Å; D137-K230 IonicContact OD2-NZ 2.7Å; D137-K230 PolarHBondContact OD2-NZ 3.5Å; R139-K230 PolarHBondContact O-NZ 3.35Å; E226-K230 WeakPolarHBondContact O-CA 3.43Å; E226-K230 PolarHBondContact O-N 2.91Å; V228-K230 VanDerWaalsContact C-N 3.32Å; V228-K230 PolarHBondContact O-N 2.9Å; K230-W232 VanDerWaalsContact C-N 3.35Å; K230-W232 PolarHBondContact O-N 3.4Å; K230-R233 PolarHBondContact O-N 3.43Å; K230-V234 PolarHBondContact O-N 2.93Å
231F91.8Very high93.4Very high72 Ų7226.2 Ų26.232%0.31612%0.124SC..Hα-helixtrans-56.1-41.4-171.675.2-91.5000114.5P140 I143 F144 E226 G235P140-F231 HydrophobicContact CB-CD1 4.33Å; P140-F231 HydrophobicContact CB-CE1 4.39Å; P140-F231 HydrophobicContact CG-CD1 3.71Å; P140-F231 HydrophobicContact CG-CE1 3.84Å; I143-F231 HydrophobicContact CB-CB 4.18Å; I143-F231 HydrophobicContact CB-CG 4.3Å; I143-F231 HydrophobicContact CD1-CD1 4.11Å; I143-F231 HydrophobicContact CD1-CE1 4.32Å; I143-F231 HydrophobicContact CD1-CG 4.49Å; F144-F231 HydrophobicContact CB-CB 4.01Å; E226-F231 HydrophobicContact CG-CB 4.17Å; E226-F231 WeakPolarHBondContact OE1-CA 3.15Å; E226-F231 WeakPolarHBondContact OE1-CB 3.18Å; F231-G235 PolarHBondContact O-N 2.92Å
232W93.3Very high93.6Very high120 Ų12026.1 Ų26.146%0.45512%0.124SC..Hα-helixtrans-73.6-34.3-173.364.6-92.4000112.7K230 L236K230-W232 VanDerWaalsContact C-N 3.35Å; K230-W232 PolarHBondContact O-N 3.4Å; W232-L236 HydrophobicContact CE3-CD1 3.99Å; W232-L236 HydrophobicContact CZ3-CD1 4.27Å; W232-L236 WeakPolarHBondContact O-CB 3.39Å; W232-L236 VanDerWaalsContact O-CG 3.28Å; W232-L236 WeakPolarHBondContact O-CG 3.41Å; W232-L236 PolarHBondContact O-N 2.77Å
233R94.8Very high93.7Very high24 Ų2429 Ų299%0.09114%0.138CC..Hα-helixtrans-68.5-46.6175.7-67.6-175.1-177.5-108.96.7110.5H229 K230 G235 L236 V237 I349 L350H229-R233 HydrophobicContact CB-CB 4.3Å; H229-R233 WeakPolarHBondContact O-CB 3.4Å; H229-R233 WeakPolarHBondContact O-CD 3.31Å; H229-R233 WeakPolarHBondContact O-CG 3.02Å; K230-R233 PolarHBondContact O-N 3.43Å; R233-G235 VanDerWaalsContact C-N 3.35Å; R233-L236 PolarHBondContact O-N 2.9Å; R233-V237 WeakPolarHBondContact O-CG2 3.22Å; R233-V237 PolarHBondContact O-N 2.98Å; R233-V237 VanDerWaalsContact O-N 3.11Å; R233-I349 HydrophobicContact CB-CG2 3.96Å; R233-I349 WeakPolarHBondContact CD-O 3.47Å; R233-I349 HydrophobicContact CG-CG2 4.25Å; R233-I349 PolarHBondContact NH1-O 2.98Å; R233-L350 HydrophobicContact CB-CD2 4.13Å
234V96.5Very high94Very high1 Ų126.8 Ų26.81%0.00613%0.127CC..Hα-helixtrans-64.5-41.8177179.20000111.1I145 L225 E226 H229 K230 L236 V237 Y238 L268 L350I145-V234 HydrophobicContact CD1-CG1 4.12Å; I145-V234 HydrophobicContact CG1-CG1 4.21Å; L225-V234 HydrophobicContact CB-CG1 4.37Å; L225-V234 HydrophobicContact CB-CG2 3.73Å; E226-V234 HydrophobicContact CB-CB 4.5Å; E226-V234 HydrophobicContact CB-CG2 4.2Å; H229-V234 HydrophobicContact CB-CG2 4.2Å; K230-V234 PolarHBondContact O-N 2.93Å; V234-L236 PolarHBondContact O-N 3.14Å; V234-V237 PolarHBondContact O-N 2.94Å; V234-Y238 WeakPolarHBondContact O-CB 3.22Å; V234-Y238 PolarHBondContact O-N 3.12Å; V234-L268 HydrophobicContact CG1-CD2 3.75Å; V234-L350 HydrophobicContact CG2-CD2 4.46Å
235G97.7Very high94.3Very high4 Ų425.6 Ų25.64%0.04112%0.121CC..Hα-helixtrans-60.6-42.8175.900000113.3F231 R233 Y238 L239F231-G235 PolarHBondContact O-N 2.92Å; R233-G235 VanDerWaalsContact C-N 3.35Å; G235-Y238 PolarHBondContact O-N 2.68Å; G235-L239 WeakPolarHBondContact O-CB 3.49Å; G235-L239 VanDerWaalsContact O-CG 3.22Å; G235-L239 WeakPolarHBondContact O-CG 3.38Å; G235-L239 PolarHBondContact O-N 2.97Å
236L98.1Very high94.6Very high79 Ų7925.5 Ų25.541%0.41412%0.12SC..Hα-helixtrans-61.6-47.6174.8-75.6171.9000112W232 R233 V234 Y238 L239 L240 I349W232-L236 HydrophobicContact CE3-CD1 3.99Å; W232-L236 HydrophobicContact CZ3-CD1 4.27Å; W232-L236 WeakPolarHBondContact O-CB 3.39Å; W232-L236 VanDerWaalsContact O-CG 3.28Å; W232-L236 WeakPolarHBondContact O-CG 3.41Å; W232-L236 PolarHBondContact O-N 2.77Å; R233-L236 PolarHBondContact O-N 2.9Å; V234-L236 PolarHBondContact O-N 3.14Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.35Å; L236-L239 PolarHBondContact O-N 2.93Å; L236-L240 VanDerWaalsContact O-CB 3.24Å; L236-L240 WeakPolarHBondContact O-CB 3.21Å; L236-L240 VanDerWaalsContact O-CG 3.24Å; L236-L240 WeakPolarHBondContact O-CG 3.46Å; L236-L240 PolarHBondContact O-N 3.4Å; L236-I349 HydrophobicContact CB-CD1 4.09Å; L236-I349 HydrophobicContact CB-CG2 4.28Å; L236-I349 HydrophobicContact CD1-CG2 4.4Å
237V98.5Very high94.8Very high1 Ų126 Ų261%0.00612%0.123CC..Hα-helixtrans-60.5-43.5177.9172.40000111.1R233 V234 G241 A267 A271 L345 I349 L350R233-V237 WeakPolarHBondContact O-CG2 3.22Å; R233-V237 PolarHBondContact O-N 2.98Å; R233-V237 VanDerWaalsContact O-N 3.11Å; V234-V237 PolarHBondContact O-N 2.94Å; V237-G241 WeakPolarHBondContact O-CA 3.43Å; V237-G241 PolarHBondContact O-N 3.34Å; V237-A267 HydrophobicContact CG1-CB 4.47Å; V237-A271 HydrophobicContact CG1-CB 3.77Å; V237-L345 HydrophobicContact CG2-CB 4.24Å; V237-I349 HydrophobicContact CG2-CB 3.89Å; V237-I349 HydrophobicContact CG2-CD1 4.12Å; V237-I349 HydrophobicContact CG2-CG1 4.5Å; V237-I349 HydrophobicContact CG2-CG2 4.04Å; V237-L350 HydrophobicContact CG2-CD2 4.05Å; V237-L350 HydrophobicContact CG2-CG 4.39Å
238Y98.7Very high95.3Very high0 Ų025 Ų250%012%0.12CC..Hα-helixtrans-62.9-52.8178.9-177-89.5000112.2F144 I148 E152 M202 Q218 V234 G235 L236 G241 V242 A261 G264 L268F144-Y238 AromaticContact CE1-CD1 3.76Å; F144-Y238 HydrophobicContact CE1-CD1 3.76Å; F144-Y238 AromaticContact CE1-CG 3.74Å; F144-Y238 HydrophobicContact CE1-CG 3.74Å; F144-Y238 AromaticContact CZ-CD1 3.64Å; F144-Y238 HydrophobicContact CZ-CD1 3.64Å; F144-Y238 HydrophobicContact CZ-CE1 4.39Å; F144-Y238 HydrophobicContact CZ-CG 4.06Å; I148-Y238 HydrophobicContact CG1-CE1 3.87Å; E152-Y238 PolarHBondContact OE1-OH 3.36Å; M202-Y238 HydrophobicContact SD-CE1 4.04Å; Q218-Y238 HydrophobicContact CG-CE2 4.08Å; Q218-Y238 PolarHBondContact NE2-OH 3.39Å; V234-Y238 WeakPolarHBondContact O-CB 3.22Å; V234-Y238 PolarHBondContact O-N 3.12Å; G235-Y238 PolarHBondContact O-N 2.68Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.35Å; Y238-G241 WeakPolarHBondContact O-CA 3.48Å; Y238-G241 PolarHBondContact O-N 3.48Å; Y238-G241 VanDerWaalsContact O-N 3.16Å; Y238-V242 HydrophobicContact CD1-CG2 4.23Å; Y238-V242 HydrophobicContact CE1-CG2 3.95Å; Y238-V242 WeakPolarHBondContact O-CG2 3.45Å; Y238-V242 PolarHBondContact O-N 3.16Å; Y238-A261 WeakPolarHBondContact OH-CB 3.38Å; Y238-G264 VanDerWaalsContact CE2-C 3.48Å; Y238-G264 VanDerWaalsContact CE2-CA 3.49Å; Y238-L268 HydrophobicContact CD2-CD1 3.95Å; Y238-L268 HydrophobicContact CD2-CD2 4.33Å; Y238-L268 HydrophobicContact CD2-CG 4.02Å; Y238-L268 HydrophobicContact CE2-CD1 4.3Å
239L98.6Very high95.9Very high56 Ų5625 Ų2529%0.29312%0.12SC..Hα-helixtrans-67.6-41-176-65.3171000111.9F144 L199 M202 G235 L236 G241 V242 I243F144-L239 HydrophobicContact CE2-CD1 4.16Å; F144-L239 HydrophobicContact CE2-CD2 4.49Å; F144-L239 HydrophobicContact CE2-CG 4.23Å; F144-L239 HydrophobicContact CZ-CD1 4.45Å; F144-L239 HydrophobicContact CZ-CD2 4.22Å; F144-L239 HydrophobicContact CZ-CG 4.03Å; L199-L239 HydrophobicContact CD1-CD2 4.02Å; M202-L239 HydrophobicContact CE-CD2 4.03Å; M202-L239 HydrophobicContact SD-CD2 4.29Å; G235-L239 WeakPolarHBondContact O-CB 3.49Å; G235-L239 VanDerWaalsContact O-CG 3.22Å; G235-L239 WeakPolarHBondContact O-CG 3.38Å; G235-L239 PolarHBondContact O-N 2.97Å; L236-L239 PolarHBondContact O-N 2.93Å; L239-G241 VanDerWaalsContact C-N 3.27Å; L239-G241 PolarHBondContact O-N 2.74Å; L239-V242 PolarHBondContact O-N 2.76Å; L239-I243 WeakPolarHBondContact O-CG1 3.23Å; L239-I243 PolarHBondContact O-N 3.06Å
240L98.4Very high96.2Very high52 Ų5225 Ų2527%0.27212%0.12SC..Hα-helixtrans-66.9-32.8173.3-68.8173.4000111.6L236 I243 A244 L345 I349 F370L236-L240 VanDerWaalsContact O-CB 3.24Å; L236-L240 WeakPolarHBondContact O-CB 3.21Å; L236-L240 VanDerWaalsContact O-CG 3.24Å; L236-L240 WeakPolarHBondContact O-CG 3.46Å; L236-L240 PolarHBondContact O-N 3.4Å; L240-I243 PolarHBondContact O-N 3.49Å; L240-A244 VanDerWaalsContact O-CB 3.26Å; L240-A244 WeakPolarHBondContact O-CB 3.27Å; L240-A244 PolarHBondContact O-N 2.9Å; L240-L345 HydrophobicContact CB-CD1 3.41Å; L240-L345 VanDerWaalsContact CB-CD1 3.41Å; L240-L345 HydrophobicContact CD1-CD1 3.75Å; L240-L345 HydrophobicContact CD1-CD2 4.29Å; L240-L345 HydrophobicContact CG-CD1 4.24Å; L240-I349 HydrophobicContact CD1-CD1 3.98Å; L240-F370 HydrophobicContact CB-CZ 4.34Å
241G98.5Very high96.5Very high0 Ų026.6 Ų26.60%013%0.132CC..Hα-helixtrans-61.6-44.9171.500000113.4V237 Y238 L239 A244 G245 G263V237-G241 WeakPolarHBondContact O-CA 3.43Å; V237-G241 PolarHBondContact O-N 3.34Å; Y238-G241 WeakPolarHBondContact O-CA 3.48Å; Y238-G241 PolarHBondContact O-N 3.48Å; Y238-G241 VanDerWaalsContact O-N 3.16Å; L239-G241 VanDerWaalsContact C-N 3.27Å; L239-G241 PolarHBondContact O-N 2.74Å; G241-A244 PolarHBondContact O-N 3.3Å; G241-G245 PolarHBondContact O-N 2.91Å; G241-G263 CarbonylContact C-O 3.46Å
242V98.5Very high96.5Very high0 Ų026.1 Ų26.10%014%0.137CC..Hα-helixtrans-59.1-48.3172.9170.60000110.5L199 Y201 M202 Y238 L239 A244 G245 S246L199-V242 HydrophobicContact CD1-CB 4.37Å; L199-V242 HydrophobicContact CD1-CG1 3.99Å; L199-V242 WeakPolarHBondContact O-CG1 3.35Å; Y201-V242 HydrophobicContact CD1-CG1 4.14Å; Y201-V242 HydrophobicContact CE1-CB 4.49Å; Y201-V242 HydrophobicContact CE1-CG1 3.32Å; Y201-V242 WeakPolarHBondContact CE1-O 3.38Å; Y201-V242 PolarHBondContact OH-O 2.88Å; M202-V242 HydrophobicContact CB-CG1 4.03Å; M202-V242 HydrophobicContact CB-CG2 4.21Å; M202-V242 HydrophobicContact CG-CG1 4.44Å; M202-V242 HydrophobicContact SD-CB 4.48Å; M202-V242 HydrophobicContact SD-CG1 4.05Å; M202-V242 HydrophobicContact SD-CG2 3.97Å; Y238-V242 HydrophobicContact CD1-CG2 4.23Å; Y238-V242 HydrophobicContact CE1-CG2 3.95Å; Y238-V242 WeakPolarHBondContact O-CG2 3.45Å; Y238-V242 PolarHBondContact O-N 3.16Å; L239-V242 PolarHBondContact O-N 2.76Å; V242-A244 PolarHBondContact O-N 2.81Å; V242-G245 PolarHBondContact O-N 2.94Å; V242-S246 PolarHBondContact O-N 2.94Å; V242-S246 PolarHBondContact O-OG 3.44Å
243I98.3Very high96.2Very high60 Ų6022.2 Ų22.231%0.30813%0.126SC..Hα-helixtrans-62.8-43.7177.8-66.3165.7000111.2L199 L239 L240 G245 S246 L247L199-I243 HydrophobicContact CB-CG1 4.45Å; L199-I243 HydrophobicContact CD1-CD1 4.36Å; L199-I243 HydrophobicContact CD1-CG1 4.08Å; L239-I243 WeakPolarHBondContact O-CG1 3.23Å; L239-I243 PolarHBondContact O-N 3.06Å; L240-I243 PolarHBondContact O-N 3.49Å; I243-G245 VanDerWaalsContact C-N 3.34Å; I243-G245 PolarHBondContact O-N 3.16Å; I243-S246 PolarHBondContact O-N 3.43Å; I243-S246 PolarHBondContact O-OG 3.12Å; I243-L247 HydrophobicContact CG2-CD1 3.89Å; I243-L247 HydrophobicContact CG2-CG 4.31Å; I243-L247 VanDerWaalsContact O-CB 3.32Å; I243-L247 WeakPolarHBondContact O-CB 3.26Å; I243-L247 VanDerWaalsContact O-CG 3.23Å; I243-L247 WeakPolarHBondContact O-CG 3.32Å; I243-L247 PolarHBondContact O-N 3.2Å
244A98.3Very high95.8Very high1 Ų121.9 Ų21.91%0.00813%0.127CC..Hα-helixtrans-65.7-37.8178.300000112.3L240 G241 V242 L247 A248 A341 F370 F373L240-A244 VanDerWaalsContact O-CB 3.26Å; L240-A244 WeakPolarHBondContact O-CB 3.27Å; L240-A244 PolarHBondContact O-N 2.9Å; G241-A244 PolarHBondContact O-N 3.3Å; V242-A244 PolarHBondContact O-N 2.81Å; A244-L247 PolarHBondContact O-N 3.46Å; A244-A248 WeakPolarHBondContact O-CB 3.32Å; A244-A248 PolarHBondContact O-N 3.35Å; A244-A341 HydrophobicContact CB-CB 3.36Å; A244-F370 HydrophobicContact CB-CE2 4.28Å; A244-F373 HydrophobicContact CB-CE1 3.77Å; A244-F373 HydrophobicContact CB-CZ 4.47Å; A244-F373 WeakPolarHBondContact O-CZ 3.42Å
245G97.4Very high95.2Very high0 Ų026.1 Ų26.10%015%0.145CC..Hα-helixtrans-61.3-49.6174.400000111.9G241 V242 I243 L247 A248 H249 A334G241-G245 PolarHBondContact O-N 2.91Å; V242-G245 PolarHBondContact O-N 2.94Å; I243-G245 VanDerWaalsContact C-N 3.34Å; I243-G245 PolarHBondContact O-N 3.16Å; G245-L247 PolarHBondContact O-N 2.91Å; G245-A248 PolarHBondContact O-N 3.4Å; G245-H249 WeakPolarHBondContact O-CB 3.16Å; G245-H249 PolarHBondContact O-N 3.43Å; G245-A334 WeakPolarHBondContact CA-O 3.37Å; G245-A334 WeakPolarHBondContact O-CA 3.42Å
246S96.8Very high94.7Very high0 Ų027.1 Ų27.10%015%0.15CC..Hα-helixtrans-66-36.9176.759.40000112.9F198 Y201 V242 I243 H249 S250F198-S246 WeakPolarHBondContact CA-OG 2.82Å; F198-S246 WeakPolarHBondContact CB-OG 3.19Å; F198-S246 WeakPolarHBondContact CD1-OG 3.28Å; F198-S246 WeakPolarHBondContact O-CB 3.23Å; F198-S246 PolarHBondContact O-OG 3.26Å; Y201-S246 VanDerWaalsContact CE1-CB 3.46Å; V242-S246 PolarHBondContact O-N 2.94Å; V242-S246 PolarHBondContact O-OG 3.44Å; I243-S246 PolarHBondContact O-N 3.43Å; I243-S246 PolarHBondContact O-OG 3.12Å; S246-H249 PolarHBondContact O-N 3.36Å; S246-S250 VanDerWaalsContact O-CB 3.25Å; S246-S250 WeakPolarHBondContact O-CB 3.36Å; S246-S250 PolarHBondContact O-N 3.2Å; S246-S250 PolarHBondContact O-OG 2.89Å
247L96.9Very high94.3Very high12 Ų1224.6 Ų24.66%0.06314%0.137CC..Hα-helixtrans-62.4-48173.4-76.8176.2000111.5F198 I243 A244 G245 H249 S250 V251 F373 A377 I378F198-L247 HydrophobicContact CD1-CD2 4.01Å; F198-L247 HydrophobicContact CD1-CG 4.37Å; F198-L247 HydrophobicContact CE1-CD2 3.94Å; I243-L247 HydrophobicContact CG2-CD1 3.89Å; I243-L247 HydrophobicContact CG2-CG 4.31Å; I243-L247 VanDerWaalsContact O-CB 3.32Å; I243-L247 WeakPolarHBondContact O-CB 3.26Å; I243-L247 VanDerWaalsContact O-CG 3.23Å; I243-L247 WeakPolarHBondContact O-CG 3.32Å; I243-L247 PolarHBondContact O-N 3.2Å; A244-L247 PolarHBondContact O-N 3.46Å; G245-L247 PolarHBondContact O-N 2.91Å; L247-H249 VanDerWaalsContact C-N 3.32Å; L247-H249 PolarHBondContact O-N 3.4Å; L247-S250 PolarHBondContact O-N 3.46Å; L247-S250 PolarHBondContact O-OG 3.31Å; L247-V251 WeakPolarHBondContact O-CG2 3.33Å; L247-V251 PolarHBondContact O-N 3.48Å; L247-F373 HydrophobicContact CB-CE1 4.41Å; L247-F373 HydrophobicContact CB-CZ 4.14Å; L247-A377 HydrophobicContact CB-CB 3.8Å; L247-A377 HydrophobicContact CD1-CB 4.35Å; L247-A377 HydrophobicContact CD2-CB 4.04Å; L247-A377 HydrophobicContact CG-CB 4.29Å; L247-I378 HydrophobicContact CD1-CG1 4.4Å; L247-I378 HydrophobicContact CD2-CG1 4.23Å
248A96.4Very high94Very high16 Ų1624.8 Ų24.813%0.13214%0.138CC..Hα-helixtrans-59.8-44.4175.900000111.5A244 G245 V251 S252 S333 F373A244-A248 WeakPolarHBondContact O-CB 3.32Å; A244-A248 PolarHBondContact O-N 3.35Å; G245-A248 PolarHBondContact O-N 3.4Å; A248-V251 PolarHBondContact O-N 2.87Å; A248-S252 PolarHBondContact O-N 2.95Å; A248-S252 PolarHBondContact O-OG 2.82Å; A248-S333 WeakPolarHBondContact CB-O 3.42Å; A248-F373 HydrophobicContact CB-CE2 4.23Å; A248-F373 HydrophobicContact CB-CZ 4.01Å
249H93.9Very high93.8Very high1 Ų125.8 Ų25.81%0.00515%0.146CC..Hα-helixtrans-62.8-43.7177.2-179.775.4000113.1Y187 G245 S246 L247 V251 S252 D253 V256 L258 S333 A334Y187-H249 AromaticContact CE1-CD2 3.97Å; G245-H249 WeakPolarHBondContact O-CB 3.16Å; G245-H249 PolarHBondContact O-N 3.43Å; S246-H249 PolarHBondContact O-N 3.36Å; L247-H249 VanDerWaalsContact C-N 3.32Å; L247-H249 PolarHBondContact O-N 3.4Å; H249-V251 PolarHBondContact O-N 3.22Å; H249-V251 VanDerWaalsContact O-N 3.14Å; H249-S252 PolarHBondContact O-N 3.5Å; H249-D253 IonicContact ND1-OD2 3.22Å; H249-D253 CarbonylContact O-C 3.44Å; H249-D253 PolarHBondContact O-N 3.1Å; H249-V256 PolarHBondContact NE2-O 2.88Å; H249-L258 HydrophobicContact CB-CD2 4Å; H249-S333 VanDerWaalsContact CA-OG 3.32Å; H249-S333 WeakPolarHBondContact CA-OG 3.29Å; H249-S333 PolarHBondContact ND1-OG 3.15Å; H249-A334 HydrophobicContact CB-CB 4.19Å
250S93Very high93.6Very high0 Ų023.1 Ų23.10%013%0.132CC..Hα-helixtrans-60.9-24.9-179.971.70000113.8Y187 R192 S246 L247 P254 F380 N381Y187-S250 WeakPolarHBondContact OH-CB 3.27Å; R192-S250 PolarHBondContact NH2-O 3.35Å; R192-S250 VanDerWaalsContact NH2-O 3.13Å; S246-S250 VanDerWaalsContact O-CB 3.25Å; S246-S250 WeakPolarHBondContact O-CB 3.36Å; S246-S250 PolarHBondContact O-N 3.2Å; S246-S250 PolarHBondContact O-OG 2.89Å; L247-S250 PolarHBondContact O-N 3.46Å; L247-S250 PolarHBondContact O-OG 3.31Å; S250-P254 WeakPolarHBondContact O-CA 3.44Å; S250-P254 WeakPolarHBondContact O-CB 3.36Å; S250-F380 WeakPolarHBondContact O-CE1 3.19Å; S250-N381 WeakPolarHBondContact CB-OD1 3.27Å; S250-N381 PolarHBondContact OG-ND2 3.46Å; S250-N381 PolarHBondContact OG-OD1 3.32Å
251V92.8Very high93.5Very high60 Ų6020.6 Ų20.636%0.36412%0.119SC..Hα-helixtrans-89-44.5177.8177.10000111.2L247 A248 H249 A377 F380L247-V251 WeakPolarHBondContact O-CG2 3.33Å; L247-V251 PolarHBondContact O-N 3.48Å; A248-V251 PolarHBondContact O-N 2.87Å; H249-V251 PolarHBondContact O-N 3.22Å; H249-V251 VanDerWaalsContact O-N 3.14Å; V251-A377 HydrophobicContact CG2-CB 4.15Å; V251-F380 HydrophobicContact CB-CD1 4.26Å; V251-F380 HydrophobicContact CB-CE1 4.38Å; V251-F380 HydrophobicContact CG2-CB 4.14Å; V251-F380 HydrophobicContact CG2-CD1 3.61Å; V251-F380 HydrophobicContact CG2-CE1 4.2Å; V251-F380 HydrophobicContact CG2-CG 3.92Å
252S90.6Very high93.3Very high61 Ų6120.8 Ų20.843%0.42712%0.12SC..Hα-helixtrans-80.2-39.8-174.374.70000113.8A248 H249 P254 S333A248-S252 PolarHBondContact O-N 2.95Å; A248-S252 PolarHBondContact O-OG 2.82Å; H249-S252 PolarHBondContact O-N 3.5Å; S252-P254 VanDerWaalsContact C-CD 3.42Å; S252-P254 WeakPolarHBondContact O-CD 3.46Å; S252-S333 WeakPolarHBondContact OG-CB 3.48Å; S252-S333 PolarHBondContact OG-OG 2.97Å
253D86.6Confident93.3Very high39 Ų3920.8 Ų20.821%0.20912%0.12CC..SBendtrans-125.765.6-177.5-67.4-67.6000108.8H249 F255 V256 S333H249-D253 IonicContact ND1-OD2 3.22Å; H249-D253 CarbonylContact O-C 3.44Å; H249-D253 PolarHBondContact O-N 3.1Å; D253-F255 PolarHBondContact O-N 3.36Å; D253-V256 HydrophobicContact CB-CB 4.19Å; D253-V256 HydrophobicContact CB-CG2 4.16Å; D253-V256 PolarHBondContact O-N 3.07Å; D253-S333 PolarHBondContact OD2-OG 3.11Å
254P86.2Confident93.2Very high17 Ų1717.9 Ų17.911%0.1111%0.105CC..THydrogen-bonded Turntrans-69.35.7-166.728.3-36000115P189 R192 S250 S252P189-P254 VanDerWaalsContact CB-O 3.29Å; P189-P254 WeakPolarHBondContact CB-O 3.07Å; R192-P254 PolarHBondContact NH1-O 2.91Å; R192-P254 VanDerWaalsContact NH1-O 3.15Å; R192-P254 VanDerWaalsContact NH2-C 3.35Å; R192-P254 VanDerWaalsContact NH2-CB 3.27Å; R192-P254 PolarHBondContact NH2-O 2.85Å; S250-P254 WeakPolarHBondContact O-CA 3.44Å; S250-P254 WeakPolarHBondContact O-CB 3.36Å; S252-P254 VanDerWaalsContact C-CD 3.42Å; S252-P254 WeakPolarHBondContact O-CD 3.46Å
255F84.8Confident93.2Very high89 Ų8917.9 Ų17.939%0.3911%0.105SC..THydrogen-bonded Turntrans-124.2-1.1-176.6-51.6-66.3000113.5D253 P391 W395D253-F255 PolarHBondContact O-N 3.36Å; F255-P391 HydrophobicContact CE1-CG 3.89Å; F255-P391 HydrophobicContact CZ-CG 4.33Å; F255-W395 WeakPolarHBondContact O-CZ2 3.45Å
256V86.3Confident93.2Very high26 Ų2618.6 Ų18.616%0.15811%0.108CC..SBendtrans-103.3142.8-173.21790000110.9P189 H249 D253P189-V256 WeakPolarHBondContact CD-O 3.4Å; P189-V256 WeakPolarHBondContact CG-O 3.3Å; H249-V256 PolarHBondContact NE2-O 2.88Å; D253-V256 HydrophobicContact CB-CB 4.19Å; D253-V256 HydrophobicContact CB-CG2 4.16Å; D253-V256 PolarHBondContact O-N 3.07Å
257L90.8Very high93.3Very high25 Ų2518.6 Ų18.613%0.13111%0.108CC..  trans-72.4143.3172.5-64.3173.2000109.5I181 I186 Y187 N188I181-L257 HydrophobicContact CB-CD1 4.1Å; I181-L257 HydrophobicContact CG2-CD1 4.01Å; I186-L257 HydrophobicContact CD1-CB 4.03Å; I186-L257 HydrophobicContact CD1-CD1 4.21Å; Y187-L257 WeakPolarHBondContact O-CA 3.4Å; Y187-L257 WeakPolarHBondContact O-CD2 3.43Å; N188-L257 HydrophobicContact CB-CD2 4.06Å
258L92.3Very high93.4Very high6 Ų618 Ų183%0.03111%0.105CC..BIsolated β-bridgetrans-118.6132.4175.9176.573.4000110.8I186 Y187 Y201 H249 A334I186-L258 WeakPolarHBondContact CG1-O 3.17Å; Y187-L258 HydrophobicContact CD1-CB 3.78Å; Y187-L258 HydrophobicContact CG-CB 4.17Å; Y187-L258 PolarHBondContact N-O 3.43Å; Y187-L258 PolarHBondContact O-N 3.24Å; Y201-L258 WeakPolarHBondContact CB-O 3.42Å; Y201-L258 HydrophobicContact CD1-CD2 4.33Å; Y201-L258 HydrophobicContact CD2-CD1 4.48Å; Y201-L258 HydrophobicContact CD2-CD2 3.74Å; Y201-L258 HydrophobicContact CD2-CG 3.57Å; Y201-L258 HydrophobicContact CE1-CD2 4.14Å; Y201-L258 HydrophobicContact CE2-CD1 4.29Å; Y201-L258 HydrophobicContact CE2-CD2 3.49Å; Y201-L258 VanDerWaalsContact CE2-CD2 3.49Å; Y201-L258 HydrophobicContact CE2-CG 3.66Å; Y201-L258 HydrophobicContact CG-CD2 4.15Å; Y201-L258 HydrophobicContact CG-CG 4.2Å; H249-L258 HydrophobicContact CB-CD2 4Å; L258-A334 HydrophobicContact CD1-CB 3.69Å; L258-A334 HydrophobicContact CD2-CB 4.09Å
259A93.5Very high93.4Very high20 Ų2017.5 Ų17.517%0.16510%0.1CC..  trans-143.2145.3177.500000108.3V179 I186 I204V179-A259 HydrophobicContact CG1-CB 4.27Å; I186-A259 HydrophobicContact CD1-CB 4.41Å; I186-A259 HydrophobicContact CG1-CB 4.31Å; I204-A259 HydrophobicContact CB-CB 3.98Å; I204-A259 HydrophobicContact CG2-CB 3.72Å; I204-A259 CarbonylContact O-C 3.16Å
260G94.5Very high93.6Very high0 Ų017.5 Ų17.50%010%0.1CC..SBendtrans120.1143.8171.300000111.9Y201 I204 S262Y201-G260 WeakPolarHBondContact CD2-O 3.37Å; Y201-G260 WeakPolarHBondContact CE2-O 3.39Å; Y201-G260 PolarHBondContact O-N 3.47Å; I204-G260 WeakPolarHBondContact O-CA 3.45Å; I204-G260 PolarHBondContact O-N 3.44Å; G260-S262 PolarHBondContact O-N 2.86Å; G260-S262 VanDerWaalsContact O-N 3.12Å
261A96.6Very high93.9Very high0 Ų017.5 Ų17.50%010%0.1CC..THydrogen-bonded Turntrans-72.22.5177.300000114.4E152 M202 H205 N214 Q218 Y238 G263 G264 C265E152-A261 VanDerWaalsContact OE1-CB 3.3Å; E152-A261 WeakPolarHBondContact OE1-CB 3.2Å; E152-A261 WeakPolarHBondContact OE2-CB 3.2Å; M202-A261 HydrophobicContact CB-CB 4.29Å; M202-A261 WeakPolarHBondContact O-CB 3.45Å; M202-A261 PolarHBondContact O-N 3.44Å; H205-A261 PolarHBondContact NE2-N 2.97Å; N214-A261 HydrophobicContact CB-CB 4.15Å; Q218-A261 VanDerWaalsContact NE2-CB 3.34Å; Y238-A261 WeakPolarHBondContact OH-CB 3.38Å; A261-G263 VanDerWaalsContact C-N 3.27Å; A261-G263 PolarHBondContact O-N 3.43Å; A261-G263 VanDerWaalsContact O-N 3.15Å; A261-G264 WeakPolarHBondContact O-CA 3.39Å; A261-G264 PolarHBondContact O-N 3.24Å; A261-C265 PolarHBondContact O-N 3.34Å; A261-C265 VanDerWaalsContact O-N 3.12Å
262S95.5Very high94.1Very high3 Ų314.7 Ų14.72%0.0218%0.083CC..Hα-helixtrans-62.4-29.5-168.2600000113.7N214 G260 G264 C265 Y266 H335N214-S262 VanDerWaalsContact OD1-CA 3.29Å; N214-S262 WeakPolarHBondContact OD1-CA 3.2Å; N214-S262 PolarHBondContact OD1-N 3.49Å; G260-S262 PolarHBondContact O-N 2.86Å; G260-S262 VanDerWaalsContact O-N 3.12Å; S262-G264 PolarHBondContact O-N 2.92Å; S262-C265 PolarHBondContact O-N 3.27Å; S262-Y266 WeakPolarHBondContact O-CB 3.36Å; S262-Y266 VanDerWaalsContact O-CD2 3.25Å; S262-Y266 WeakPolarHBondContact O-CD2 3.43Å; S262-Y266 PolarHBondContact O-N 2.69Å; S262-H335 VanDerWaalsContact CB-NE2 3.32Å; S262-H335 WeakPolarHBondContact CB-NE2 3.47Å; S262-H335 PolarHBondContact OG-CD2 2.96Å; S262-H335 PolarHBondContact OG-NE2 3.05Å
263G96.8Very high94.4Very high0 Ų013.9 Ų13.90%07%0.073CC..Hα-helixtrans-56.1-41.3171.800000112.4G241 A261 A267 G338G241-G263 CarbonylContact C-O 3.46Å; A261-G263 VanDerWaalsContact C-N 3.27Å; A261-G263 PolarHBondContact O-N 3.43Å; A261-G263 VanDerWaalsContact O-N 3.15Å; G263-A267 WeakPolarHBondContact O-CB 3.49Å; G263-A267 PolarHBondContact O-N 3Å; G263-A267 VanDerWaalsContact O-N 3.15Å; G263-G338 VanDerWaalsContact O-CA 3.32Å; G263-G338 WeakPolarHBondContact O-CA 3.22Å
264G98.2Very high94.9Very high0 Ų012 Ų120%06%0.064CC..Hα-helixtrans-72.8-42.7173.500000112.6Y238 A261 S262 Y266 A267 L268Y238-G264 VanDerWaalsContact CE2-C 3.48Å; Y238-G264 VanDerWaalsContact CE2-CA 3.49Å; A261-G264 WeakPolarHBondContact O-CA 3.39Å; A261-G264 PolarHBondContact O-N 3.24Å; S262-G264 PolarHBondContact O-N 2.92Å; G264-Y266 PolarHBondContact O-N 2.92Å; G264-A267 WeakPolarHBondContact O-CA 3.25Å; G264-A267 WeakPolarHBondContact O-CB 3.28Å; G264-A267 PolarHBondContact O-N 3Å; G264-A267 VanDerWaalsContact O-N 3.12Å; G264-L268 WeakPolarHBondContact O-CG 3.43Å; G264-L268 PolarHBondContact O-N 2.83Å
265C97.7Very high95.2Very high0 Ų011.4 Ų11.40%06%0.059CC..Hα-helixtrans-58.8-45.4177.2-60.80000112.5N214 L217 A261 S262 A267 L268 I269N214-C265 PolarHBondContact OD1-SG 2.96Å; L217-C265 HydrophobicContact CB-CB 4.05Å; L217-C265 HydrophobicContact CD1-CB 4.04Å; A261-C265 PolarHBondContact O-N 3.34Å; A261-C265 VanDerWaalsContact O-N 3.12Å; S262-C265 PolarHBondContact O-N 3.27Å; C265-A267 VanDerWaalsContact C-N 3.31Å; C265-A267 PolarHBondContact O-N 2.94Å; C265-L268 WeakPolarHBondContact O-CB 3.49Å; C265-L268 PolarHBondContact O-N 3.45Å; C265-L268 VanDerWaalsContact O-N 3.16Å; C265-I269 PolarHBondContact O-N 3.43Å
266Y97.7Very high95.7Very high15 Ų157.4 Ų7.46%0.0594%0.042CC..Hα-helixtrans-70.1-30.2176.6-82.2-105.9000111.8S262 G264 L268 I269 G270 D312 T313 H335 F339S262-Y266 WeakPolarHBondContact O-CB 3.36Å; S262-Y266 VanDerWaalsContact O-CD2 3.25Å; S262-Y266 WeakPolarHBondContact O-CD2 3.43Å; S262-Y266 PolarHBondContact O-N 2.69Å; G264-Y266 PolarHBondContact O-N 2.92Å; Y266-L268 VanDerWaalsContact C-N 3.32Å; Y266-L268 PolarHBondContact O-N 2.87Å; Y266-I269 HydrophobicContact CD1-CD1 4.28Å; Y266-I269 HydrophobicContact CG-CD1 4.31Å; Y266-I269 WeakPolarHBondContact O-CB 3.26Å; Y266-I269 PolarHBondContact O-N 3.04Å; Y266-G270 PolarHBondContact O-N 3.41Å; Y266-D312 VanDerWaalsContact CE2-OD2 3.31Å; Y266-D312 WeakPolarHBondContact CE2-OD2 3.29Å; Y266-D312 PolarHBondContact OH-OD2 2.89Å; Y266-T313 WeakPolarHBondContact OH-CA 3.36Å; Y266-T313 PolarHBondContact OH-N 2.93Å; Y266-T313 PolarHBondContact OH-OG1 3.06Å; Y266-H335 WeakPolarHBondContact CB-O 3.44Å; Y266-H335 HydrophobicContact CD1-CB 3.83Å; Y266-H335 WeakPolarHBondContact CD1-O 3.27Å; Y266-H335 HydrophobicContact CD2-CB 3.9Å; Y266-H335 AromaticContact CD2-CG 3.94Å; Y266-H335 HydrophobicContact CE1-CB 3.7Å; Y266-H335 HydrophobicContact CE2-CB 3.74Å; Y266-H335 AromaticContact CE2-CE1 3.93Å; Y266-H335 AromaticContact CE2-CG 3.47Å; Y266-H335 VanDerWaalsContact CE2-CG 3.47Å; Y266-H335 AromaticContact CE2-ND1 3.4Å; Y266-H335 WeakPolarHBondContact CE2-ND1 3.35Å; Y266-H335 HydrophobicContact CG-CB 3.91Å; Y266-H335 AromaticContact CZ-CG 3.63Å; Y266-H335 AromaticContact CZ-ND1 3.36Å; Y266-H335 PolarHBondContact OH-ND1 2.85Å; Y266-H335 VanDerWaalsContact OH-ND1 3.09Å; Y266-F339 HydrophobicContact CD1-CB 4.23Å; Y266-F339 WeakPolarHBondContact O-CA 3.34Å
267A98.6Very high96Very high0 Ų010 Ų100%05%0.054CC..Hα-helixtrans-63.5-37.6169.300000112.3V237 G263 G264 C265 G270 A271 G338 G342V237-A267 HydrophobicContact CG1-CB 4.47Å; G263-A267 WeakPolarHBondContact O-CB 3.49Å; G263-A267 PolarHBondContact O-N 3Å; G263-A267 VanDerWaalsContact O-N 3.15Å; G264-A267 WeakPolarHBondContact O-CA 3.25Å; G264-A267 WeakPolarHBondContact O-CB 3.28Å; G264-A267 PolarHBondContact O-N 3Å; G264-A267 VanDerWaalsContact O-N 3.12Å; C265-A267 VanDerWaalsContact C-N 3.31Å; C265-A267 PolarHBondContact O-N 2.94Å; A267-G270 PolarHBondContact O-N 2.87Å; A267-A271 WeakPolarHBondContact O-CB 3.45Å; A267-A271 PolarHBondContact O-N 2.9Å; A267-G338 WeakPolarHBondContact CA-O 3.45Å; A267-G338 WeakPolarHBondContact CB-O 3.04Å; A267-G338 PolarHBondContact N-O 2.79Å; A267-G342 WeakPolarHBondContact O-CA 3.49Å
268L98.3Very high95.9Very high1 Ų19.7 Ų9.71%0.0055%0.053CC..Hα-helixtrans-63.2-41171.3-60.7172.7000111.5I145 L221 L225 V234 Y238 G264 C265 Y266 A271 H272I145-L268 HydrophobicContact CD1-CD1 4.08Å; L221-L268 HydrophobicContact CB-CB 4.35Å; L225-L268 HydrophobicContact CD1-CB 4.28Å; L225-L268 HydrophobicContact CD1-CD2 3.96Å; V234-L268 HydrophobicContact CG1-CD2 3.75Å; Y238-L268 HydrophobicContact CD2-CD1 3.95Å; Y238-L268 HydrophobicContact CD2-CD2 4.33Å; Y238-L268 HydrophobicContact CD2-CG 4.02Å; Y238-L268 HydrophobicContact CE2-CD1 4.3Å; G264-L268 WeakPolarHBondContact O-CG 3.43Å; G264-L268 PolarHBondContact O-N 2.83Å; C265-L268 WeakPolarHBondContact O-CB 3.49Å; C265-L268 PolarHBondContact O-N 3.45Å; C265-L268 VanDerWaalsContact O-N 3.16Å; Y266-L268 VanDerWaalsContact C-N 3.32Å; Y266-L268 PolarHBondContact O-N 2.87Å; L268-A271 PolarHBondContact O-N 3.46Å; L268-H272 PolarHBondContact O-CD2 2.98Å; L268-H272 PolarHBondContact O-N 3.42Å
269I97.7Very high95.6Very high5 Ų59.6 Ų9.63%0.0265%0.052CC..Hα-helixtrans-59.1-50.5174.8-66.4170.4000110.9L217 L221 C265 Y266 A271 H272 L273 I305 F339L217-I269 HydrophobicContact CD2-CD1 4.34Å; L221-I269 HydrophobicContact CD1-CD1 4.35Å; L221-I269 HydrophobicContact CD1-CG1 3.45Å; L221-I269 VanDerWaalsContact CD1-CG1 3.45Å; C265-I269 PolarHBondContact O-N 3.43Å; Y266-I269 HydrophobicContact CD1-CD1 4.28Å; Y266-I269 HydrophobicContact CG-CD1 4.31Å; Y266-I269 WeakPolarHBondContact O-CB 3.26Å; Y266-I269 PolarHBondContact O-N 3.04Å; I269-A271 VanDerWaalsContact C-N 3.28Å; I269-A271 PolarHBondContact O-N 2.9Å; I269-H272 WeakPolarHBondContact O-CB 3.26Å; I269-H272 PolarHBondContact O-N 2.92Å; I269-L273 PolarHBondContact O-N 3Å; I269-I305 HydrophobicContact CG2-CB 4.42Å; I269-I305 HydrophobicContact CG2-CG1 4.21Å; I269-I305 HydrophobicContact CG2-CG2 3.65Å; I269-F339 HydrophobicContact CB-CD2 4.38Å; I269-F339 HydrophobicContact CG2-CD2 3.89Å; I269-F339 HydrophobicContact CG2-CE2 3.94Å
270G98.1Very high95.5Very high0 Ų013.5 Ų13.50%06%0.063CC..Hα-helixtrans-60.9-38.7177.500000112.2Y266 A267 L273 A274 G342 L343Y266-G270 PolarHBondContact O-N 3.41Å; A267-G270 PolarHBondContact O-N 2.87Å; G270-L273 WeakPolarHBondContact O-CB 3.49Å; G270-L273 PolarHBondContact O-N 2.89Å; G270-A274 PolarHBondContact O-N 3.37Å; G270-G342 VanDerWaalsContact C-C 3.48Å; G270-G342 CarbonylContact C-O 3.25Å; G270-L343 WeakPolarHBondContact O-CA 3.4Å
271A98.3Very high95Very high0 Ų018 Ų180%09%0.087CC..Hα-helixtrans-69.7-34.3178.800000112.9L225 V237 A267 L268 I269 A274 T275 G342 L350L225-A271 HydrophobicContact CD1-CB 4.05Å; V237-A271 HydrophobicContact CG1-CB 3.77Å; A267-A271 WeakPolarHBondContact O-CB 3.45Å; A267-A271 PolarHBondContact O-N 2.9Å; L268-A271 PolarHBondContact O-N 3.46Å; I269-A271 VanDerWaalsContact C-N 3.28Å; I269-A271 PolarHBondContact O-N 2.9Å; A271-A274 PolarHBondContact O-N 3.2Å; A271-T275 WeakPolarHBondContact O-CB 3.35Å; A271-T275 PolarHBondContact O-N 3.19Å; A271-T275 PolarHBondContact O-OG1 2.69Å; A271-G342 WeakPolarHBondContact CA-O 3.29Å; A271-G342 PolarHBondContact N-O 2.95Å; A271-L350 HydrophobicContact CB-CD1 3.85Å
272H96.9Very high94.3Very high1 Ų118.5 Ų18.51%0.0059%0.089CC..Hα-helixtrans-61.9-45.7167.8-87.3-75.9000111.4L221 L225 L268 I269 A274 T275 V276 R301 I305L221-H272 WeakPolarHBondContact CA-NE2 3.47Å; L221-H272 WeakPolarHBondContact CB-NE2 3.22Å; L221-H272 PolarHBondContact O-NE2 3.24Å; L225-H272 WeakPolarHBondContact CG-NE2 3.31Å; L268-H272 PolarHBondContact O-CD2 2.98Å; L268-H272 PolarHBondContact O-N 3.42Å; I269-H272 WeakPolarHBondContact O-CB 3.26Å; I269-H272 PolarHBondContact O-N 2.92Å; H272-A274 VanDerWaalsContact C-N 3.33Å; H272-A274 PolarHBondContact O-N 3.17Å; H272-T275 WeakPolarHBondContact O-CB 3.49Å; H272-T275 PolarHBondContact O-N 3.45Å; H272-T275 VanDerWaalsContact O-N 3.16Å; H272-V276 VanDerWaalsContact O-CG2 3.26Å; H272-V276 WeakPolarHBondContact O-CG2 3.47Å; H272-V276 PolarHBondContact O-N 3.32Å; H272-R301 PolarHBondContact CE1-NH1 3.03Å; H272-R301 VanDerWaalsContact CE1-NH1 3.28Å; H272-R301 PolarHBondContact ND1-NH1 3.33Å; H272-I305 HydrophobicContact CB-CD1 3.69Å; H272-I305 HydrophobicContact CB-CG1 4.09Å
273L97.3Very high93.9Very high44 Ų4418.5 Ų18.523%0.239%0.089CC..Hα-helixtrans-60.8-44.2177.6-18060.6000111.2I269 G270 T275 V276 I277 L302 I305 F339 L343I269-L273 PolarHBondContact O-N 3Å; G270-L273 WeakPolarHBondContact O-CB 3.49Å; G270-L273 PolarHBondContact O-N 2.89Å; L273-T275 VanDerWaalsContact C-N 3.34Å; L273-T275 PolarHBondContact O-N 3.16Å; L273-V276 PolarHBondContact O-N 2.92Å; L273-I277 HydrophobicContact CD1-CD1 4.17Å; L273-I277 HydrophobicContact CD1-CG1 4.39Å; L273-I277 HydrophobicContact CG-CD1 3.96Å; L273-I277 VanDerWaalsContact O-CG1 3.3Å; L273-I277 WeakPolarHBondContact O-CG1 3.44Å; L273-I277 PolarHBondContact O-N 3.24Å; L273-L302 HydrophobicContact CD1-CD2 3.98Å; L273-I305 HydrophobicContact CB-CD1 4.34Å; L273-F339 HydrophobicContact CD2-CE2 4.25Å; L273-F339 HydrophobicContact CD2-CZ 3.75Å; L273-L343 HydrophobicContact CB-CD1 4.31Å; L273-L343 HydrophobicContact CD2-CD1 4.14Å; L273-L343 HydrophobicContact CG-CD1 4.07Å
274A96.7Very high93.5Very high1 Ų120.1 Ų20.11%0.00810%0.097CC..Hα-helixtrans-56.3-48.9172.600000111.3G270 A271 H272 V276 I277 M278 L343 V347G270-A274 PolarHBondContact O-N 3.37Å; A271-A274 PolarHBondContact O-N 3.2Å; H272-A274 VanDerWaalsContact C-N 3.33Å; H272-A274 PolarHBondContact O-N 3.17Å; A274-V276 VanDerWaalsContact C-N 3.3Å; A274-V276 PolarHBondContact O-N 3.1Å; A274-I277 PolarHBondContact O-N 2.84Å; A274-I277 VanDerWaalsContact O-N 3.16Å; A274-M278 WeakPolarHBondContact O-CG 3.43Å; A274-M278 PolarHBondContact O-N 3.12Å; A274-L343 HydrophobicContact CB-CD1 4.07Å; A274-L343 WeakPolarHBondContact CB-O 3.32Å; A274-V347 HydrophobicContact CB-CG2 3.96Å
275T93.3Very high92.7Very high3 Ų323.5 Ų23.52%0.01811%0.113CC..Hα-helixtrans-58.3-42.9179.3-58.50000111.9Y132 H229 A271 H272 L273 M278 N279 M283 L350Y132-T275 HydrophobicContact CE2-CG2 4.07Å; Y132-T275 WeakPolarHBondContact OH-CG2 3.24Å; H229-T275 PolarHBondContact NE2-OG1 3.49Å; A271-T275 WeakPolarHBondContact O-CB 3.35Å; A271-T275 PolarHBondContact O-N 3.19Å; A271-T275 PolarHBondContact O-OG1 2.69Å; H272-T275 WeakPolarHBondContact O-CB 3.49Å; H272-T275 PolarHBondContact O-N 3.45Å; H272-T275 VanDerWaalsContact O-N 3.16Å; L273-T275 VanDerWaalsContact C-N 3.34Å; L273-T275 PolarHBondContact O-N 3.16Å; T275-M278 PolarHBondContact O-N 3.18Å; T275-N279 WeakPolarHBondContact O-CB 3.44Å; T275-N279 PolarHBondContact O-N 3.15Å; T275-N279 PolarHBondContact O-ND2 3.49Å; T275-M283 HydrophobicContact CG2-SD 4.43Å; T275-L350 WeakPolarHBondContact OG1-CD1 3.47Å
276V94.4Very high91.9Very high5 Ų524.3 Ų24.33%0.0312%0.121CC..Hα-helixtrans-63.6-43.5177.11720000111.2H272 L273 A274 W280 M283 R301 L302H272-V276 VanDerWaalsContact O-CG2 3.26Å; H272-V276 WeakPolarHBondContact O-CG2 3.47Å; H272-V276 PolarHBondContact O-N 3.32Å; L273-V276 PolarHBondContact O-N 2.92Å; A274-V276 VanDerWaalsContact C-N 3.3Å; A274-V276 PolarHBondContact O-N 3.1Å; V276-W280 HydrophobicContact CG1-CE3 3.63Å; V276-W280 HydrophobicContact CG1-CZ3 3.83Å; V276-W280 WeakPolarHBondContact O-CA 3.4Å; V276-W280 WeakPolarHBondContact O-CB 3.31Å; V276-W280 PolarHBondContact O-N 3.43Å; V276-W280 VanDerWaalsContact O-N 3.16Å; V276-M283 HydrophobicContact CG2-CE 4.08Å; V276-R301 HydrophobicContact CG2-CB 3.94Å; V276-L302 HydrophobicContact CG1-CD1 4.16Å; V276-L302 HydrophobicContact CG1-CD2 4.18Å; V276-L302 HydrophobicContact CG1-CG 4.06Å
277I92.8Very high91.4Very high80 Ų8026.8 Ų26.841%0.4113%0.13SC..Hα-helixtrans-63.2-45.8178.4-70165.1000110.7L273 A274 L343 W358L273-I277 HydrophobicContact CD1-CD1 4.17Å; L273-I277 HydrophobicContact CD1-CG1 4.39Å; L273-I277 HydrophobicContact CG-CD1 3.96Å; L273-I277 VanDerWaalsContact O-CG1 3.3Å; L273-I277 WeakPolarHBondContact O-CG1 3.44Å; L273-I277 PolarHBondContact O-N 3.24Å; A274-I277 PolarHBondContact O-N 2.84Å; A274-I277 VanDerWaalsContact O-N 3.16Å; I277-L343 HydrophobicContact CD1-CD1 4.25Å; I277-W358 HydrophobicContact CG2-CH2 4.14Å
278M89.2Confident91.1Very high19 Ų1932.8 Ų32.89%0.09416%0.161CC..Hα-helixtrans-80.4-23.3-173.5-56.9-62.5-69.400113.5A274 T275 V347 N352 W358 E359 F362A274-M278 WeakPolarHBondContact O-CG 3.43Å; A274-M278 PolarHBondContact O-N 3.12Å; T275-M278 PolarHBondContact O-N 3.18Å; M278-V347 HydrophobicContact CE-CG1 4.12Å; M278-V347 HydrophobicContact CG-CG2 4.41Å; M278-V347 HydrophobicContact SD-CG1 4.18Å; M278-V347 HydrophobicContact SD-CG2 4.3Å; M278-N352 WeakPolarHBondContact CE-ND2 3.33Å; M278-W358 HydrophobicContact SD-CH2 3.85Å; M278-W358 HydrophobicContact SD-CZ3 4.23Å; M278-E359 HydrophobicContact CE-CB 3.59Å; M278-E359 VanDerWaalsContact CE-CD 3.4Å; M278-E359 HydrophobicContact CE-CG 3.44Å; M278-E359 VanDerWaalsContact CE-CG 3.44Å; M278-E359 WeakPolarHBondContact CE-OE1 3.3Å; M278-E359 HydrophobicContact SD-CG 4.25Å; M278-F362 HydrophobicContact SD-CD1 4.12Å; M278-F362 HydrophobicContact SD-CE1 4.35Å
279N86.5Confident90.3Very high4 Ų437.8 Ų37.82%0.02118%0.183CC..Hα-helixtrans-124.820.3-172.6-57.3-94.1000113.3Y132 T275 D281 I282 M283 L353Y132-N279 HydrophobicContact CD2-CB 4.05Å; Y132-N279 HydrophobicContact CE2-CB 3.98Å; T275-N279 WeakPolarHBondContact O-CB 3.44Å; T275-N279 PolarHBondContact O-N 3.15Å; T275-N279 PolarHBondContact O-ND2 3.49Å; N279-D281 PolarHBondContact O-N 3.06Å; N279-I282 PolarHBondContact O-N 3.3Å; N279-M283 HydrophobicContact CB-CG 4.14Å; N279-M283 HydrophobicContact CB-SD 3.95Å; N279-M283 WeakPolarHBondContact O-CB 3.44Å; N279-M283 WeakPolarHBondContact O-CG 3.4Å; N279-M283 PolarHBondContact O-N 2.82Å; N279-L353 PolarHBondContact OD1-N 3.45Å
280W90.4Very high89.5Confident102 Ų10240.4 Ų40.439%0.38620%0.197SC..Hα-helixtrans-49.6-56.4-172.1-179.9-99.6000113.1V276 I282 M283 Q284 V299 L302V276-W280 HydrophobicContact CG1-CE3 3.63Å; V276-W280 HydrophobicContact CG1-CZ3 3.83Å; V276-W280 WeakPolarHBondContact O-CA 3.4Å; V276-W280 WeakPolarHBondContact O-CB 3.31Å; V276-W280 PolarHBondContact O-N 3.43Å; V276-W280 VanDerWaalsContact O-N 3.16Å; W280-I282 VanDerWaalsContact C-N 3.32Å; W280-I282 PolarHBondContact O-N 2.88Å; W280-M283 PolarHBondContact O-N 2.87Å; W280-M283 VanDerWaalsContact O-N 3.1Å; W280-Q284 HydrophobicContact CD2-CG 4.12Å; W280-Q284 HydrophobicContact CG-CG 4.48Å; W280-Q284 HydrophobicContact CZ2-CG 3.96Å; W280-Q284 WeakPolarHBondContact O-CG 3.25Å; W280-Q284 PolarHBondContact O-N 3.25Å; W280-V299 HydrophobicContact CH2-CG2 3.95Å; W280-L302 HydrophobicContact CH2-CD1 4.45Å; W280-L302 HydrophobicContact CZ3-CD1 3.94Å
281D85.1Confident88.8Confident96 Ų9645.2 Ų45.251%0.51323%0.228SC..Hα-helixtrans-61.3-41.2-173.7-66.6-26.2000112.4N279 M283 Q284 E285N279-D281 PolarHBondContact O-N 3.06Å; D281-M283 VanDerWaalsContact C-N 3.32Å; D281-M283 PolarHBondContact O-N 2.9Å; D281-Q284 PolarHBondContact O-N 3.3Å; D281-E285 PolarHBondContact O-N 3Å; D281-E285 VanDerWaalsContact O-N 3.12Å
282I81Confident87.9Confident9 Ų950.1 Ų50.15%0.04625%0.254CS..Hα-helixtrans-70.7-31.1179.8-55.5172.5000111.1Y132 N279 W280 L353 K354Y132-I282 PolarHBondContact N-O 2.69Å; N279-I282 PolarHBondContact O-N 3.3Å; W280-I282 VanDerWaalsContact C-N 3.32Å; W280-I282 PolarHBondContact O-N 2.88Å; I282-L353 HydrophobicContact CD1-CB 4Å; I282-L353 HydrophobicContact CG2-CD1 4.28Å; I282-K354 HydrophobicContact CD1-CB 4.05Å; I282-K354 HydrophobicContact CD1-CD 3.68Å; I282-K354 HydrophobicContact CD1-CG 3.64Å; I282-K354 HydrophobicContact CG1-CD 4.33Å
283M86.3Confident87.1Confident3 Ų350.5 Ų50.52%0.01526%0.256CS..Hα-helixtrans-76.5-27.3176.3-70.1171.575.700112.8Y132 T275 V276 N279 W280 D281 S296 R301Y132-M283 HydrophobicContact CD1-CG 4.02Å; Y132-M283 HydrophobicContact CD2-CG 3.56Å; Y132-M283 HydrophobicContact CD2-SD 4.33Å; Y132-M283 HydrophobicContact CE2-CG 4.16Å; Y132-M283 HydrophobicContact CE2-SD 4.35Å; Y132-M283 HydrophobicContact CG-CG 3.5Å; Y132-M283 VanDerWaalsContact CG-CG 3.5Å; T275-M283 HydrophobicContact CG2-SD 4.43Å; V276-M283 HydrophobicContact CG2-CE 4.08Å; N279-M283 HydrophobicContact CB-CG 4.14Å; N279-M283 HydrophobicContact CB-SD 3.95Å; N279-M283 WeakPolarHBondContact O-CB 3.44Å; N279-M283 WeakPolarHBondContact O-CG 3.4Å; N279-M283 PolarHBondContact O-N 2.82Å; W280-M283 PolarHBondContact O-N 2.87Å; W280-M283 VanDerWaalsContact O-N 3.1Å; D281-M283 VanDerWaalsContact C-N 3.32Å; D281-M283 PolarHBondContact O-N 2.9Å; M283-S296 WeakPolarHBondContact CE-O 3.46Å; M283-R301 VanDerWaalsContact CE-CD 3.48Å; M283-R301 HydrophobicContact CE-CG 4.29Å
284Q90Very high86.6Confident35 Ų3552.9 Ų52.916%0.16427%0.265CS..Hα-helixtrans-87.8-12.7175.8-58.2-50.4-34.700113.1W280 D281 G286 W287 G298W280-Q284 HydrophobicContact CD2-CG 4.12Å; W280-Q284 HydrophobicContact CG-CG 4.48Å; W280-Q284 HydrophobicContact CZ2-CG 3.96Å; W280-Q284 WeakPolarHBondContact O-CG 3.25Å; W280-Q284 PolarHBondContact O-N 3.25Å; D281-Q284 PolarHBondContact O-N 3.3Å; Q284-G286 PolarHBondContact O-N 3.32Å; Q284-W287 VanDerWaalsContact O-CD1 3.25Å; Q284-W287 PolarHBondContact O-N 2.87Å; Q284-G298 VanDerWaalsContact NE2-CA 3.34Å
285E80.8Confident86.2Confident71 Ų7156.3 Ų56.333%0.33228%0.282SS..THydrogen-bonded Turntrans-64.5103.8-179.5-169.7178.6158.600111.8D281 W287D281-E285 PolarHBondContact O-N 3Å; D281-E285 VanDerWaalsContact O-N 3.12Å; E285-W287 VanDerWaalsContact C-N 3.28Å; E285-W287 PolarHBondContact O-N 3.34Å
286G81.4Confident85.7Confident17 Ų1756.3 Ų56.318%0.17528%0.282CS..THydrogen-bonded Turntrans67.127.6178.800000114.3Q284 L288 K289 N293Q284-G286 PolarHBondContact O-N 3.32Å; G286-L288 PolarHBondContact O-N 3.01Å; G286-L288 VanDerWaalsContact O-N 3.14Å; G286-K289 VanDerWaalsContact CA-NZ 3.34Å; G286-K289 VanDerWaalsContact O-CB 3.3Å; G286-K289 WeakPolarHBondContact O-CB 3.27Å; G286-K289 WeakPolarHBondContact O-CG 3.25Å; G286-K289 PolarHBondContact O-N 3.49Å; G286-N293 PolarHBondContact O-ND2 2.92Å; G286-N293 VanDerWaalsContact O-ND2 3.08Å
287W87.4Confident85.6Confident67 Ų6756.1 Ų56.125%0.25428%0.281SS..THydrogen-bonded Turntrans-59-25.8-175.175.5-78.8000114.5Q284 E285 N293 F294 V300Q284-W287 VanDerWaalsContact O-CD1 3.25Å; Q284-W287 PolarHBondContact O-N 2.87Å; E285-W287 VanDerWaalsContact C-N 3.28Å; E285-W287 PolarHBondContact O-N 3.34Å; W287-N293 CarbonylContact O-C 3.49Å; W287-N293 VanDerWaalsContact O-C 3.25Å; W287-N293 WeakPolarHBondContact O-CB 3.46Å; W287-F294 AromaticContact CE3-CD2 3.77Å; W287-F294 HydrophobicContact CE3-CD2 3.77Å; W287-F294 HydrophobicContact CE3-CE2 4.26Å; W287-F294 HydrophobicContact CH2-CE2 4.39Å; W287-F294 AromaticContact CZ3-CD2 3.55Å; W287-F294 HydrophobicContact CZ3-CD2 3.55Å; W287-F294 AromaticContact CZ3-CE2 3.55Å; W287-F294 HydrophobicContact CZ3-CE2 3.55Å; W287-F294 WeakPolarHBondContact O-CA 3.19Å; W287-F294 PolarHBondContact O-N 3.44Å; W287-V300 HydrophobicContact CZ3-CG2 4.49Å
288L90.4Very high85.6Confident125 Ų12552.3 Ų52.365%0.65426%0.261SS*.THydrogen-bonded Turntrans-86.3-3.6176.6-66.4175.6000114.8G286 F294G286-L288 PolarHBondContact O-N 3.01Å; G286-L288 VanDerWaalsContact O-N 3.14Å; L288-F294 HydrophobicContact CD2-CD2 4.17Å; L288-F294 HydrophobicContact CD2-CE2 4.49Å
289K82.7Confident85.9Confident107 Ų10753.8 Ų53.847%0.46527%0.271SS..SBendtrans-76.8-28.5-169.9-66.5177-174.7142.90113.9M1 G286M1-K289 PolarHBondContact O-NZ 2.8Å; G286-K289 VanDerWaalsContact CA-NZ 3.34Å; G286-K289 VanDerWaalsContact O-CB 3.3Å; G286-K289 WeakPolarHBondContact O-CB 3.27Å; G286-K289 WeakPolarHBondContact O-CG 3.25Å; G286-K289 PolarHBondContact O-N 3.49Å
290D80.4Confident86.3Confident59 Ų5954.4 Ų54.432%0.31628%0.275SS..SBendtrans-153.2159.2-179.467.177.9000111.3I133 L292 N293 F294I133-D290 WeakPolarHBondContact CD1-OD1 3.33Å; D290-L292 VanDerWaalsContact C-N 3.28Å; D290-L292 PolarHBondContact O-N 2.81Å; D290-L292 WeakPolarHBondContact OD1-CB 3.41Å; D290-L292 PolarHBondContact OD1-N 2.64Å; D290-L292 VanDerWaalsContact OD1-N 3.11Å; D290-N293 WeakPolarHBondContact O-CB 3.1Å; D290-N293 PolarHBondContact O-N 3.42Å; D290-N293 PolarHBondContact OD1-N 3.37Å; D290-N293 VanDerWaalsContact OD2-CG 3.3Å; D290-N293 PolarHBondContact OD2-ND2 3.31Å; D290-F294 PolarHBondContact O-N 3.37Å
291P83.2Confident86.5Confident101 Ų10149.6 Ų49.666%0.65626%0.257SS*.Hα-helixtrans-60.9-32.2-174.5-25.735.2000114.5F294 I295P291-F294 PolarHBondContact O-N 3.34Å; P291-I295 WeakPolarHBondContact O-CG1 3.28Å; P291-I295 PolarHBondContact O-N 3.49Å
292L78.8Confident87Confident103 Ų10347.5 Ų47.554%0.53925%0.246SC..Hα-helixtrans-73.1-37-179.9-70.1172.8000110.9I133 D290 F294 S296I133-L292 HydrophobicContact CD1-CB 3.62Å; I133-L292 HydrophobicContact CG1-CB 4.25Å; D290-L292 VanDerWaalsContact C-N 3.28Å; D290-L292 PolarHBondContact O-N 2.81Å; D290-L292 WeakPolarHBondContact OD1-CB 3.41Å; D290-L292 PolarHBondContact OD1-N 2.64Å; D290-L292 VanDerWaalsContact OD1-N 3.11Å; L292-F294 VanDerWaalsContact C-N 3.28Å; L292-S296 WeakPolarHBondContact O-CB 3.49Å; L292-S296 PolarHBondContact O-N 2.81Å; L292-S296 PolarHBondContact O-OG 2.65Å
293N80.6Confident87.8Confident9 Ų951.2 Ų51.25%0.04827%0.265CS..Hα-helixtrans-66.5-39.7177.2-102.1-19.8000108.9N131 I133 G286 W287 D290 S296 S297N131-N293 PolarHBondContact ND2-ND2 3.49Å; N131-N293 PolarHBondContact ND2-OD1 3.12Å; I133-N293 VanDerWaalsContact CD1-CA 3.49Å; I133-N293 HydrophobicContact CD1-CB 3.71Å; I133-N293 WeakPolarHBondContact CD1-OD1 3.42Å; I133-N293 HydrophobicContact CG1-CB 4.4Å; I133-N293 WeakPolarHBondContact CG1-OD1 3.4Å; G286-N293 PolarHBondContact O-ND2 2.92Å; G286-N293 VanDerWaalsContact O-ND2 3.08Å; W287-N293 CarbonylContact O-C 3.49Å; W287-N293 VanDerWaalsContact O-C 3.25Å; W287-N293 WeakPolarHBondContact O-CB 3.46Å; D290-N293 WeakPolarHBondContact O-CB 3.1Å; D290-N293 PolarHBondContact O-N 3.42Å; D290-N293 PolarHBondContact OD1-N 3.37Å; D290-N293 VanDerWaalsContact OD2-CG 3.3Å; D290-N293 PolarHBondContact OD2-ND2 3.31Å; N293-S296 PolarHBondContact O-N 3.18Å; N293-S297 PolarHBondContact O-N 3.41Å
294F88.2Confident88.2Confident94 Ų9453 Ų5341%0.41227%0.274SS..Hα-helixtrans-63-53.9177.2179.1-98.4000111.3W287 L288 D290 P291 L292 S296 S297 V300W287-F294 AromaticContact CE3-CD2 3.77Å; W287-F294 HydrophobicContact CE3-CD2 3.77Å; W287-F294 HydrophobicContact CE3-CE2 4.26Å; W287-F294 HydrophobicContact CH2-CE2 4.39Å; W287-F294 AromaticContact CZ3-CD2 3.55Å; W287-F294 HydrophobicContact CZ3-CD2 3.55Å; W287-F294 AromaticContact CZ3-CE2 3.55Å; W287-F294 HydrophobicContact CZ3-CE2 3.55Å; W287-F294 WeakPolarHBondContact O-CA 3.19Å; W287-F294 PolarHBondContact O-N 3.44Å; L288-F294 HydrophobicContact CD2-CD2 4.17Å; L288-F294 HydrophobicContact CD2-CE2 4.49Å; D290-F294 PolarHBondContact O-N 3.37Å; P291-F294 PolarHBondContact O-N 3.34Å; L292-F294 VanDerWaalsContact C-N 3.28Å; F294-S296 PolarHBondContact O-N 3.42Å; F294-S297 VanDerWaalsContact O-CB 3.23Å; F294-S297 WeakPolarHBondContact O-CB 3.39Å; F294-S297 PolarHBondContact O-N 2.99Å; F294-S297 VanDerWaalsContact O-N 3.11Å; F294-S297 PolarHBondContact O-OG 2.75Å; F294-V300 HydrophobicContact CD1-CG2 4Å; F294-V300 HydrophobicContact CD2-CG2 4.16Å; F294-V300 HydrophobicContact CE1-CG2 3.67Å; F294-V300 HydrophobicContact CE2-CG2 3.85Å; F294-V300 HydrophobicContact CG-CG2 4.23Å; F294-V300 HydrophobicContact CZ-CG2 3.59Å; F294-V300 WeakPolarHBondContact O-CB 3.25Å; F294-V300 WeakPolarHBondContact O-CG2 3.45Å
295I86.9Confident88.4Confident74 Ų7452.4 Ų52.438%0.37927%0.272SS..Hα-helixtrans-62-35179.5-68.3167.8000111.5L224 P291 S297L224-I295 HydrophobicContact CD1-CG2 4.46Å; L224-I295 HydrophobicContact CD2-CG2 3.88Å; P291-I295 WeakPolarHBondContact O-CG1 3.28Å; P291-I295 PolarHBondContact O-N 3.49Å; I295-S297 VanDerWaalsContact C-N 3.3Å
296S84.4Confident89.2Confident3 Ų354.7 Ų54.72%0.02129%0.285CS..Hα-helixtrans-81.6-8-179.8-56.30000113.9Y136 M283 L292 N293 F294Y136-S296 VanDerWaalsContact CE2-OG 3.26Å; Y136-S296 WeakPolarHBondContact CE2-OG 3.22Å; Y136-S296 WeakPolarHBondContact OH-CB 3.32Å; Y136-S296 PolarHBondContact OH-OG 2.94Å; M283-S296 WeakPolarHBondContact CE-O 3.46Å; L292-S296 WeakPolarHBondContact O-CB 3.49Å; L292-S296 PolarHBondContact O-N 2.81Å; L292-S296 PolarHBondContact O-OG 2.65Å; N293-S296 PolarHBondContact O-N 3.18Å; F294-S296 PolarHBondContact O-N 3.42Å
297S91.1Very high89.8Confident0 Ų059.4 Ų59.40%031%0.306CS..SBendtrans-65.2151.4-177.473.80000112.2N293 F294 I295 V299 V300 R301N293-S297 PolarHBondContact O-N 3.41Å; F294-S297 VanDerWaalsContact O-CB 3.23Å; F294-S297 WeakPolarHBondContact O-CB 3.39Å; F294-S297 PolarHBondContact O-N 2.99Å; F294-S297 VanDerWaalsContact O-N 3.11Å; F294-S297 PolarHBondContact O-OG 2.75Å; I295-S297 VanDerWaalsContact C-N 3.3Å; S297-V299 PolarHBondContact O-N 2.91Å; S297-V300 PolarHBondContact O-N 2.94Å; S297-V300 WeakPolarHBondContact OG-CB 3.33Å; S297-V300 VanDerWaalsContact OG-CG2 3.32Å; S297-V300 WeakPolarHBondContact OG-CG2 3.41Å; S297-V300 PolarHBondContact OG-N 3.15Å; S297-V300 VanDerWaalsContact OG-N 3.13Å; S297-R301 WeakPolarHBondContact O-CG 3.27Å; S297-R301 PolarHBondContact O-N 3.22Å
298G93.4Very high90.1Very high0 Ų058 Ų580%030%0.303CS..Hα-helixtrans-62.5-33.617700000112Q284 R301 L302Q284-G298 VanDerWaalsContact NE2-CA 3.34Å; G298-R301 PolarHBondContact O-N 2.04Å; G298-L302 WeakPolarHBondContact O-CB 3.2Å; G298-L302 VanDerWaalsContact O-CG 3.23Å; G298-L302 WeakPolarHBondContact O-CG 3.49Å; G298-L302 PolarHBondContact O-N 3.49Å
299V95.4Very high90.2Very high50 Ų5052.4 Ų52.430%0.30328%0.276SS..Hα-helixtrans-65.6-50.2179.6174.20000110.4W280 S297 R301 L302 I303W280-V299 HydrophobicContact CH2-CG2 3.95Å; S297-V299 PolarHBondContact O-N 2.91Å; V299-R301 VanDerWaalsContact C-N 3.34Å; V299-R301 PolarHBondContact O-N 3.14Å; V299-L302 PolarHBondContact O-N 2.93Å; V299-I303 HydrophobicContact CG1-CD1 4.07Å; V299-I303 WeakPolarHBondContact O-CG1 3.38Å; V299-I303 PolarHBondContact O-N 3.09Å
300V94.2Very high90.7Very high17 Ų1749.3 Ų49.310%0.10327%0.274CS..Hα-helixtrans-65.2-39.8179.3173.80000111W287 F294 S297 L302 I303 L304W287-V300 HydrophobicContact CZ3-CG2 4.49Å; F294-V300 HydrophobicContact CD1-CG2 4Å; F294-V300 HydrophobicContact CD2-CG2 4.16Å; F294-V300 HydrophobicContact CE1-CG2 3.67Å; F294-V300 HydrophobicContact CE2-CG2 3.85Å; F294-V300 HydrophobicContact CG-CG2 4.23Å; F294-V300 HydrophobicContact CZ-CG2 3.59Å; F294-V300 WeakPolarHBondContact O-CB 3.25Å; F294-V300 WeakPolarHBondContact O-CG2 3.45Å; S297-V300 PolarHBondContact O-N 2.94Å; S297-V300 WeakPolarHBondContact OG-CB 3.33Å; S297-V300 VanDerWaalsContact OG-CG2 3.32Å; S297-V300 WeakPolarHBondContact OG-CG2 3.41Å; S297-V300 PolarHBondContact OG-N 3.15Å; S297-V300 VanDerWaalsContact OG-N 3.13Å; V300-L302 PolarHBondContact O-N 3.38Å; V300-I303 PolarHBondContact O-N 3.38Å; V300-L304 HydrophobicContact CG1-CD1 4.21Å; V300-L304 HydrophobicContact CG1-CG 4.35Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3.23Å
301R94.3Very high91.2Very high1 Ų148.4 Ų48.40%0.00428%0.278CS..Hα-helixtrans-61.7-41.4174.9-71.6-168-177.9-140.8-5.9112.7Y136 L224 H272 V276 M283 S297 G298 V299 L304 I305Y136-R301 PolarHBondContact OH-NH2 3.27Å; L224-R301 PolarHBondContact O-NH2 3.43Å; L224-R301 VanDerWaalsContact O-NH2 3.1Å; H272-R301 PolarHBondContact CE1-NH1 3.03Å; H272-R301 VanDerWaalsContact CE1-NH1 3.28Å; H272-R301 PolarHBondContact ND1-NH1 3.33Å; V276-R301 HydrophobicContact CG2-CB 3.94Å; M283-R301 VanDerWaalsContact CE-CD 3.48Å; M283-R301 HydrophobicContact CE-CG 4.29Å; S297-R301 WeakPolarHBondContact O-CG 3.27Å; S297-R301 PolarHBondContact O-N 3.22Å; G298-R301 PolarHBondContact O-N 2.04Å; V299-R301 VanDerWaalsContact C-N 3.34Å; V299-R301 PolarHBondContact O-N 3.14Å; R301-L304 PolarHBondContact O-N 3.49Å; R301-I305 VanDerWaalsContact O-CG1 3.29Å; R301-I305 WeakPolarHBondContact O-CG1 2.94Å; R301-I305 PolarHBondContact O-N 2.89Å
302L96.9Very high91.6Very high53 Ų5344 Ų4428%0.27725%0.249SC..Hα-helixtrans-63.2-41174.5-72.1172.8000111.8L273 V276 W280 G298 V299 V300 I305 I306L273-L302 HydrophobicContact CD1-CD2 3.98Å; V276-L302 HydrophobicContact CG1-CD1 4.16Å; V276-L302 HydrophobicContact CG1-CD2 4.18Å; V276-L302 HydrophobicContact CG1-CG 4.06Å; W280-L302 HydrophobicContact CH2-CD1 4.45Å; W280-L302 HydrophobicContact CZ3-CD1 3.94Å; G298-L302 WeakPolarHBondContact O-CB 3.2Å; G298-L302 VanDerWaalsContact O-CG 3.23Å; G298-L302 WeakPolarHBondContact O-CG 3.49Å; G298-L302 PolarHBondContact O-N 3.49Å; V299-L302 PolarHBondContact O-N 2.93Å; V300-L302 PolarHBondContact O-N 3.38Å; L302-I305 HydrophobicContact CD2-CD1 4.37Å; L302-I305 PolarHBondContact O-N 3.36Å; L302-I306 VanDerWaalsContact O-CG1 3.27Å; L302-I306 WeakPolarHBondContact O-CG1 3.4Å; L302-I306 PolarHBondContact O-N 2.94Å
303I97Very high92.2Very high86 Ų8641.3 Ų41.344%0.44124%0.237SC..Hα-helixtrans-61.3-46.4174.2-68.4167000110.6V299 V300 I305 I306 L307V299-I303 HydrophobicContact CG1-CD1 4.07Å; V299-I303 WeakPolarHBondContact O-CG1 3.38Å; V299-I303 PolarHBondContact O-N 3.09Å; V300-I303 PolarHBondContact O-N 3.38Å; I303-I305 PolarHBondContact O-N 3.48Å; I303-I306 PolarHBondContact O-N 3.06Å; I303-L307 HydrophobicContact CG2-CD1 3.65Å; I303-L307 HydrophobicContact CG2-CG 4.15Å; I303-L307 WeakPolarHBondContact O-CB 2.92Å; I303-L307 WeakPolarHBondContact O-CG 3.45Å; I303-L307 PolarHBondContact O-N 3.27Å
304L94.8Very high92.6Very high41 Ų4142.7 Ų42.722%0.21525%0.253CS..Hα-helixtrans-60.3-43.5176.9-70.7173.5000111.9L221 L224 V300 R301 L308L221-L304 HydrophobicContact CD2-CB 4.32Å; L224-L304 HydrophobicContact CD1-CD1 4Å; V300-L304 HydrophobicContact CG1-CD1 4.21Å; V300-L304 HydrophobicContact CG1-CG 4.35Å; V300-L304 WeakPolarHBondContact O-CG 3.45Å; V300-L304 PolarHBondContact O-N 3.23Å; R301-L304 PolarHBondContact O-N 3.49Å; L304-L308 VanDerWaalsContact O-CB 3.25Å; L304-L308 WeakPolarHBondContact O-CB 2.85Å; L304-L308 WeakPolarHBondContact O-CG 3.37Å; L304-L308 PolarHBondContact O-N 3.09Å
305I95.2Very high92.6Very high22 Ų2241.2 Ų41.211%0.11325%0.249CC..Iπ-helixtrans-57.7-49.7174.7-73.8161.2000110.6I269 H272 L273 R301 L302 I303 G309I269-I305 HydrophobicContact CG2-CB 4.42Å; I269-I305 HydrophobicContact CG2-CG1 4.21Å; I269-I305 HydrophobicContact CG2-CG2 3.65Å; H272-I305 HydrophobicContact CB-CD1 3.69Å; H272-I305 HydrophobicContact CB-CG1 4.09Å; L273-I305 HydrophobicContact CB-CD1 4.34Å; R301-I305 VanDerWaalsContact O-CG1 3.29Å; R301-I305 WeakPolarHBondContact O-CG1 2.94Å; R301-I305 PolarHBondContact O-N 2.89Å; L302-I305 HydrophobicContact CD2-CD1 4.37Å; L302-I305 PolarHBondContact O-N 3.36Å; I303-I305 PolarHBondContact O-N 3.48Å; I305-G309 VanDerWaalsContact O-CA 3.27Å; I305-G309 WeakPolarHBondContact O-CA 3.16Å; I305-G309 PolarHBondContact O-N 3.16Å
306I95.9Very high92.6Very high119 Ų11938 Ų3861%0.6123%0.234SC*.Iπ-helixtrans-65-47.1-177.4-69.3165.2000110.7L302 I303 G310L302-I306 VanDerWaalsContact O-CG1 3.27Å; L302-I306 WeakPolarHBondContact O-CG1 3.4Å; L302-I306 PolarHBondContact O-N 2.94Å; I303-I306 PolarHBondContact O-N 3.06Å; I306-G310 WeakPolarHBondContact O-CA 3.05Å; I306-G310 PolarHBondContact O-N 3.23Å
307L95.4Very high92.8Very high117 Ų11741.4 Ų41.461%0.61325%0.251SS*.Iπ-helixtrans-68.7-50.9-177.2-69.9178000112.2I303 G311I303-L307 HydrophobicContact CG2-CD1 3.65Å; I303-L307 HydrophobicContact CG2-CG 4.15Å; I303-L307 WeakPolarHBondContact O-CB 2.92Å; I303-L307 WeakPolarHBondContact O-CG 3.45Å; I303-L307 PolarHBondContact O-N 3.27Å; L307-G311 WeakPolarHBondContact O-CA 3.41Å; L307-G311 PolarHBondContact O-N 3.09Å
308L93.9Very high92.6Very high38 Ų3847.6 Ų47.620%0.19928%0.276CS..Iπ-helixtrans-76.9-47.1-175.5-60.1175.6000111.4L216 L217 V220 L221 L304 D312L216-L308 HydrophobicContact CD2-CD2 4.45Å; L217-L308 HydrophobicContact CD2-CB 3.55Å; L217-L308 HydrophobicContact CD2-CD1 4.44Å; V220-L308 HydrophobicContact CB-CD1 4.16Å; V220-L308 HydrophobicContact CG1-CD1 3.75Å; L221-L308 HydrophobicContact CD2-CD1 4.11Å; L221-L308 HydrophobicContact CG-CD1 4.16Å; L304-L308 VanDerWaalsContact O-CB 3.25Å; L304-L308 WeakPolarHBondContact O-CB 2.85Å; L304-L308 WeakPolarHBondContact O-CG 3.37Å; L304-L308 PolarHBondContact O-N 3.09Å; L308-D312 WeakPolarHBondContact O-CB 3.48Å; L308-D312 PolarHBondContact O-N 3.44Å
309G92.5Very high92.2Very high7 Ų749 Ų497%0.07229%0.287CS..Iπ-helixtrans-69-42.3178.700000112.7I305 T313I305-G309 VanDerWaalsContact O-CA 3.27Å; I305-G309 WeakPolarHBondContact O-CA 3.16Å; I305-G309 PolarHBondContact O-N 3.16Å; G309-T313 VanDerWaalsContact O-CB 3.27Å; G309-T313 WeakPolarHBondContact O-CB 3.38Å; G309-T313 PolarHBondContact O-N 3.02Å; G309-T313 PolarHBondContact O-OG1 2.76Å
310G92.1Very high91.6Very high42 Ų4249.7 Ų49.743%0.43328%0.284SS..Hα-helixtrans-66.7-41.9174.800000112.4I306 T313 G314I306-G310 WeakPolarHBondContact O-CA 3.05Å; I306-G310 PolarHBondContact O-N 3.23Å; G310-T313 PolarHBondContact O-N 2.78Å; G310-G314 PolarHBondContact O-N 3.39Å
311G92.1Very high91.2Very high39 Ų3955.8 Ų55.840%0.40232%0.315SS..Hα-helixtrans-61.7-48.7176.200000113.1L307 G314 L315L307-G311 WeakPolarHBondContact O-CA 3.41Å; L307-G311 PolarHBondContact O-N 3.09Å; G311-G314 PolarHBondContact O-N 3.45Å; G311-L315 PolarHBondContact O-N 2.88Å
312D90.7Very high90.8Very high10 Ų1062 Ų625%0.05334%0.343CS..Hα-helixtrans-63.8-43.4176.6-174.473.4000111.8L217 Y266 L308 G314 L315 A316L217-D312 HydrophobicContact CD1-CB 4.02Å; Y266-D312 VanDerWaalsContact CE2-OD2 3.31Å; Y266-D312 WeakPolarHBondContact CE2-OD2 3.29Å; Y266-D312 PolarHBondContact OH-OD2 2.89Å; L308-D312 WeakPolarHBondContact O-CB 3.48Å; L308-D312 PolarHBondContact O-N 3.44Å; D312-G314 VanDerWaalsContact C-N 3.32Å; D312-G314 PolarHBondContact O-N 3.12Å; D312-L315 PolarHBondContact O-N 3.39Å; D312-A316 WeakPolarHBondContact O-CB 3.28Å; D312-A316 PolarHBondContact O-N 3.46Å
313T90.4Very high89.8Confident46 Ų4661.3 Ų61.328%0.28234%0.339SS..Hα-helixtrans-59.7-43.8175.2-55.60000111.2Y266 G309 G310 A316 I317Y266-T313 WeakPolarHBondContact OH-CA 3.36Å; Y266-T313 PolarHBondContact OH-N 2.93Å; Y266-T313 PolarHBondContact OH-OG1 3.06Å; G309-T313 VanDerWaalsContact O-CB 3.27Å; G309-T313 WeakPolarHBondContact O-CB 3.38Å; G309-T313 PolarHBondContact O-N 3.02Å; G309-T313 PolarHBondContact O-OG1 2.76Å; G310-T313 PolarHBondContact O-N 2.78Å; T313-A316 PolarHBondContact O-N 3Å; T313-I317 HydrophobicContact CG2-CD1 4.06Å; T313-I317 VanDerWaalsContact O-CG1 3.27Å; T313-I317 WeakPolarHBondContact O-CG1 3.33Å; T313-I317 PolarHBondContact O-N 3.17Å
314G90.6Very high88.8Confident37 Ų3762.8 Ų62.838%0.38135%0.354SS..Hα-helixtrans-61.3-43.2176.300000112.5G310 G311 D312 I317 Y318G310-G314 PolarHBondContact O-N 3.39Å; G311-G314 PolarHBondContact O-N 3.45Å; D312-G314 VanDerWaalsContact C-N 3.32Å; D312-G314 PolarHBondContact O-N 3.12Å; G314-I317 PolarHBondContact O-N 3.33Å; G314-Y318 WeakPolarHBondContact O-CB 3.45Å; G314-Y318 PolarHBondContact O-N 2.96Å
315L88.2Confident87.8Confident63 Ų6363.3 Ų63.333%0.3336%0.357SS..Hα-helixtrans-65.2-41.3176-176.462.2000111.8V209 F213 G311 D312 Y318 A319V209-L315 HydrophobicContact CG1-CD2 4.15Å; F213-L315 HydrophobicContact CD2-CD2 3.75Å; F213-L315 HydrophobicContact CE2-CD2 3.66Å; F213-L315 HydrophobicContact CG-CD2 4.3Å; F213-L315 HydrophobicContact CZ-CD2 4.15Å; G311-L315 PolarHBondContact O-N 2.88Å; D312-L315 PolarHBondContact O-N 3.39Å; L315-Y318 PolarHBondContact O-N 2.83Å; L315-A319 WeakPolarHBondContact O-CB 3.42Å; L315-A319 PolarHBondContact O-N 3.16Å
316A87Confident86.6Confident8 Ų868 Ų687%0.06638%0.379CS..Hα-helixtrans-61.9-41.9175.500000112D312 T313 R320 V330 F332D312-A316 WeakPolarHBondContact O-CB 3.28Å; D312-A316 PolarHBondContact O-N 3.46Å; T313-A316 PolarHBondContact O-N 3Å; A316-R320 WeakPolarHBondContact O-CB 3.29Å; A316-R320 PolarHBondContact O-N 3.07Å; A316-V330 HydrophobicContact CB-CG1 3.9Å; A316-F332 HydrophobicContact CB-CE1 4.29Å
317I87.7Confident85.2Confident73 Ų7368.1 Ų68.137%0.37437%0.371SS..Hα-helixtrans-62.1-50.2174.2-66.8165.1000110.7T313 G314 A319 R320 L321 F332T313-I317 HydrophobicContact CG2-CD1 4.06Å; T313-I317 VanDerWaalsContact O-CG1 3.27Å; T313-I317 WeakPolarHBondContact O-CG1 3.33Å; T313-I317 PolarHBondContact O-N 3.17Å; G314-I317 PolarHBondContact O-N 3.33Å; I317-A319 VanDerWaalsContact C-N 3.34Å; I317-A319 PolarHBondContact O-N 3.27Å; I317-R320 PolarHBondContact O-N 3.27Å; I317-L321 HydrophobicContact CG2-CD1 3.97Å; I317-L321 HydrophobicContact CG2-CG 4.42Å; I317-L321 WeakPolarHBondContact O-CG 3.3Å; I317-L321 PolarHBondContact O-N 2.94Å; I317-F332 HydrophobicContact CB-CE1 4.26Å; I317-F332 HydrophobicContact CB-CZ 4.1Å; I317-F332 HydrophobicContact CG1-CD1 4.47Å; I317-F332 HydrophobicContact CG1-CE1 3.37Å; I317-F332 HydrophobicContact CG1-CZ 3.45Å; I317-F332 VanDerWaalsContact CG1-CZ 3.45Å
318Y88Confident84Confident131 Ų13164.4 Ų64.451%0.51435%0.353SS..Hα-helixtrans-58.2-45.4178.8178.1-98.2000112.4G314 L315 L321 K322G314-Y318 WeakPolarHBondContact O-CB 3.45Å; G314-Y318 PolarHBondContact O-N 2.96Å; L315-Y318 PolarHBondContact O-N 2.83Å; Y318-L321 PolarHBondContact O-N 2.96Å; Y318-K322 HydrophobicContact CD1-CD 4.42Å; Y318-K322 HydrophobicContact CE1-CD 3.73Å; Y318-K322 HydrophobicContact CE2-CD 4.11Å; Y318-K322 PolarHBondContact O-N 2.74Å; Y318-K322 VanDerWaalsContact O-N 3.11Å; Y318-K322 WeakPolarHBondContact OH-CE 3.39Å; Y318-K322 PolarHBondContact OH-NZ 3.41Å
319A83.7Confident83.3Confident29 Ų2966 Ų6624%0.2436%0.357CS..Hα-helixtrans-62.7-44.5177.600000111.5L315 I317 L321 K322 N323 V330L315-A319 WeakPolarHBondContact O-CB 3.42Å; L315-A319 PolarHBondContact O-N 3.16Å; I317-A319 VanDerWaalsContact C-N 3.34Å; I317-A319 PolarHBondContact O-N 3.27Å; A319-L321 VanDerWaalsContact C-N 3.35Å; A319-L321 PolarHBondContact O-N 2.9Å; A319-K322 PolarHBondContact O-N 3.09Å; A319-N323 WeakPolarHBondContact O-CB 3.5Å; A319-N323 PolarHBondContact O-N 2.9Å; A319-N323 PolarHBondContact O-ND2 3.29Å; A319-N323 PolarHBondContact O-OD1 3.02Å; A319-V330 HydrophobicContact CB-CG2 4.3Å
320R83.2Confident82.5Confident65 Ų6567.3 Ų67.325%0.24536%0.363CS..Hα-helixtrans-60.3-42.7177.2-174.8178.7-179.4119.9-5.6112.3A316 I317 K322 N323 R329 V330 F332A316-R320 WeakPolarHBondContact O-CB 3.29Å; A316-R320 PolarHBondContact O-N 3.07Å; I317-R320 PolarHBondContact O-N 3.27Å; R320-K322 VanDerWaalsContact C-N 3.32Å; R320-K322 PolarHBondContact O-N 3.15Å; R320-N323 PolarHBondContact O-N 2.97Å; R320-R329 HydrophobicContact CG-CB 4.11Å; R320-R329 HydrophobicContact CG-CG 4.16Å; R320-V330 PolarHBondContact NH1-O 2.83Å; R320-F332 HydrophobicContact CB-CZ 4.34Å
321L86.4Confident81.7Confident145 Ų14565.5 Ų65.576%0.75935%0.345SS*.Hα-helixtrans-69.4-29.1-179.8-68.2176.3000113I317 Y318 A319I317-L321 HydrophobicContact CG2-CD1 3.97Å; I317-L321 HydrophobicContact CG2-CG 4.42Å; I317-L321 WeakPolarHBondContact O-CG 3.3Å; I317-L321 PolarHBondContact O-N 2.94Å; Y318-L321 PolarHBondContact O-N 2.96Å; A319-L321 VanDerWaalsContact C-N 3.35Å; A319-L321 PolarHBondContact O-N 2.9Å
322K84.7Confident81.4Confident132 Ų13267.2 Ų67.257%0.57434%0.341SS*.Hα-helixtrans-87.3-18177.7-77.5-161.7166-167.50114.7Y318 A319 R320 P324Y318-K322 HydrophobicContact CD1-CD 4.42Å; Y318-K322 HydrophobicContact CE1-CD 3.73Å; Y318-K322 HydrophobicContact CE2-CD 4.11Å; Y318-K322 PolarHBondContact O-N 2.74Å; Y318-K322 VanDerWaalsContact O-N 3.11Å; Y318-K322 WeakPolarHBondContact OH-CE 3.39Å; Y318-K322 PolarHBondContact OH-NZ 3.41Å; A319-K322 PolarHBondContact O-N 3.09Å; R320-K322 VanDerWaalsContact C-N 3.32Å; R320-K322 PolarHBondContact O-N 3.15Å; K322-P324 WeakPolarHBondContact O-CD 3.31Å
323N77.2Confident81.3Confident37 Ų3767.5 Ų67.520%0.19834%0.344CS..  trans-81.4110.8-176.2-74.9-17.8000111.2A319 R320 D325 R329A319-N323 WeakPolarHBondContact O-CB 3.5Å; A319-N323 PolarHBondContact O-N 2.9Å; A319-N323 PolarHBondContact O-ND2 3.29Å; A319-N323 PolarHBondContact O-OD1 3.02Å; R320-N323 PolarHBondContact O-N 2.97Å; N323-D325 VanDerWaalsContact C-N 3.31Å; N323-R329 HydrophobicContact CB-CG 4.45Å
324P75.5Confident81.4Confident118 Ų11865.3 Ų65.377%0.76633%0.331SS*.  trans-71.5-27.9177.630.3-34.9000112K322 E326K322-P324 WeakPolarHBondContact O-CD 3.31Å; P324-E326 PolarHBondContact O-N 3.25Å
325D73.7Confident81.5Confident51 Ų5164.1 Ų64.127%0.27332%0.315SS..  trans-78.9106.3178-171.3-10.9000110.7N323 R327 T328N323-D325 VanDerWaalsContact C-N 3.31Å; D325-R327 PolarHBondContact O-N 3.45Å; D325-R327 VanDerWaalsContact OD1-CB 3.23Å; D325-R327 WeakPolarHBondContact OD1-CB 3.27Å; D325-R327 VanDerWaalsContact OD1-CG 3.27Å; D325-R327 WeakPolarHBondContact OD1-CG 3.16Å; D325-R327 IonicContact OD1-CZ 3.86Å; D325-R327 PolarHBondContact OD1-N 3.09Å; D325-R327 IonicContact OD1-NE 3.5Å; D325-R327 PolarHBondContact OD1-NE 3.39Å; D325-R327 VanDerWaalsContact OD1-NE 3.12Å; D325-R327 IonicContact OD1-NH2 2.69Å; D325-R327 IonicContact OD2-CZ 2.96Å; D325-R327 IonicContact OD2-NE 3.54Å; D325-R327 PolarHBondContact OD2-NE 3.31Å; D325-R327 IonicContact OD2-NH2 3.55Å; D325-R327 PolarHBondContact OD2-NH2 2.87Å; D325-T328 PolarHBondContact O-N 2.69Å; D325-T328 PolarHBondContact O-OG1 3.33Å
326E70.3Confident81.8Confident121 Ų12167.6 Ų67.657%0.56533%0.328SS*.G310 helixtrans-60.2-26.3-179.7-47.4-147.8122.100113P324 T328 R329P324-E326 PolarHBondContact O-N 3.25Å; E326-T328 VanDerWaalsContact C-N 3.28Å; E326-T328 PolarHBondContact O-N 2.93Å; E326-R329 IonicContact OE1-CZ 3.87Å; E326-R329 IonicContact OE1-NH1 2.64Å; E326-R329 PolarHBondContact OE1-NH1 3.43Å; E326-R329 IonicContact OE1-NH2 3.07Å; E326-R329 PolarHBondContact OE1-NH2 3.47Å
327R66.6Low82.2Confident121 Ų12167.5 Ų67.546%0.45733%0.328SS..G310 helixtrans-71.6-24.6-176.5-53.8-179-70.1-124.4-6.1113.1D325 W395D325-R327 PolarHBondContact O-N 3.45Å; D325-R327 VanDerWaalsContact OD1-CB 3.23Å; D325-R327 WeakPolarHBondContact OD1-CB 3.27Å; D325-R327 VanDerWaalsContact OD1-CG 3.27Å; D325-R327 WeakPolarHBondContact OD1-CG 3.16Å; D325-R327 IonicContact OD1-CZ 3.86Å; D325-R327 PolarHBondContact OD1-N 3.09Å; D325-R327 IonicContact OD1-NE 3.5Å; D325-R327 PolarHBondContact OD1-NE 3.39Å; D325-R327 VanDerWaalsContact OD1-NE 3.12Å; D325-R327 IonicContact OD1-NH2 2.69Å; D325-R327 IonicContact OD2-CZ 2.96Å; D325-R327 IonicContact OD2-NE 3.54Å; D325-R327 PolarHBondContact OD2-NE 3.31Å; D325-R327 IonicContact OD2-NH2 3.55Å; D325-R327 PolarHBondContact OD2-NH2 2.87Å; R327-W395 HydrophobicContact CB-CH2 4.14Å; R327-W395 HydrophobicContact CB-CZ3 4.4Å; R327-W395 HydrophobicContact CG-CE3 4.29Å; R327-W395 HydrophobicContact CG-CH2 3.48Å; R327-W395 VanDerWaalsContact CG-CH2 3.48Å; R327-W395 HydrophobicContact CG-CZ3 3.35Å
328T70.4Confident82.7Confident39 Ų3964 Ų6424%0.23931%0.31CS..G310 helixtrans-114.213.4-175.661.40000112.3D325 E326D325-T328 PolarHBondContact O-N 2.69Å; D325-T328 PolarHBondContact O-OG1 3.33Å; E326-T328 VanDerWaalsContact C-N 3.28Å; E326-T328 PolarHBondContact O-N 2.93Å
329R77.7Confident83.2Confident73 Ų7360.1 Ų60.128%0.27530%0.296SS..PPolyproline II helixtrans-63.1136.9173.1-78.8-178.1-175.3159.88.7110.4R320 N323 E326 G331R320-R329 HydrophobicContact CG-CB 4.11Å; R320-R329 HydrophobicContact CG-CG 4.16Å; N323-R329 HydrophobicContact CB-CG 4.45Å; E326-R329 IonicContact OE1-CZ 3.87Å; E326-R329 IonicContact OE1-NH1 2.64Å; E326-R329 PolarHBondContact OE1-NH1 3.43Å; E326-R329 IonicContact OE1-NH2 3.07Å; E326-R329 PolarHBondContact OE1-NH2 3.47Å; R329-G331 PolarHBondContact O-N 3.2Å
330V76Confident83.9Confident33 Ų3361.7 Ų61.720%0.230%0.3CS..PPolyproline II helixtrans-64.3126.5176.3-176.40000109.7A316 A319 R320A316-V330 HydrophobicContact CB-CG1 3.9Å; A319-V330 HydrophobicContact CB-CG2 4.3Å; R320-V330 PolarHBondContact NH1-O 2.83Å
331G75.6Confident84.6Confident5 Ų558.7 Ų58.75%0.05229%0.289CS..PPolyproline II helixtrans-87116.117900000112.4R329 S333R329-G331 PolarHBondContact O-N 3.2Å; G331-S333 VanDerWaalsContact C-N 3.3Å; G331-S333 PolarHBondContact O-N 2.97Å
332F86.2Confident85.1Confident74 Ų7451.8 Ų51.833%0.32525%0.253SS..Hα-helixtrans-70.9-26177.6-61.9-60.6000113.8A316 I317 R320 A334 H335 F336A316-F332 HydrophobicContact CB-CE1 4.29Å; I317-F332 HydrophobicContact CB-CE1 4.26Å; I317-F332 HydrophobicContact CB-CZ 4.1Å; I317-F332 HydrophobicContact CG1-CD1 4.47Å; I317-F332 HydrophobicContact CG1-CE1 3.37Å; I317-F332 HydrophobicContact CG1-CZ 3.45Å; I317-F332 VanDerWaalsContact CG1-CZ 3.45Å; R320-F332 HydrophobicContact CB-CZ 4.34Å; F332-A334 VanDerWaalsContact C-N 3.3Å; F332-A334 PolarHBondContact O-N 3.33Å; F332-H335 WeakPolarHBondContact O-CB 3.28Å; F332-H335 PolarHBondContact O-N 3.37Å; F332-F336 PolarHBondContact O-N 3.37Å
333S88.8Confident85.8Confident17 Ų1747.3 Ų47.312%0.11924%0.235CC..Hα-helixtrans-63.6-34.7-179.544.90000113.2A248 H249 S252 D253 G331 H335 G337A248-S333 WeakPolarHBondContact CB-O 3.42Å; H249-S333 VanDerWaalsContact CA-OG 3.32Å; H249-S333 WeakPolarHBondContact CA-OG 3.29Å; H249-S333 PolarHBondContact ND1-OG 3.15Å; S252-S333 WeakPolarHBondContact OG-CB 3.48Å; S252-S333 PolarHBondContact OG-OG 2.97Å; D253-S333 PolarHBondContact OD2-OG 3.11Å; G331-S333 VanDerWaalsContact C-N 3.3Å; G331-S333 PolarHBondContact O-N 2.97Å; S333-H335 VanDerWaalsContact C-N 3.33Å; S333-G337 PolarHBondContact O-N 2.79Å
334A91Very high86.8Confident0 Ų046.7 Ų46.70%023%0.232CC..Hα-helixtrans-64.6-41174.200000111.4G245 H249 L258 F332 G338G245-A334 WeakPolarHBondContact CA-O 3.37Å; G245-A334 WeakPolarHBondContact O-CA 3.42Å; H249-A334 HydrophobicContact CB-CB 4.19Å; L258-A334 HydrophobicContact CD1-CB 3.69Å; L258-A334 HydrophobicContact CD2-CB 4.09Å; F332-A334 VanDerWaalsContact C-N 3.3Å; F332-A334 PolarHBondContact O-N 3.33Å; A334-G338 PolarHBondContact O-N 3.13Å
335H94.2Very high87.8Confident11 Ų1141.6 Ų41.65%0.05120%0.198CC..Hα-helixtrans-65.5-49.2177.7-63.3-168000110.4S262 Y266 F332 S333 G338 F339S262-H335 VanDerWaalsContact CB-NE2 3.32Å; S262-H335 WeakPolarHBondContact CB-NE2 3.47Å; S262-H335 PolarHBondContact OG-CD2 2.96Å; S262-H335 PolarHBondContact OG-NE2 3.05Å; Y266-H335 WeakPolarHBondContact CB-O 3.44Å; Y266-H335 HydrophobicContact CD1-CB 3.83Å; Y266-H335 WeakPolarHBondContact CD1-O 3.27Å; Y266-H335 HydrophobicContact CD2-CB 3.9Å; Y266-H335 AromaticContact CD2-CG 3.94Å; Y266-H335 HydrophobicContact CE1-CB 3.7Å; Y266-H335 HydrophobicContact CE2-CB 3.74Å; Y266-H335 AromaticContact CE2-CE1 3.93Å; Y266-H335 AromaticContact CE2-CG 3.47Å; Y266-H335 VanDerWaalsContact CE2-CG 3.47Å; Y266-H335 AromaticContact CE2-ND1 3.4Å; Y266-H335 WeakPolarHBondContact CE2-ND1 3.35Å; Y266-H335 HydrophobicContact CG-CB 3.91Å; Y266-H335 AromaticContact CZ-CG 3.63Å; Y266-H335 AromaticContact CZ-ND1 3.36Å; Y266-H335 PolarHBondContact OH-ND1 2.85Å; Y266-H335 VanDerWaalsContact OH-ND1 3.09Å; F332-H335 WeakPolarHBondContact O-CB 3.28Å; F332-H335 PolarHBondContact O-N 3.37Å; S333-H335 VanDerWaalsContact C-N 3.33Å; H335-G338 PolarHBondContact O-N 2.83Å; H335-F339 WeakPolarHBondContact O-CB 3.36Å; H335-F339 PolarHBondContact O-N 3.14Å
336F94.2Very high88.9Confident136 Ų13639.3 Ų39.360%0.59619%0.187SC*.Hα-helixtrans-66.2-44-179.8-173-110.6000112.6F332 G338 F339 I340F332-F336 PolarHBondContact O-N 3.37Å; F336-G338 PolarHBondContact O-N 2.9Å; F336-F339 PolarHBondContact O-N 3.3Å; F336-I340 HydrophobicContact CD1-CG1 4.36Å; F336-I340 HydrophobicContact CD2-CG1 4.45Å; F336-I340 HydrophobicContact CE1-CG1 3.96Å; F336-I340 HydrophobicContact CE2-CD1 4.1Å; F336-I340 HydrophobicContact CE2-CG1 4.05Å; F336-I340 HydrophobicContact CZ-CD1 3.95Å; F336-I340 HydrophobicContact CZ-CG1 3.79Å; F336-I340 WeakPolarHBondContact O-CG1 3.47Å; F336-I340 PolarHBondContact O-N 2.93Å
337G96.2Very high90.1Very high7 Ų734.1 Ų34.17%0.07216%0.163CC..Hα-helixtrans-61.1-43.2175.800000112.2S333 A341S333-G337 PolarHBondContact O-N 2.79Å; G337-A341 VanDerWaalsContact O-CB 3.27Å; G337-A341 WeakPolarHBondContact O-CB 3.19Å; G337-A341 PolarHBondContact O-N 3.32Å
338G97.7Very high91.3Very high0 Ų030 Ų300%015%0.151CC..Hα-helixtrans-59.2-48.1172.100000112.2G263 A267 A334 H335 F336 A341 G342G263-G338 VanDerWaalsContact O-CA 3.32Å; G263-G338 WeakPolarHBondContact O-CA 3.22Å; A267-G338 WeakPolarHBondContact CA-O 3.45Å; A267-G338 WeakPolarHBondContact CB-O 3.04Å; A267-G338 PolarHBondContact N-O 2.79Å; A334-G338 PolarHBondContact O-N 3.13Å; H335-G338 PolarHBondContact O-N 2.83Å; F336-G338 PolarHBondContact O-N 2.9Å; G338-A341 PolarHBondContact O-N 3.32Å; G338-G342 PolarHBondContact O-N 2.95Å
339F97.7Very high92.4Very high49 Ų4929.2 Ų29.222%0.21515%0.146CC..Hα-helixtrans-58.8-50178.7174.8-101.3000113.1Y266 I269 L273 H335 F336 G342 L343Y266-F339 HydrophobicContact CD1-CB 4.23Å; Y266-F339 WeakPolarHBondContact O-CA 3.34Å; I269-F339 HydrophobicContact CB-CD2 4.38Å; I269-F339 HydrophobicContact CG2-CD2 3.89Å; I269-F339 HydrophobicContact CG2-CE2 3.94Å; L273-F339 HydrophobicContact CD2-CE2 4.25Å; L273-F339 HydrophobicContact CD2-CZ 3.75Å; H335-F339 WeakPolarHBondContact O-CB 3.36Å; H335-F339 PolarHBondContact O-N 3.14Å; F336-F339 PolarHBondContact O-N 3.3Å; F339-G342 PolarHBondContact O-N 3.4Å; F339-L343 PolarHBondContact O-N 3.31Å
340I97.8Very high93Very high61 Ų6126.2 Ų26.231%0.31314%0.135SC..Hα-helixtrans-64.3-43.8179.1-64-61000110.6F336 G342 L343 L344F336-I340 HydrophobicContact CD1-CG1 4.36Å; F336-I340 HydrophobicContact CD2-CG1 4.45Å; F336-I340 HydrophobicContact CE1-CG1 3.96Å; F336-I340 HydrophobicContact CE2-CD1 4.1Å; F336-I340 HydrophobicContact CE2-CG1 4.05Å; F336-I340 HydrophobicContact CZ-CD1 3.95Å; F336-I340 HydrophobicContact CZ-CG1 3.79Å; F336-I340 WeakPolarHBondContact O-CG1 3.47Å; F336-I340 PolarHBondContact O-N 2.93Å; I340-G342 VanDerWaalsContact C-N 3.32Å; I340-G342 PolarHBondContact O-N 2.93Å; I340-L343 PolarHBondContact O-N 2.76Å; I340-L344 HydrophobicContact CG2-CD1 3.99Å; I340-L344 HydrophobicContact CG2-CG 4.31Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.36Å; I340-L344 PolarHBondContact O-N 3.14Å
341A98.2Very high93.2Very high3 Ų325 Ų253%0.02513%0.127CC..Hα-helixtrans-59.5-43.9174.900000111.8A244 G337 G338 L343 L344 L345 F370A244-A341 HydrophobicContact CB-CB 3.36Å; G337-A341 VanDerWaalsContact O-CB 3.27Å; G337-A341 WeakPolarHBondContact O-CB 3.19Å; G337-A341 PolarHBondContact O-N 3.32Å; G338-A341 PolarHBondContact O-N 3.32Å; A341-L343 PolarHBondContact O-N 3.01Å; A341-L344 PolarHBondContact O-N 3.49Å; A341-L345 HydrophobicContact CB-CD1 4.47Å; A341-L345 WeakPolarHBondContact O-CB 3.43Å; A341-L345 WeakPolarHBondContact O-CG 3.46Å; A341-L345 PolarHBondContact O-N 2.9Å; A341-F370 HydrophobicContact CB-CD2 4.34Å; A341-F370 HydrophobicContact CB-CE2 3.93Å
342G98.4Very high93.4Very high0 Ų025.6 Ų25.60%013%0.129CC..Hα-helixtrans-60-41.5175.100000113.7A267 G270 A271 G338 F339 I340 G346A267-G342 WeakPolarHBondContact O-CA 3.49Å; G270-G342 VanDerWaalsContact C-C 3.48Å; G270-G342 CarbonylContact C-O 3.25Å; A271-G342 WeakPolarHBondContact CA-O 3.29Å; A271-G342 PolarHBondContact N-O 2.95Å; G338-G342 PolarHBondContact O-N 2.95Å; F339-G342 PolarHBondContact O-N 3.4Å; I340-G342 VanDerWaalsContact C-N 3.32Å; I340-G342 PolarHBondContact O-N 2.93Å; G342-G346 VanDerWaalsContact O-CA 3.25Å; G342-G346 WeakPolarHBondContact O-CA 3.27Å; G342-G346 PolarHBondContact O-N 3.39Å
343L98.1Very high92.7Very high37 Ų3723 Ų2319%0.19412%0.118CC..Hα-helixtrans-64.4-48.9176.5179.761.6000111.3G270 L273 A274 I277 F339 I340 A341 V347G270-L343 WeakPolarHBondContact O-CA 3.4Å; L273-L343 HydrophobicContact CB-CD1 4.31Å; L273-L343 HydrophobicContact CD2-CD1 4.14Å; L273-L343 HydrophobicContact CG-CD1 4.07Å; A274-L343 HydrophobicContact CB-CD1 4.07Å; A274-L343 WeakPolarHBondContact CB-O 3.32Å; I277-L343 HydrophobicContact CD1-CD1 4.25Å; F339-L343 PolarHBondContact O-N 3.31Å; I340-L343 PolarHBondContact O-N 2.76Å; A341-L343 PolarHBondContact O-N 3.01Å; L343-V347 WeakPolarHBondContact O-CG2 3.45Å; L343-V347 PolarHBondContact O-N 2.64Å
344L98.2Very high91.8Very high25 Ų2524.6 Ų24.613%0.13112%0.123CC..Hα-helixtrans-67.6-48.7-179.3-61.5177.7000111.8I340 A341 G346 V347 V348 C366 F369 F370I340-L344 HydrophobicContact CG2-CD1 3.99Å; I340-L344 HydrophobicContact CG2-CG 4.31Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.36Å; I340-L344 PolarHBondContact O-N 3.14Å; A341-L344 PolarHBondContact O-N 3.49Å; L344-G346 VanDerWaalsContact C-N 3.3Å; L344-G346 PolarHBondContact O-N 3.22Å; L344-V347 PolarHBondContact O-N 2.78Å; L344-V348 WeakPolarHBondContact O-CG2 3.38Å; L344-V348 PolarHBondContact O-N 3.18Å; L344-C366 HydrophobicContact CB-CB 4.25Å; L344-C366 HydrophobicContact CD2-CB 4.14Å; L344-F369 HydrophobicContact CD1-CB 3.98Å; L344-F370 HydrophobicContact CD1-CB 4.2Å
345L97.8Very high91.1Very high10 Ų1025.7 Ų25.75%0.05213%0.129CC..Hα-helixtrans-73.2-24.7-179.8-63.4174.4000112.1V237 L240 A341 V347 V348 I349 F370V237-L345 HydrophobicContact CG2-CB 4.24Å; L240-L345 HydrophobicContact CB-CD1 3.41Å; L240-L345 VanDerWaalsContact CB-CD1 3.41Å; L240-L345 HydrophobicContact CD1-CD1 3.75Å; L240-L345 HydrophobicContact CD1-CD2 4.29Å; L240-L345 HydrophobicContact CG-CD1 4.24Å; A341-L345 HydrophobicContact CB-CD1 4.47Å; A341-L345 WeakPolarHBondContact O-CB 3.43Å; A341-L345 WeakPolarHBondContact O-CG 3.46Å; A341-L345 PolarHBondContact O-N 2.9Å; L345-V347 VanDerWaalsContact C-N 3.33Å; L345-V348 PolarHBondContact O-N 3.26Å; L345-I349 HydrophobicContact CB-CD1 4.08Å; L345-I349 HydrophobicContact CB-CG1 4.43Å; L345-I349 HydrophobicContact CD2-CD1 4.08Å; L345-I349 WeakPolarHBondContact O-CA 3.43Å; L345-I349 VanDerWaalsContact O-CB 3.25Å; L345-I349 WeakPolarHBondContact O-CB 3.41Å; L345-I349 WeakPolarHBondContact O-CG1 3.35Å; L345-I349 PolarHBondContact O-N 2.9Å; L345-F370 HydrophobicContact CD1-CD2 4.24Å; L345-F370 HydrophobicContact CD1-CE1 4.45Å; L345-F370 HydrophobicContact CD1-CE2 3.7Å; L345-F370 HydrophobicContact CD1-CZ 3.82Å; L345-F370 HydrophobicContact CD2-CD1 3.89Å; L345-F370 HydrophobicContact CD2-CD2 4.12Å; L345-F370 HydrophobicContact CD2-CE1 4Å; L345-F370 HydrophobicContact CD2-CE2 4.23Å; L345-F370 HydrophobicContact CD2-CG 3.95Å; L345-F370 HydrophobicContact CD2-CZ 4.17Å; L345-F370 HydrophobicContact CG-CD2 4.05Å; L345-F370 HydrophobicContact CG-CE2 4.03Å; L345-F370 HydrophobicContact CG-CG 4.38Å; L345-F370 HydrophobicContact CG-CZ 4.34Å
346G96.6Very high90.4Very high4 Ų428.1 Ų28.14%0.04114%0.141CC..Hα-helixtrans-58.3-46.8172.200000111.4G342 L344 V348 L350G342-G346 VanDerWaalsContact O-CA 3.25Å; G342-G346 WeakPolarHBondContact O-CA 3.27Å; G342-G346 PolarHBondContact O-N 3.39Å; L344-G346 VanDerWaalsContact C-N 3.3Å; L344-G346 PolarHBondContact O-N 3.22Å; G346-V348 VanDerWaalsContact C-N 3.3Å; G346-V348 PolarHBondContact O-N 2.71Å; G346-L350 WeakPolarHBondContact O-CB 3.47Å; G346-L350 WeakPolarHBondContact O-CG 3.2Å; G346-L350 PolarHBondContact O-N 3.37Å; G346-L350 VanDerWaalsContact O-N 3.11Å
347V94.1Very high89.7Confident11 Ų1128.8 Ų28.87%0.06714%0.143CC..Hα-helixtrans-63.6-36.5176.3177.60000111.9A274 M278 L343 L344 L345 F362A274-V347 HydrophobicContact CB-CG2 3.96Å; M278-V347 HydrophobicContact CE-CG1 4.12Å; M278-V347 HydrophobicContact CG-CG2 4.41Å; M278-V347 HydrophobicContact SD-CG1 4.18Å; M278-V347 HydrophobicContact SD-CG2 4.3Å; L343-V347 WeakPolarHBondContact O-CG2 3.45Å; L343-V347 PolarHBondContact O-N 2.64Å; L344-V347 PolarHBondContact O-N 2.78Å; L345-V347 VanDerWaalsContact C-N 3.33Å; V347-F362 HydrophobicContact CB-CE1 4.37Å; V347-F362 HydrophobicContact CG1-CD1 3.72Å; V347-F362 HydrophobicContact CG1-CE1 4.01Å; V347-F362 HydrophobicContact CG2-CD1 4.09Å; V347-F362 HydrophobicContact CG2-CE1 3.49Å; V347-F362 VanDerWaalsContact CG2-CE1 3.49Å; V347-F362 HydrophobicContact CG2-CZ 4.25Å
348V92.5Very high89.3Confident34 Ų3434 Ų3421%0.20616%0.161CC..Hα-helixtrans-85.7-42.8-172.6174.40000112.9L344 L345 G346 F363 C366 I367L344-V348 WeakPolarHBondContact O-CG2 3.38Å; L344-V348 PolarHBondContact O-N 3.18Å; L345-V348 PolarHBondContact O-N 3.26Å; G346-V348 VanDerWaalsContact C-N 3.3Å; G346-V348 PolarHBondContact O-N 2.71Å; V348-F363 HydrophobicContact CB-CD2 4.31Å; V348-F363 HydrophobicContact CB-CE2 4.06Å; V348-F363 HydrophobicContact CG1-CD2 4.4Å; V348-F363 HydrophobicContact CG1-CE2 3.7Å; V348-F363 HydrophobicContact CG1-CZ 4.07Å; V348-F363 HydrophobicContact CG2-CD2 4.12Å; V348-F363 HydrophobicContact CG2-CE2 4.24Å; V348-C366 HydrophobicContact CG2-CB 3.81Å; V348-I367 HydrophobicContact CB-CG1 4.49Å; V348-I367 HydrophobicContact CG1-CD1 4.1Å; V348-I367 HydrophobicContact CG1-CG1 3.91Å; V348-I367 HydrophobicContact CG2-CD1 4.47Å; V348-I367 HydrophobicContact CG2-CG1 3.67Å
349I93.1Very high88.8Confident24 Ų2434.3 Ų34.312%0.12316%0.162CC..Hα-helixtrans-100.1-35.5-168.3-58.6-177.5000111.1R233 L236 V237 L240 L345R233-I349 HydrophobicContact CB-CG2 3.96Å; R233-I349 WeakPolarHBondContact CD-O 3.47Å; R233-I349 HydrophobicContact CG-CG2 4.25Å; R233-I349 PolarHBondContact NH1-O 2.98Å; L236-I349 HydrophobicContact CB-CD1 4.09Å; L236-I349 HydrophobicContact CB-CG2 4.28Å; L236-I349 HydrophobicContact CD1-CG2 4.4Å; V237-I349 HydrophobicContact CG2-CB 3.89Å; V237-I349 HydrophobicContact CG2-CD1 4.12Å; V237-I349 HydrophobicContact CG2-CG1 4.5Å; V237-I349 HydrophobicContact CG2-CG2 4.04Å; L240-I349 HydrophobicContact CD1-CD1 3.98Å; L345-I349 HydrophobicContact CB-CD1 4.08Å; L345-I349 HydrophobicContact CB-CG1 4.43Å; L345-I349 HydrophobicContact CD2-CD1 4.08Å; L345-I349 WeakPolarHBondContact O-CA 3.43Å; L345-I349 VanDerWaalsContact O-CB 3.25Å; L345-I349 WeakPolarHBondContact O-CB 3.41Å; L345-I349 WeakPolarHBondContact O-CG1 3.35Å; L345-I349 PolarHBondContact O-N 2.9Å
350L90.7Very high88.3Confident10 Ų1036.6 Ų36.65%0.05217%0.172CC..SBendtrans-76.3164.4-177.1-56.7-175.6000111.6L225 H229 R233 V234 V237 A271 T275 G346 N352L225-L350 HydrophobicContact CD2-CD1 4.01Å; H229-L350 HydrophobicContact CB-CB 4.48Å; H229-L350 HydrophobicContact CB-CD2 3.75Å; R233-L350 HydrophobicContact CB-CD2 4.13Å; V234-L350 HydrophobicContact CG2-CD2 4.46Å; V237-L350 HydrophobicContact CG2-CD2 4.05Å; V237-L350 HydrophobicContact CG2-CG 4.39Å; A271-L350 HydrophobicContact CB-CD1 3.85Å; T275-L350 WeakPolarHBondContact OG1-CD1 3.47Å; G346-L350 WeakPolarHBondContact O-CB 3.47Å; G346-L350 WeakPolarHBondContact O-CG 3.2Å; G346-L350 PolarHBondContact O-N 3.37Å; G346-L350 VanDerWaalsContact O-N 3.11Å; L350-N352 PolarHBondContact O-N 2.71Å
351R81.4Confident88Confident7 Ų738.1 Ų38.13%0.02618%0.184CC..  trans-74.1127.5-178-55.3-163.8-64.4163.94.1109.7N123 E126 A135 V228 H229N123-R351 WeakPolarHBondContact OD1-CD 3.15Å; N123-R351 PolarHBondContact OD1-NH1 3.48Å; E126-R351 IonicContact OE2-CZ 3.91Å; E126-R351 IonicContact OE2-NH1 2.76Å; E126-R351 PolarHBondContact OE2-NH1 3.11Å; E126-R351 IonicContact OE2-NH2 3.55Å; A135-R351 PolarHBondContact O-NH2 3.06Å; V228-R351 PolarHBondContact O-NE 3.46Å; V228-R351 PolarHBondContact O-NH2 2.92Å; H229-R351 HydrophobicContact CB-CG 4.39Å; H229-R351 PolarHBondContact ND1-N 3.4Å; H229-R351 VanDerWaalsContact ND1-N 3.15Å
352N78.4Confident87.7Confident18 Ų1840.9 Ų40.910%0.09620%0.196CC..  trans-105.4113.5166.7-175.51.1000108.6D120 M278 L350 K354 V355 E359D120-N352 WeakPolarHBondContact CB-O 3.39Å; M278-N352 WeakPolarHBondContact CE-ND2 3.33Å; L350-N352 PolarHBondContact O-N 2.71Å; N352-K354 PolarHBondContact OD1-O 2.91Å; N352-V355 HydrophobicContact CB-CG2 4.37Å; N352-E359 VanDerWaalsContact ND2-CD 3.3Å; N352-E359 PolarHBondContact ND2-OE2 3.38Å
353L71.3Confident87.4Confident18 Ų1843.9 Ų43.99%0.09421%0.209CC..SBendtrans-72.9-34.3-169-62.8174.8000112.5V129 Y132 A135 N279 I282V129-L353 HydrophobicContact CG1-CD1 4Å; Y132-L353 HydrophobicContact CD2-CD1 3.7Å; Y132-L353 HydrophobicContact CE2-CD1 4.12Å; A135-L353 HydrophobicContact CB-CD1 4.01Å; A135-L353 HydrophobicContact CB-CD2 3.87Å; N279-L353 PolarHBondContact OD1-N 3.45Å; I282-L353 HydrophobicContact CD1-CB 4Å; I282-L353 HydrophobicContact CG2-CD1 4.28Å
354K71Confident87.2Confident51 Ų5150.4 Ų50.422%0.22223%0.231CC..SBendtrans-138.1122.2176.7-60.7-175.7-171.1172.60108.7Y116 I282 N352Y116-K354 HydrophobicContact CD1-CB 3.49Å; Y116-K354 VanDerWaalsContact CD1-CB 3.49Å; Y116-K354 HydrophobicContact CD1-CD 3.83Å; Y116-K354 HydrophobicContact CD1-CG 4.29Å; Y116-K354 HydrophobicContact CD2-CD 3.58Å; Y116-K354 HydrophobicContact CE1-CB 3.77Å; Y116-K354 HydrophobicContact CE1-CD 3.62Å; Y116-K354 HydrophobicContact CE1-CG 4.38Å; Y116-K354 HydrophobicContact CE2-CD 3.35Å; Y116-K354 HydrophobicContact CG-CB 3.9Å; Y116-K354 HydrophobicContact CG-CD 3.79Å; Y116-K354 HydrophobicContact CG-CG 4.36Å; I282-K354 HydrophobicContact CD1-CB 4.05Å; I282-K354 HydrophobicContact CD1-CD 3.68Å; I282-K354 HydrophobicContact CD1-CG 3.64Å; I282-K354 HydrophobicContact CG1-CD 4.33Å; N352-K354 PolarHBondContact OD1-O 2.91Å
355V76.4Confident87.2Confident23 Ų2352.6 Ų52.614%0.13924%0.242CC..BIsolated β-bridgetrans-99.6126.6-170.1-174.40000111.2D117 A118 N352 E359 K360D117-V355 PolarHBondContact N-O 2.96Å; A118-V355 PolarHBondContact N-O 3.37Å; A118-V355 PolarHBondContact O-N 3.45Å; N352-V355 HydrophobicContact CB-CG2 4.37Å; V355-E359 VanDerWaalsContact CA-OE2 3.27Å; V355-E359 WeakPolarHBondContact CA-OE2 3.34Å; V355-E359 HydrophobicContact CG1-CB 4.41Å; V355-K360 HydrophobicContact CG1-CG 3.97Å
356E78.3Confident87.1Confident63 Ų6352.2 Ų52.229%0.29424%0.24SC..  trans-97.7164.7173.7-59.8-171.3-172.500112.6Y116 D117 W358 E359Y116-E356 HydrophobicContact CD1-CG 4.38Å; D117-E356 WeakPolarHBondContact OD2-CA 3.48Å; E356-W358 PolarHBondContact O-N 3.15Å; E356-W358 VanDerWaalsContact OE2-CD1 3.26Å; E356-W358 PolarHBondContact OE2-NE1 3.2Å; E356-E359 HydrophobicContact CB-CG 4.08Å; E356-E359 PolarHBondContact N-OE2 2.85Å; E356-E359 WeakPolarHBondContact O-CB 3.4Å; E356-E359 PolarHBondContact O-N 3.24Å
357K80.9Confident87.1Confident149 Ų14954.3 Ų54.365%0.64825%0.25SS*.Hα-helixtrans-60.4-45.1-178.4-55.6-167.5-177.8168.90113.3D117 E359 K360D117-K357 VanDerWaalsContact CG-CG 3.43Å; D117-K357 WeakPolarHBondContact OD1-CE 3.34Å; D117-K357 WeakPolarHBondContact OD1-CG 3.43Å; D117-K357 IonicContact OD1-NZ 2.7Å; D117-K357 WeakPolarHBondContact OD2-CG 3.27Å; D117-K357 PolarHBondContact OD2-N 2.69Å; K357-E359 PolarHBondContact O-N 3.07Å; K357-K360 PolarHBondContact O-N 3.33Å
358W87.2Confident87.2Confident117 Ų11758.7 Ų58.744%0.44327%0.272SS..Hα-helixtrans-66.2-31.6-175.767.5-91.7000111.2I277 M278 E356 K360 V361 F362I277-W358 HydrophobicContact CG2-CH2 4.14Å; M278-W358 HydrophobicContact SD-CH2 3.85Å; M278-W358 HydrophobicContact SD-CZ3 4.23Å; E356-W358 PolarHBondContact O-N 3.15Å; E356-W358 VanDerWaalsContact OE2-CD1 3.26Å; E356-W358 PolarHBondContact OE2-NE1 3.2Å; W358-K360 VanDerWaalsContact C-N 3.33Å; W358-K360 PolarHBondContact O-N 2.95Å; W358-V361 PolarHBondContact O-N 2.92Å; W358-F362 HydrophobicContact CE3-CB 4.19Å; W358-F362 HydrophobicContact CZ3-CB 4.32Å; W358-F362 AromaticContact CZ3-CD1 3.87Å; W358-F362 HydrophobicContact CZ3-CD1 3.87Å; W358-F362 HydrophobicContact CZ3-CG 4.27Å; W358-F362 WeakPolarHBondContact O-CB 3.39Å; W358-F362 PolarHBondContact O-N 2.78Å
359E87.4Confident87.5Confident6 Ų662.9 Ų62.93%0.02829%0.288CS..Hα-helixtrans-65-34.9178.8-63.7-177.1147.100112.6M278 N352 V355 E356 K357 V361 F362 F363M278-E359 HydrophobicContact CE-CB 3.59Å; M278-E359 VanDerWaalsContact CE-CD 3.4Å; M278-E359 HydrophobicContact CE-CG 3.44Å; M278-E359 VanDerWaalsContact CE-CG 3.44Å; M278-E359 WeakPolarHBondContact CE-OE1 3.3Å; M278-E359 HydrophobicContact SD-CG 4.25Å; N352-E359 VanDerWaalsContact ND2-CD 3.3Å; N352-E359 PolarHBondContact ND2-OE2 3.38Å; V355-E359 VanDerWaalsContact CA-OE2 3.27Å; V355-E359 WeakPolarHBondContact CA-OE2 3.34Å; V355-E359 HydrophobicContact CG1-CB 4.41Å; E356-E359 HydrophobicContact CB-CG 4.08Å; E356-E359 PolarHBondContact N-OE2 2.85Å; E356-E359 WeakPolarHBondContact O-CB 3.4Å; E356-E359 PolarHBondContact O-N 3.24Å; K357-E359 PolarHBondContact O-N 3.07Å; E359-V361 VanDerWaalsContact C-N 3.33Å; E359-V361 PolarHBondContact O-N 3.35Å; E359-F362 PolarHBondContact O-N 2.78Å; E359-F363 VanDerWaalsContact O-CB 3.29Å; E359-F363 WeakPolarHBondContact O-CB 3.3Å; E359-F363 PolarHBondContact O-N 2.96Å
360K86.9Confident87.7Confident98 Ų9863.4 Ų63.443%0.42629%0.29SS..Hα-helixtrans-64.6-38.8175.4-66175.7-176.9170.30111.9V355 K357 W358V355-K360 HydrophobicContact CG1-CG 3.97Å; K357-K360 PolarHBondContact O-N 3.33Å; W358-K360 VanDerWaalsContact C-N 3.33Å; W358-K360 PolarHBondContact O-N 2.95Å
361V91Very high88Confident92 Ų9266.1 Ų66.156%0.55831%0.307SS*.Hα-helixtrans-72.1-44.3175.9-1800000109.7W358 E359 F363 W364 I365W358-V361 PolarHBondContact O-N 2.92Å; E359-V361 VanDerWaalsContact C-N 3.33Å; E359-V361 PolarHBondContact O-N 3.35Å; V361-F363 VanDerWaalsContact C-N 3.31Å; V361-F363 PolarHBondContact O-N 3.01Å; V361-W364 PolarHBondContact O-N 3.37Å; V361-I365 HydrophobicContact CG1-CD1 3.94Å; V361-I365 WeakPolarHBondContact O-CG1 3.27Å; V361-I365 PolarHBondContact O-N 3.17Å; V361-I365 VanDerWaalsContact O-N 3.09Å
362F92.6Very high88.8Confident62 Ų6270.4 Ų70.427%0.27233%0.33SS..Hα-helixtrans-60.6-39.3179-172.5-131.7000112.5M278 V347 W358 E359 W364 I365 C366M278-F362 HydrophobicContact SD-CD1 4.12Å; M278-F362 HydrophobicContact SD-CE1 4.35Å; V347-F362 HydrophobicContact CB-CE1 4.37Å; V347-F362 HydrophobicContact CG1-CD1 3.72Å; V347-F362 HydrophobicContact CG1-CE1 4.01Å; V347-F362 HydrophobicContact CG2-CD1 4.09Å; V347-F362 HydrophobicContact CG2-CE1 3.49Å; V347-F362 VanDerWaalsContact CG2-CE1 3.49Å; V347-F362 HydrophobicContact CG2-CZ 4.25Å; W358-F362 HydrophobicContact CE3-CB 4.19Å; W358-F362 HydrophobicContact CZ3-CB 4.32Å; W358-F362 AromaticContact CZ3-CD1 3.87Å; W358-F362 HydrophobicContact CZ3-CD1 3.87Å; W358-F362 HydrophobicContact CZ3-CG 4.27Å; W358-F362 WeakPolarHBondContact O-CB 3.39Å; W358-F362 PolarHBondContact O-N 2.78Å; E359-F362 PolarHBondContact O-N 2.78Å; F362-W364 PolarHBondContact O-N 3.5Å; F362-I365 WeakPolarHBondContact O-CB 3.48Å; F362-I365 PolarHBondContact O-N 3.24Å; F362-C366 PolarHBondContact O-N 3.42Å; F362-C366 PolarHBondContact O-SG 2.92Å; F362-C366 VanDerWaalsContact O-SG 3.32Å
363F92Very high89.7Confident63 Ų6373 Ų7328%0.27634%0.34SS..Hα-helixtrans-51.5-50.7172.5173.3-89.1000112.5V348 E359 V361 C366 I367V348-F363 HydrophobicContact CB-CD2 4.31Å; V348-F363 HydrophobicContact CB-CE2 4.06Å; V348-F363 HydrophobicContact CG1-CD2 4.4Å; V348-F363 HydrophobicContact CG1-CE2 3.7Å; V348-F363 HydrophobicContact CG1-CZ 4.07Å; V348-F363 HydrophobicContact CG2-CD2 4.12Å; V348-F363 HydrophobicContact CG2-CE2 4.24Å; E359-F363 VanDerWaalsContact O-CB 3.29Å; E359-F363 WeakPolarHBondContact O-CB 3.3Å; E359-F363 PolarHBondContact O-N 2.96Å; V361-F363 VanDerWaalsContact C-N 3.31Å; V361-F363 PolarHBondContact O-N 3.01Å; F363-C366 PolarHBondContact O-N 2.94Å; F363-I367 HydrophobicContact CD1-CD1 3.96Å; F363-I367 HydrophobicContact CE1-CD1 3.32Å; F363-I367 HydrophobicContact CE1-CG1 4.43Å; F363-I367 HydrophobicContact CE2-CD1 4.39Å; F363-I367 HydrophobicContact CZ-CD1 3.58Å; F363-I367 PolarHBondContact O-N 3.46Å; F363-I367 VanDerWaalsContact O-N 3.1Å
364W94.6Very high91Very high173 Ų17373 Ų7366%0.65534%0.343SS*.Hα-helixtrans-68.5-36.2179.5-71.8114.1000112.6V361 F362 C366 I367 L368V361-W364 PolarHBondContact O-N 3.37Å; F362-W364 PolarHBondContact O-N 3.5Å; W364-C366 VanDerWaalsContact C-N 3.34Å; W364-I367 HydrophobicContact CE3-CD1 4.03Å; W364-I367 HydrophobicContact CZ3-CD1 4.09Å; W364-I367 PolarHBondContact O-N 3.42Å; W364-L368 WeakPolarHBondContact O-CB 3.48Å; W364-L368 PolarHBondContact O-N 3.17Å
365I96.5Very high92.2Very high72 Ų7274.9 Ų74.937%0.36935%0.354SS..Hα-helixtrans-60.2-45.9173.4-69171.4000110.2V361 F362 I367 L368 F369V361-I365 HydrophobicContact CG1-CD1 3.94Å; V361-I365 WeakPolarHBondContact O-CG1 3.27Å; V361-I365 PolarHBondContact O-N 3.17Å; V361-I365 VanDerWaalsContact O-N 3.09Å; F362-I365 WeakPolarHBondContact O-CB 3.48Å; F362-I365 PolarHBondContact O-N 3.24Å; I365-I367 PolarHBondContact O-N 2.98Å; I365-L368 PolarHBondContact O-N 2.93Å; I365-F369 HydrophobicContact CG2-CD2 3.56Å; I365-F369 HydrophobicContact CG2-CE2 3.48Å; I365-F369 VanDerWaalsContact CG2-CE2 3.48Å; I365-F369 VanDerWaalsContact O-CD2 3.25Å; I365-F369 WeakPolarHBondContact O-CD2 3.39Å; I365-F369 PolarHBondContact O-N 2.9Å
366C96.5Very high93.2Very high1 Ų176.6 Ų76.61%0.00737%0.371CS..Hα-helixtrans-61.6-43.3178.3-700000112.6L344 V348 F362 F363 W364 F370L344-C366 HydrophobicContact CB-CB 4.25Å; L344-C366 HydrophobicContact CD2-CB 4.14Å; V348-C366 HydrophobicContact CG2-CB 3.81Å; F362-C366 PolarHBondContact O-N 3.42Å; F362-C366 PolarHBondContact O-SG 2.92Å; F362-C366 VanDerWaalsContact O-SG 3.32Å; F363-C366 PolarHBondContact O-N 2.94Å; W364-C366 VanDerWaalsContact C-N 3.34Å; C366-F370 WeakPolarHBondContact O-CB 3.06Å; C366-F370 PolarHBondContact O-N 3.45Å
367I96.2Very high94.1Very high49 Ų4973.8 Ų73.825%0.25136%0.359SS..Hα-helixtrans-59.1-49.5174.4-70177.7000110.6V348 F363 W364 I365 F369 F370 V371V348-I367 HydrophobicContact CB-CG1 4.49Å; V348-I367 HydrophobicContact CG1-CD1 4.1Å; V348-I367 HydrophobicContact CG1-CG1 3.91Å; V348-I367 HydrophobicContact CG2-CD1 4.47Å; V348-I367 HydrophobicContact CG2-CG1 3.67Å; F363-I367 HydrophobicContact CD1-CD1 3.96Å; F363-I367 HydrophobicContact CE1-CD1 3.32Å; F363-I367 HydrophobicContact CE1-CG1 4.43Å; F363-I367 HydrophobicContact CE2-CD1 4.39Å; F363-I367 HydrophobicContact CZ-CD1 3.58Å; F363-I367 PolarHBondContact O-N 3.46Å; F363-I367 VanDerWaalsContact O-N 3.1Å; W364-I367 HydrophobicContact CE3-CD1 4.03Å; W364-I367 HydrophobicContact CZ3-CD1 4.09Å; W364-I367 PolarHBondContact O-N 3.42Å; I365-I367 PolarHBondContact O-N 2.98Å; I367-F369 PolarHBondContact O-N 3.13Å; I367-F370 PolarHBondContact O-N 3.02Å; I367-V371 HydrophobicContact CG2-CG2 4.17Å; I367-V371 WeakPolarHBondContact O-CB 3.29Å; I367-V371 VanDerWaalsContact O-CG2 3.3Å; I367-V371 WeakPolarHBondContact O-CG2 3.41Å; I367-V371 PolarHBondContact O-N 3.25Å
368L97.5Very high94.8Very high102 Ų10271 Ų7153%0.53435%0.35SS..Hα-helixtrans-57.4-50.2-178.4177.664.1000111.3W364 I365 F370 V371 L372W364-L368 WeakPolarHBondContact O-CB 3.48Å; W364-L368 PolarHBondContact O-N 3.17Å; I365-L368 PolarHBondContact O-N 2.93Å; L368-F370 PolarHBondContact O-N 2.85Å; L368-V371 PolarHBondContact O-N 2.96Å; L368-L372 HydrophobicContact CD1-CD1 3.88Å; L368-L372 HydrophobicContact CD1-CG 4.07Å; L368-L372 HydrophobicContact CG-CD1 3.9Å; L368-L372 HydrophobicContact CG-CG 4.44Å; L368-L372 WeakPolarHBondContact O-CB 3.17Å; L368-L372 VanDerWaalsContact O-CG 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.29Å; L368-L372 PolarHBondContact O-N 3.18Å
369F97.7Very high95.2Very high123 Ų12369.5 Ų69.554%0.53935%0.35SS..Hα-helixtrans-62.7-42.3179.9-82.4-66.9000112.8L344 I365 I367 F373L344-F369 HydrophobicContact CD1-CB 3.98Å; I365-F369 HydrophobicContact CG2-CD2 3.56Å; I365-F369 HydrophobicContact CG2-CE2 3.48Å; I365-F369 VanDerWaalsContact CG2-CE2 3.48Å; I365-F369 VanDerWaalsContact O-CD2 3.25Å; I365-F369 WeakPolarHBondContact O-CD2 3.39Å; I365-F369 PolarHBondContact O-N 2.9Å; I367-F369 PolarHBondContact O-N 3.13Å; F369-F373 WeakPolarHBondContact O-CB 3.48Å; F369-F373 PolarHBondContact O-N 3.39Å
370F97.9Very high95.5Very high35 Ų3571.6 Ų71.615%0.15436%0.359CS..Hα-helixtrans-65.3-44.4178.7-177.6-99.4000111.9L240 A244 A341 L344 L345 C366 I367 L368 F373 A374L240-F370 HydrophobicContact CB-CZ 4.34Å; A244-F370 HydrophobicContact CB-CE2 4.28Å; A341-F370 HydrophobicContact CB-CD2 4.34Å; A341-F370 HydrophobicContact CB-CE2 3.93Å; L344-F370 HydrophobicContact CD1-CB 4.2Å; L345-F370 HydrophobicContact CD1-CD2 4.24Å; L345-F370 HydrophobicContact CD1-CE1 4.45Å; L345-F370 HydrophobicContact CD1-CE2 3.7Å; L345-F370 HydrophobicContact CD1-CZ 3.82Å; L345-F370 HydrophobicContact CD2-CD1 3.89Å; L345-F370 HydrophobicContact CD2-CD2 4.12Å; L345-F370 HydrophobicContact CD2-CE1 4Å; L345-F370 HydrophobicContact CD2-CE2 4.23Å; L345-F370 HydrophobicContact CD2-CG 3.95Å; L345-F370 HydrophobicContact CD2-CZ 4.17Å; L345-F370 HydrophobicContact CG-CD2 4.05Å; L345-F370 HydrophobicContact CG-CE2 4.03Å; L345-F370 HydrophobicContact CG-CG 4.38Å; L345-F370 HydrophobicContact CG-CZ 4.34Å; C366-F370 WeakPolarHBondContact O-CB 3.06Å; C366-F370 PolarHBondContact O-N 3.45Å; I367-F370 PolarHBondContact O-N 3.02Å; L368-F370 PolarHBondContact O-N 2.85Å; F370-F373 PolarHBondContact O-N 3.4Å; F370-A374 WeakPolarHBondContact O-CB 3.37Å; F370-A374 PolarHBondContact O-N 3Å
371V97.6Very high95.8Very high67 Ų6767.9 Ų67.941%0.40634%0.344SS..Hα-helixtrans-64.9-43.8178.41710000111.1I367 L368 F373 A374 I375I367-V371 HydrophobicContact CG2-CG2 4.17Å; I367-V371 WeakPolarHBondContact O-CB 3.29Å; I367-V371 VanDerWaalsContact O-CG2 3.3Å; I367-V371 WeakPolarHBondContact O-CG2 3.41Å; I367-V371 PolarHBondContact O-N 3.25Å; L368-V371 PolarHBondContact O-N 2.96Å; V371-F373 PolarHBondContact O-N 3.17Å; V371-A374 PolarHBondContact O-N 3.39Å; V371-I375 HydrophobicContact CG1-CD1 3.61Å; V371-I375 HydrophobicContact CG1-CG1 4.29Å; V371-I375 WeakPolarHBondContact O-CB 3.31Å; V371-I375 VanDerWaalsContact O-CG1 3.29Å; V371-I375 WeakPolarHBondContact O-CG1 3.06Å; V371-I375 PolarHBondContact O-N 3.41Å
372L97.8Very high95.8Very high97 Ų9768 Ų6851%0.50835%0.345SS..Hα-helixtrans-60.9-45.3176.3-74174.6000111.7L368 A376L368-L372 HydrophobicContact CD1-CD1 3.88Å; L368-L372 HydrophobicContact CD1-CG 4.07Å; L368-L372 HydrophobicContact CG-CD1 3.9Å; L368-L372 HydrophobicContact CG-CG 4.44Å; L368-L372 WeakPolarHBondContact O-CB 3.17Å; L368-L372 VanDerWaalsContact O-CG 3.25Å; L368-L372 WeakPolarHBondContact O-CG 3.29Å; L368-L372 PolarHBondContact O-N 3.18Å; L372-A376 VanDerWaalsContact O-CB 3.25Å; L372-A376 WeakPolarHBondContact O-CB 3.37Å; L372-A376 PolarHBondContact O-N 3.49Å
373F97.2Very high95.8Very high71 Ų7169.4 Ų69.431%0.31135%0.351SS..Hα-helixtrans-58.9-50.4175.1164.3-100.4000111.6A244 L247 A248 F369 F370 V371 I375 A376 A377A244-F373 HydrophobicContact CB-CE1 3.77Å; A244-F373 HydrophobicContact CB-CZ 4.47Å; A244-F373 WeakPolarHBondContact O-CZ 3.42Å; L247-F373 HydrophobicContact CB-CE1 4.41Å; L247-F373 HydrophobicContact CB-CZ 4.14Å; A248-F373 HydrophobicContact CB-CE2 4.23Å; A248-F373 HydrophobicContact CB-CZ 4.01Å; F369-F373 WeakPolarHBondContact O-CB 3.48Å; F369-F373 PolarHBondContact O-N 3.39Å; F370-F373 PolarHBondContact O-N 3.4Å; V371-F373 PolarHBondContact O-N 3.17Å; F373-I375 PolarHBondContact O-N 2.88Å; F373-A376 PolarHBondContact O-N 3.25Å; F373-A377 WeakPolarHBondContact O-CB 3.33Å; F373-A377 PolarHBondContact O-N 3.43Å
374A97.3Very high95.7Very high20 Ų2066.4 Ų66.417%0.16534%0.338CS..Hα-helixtrans-61.2-47.5-178.500000111.5F370 V371 A377 I378F370-A374 WeakPolarHBondContact O-CB 3.37Å; F370-A374 PolarHBondContact O-N 3Å; V371-A374 PolarHBondContact O-N 3.39Å; A374-A377 PolarHBondContact O-N 3.27Å; A374-I378 WeakPolarHBondContact O-CB 3.49Å; A374-I378 WeakPolarHBondContact O-CD1 3.27Å; A374-I378 WeakPolarHBondContact O-CG1 3.27Å; A374-I378 PolarHBondContact O-N 3.42Å
375I97.8Very high95.1Very high89 Ų8962.5 Ų62.546%0.45633%0.333SS..Hα-helixtrans-61-48.2177.7-69.2172000110.5V371 F373 A377 I378 L379V371-I375 HydrophobicContact CG1-CD1 3.61Å; V371-I375 HydrophobicContact CG1-CG1 4.29Å; V371-I375 WeakPolarHBondContact O-CB 3.31Å; V371-I375 VanDerWaalsContact O-CG1 3.29Å; V371-I375 WeakPolarHBondContact O-CG1 3.06Å; V371-I375 PolarHBondContact O-N 3.41Å; F373-I375 PolarHBondContact O-N 2.88Å; I375-A377 PolarHBondContact O-N 3.49Å; I375-I378 PolarHBondContact O-N 3.11Å; I375-L379 HydrophobicContact CG2-CD1 3.69Å; I375-L379 HydrophobicContact CG2-CG 4.19Å; I375-L379 WeakPolarHBondContact O-CB 3.09Å; I375-L379 VanDerWaalsContact O-CG 3.22Å; I375-L379 WeakPolarHBondContact O-CG 3.43Å; I375-L379 PolarHBondContact O-N 3.38Å
376A96.8Very high94.4Very high60 Ų6069 Ų6950%0.49635%0.353SS..Hα-helixtrans-60.7-44.2-179.500000112.2L372 F373 L379 F380L372-A376 VanDerWaalsContact O-CB 3.25Å; L372-A376 WeakPolarHBondContact O-CB 3.37Å; L372-A376 PolarHBondContact O-N 3.49Å; F373-A376 PolarHBondContact O-N 3.25Å; A376-L379 PolarHBondContact O-N 3.21Å; A376-F380 WeakPolarHBondContact O-CB 3.12Å; A376-F380 PolarHBondContact O-N 3.43Å
377A96Very high93.7Very high4 Ų473.7 Ų73.73%0.03338%0.377CS..Hα-helixtrans-69.9-37.5179.400000112.6L247 V251 F373 A374 I375 F380 N381L247-A377 HydrophobicContact CB-CB 3.8Å; L247-A377 HydrophobicContact CD1-CB 4.35Å; L247-A377 HydrophobicContact CD2-CB 4.04Å; L247-A377 HydrophobicContact CG-CB 4.29Å; V251-A377 HydrophobicContact CG2-CB 4.15Å; F373-A377 WeakPolarHBondContact O-CB 3.33Å; F373-A377 PolarHBondContact O-N 3.43Å; A374-A377 PolarHBondContact O-N 3.27Å; I375-A377 PolarHBondContact O-N 3.49Å; A377-F380 PolarHBondContact O-N 2.79Å; A377-N381 PolarHBondContact O-N 2.8Å; A377-N381 PolarHBondContact O-ND2 2.87Å
378I95.8Very high92.9Very high89 Ų8977.7 Ų77.746%0.45640%0.398SS..Hα-helixtrans-64.1-49.1174-70.2165.7000110L247 A374 I375 F380 N381 V382L247-I378 HydrophobicContact CD1-CG1 4.4Å; L247-I378 HydrophobicContact CD2-CG1 4.23Å; A374-I378 WeakPolarHBondContact O-CB 3.49Å; A374-I378 WeakPolarHBondContact O-CD1 3.27Å; A374-I378 WeakPolarHBondContact O-CG1 3.27Å; A374-I378 PolarHBondContact O-N 3.42Å; I375-I378 PolarHBondContact O-N 3.11Å; I378-F380 VanDerWaalsContact C-N 3.28Å; I378-F380 PolarHBondContact O-N 3.4Å; I378-N381 PolarHBondContact O-N 3.45Å; I378-N381 VanDerWaalsContact O-N 3.1Å; I378-V382 HydrophobicContact CG2-CG2 4.4Å; I378-V382 WeakPolarHBondContact O-CG2 3.23Å; I378-V382 PolarHBondContact O-N 2.62Å
379L95.5Very high92.1Very high87 Ų8779.3 Ų79.346%0.45540%0.401SS..Hα-helixtrans-60-39.9177.6-68.7173.9000111.4I375 A376 N381 V382 F383I375-L379 HydrophobicContact CG2-CD1 3.69Å; I375-L379 HydrophobicContact CG2-CG 4.19Å; I375-L379 WeakPolarHBondContact O-CB 3.09Å; I375-L379 VanDerWaalsContact O-CG 3.22Å; I375-L379 WeakPolarHBondContact O-CG 3.43Å; I375-L379 PolarHBondContact O-N 3.38Å; A376-L379 PolarHBondContact O-N 3.21Å; L379-N381 PolarHBondContact O-N 3.28Å; L379-V382 PolarHBondContact O-N 3.45Å; L379-F383 HydrophobicContact CB-CD2 4.43Å; L379-F383 HydrophobicContact CD2-CE2 3.92Å; L379-F383 WeakPolarHBondContact O-CD2 3.38Å; L379-F383 PolarHBondContact O-N 3.16Å
380F94.4Very high91.3Very high49 Ų4973.5 Ų73.522%0.21538%0.376CS..Hα-helixtrans-56.6-51.2172.7177.8-91.9000111.1S250 V251 A376 A377 I378 V382 F383 C384 K389S250-F380 WeakPolarHBondContact O-CE1 3.19Å; V251-F380 HydrophobicContact CB-CD1 4.26Å; V251-F380 HydrophobicContact CB-CE1 4.38Å; V251-F380 HydrophobicContact CG2-CB 4.14Å; V251-F380 HydrophobicContact CG2-CD1 3.61Å; V251-F380 HydrophobicContact CG2-CE1 4.2Å; V251-F380 HydrophobicContact CG2-CG 3.92Å; A376-F380 WeakPolarHBondContact O-CB 3.12Å; A376-F380 PolarHBondContact O-N 3.43Å; A377-F380 PolarHBondContact O-N 2.79Å; I378-F380 VanDerWaalsContact C-N 3.28Å; I378-F380 PolarHBondContact O-N 3.4Å; F380-V382 VanDerWaalsContact C-N 3.3Å; F380-V382 PolarHBondContact O-N 2.75Å; F380-F383 PolarHBondContact O-N 3.06Å; F380-C384 HydrophobicContact CD1-CB 4.07Å; F380-C384 HydrophobicContact CD2-CB 4.25Å; F380-C384 HydrophobicContact CE1-CB 3.78Å; F380-C384 HydrophobicContact CE2-CB 3.97Å; F380-C384 HydrophobicContact CG-CB 4.31Å; F380-C384 HydrophobicContact CZ-CB 3.73Å; F380-C384 WeakPolarHBondContact O-CA 3.18Å; F380-C384 WeakPolarHBondContact O-CB 3.31Å; F380-C384 PolarHBondContact O-N 3.03Å; F380-K389 HydrophobicContact CE2-CB 4.36Å; F380-K389 HydrophobicContact CZ-CB 4.48Å
381N93.1Very high89.7Confident20 Ų2075.1 Ų75.111%0.10739%0.39CS..Hα-helixtrans-65.3-31.7-179-78.8-80.1000113.5R192 F198 S250 A377 I378 L379R192-N381 VanDerWaalsContact CD-OD1 3.28Å; R192-N381 WeakPolarHBondContact CD-OD1 3.49Å; R192-N381 PolarHBondContact NE-OD1 2.86Å; F198-N381 HydrophobicContact CZ-CB 4.43Å; S250-N381 WeakPolarHBondContact CB-OD1 3.27Å; S250-N381 PolarHBondContact OG-ND2 3.46Å; S250-N381 PolarHBondContact OG-OD1 3.32Å; A377-N381 PolarHBondContact O-N 2.8Å; A377-N381 PolarHBondContact O-ND2 2.87Å; I378-N381 PolarHBondContact O-N 3.45Å; I378-N381 VanDerWaalsContact O-N 3.1Å; L379-N381 PolarHBondContact O-N 3.28Å
382V92.2Very high87.9Confident94 Ų9475 Ų7557%0.5740%0.396SS*.Hα-helixtrans-68-40.9175171.80000111.4I378 L379 F380I378-V382 HydrophobicContact CG2-CG2 4.4Å; I378-V382 WeakPolarHBondContact O-CG2 3.23Å; I378-V382 PolarHBondContact O-N 2.62Å; L379-V382 PolarHBondContact O-N 3.45Å; F380-V382 VanDerWaalsContact C-N 3.3Å; F380-V382 PolarHBondContact O-N 2.75Å
383F91.7Very high85.9Confident93 Ų9371.9 Ų71.941%0.40838%0.382SS..Hα-helixtrans-102.7-15.3-171.6-65-63.6000115L379 F380 V385 R386 I387L379-F383 HydrophobicContact CB-CD2 4.43Å; L379-F383 HydrophobicContact CD2-CE2 3.92Å; L379-F383 WeakPolarHBondContact O-CD2 3.38Å; L379-F383 PolarHBondContact O-N 3.16Å; F380-F383 PolarHBondContact O-N 3.06Å; F383-V385 VanDerWaalsContact C-N 3.26Å; F383-V385 PolarHBondContact O-N 3.28Å; F383-V385 VanDerWaalsContact O-N 3.15Å; F383-R386 WeakPolarHBondContact O-CA 3.17Å; F383-R386 WeakPolarHBondContact O-CB 3.18Å; F383-R386 PolarHBondContact O-N 3.07Å; F383-I387 WeakPolarHBondContact O-CG1 3.37Å; F383-I387 PolarHBondContact O-N 2.83Å; F383-I387 VanDerWaalsContact O-N 3.09Å
384C89.8Confident83.6Confident0 Ų075.4 Ų75.40%040%0.403CS..THydrogen-bonded Turntrans-63.9-28-167.272.10000114.4F380 N388 K389 C390F380-C384 HydrophobicContact CD1-CB 4.07Å; F380-C384 HydrophobicContact CD2-CB 4.25Å; F380-C384 HydrophobicContact CE1-CB 3.78Å; F380-C384 HydrophobicContact CE2-CB 3.97Å; F380-C384 HydrophobicContact CG-CB 4.31Å; F380-C384 HydrophobicContact CZ-CB 3.73Å; F380-C384 WeakPolarHBondContact O-CA 3.18Å; F380-C384 WeakPolarHBondContact O-CB 3.31Å; F380-C384 PolarHBondContact O-N 3.03Å; C384-N388 PolarHBondContact O-N 2.87Å; C384-K389 HydrophobicContact CB-CB 4.22Å; C384-K389 PolarHBondContact O-N 3.36Å; C384-C390 HydrophobicContact CB-CB 3.82Å; C384-C390 WeakPolarHBondContact CB-SG 3.16Å; C384-C390 PolarHBondContact O-N 3.12Å; C384-C390 WeakPolarHBondContact SG-CB 3.27Å; C384-C390 CovalentContact SG-SG 2.04Å; C384-C390 PolarHBondContact SG-SG 2.73Å
385V82.4Confident81.3Confident90 Ų9078.7 Ų78.755%0.54541%0.411SS..THydrogen-bonded Turntrans-67-46.9171.4179.10000110.6F383 I387 N388 C390F383-V385 VanDerWaalsContact C-N 3.26Å; F383-V385 PolarHBondContact O-N 3.28Å; F383-V385 VanDerWaalsContact O-N 3.15Å; V385-I387 VanDerWaalsContact C-N 3.28Å; V385-I387 PolarHBondContact O-N 3.28Å; V385-N388 PolarHBondContact O-N 2.82Å; V385-N388 VanDerWaalsContact O-N 3.11Å; V385-C390 HydrophobicContact CG2-CB 4.48Å
386R81Confident78.5Confident209 Ų20981.8 Ų81.879%0.78943%0.428SS*.THydrogen-bonded Turntrans-62.8-33.9-179.2-172.6-180-177.1-175.91.9112.7F383 N388F383-R386 WeakPolarHBondContact O-CA 3.17Å; F383-R386 WeakPolarHBondContact O-CB 3.18Å; F383-R386 PolarHBondContact O-N 3.07Å; R386-N388 VanDerWaalsContact C-N 3.34Å
387I82.9Confident75.7Confident100 Ų10088.5 Ų88.551%0.51346%0.464SS..THydrogen-bonded Turntrans-92.413178.463.7171.2000113.3F383 V385 K389F383-I387 WeakPolarHBondContact O-CG1 3.37Å; F383-I387 PolarHBondContact O-N 2.83Å; F383-I387 VanDerWaalsContact O-N 3.09Å; V385-I387 VanDerWaalsContact C-N 3.28Å; V385-I387 PolarHBondContact O-N 3.28Å; I387-K389 HydrophobicContact CD1-CB 4.1Å; I387-K389 HydrophobicContact CD1-CG 3.63Å; I387-K389 HydrophobicContact CG1-CB 4Å; I387-K389 HydrophobicContact CG1-CG 3.75Å; I387-K389 PolarHBondContact O-N 3.11Å; I387-K389 VanDerWaalsContact O-N 3.14Å
388N79.3Confident74.7Confident132 Ų13292.7 Ų92.771%0.70649%0.485SS*.THydrogen-bonded Turntrans5429.8-179-70-20.9000114.7C384 V385 R386C384-N388 PolarHBondContact O-N 2.87Å; V385-N388 PolarHBondContact O-N 2.82Å; V385-N388 VanDerWaalsContact O-N 3.11Å; R386-N388 VanDerWaalsContact C-N 3.34Å
389K80Confident73.6Confident137 Ų13792.9 Ų92.960%0.59649%0.487SS*.SBendtrans-94.8-18.5174.5-69.3-67-175.7178.50113.2F380 C384 I387F380-K389 HydrophobicContact CE2-CB 4.36Å; F380-K389 HydrophobicContact CZ-CB 4.48Å; C384-K389 HydrophobicContact CB-CB 4.22Å; C384-K389 PolarHBondContact O-N 3.36Å; I387-K389 HydrophobicContact CD1-CB 4.1Å; I387-K389 HydrophobicContact CD1-CG 3.63Å; I387-K389 HydrophobicContact CG1-CB 4Å; I387-K389 HydrophobicContact CG1-CG 3.75Å; I387-K389 PolarHBondContact O-N 3.11Å; I387-K389 VanDerWaalsContact O-N 3.14Å
390C80.4Confident72.4Confident1 Ų193.2 Ų93.21%0.00749%0.488CS..SBendtrans-130.860.8172.9-55.70000110.9R192 C384 V385 A392R192-C390 VanDerWaalsContact CZ-SG 3.54Å; C384-C390 HydrophobicContact CB-CB 3.82Å; C384-C390 WeakPolarHBondContact CB-SG 3.16Å; C384-C390 PolarHBondContact O-N 3.12Å; C384-C390 WeakPolarHBondContact SG-CB 3.27Å; C384-C390 CovalentContact SG-SG 2.04Å; C384-C390 PolarHBondContact SG-SG 2.73Å; V385-C390 HydrophobicContact CG2-CB 4.48Å; C390-A392 PolarHBondContact O-N 3.34Å
391P65.1Low71.1Confident68 Ų6895.8 Ų95.844%0.44250%0.504SS..  trans-54.1140.4170.123.9-33.5000109.2F255 S393F255-P391 HydrophobicContact CE1-CG 3.89Å; F255-P391 HydrophobicContact CZ-CG 4.33Å; P391-S393 PolarHBondContact O-N 3.18Å
392A58.8Low69.7Low66 Ų66100.6 Ų100.655%0.54553%0.529SS..  trans-56.6111.5169.800000106.7C390 I394C390-A392 PolarHBondContact O-N 3.34Å; A392-I394 PolarHBondContact O-N 3.2Å
393S55.7Low68.2Low31 Ų31101 Ų10122%0.21753%0.527CS..  trans-63.1101.6161.748.30000104.7T190 P391 W395T190-S393 VanDerWaalsContact CG2-O 3.29Å; T190-S393 WeakPolarHBondContact CG2-O 3.46Å; P391-S393 PolarHBondContact O-N 3.18Å; S393-W395 PolarHBondContact O-N 3.19Å
394I49.9Very low66.5Low144 Ų144101.6 Ų101.674%0.73854%0.535SS*.  trans-63.999.3165.4-53.8171.7000103.2A392 N396A392-I394 PolarHBondContact O-N 3.2Å; I394-N396 VanDerWaalsContact C-N 3.32Å; I394-N396 PolarHBondContact O-N 3.01Å
395W49.7Very low64.8Low89 Ų89109.4 Ų109.434%0.33758%0.576SS.*  trans-64106.1161.9-56107.9000103.9F255 R327 S393 T397F255-W395 WeakPolarHBondContact O-CZ2 3.45Å; R327-W395 HydrophobicContact CB-CH2 4.14Å; R327-W395 HydrophobicContact CB-CZ3 4.4Å; R327-W395 HydrophobicContact CG-CE3 4.29Å; R327-W395 HydrophobicContact CG-CH2 3.48Å; R327-W395 VanDerWaalsContact CG-CH2 3.48Å; R327-W395 HydrophobicContact CG-CZ3 3.35Å; S393-W395 PolarHBondContact O-N 3.19Å; W395-T397 PolarHBondContact O-N 3.46Å
396N38.7Very low63.3Low154 Ų154111 Ų11182%0.82458%0.579SS**  trans-60.298.7162.5-76.7-11.9000105.2I394I394-N396 VanDerWaalsContact C-N 3.32Å; I394-N396 PolarHBondContact O-N 3.01Å
397T37.9Very low61.7Low201 Ų201102.1 Ų102.1100%1.23356%0.56SS**  trans-65.70167.249.30000109.6W395W395-T397 PolarHBondContact O-N 3.46Å

Retrieved 397 of 397 residues in 610.5 ms (Link to these results)

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