A0A087XCX6_POEFO Loading...

Vasoactive intestinal peptide receptor 1b

AlphaFold DB , UniProt , Accession A0A087XCX6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 301 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
1M53Low71.7Confident176 Ų17676.6 Ų76.687%0.86739%0.392SS*.  0-46.30-156.2152.1-153.900111.2D3 V4 M5M1-D3 PolarHBondContact O-N 3Å; M1-V4 WeakPolarHBondContact O-CB 3.25Å; M1-V4 PolarHBondContact O-N 3.31Å; M1-M5 PolarHBondContact O-N 3.11Å
2C57.8Low73Confident70 Ų7076.2 Ų76.247%0.47339%0.385SS..Hα-helixtrans-63.8-34.3176-520000114.4V4 M5 N6C2-V4 VanDerWaalsContact C-N 3.33Å; C2-V4 PolarHBondContact O-N 2.99Å; C2-M5 WeakPolarHBondContact O-CB 3.38Å; C2-M5 PolarHBondContact O-N 3.15Å; C2-N6 PolarHBondContact O-N 2.81Å
3D61.2Low74.1Confident50 Ų5079.2 Ų79.227%0.26740%0.397SS..Hα-helixtrans-65.9-38.1177.1-52.6-48.6000112.2M1 M5 N6 E7 I250M1-D3 PolarHBondContact O-N 3Å; D3-M5 VanDerWaalsContact C-N 3.33Å; D3-M5 PolarHBondContact O-N 3.34Å; D3-N6 PolarHBondContact O-N 2.97Å; D3-E7 WeakPolarHBondContact O-CB 3.32Å; D3-E7 PolarHBondContact O-N 3.32Å; D3-I250 WeakPolarHBondContact OD2-CD1 3.39Å
4V69.3Low75Confident12 Ų1276.2 Ų76.27%0.07339%0.387CS..Hα-helixtrans-60.4-45.9173.1-176.80000109.8M1 C2 N6 E7 I8 Y54 Y57 F58M1-V4 WeakPolarHBondContact O-CB 3.25Å; M1-V4 PolarHBondContact O-N 3.31Å; C2-V4 VanDerWaalsContact C-N 3.33Å; C2-V4 PolarHBondContact O-N 2.99Å; V4-N6 VanDerWaalsContact C-N 3.33Å; V4-N6 PolarHBondContact O-N 3.17Å; V4-E7 PolarHBondContact O-N 3Å; V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.29Å; V4-I8 PolarHBondContact O-N 3.4Å; V4-Y54 HydrophobicContact CG1-CD2 4.31Å; V4-Y54 HydrophobicContact CG1-CG 4.48Å; V4-Y57 HydrophobicContact CG2-CD1 4.45Å; V4-Y57 HydrophobicContact CG2-CD2 3.61Å; V4-Y57 HydrophobicContact CG2-CE2 4.15Å; V4-Y57 HydrophobicContact CG2-CG 3.78Å; V4-F58 HydrophobicContact CG1-CE2 3.65Å; V4-F58 HydrophobicContact CG1-CZ 3.96Å; V4-F58 HydrophobicContact CG2-CE2 4.22Å; V4-F58 HydrophobicContact CG2-CZ 4.13Å
5M68.7Low75.8Confident94 Ų9471.3 Ų71.346%0.46336%0.363SS..Hα-helixtrans-61.7-41.7177.8-163109.1-7700111.6M1 C2 D3 I8 E9M1-M5 PolarHBondContact O-N 3.11Å; C2-M5 WeakPolarHBondContact O-CB 3.38Å; C2-M5 PolarHBondContact O-N 3.15Å; D3-M5 VanDerWaalsContact C-N 3.33Å; D3-M5 PolarHBondContact O-N 3.34Å; M5-I8 HydrophobicContact CE-CD1 4.5Å; M5-I8 PolarHBondContact O-N 3.44Å; M5-E9 PolarHBondContact O-N 2.94Å
6N70.3Confident76.5Confident66 Ų6672.4 Ų72.435%0.35337%0.366SS..Hα-helixtrans-65.9-42177.2-173.450.8000112.4C2 D3 V4 I8 E9 L10C2-N6 PolarHBondContact O-N 2.81Å; D3-N6 PolarHBondContact O-N 2.97Å; V4-N6 VanDerWaalsContact C-N 3.33Å; V4-N6 PolarHBondContact O-N 3.17Å; N6-I8 VanDerWaalsContact C-N 3.31Å; N6-I8 PolarHBondContact O-N 3.37Å; N6-E9 PolarHBondContact O-N 2.98Å; N6-L10 WeakPolarHBondContact O-CB 3.29Å; N6-L10 WeakPolarHBondContact O-CG 3.17Å; N6-L10 PolarHBondContact O-N 3.32Å
7E76.9Confident77Confident52 Ų5274.6 Ų74.624%0.24338%0.379CS..Hα-helixtrans-63.9-38.3176.1-163.4174.4166.400111.2D3 V4 E11 T53 Y54D3-E7 WeakPolarHBondContact O-CB 3.32Å; D3-E7 PolarHBondContact O-N 3.32Å; V4-E7 PolarHBondContact O-N 3Å; E7-E11 WeakPolarHBondContact O-CB 3.33Å; E7-E11 WeakPolarHBondContact O-CG 3.35Å; E7-E11 PolarHBondContact O-N 2.99Å; E7-T53 WeakPolarHBondContact OE1-CB 3.31Å; E7-T53 PolarHBondContact OE1-OG1 3.3Å; E7-Y54 HydrophobicContact CG-CD1 4.34Å
8I82.2Confident77.2Confident27 Ų2779.9 Ų79.914%0.13839%0.394CS..Hα-helixtrans-64-45.1173.5-69.2167.4000111.4V4 M5 N6 E11 K12 W32 Y54V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.29Å; V4-I8 PolarHBondContact O-N 3.4Å; M5-I8 HydrophobicContact CE-CD1 4.5Å; M5-I8 PolarHBondContact O-N 3.44Å; N6-I8 VanDerWaalsContact C-N 3.31Å; N6-I8 PolarHBondContact O-N 3.37Å; I8-E11 PolarHBondContact O-N 3.33Å; I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 PolarHBondContact O-N 3.24Å; I8-W32 HydrophobicContact CG2-CZ2 3.96Å; I8-Y54 HydrophobicContact CD1-CD2 4.08Å; I8-Y54 HydrophobicContact CD1-CE2 4.1Å; I8-Y54 HydrophobicContact CD1-CG 4.47Å; I8-Y54 HydrophobicContact CG1-CD1 3.77Å; I8-Y54 HydrophobicContact CG1-CD2 3.89Å; I8-Y54 HydrophobicContact CG1-CE1 3.72Å; I8-Y54 HydrophobicContact CG1-CE2 3.89Å; I8-Y54 HydrophobicContact CG1-CG 3.87Å
9E81.1Confident77.1Confident115 Ų11577.7 Ų77.754%0.53739%0.385SS..Hα-helixtrans-63.8-43.9179.9-158.994.3-138.600111.6M5 N6 K12 E13M5-E9 PolarHBondContact O-N 2.94Å; N6-E9 PolarHBondContact O-N 2.98Å; E9-K12 WeakPolarHBondContact O-CB 3.48Å; E9-K12 PolarHBondContact O-N 2.86Å; E9-E13 PolarHBondContact O-N 3.23Å
10L84.1Confident76.5Confident97 Ų9778.8 Ų78.851%0.50840%0.4SS..Hα-helixtrans-63.5-43176.8-74.2169.3000112.1N6 K12 E13 S14N6-L10 WeakPolarHBondContact O-CB 3.29Å; N6-L10 WeakPolarHBondContact O-CG 3.17Å; N6-L10 PolarHBondContact O-N 3.32Å; L10-K12 VanDerWaalsContact C-N 3.32Å; L10-E13 PolarHBondContact O-N 3.3Å; L10-S14 VanDerWaalsContact O-CB 3.26Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.47Å
11E84.6Confident75.9Confident84 Ų8478 Ų7839%0.39341%0.412SS..Hα-helixtrans-64.7-37.8175.2-81.9-69.1135.500111.7E7 I8 S14 C15 W32E7-E11 WeakPolarHBondContact O-CB 3.33Å; E7-E11 WeakPolarHBondContact O-CG 3.35Å; E7-E11 PolarHBondContact O-N 2.99Å; I8-E11 PolarHBondContact O-N 3.33Å; E11-S14 PolarHBondContact O-N 3.47Å; E11-C15 WeakPolarHBondContact O-CB 3.47Å; E11-C15 PolarHBondContact O-N 3.15Å; E11-W32 HydrophobicContact CB-CH2 3.86Å; E11-W32 HydrophobicContact CB-CZ3 4Å
12K87.3Confident76.1Confident71 Ų7174.4 Ų74.431%0.30940%0.397SS..Hα-helixtrans-62.2-50.5174.8179.7-176.5171.4-164.90111.8I8 E9 L10 S14 C15 E16 W32I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 PolarHBondContact O-N 3.24Å; E9-K12 WeakPolarHBondContact O-CB 3.48Å; E9-K12 PolarHBondContact O-N 2.86Å; L10-K12 VanDerWaalsContact C-N 3.32Å; K12-S14 VanDerWaalsContact C-N 3.31Å; K12-S14 PolarHBondContact O-N 2.71Å; K12-C15 VanDerWaalsContact O-CB 3.31Å; K12-C15 WeakPolarHBondContact O-CB 3.16Å; K12-C15 PolarHBondContact O-N 2.95Å; K12-C15 VanDerWaalsContact O-N 3.1Å; K12-E16 WeakPolarHBondContact CE-OE1 3.37Å; K12-E16 WeakPolarHBondContact O-CG 3.49Å; K12-E16 PolarHBondContact O-N 3.3Å; K12-W32 HydrophobicContact CB-CD2 3.85Å; K12-W32 HydrophobicContact CB-CE3 4.13Å; K12-W32 HydrophobicContact CB-CG 4.37Å; K12-W32 HydrophobicContact CB-CH2 4.1Å; K12-W32 HydrophobicContact CB-CZ2 3.87Å; K12-W32 HydrophobicContact CB-CZ3 4.24Å; K12-W32 HydrophobicContact CD-CG 4.47Å; K12-W32 HydrophobicContact CG-CB 4.46Å; K12-W32 HydrophobicContact CG-CD2 3.86Å; K12-W32 HydrophobicContact CG-CE3 4.47Å; K12-W32 HydrophobicContact CG-CG 3.83Å
13E87.1Confident76Confident116 Ų11676.8 Ų76.854%0.54241%0.409SS..Hα-helixtrans-61.5-41.7179-170.7-176.3-179.200111.4E9 L10 C15 E16 N17E9-E13 PolarHBondContact O-N 3.23Å; L10-E13 PolarHBondContact O-N 3.3Å; E13-C15 VanDerWaalsContact C-N 3.3Å; E13-C15 PolarHBondContact O-N 2.97Å; E13-E16 PolarHBondContact O-N 3.03Å; E13-N17 WeakPolarHBondContact O-CB 3.32Å; E13-N17 PolarHBondContact O-N 3.48Å; E13-N17 PolarHBondContact O-ND2 3.25Å
14S87Confident75.8Confident37 Ų3778.4 Ų78.426%0.25942%0.42SS..Hα-helixtrans-60.8-38.6174.2-172.80000112.1L10 E11 K12 R18L10-S14 VanDerWaalsContact O-CB 3.26Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.47Å; E11-S14 PolarHBondContact O-N 3.47Å; K12-S14 VanDerWaalsContact C-N 3.31Å; K12-S14 PolarHBondContact O-N 2.71Å; S14-R18 VanDerWaalsContact O-CG 3.31Å; S14-R18 WeakPolarHBondContact O-CG 3.48Å; S14-R18 PolarHBondContact O-N 3.03Å; S14-R18 PolarHBondContact OG-NH2 3.18Å
15C87.3Confident75.3Confident2 Ų284 Ų841%0.01446%0.46CS..Hα-helixtrans-66.5-52.3176-170.50000111.8E11 K12 E13 N17 R18 T19 W32 C37E11-C15 WeakPolarHBondContact O-CB 3.47Å; E11-C15 PolarHBondContact O-N 3.15Å; K12-C15 VanDerWaalsContact O-CB 3.31Å; K12-C15 WeakPolarHBondContact O-CB 3.16Å; K12-C15 PolarHBondContact O-N 2.95Å; K12-C15 VanDerWaalsContact O-N 3.1Å; E13-C15 VanDerWaalsContact C-N 3.3Å; E13-C15 PolarHBondContact O-N 2.97Å; C15-N17 VanDerWaalsContact C-N 3.27Å; C15-N17 PolarHBondContact O-N 3.49Å; C15-R18 PolarHBondContact O-N 2.79Å; C15-T19 PolarHBondContact O-N 3.28Å; C15-T19 PolarHBondContact O-OG1 3.26Å; C15-W32 HydrophobicContact CB-CE3 3.72Å; C15-W32 HydrophobicContact CB-CZ3 4.3Å; C15-C37 VanDerWaalsContact CA-SG 3.58Å; C15-C37 HydrophobicContact CB-CB 3.58Å; C15-C37 WeakPolarHBondContact CB-SG 3.23Å; C15-C37 WeakPolarHBondContact SG-CA 3.44Å; C15-C37 WeakPolarHBondContact SG-CB 3.45Å; C15-C37 CovalentContact SG-SG 2.03Å; C15-C37 PolarHBondContact SG-SG 3.22Å
16E86.2Confident75.3Confident90 Ų9083.3 Ų83.342%0.42147%0.469SS..Hα-helixtrans-59.5-38.3-177.9-72.3179.117300111.8K12 E13 T19 S20K12-E16 WeakPolarHBondContact CE-OE1 3.37Å; K12-E16 WeakPolarHBondContact O-CG 3.49Å; K12-E16 PolarHBondContact O-N 3.3Å; E13-E16 PolarHBondContact O-N 3.03Å; E16-T19 VanDerWaalsContact CA-OG1 3.31Å; E16-T19 WeakPolarHBondContact CA-OG1 3.35Å; E16-T19 PolarHBondContact O-N 3.4Å; E16-T19 PolarHBondContact O-OG1 3.18Å; E16-S20 WeakPolarHBondContact O-CB 3.31Å; E16-S20 PolarHBondContact O-N 3.27Å; E16-S20 PolarHBondContact O-OG 2.91Å
17N85Confident75.8Confident110 Ų11081.6 Ų81.659%0.58847%0.467SS*.Hα-helixtrans-64.2-40.3173.7-81.4-38000112.8E13 C15E13-N17 WeakPolarHBondContact O-CB 3.32Å; E13-N17 PolarHBondContact O-N 3.48Å; E13-N17 PolarHBondContact O-ND2 3.25Å; C15-N17 VanDerWaalsContact C-N 3.27Å; C15-N17 PolarHBondContact O-N 3.49Å
18R80.6Confident76.2Confident170 Ų17079.5 Ų79.564%0.64246%0.458SS*.Hα-helixtrans-70.8-35.2177.8-71.2176.6-147.8-153.77.1112.4S14 C15S14-R18 VanDerWaalsContact O-CG 3.31Å; S14-R18 WeakPolarHBondContact O-CG 3.48Å; S14-R18 PolarHBondContact O-N 3.03Å; S14-R18 PolarHBondContact OG-NH2 3.18Å; C15-R18 PolarHBondContact O-N 2.79Å
19T74.9Confident76.3Confident37 Ų3783.8 Ų83.823%0.22748%0.478CS..Hα-helixtrans-77.4-26.3-178.648.10000112.6C15 E16 G21 N22 G30C15-T19 PolarHBondContact O-N 3.28Å; C15-T19 PolarHBondContact O-OG1 3.26Å; E16-T19 VanDerWaalsContact CA-OG1 3.31Å; E16-T19 WeakPolarHBondContact CA-OG1 3.35Å; E16-T19 PolarHBondContact O-N 3.4Å; E16-T19 PolarHBondContact O-OG1 3.18Å; T19-G21 PolarHBondContact O-N 2.94Å; T19-G21 VanDerWaalsContact O-N 3.13Å; T19-N22 PolarHBondContact O-N 3.4Å; T19-G30 VanDerWaalsContact CG2-O 3.31Å; T19-G30 WeakPolarHBondContact CG2-O 3.44Å
20S66.2Low76.6Confident99 Ų9978.9 Ų78.969%0.69246%0.458SS*.THydrogen-bonded Turntrans-64.3-14.5178.2-64.60000114.6E16E16-S20 WeakPolarHBondContact O-CB 3.31Å; E16-S20 PolarHBondContact O-N 3.27Å; E16-S20 PolarHBondContact O-OG 2.91Å
21G62.2Low76.8Confident63 Ų6377.6 Ų77.665%0.64945%0.45SS*.THydrogen-bonded Turntrans-103.5-12.1-178.300000116.8T19T19-G21 PolarHBondContact O-N 2.94Å; T19-G21 VanDerWaalsContact O-N 3.13Å
22N58.7Low76.8Confident101 Ų10175.7 Ų75.754%0.5444%0.44SS..  trans-110.482.7-171.8-93.4-21.6000112T19 T24T19-N22 PolarHBondContact O-N 3.4Å; N22-T24 PolarHBondContact O-N 3.49Å
23V55.9Low76.7Confident120 Ų12074 Ų7473%0.72743%0.434SS*.  trans-90.980.6171.9-172.30000109.3
24T57.1Low76.3Confident83 Ų8372.2 Ų72.251%0.50943%0.427SS..  trans-87.9121.4163.435.40000109.7N22 A26N22-T24 PolarHBondContact O-N 3.49Å; T24-A26 VanDerWaalsContact C-N 3.26Å; T24-A26 PolarHBondContact O-N 3.27Å
25S58.6Low76Confident129 Ų12971.8 Ų71.890%0.90242%0.423SS*.SBendtrans-77.95.2-171.149.80000115.7
26A68.4Low76Confident80 Ų8071.9 Ų71.966%0.66142%0.424SS*.SBendtrans-143.792.6178.900000110.8T24T24-A26 VanDerWaalsContact C-N 3.26Å; T24-A26 PolarHBondContact O-N 3.27Å
27G80.2Confident76.1Confident30 Ų3069.4 Ų69.431%0.30942%0.416SS..SBendtrans150.6-177.8-177.900000113.4A41G27-A41 CarbonylContact C-O 3.42Å; G27-A41 VanDerWaalsContact CA-O 3.24Å; G27-A41 WeakPolarHBondContact CA-O 3.4Å
28C85.1Confident76.3Confident9 Ų964.4 Ų64.46%0.06139%0.389CS..BIsolated β-bridgetrans-84.2127.6172.1-53.80000109.6S40 A41 C70 G74 W75C28-S40 WeakPolarHBondContact O-CA 3.47Å; C28-A41 PolarHBondContact N-O 3.48Å; C28-A41 PolarHBondContact O-N 3.08Å; C28-C70 HydrophobicContact CB-CB 3.82Å; C28-C70 WeakPolarHBondContact CB-SG 3.03Å; C28-C70 PolarHBondContact N-SG 3.37Å; C28-C70 WeakPolarHBondContact SG-CA 3.45Å; C28-C70 WeakPolarHBondContact SG-CB 3.37Å; C28-C70 CovalentContact SG-SG 2.03Å; C28-C70 PolarHBondContact SG-SG 3.43Å; C28-G74 VanDerWaalsContact SG-C 3.58Å; C28-W75 HydrophobicContact CB-CD2 3.91Å; C28-W75 VanDerWaalsContact CB-CE2 3.43Å; C28-W75 HydrophobicContact CB-CG 4.16Å; C28-W75 HydrophobicContact CB-CZ2 3.81Å
29Q85.6Confident76.7Confident117 Ų11759.3 Ų59.355%0.54738%0.378SS..PPolyproline II helixtrans-70149.8176.2-72.4-171.6-21.900111W75Q29-W75 PolarHBondContact O-NE1 2.93Å
30G86.2Confident77.3Confident12 Ų1259.3 Ų59.312%0.12438%0.38CS..PPolyproline II helixtrans-65.4141.5174.200000110.1T19 W38 S40T19-G30 VanDerWaalsContact CG2-O 3.31Å; T19-G30 WeakPolarHBondContact CG2-O 3.44Å; G30-W38 CarbonylContact C-O 3.52Å; G30-W38 WeakPolarHBondContact CA-O 3.13Å; G30-S40 PolarHBondContact N-OG 2.93Å
31M87.7Confident78.2Confident70 Ų7055 Ų5535%0.34535%0.35SS..EExtended strand (participates in β ladder)trans-148.3152.6-175.566.2179.1-64.300111.3D33 W38 W75M31-D33 HydrophobicContact CE-CB 4.15Å; M31-W38 HydrophobicContact CG-CB 4.38Å; M31-W38 PolarHBondContact N-O 2.9Å; M31-W38 WeakPolarHBondContact O-CB 3.38Å; M31-W38 PolarHBondContact O-N 3.23Å; M31-W75 HydrophobicContact SD-CB 4.47Å; M31-W75 HydrophobicContact SD-CG 4.13Å
32W86.4Confident79.4Confident43 Ų4361 Ų6116%0.16335%0.353CS..EExtended strand (participates in β ladder)trans-80.8128.4161.4-176.2-97.6000109.3I8 E11 K12 C15 I34 V35 C37I8-W32 HydrophobicContact CG2-CZ2 3.96Å; E11-W32 HydrophobicContact CB-CH2 3.86Å; E11-W32 HydrophobicContact CB-CZ3 4Å; K12-W32 HydrophobicContact CB-CD2 3.85Å; K12-W32 HydrophobicContact CB-CE3 4.13Å; K12-W32 HydrophobicContact CB-CG 4.37Å; K12-W32 HydrophobicContact CB-CH2 4.1Å; K12-W32 HydrophobicContact CB-CZ2 3.87Å; K12-W32 HydrophobicContact CB-CZ3 4.24Å; K12-W32 HydrophobicContact CD-CG 4.47Å; K12-W32 HydrophobicContact CG-CB 4.46Å; K12-W32 HydrophobicContact CG-CD2 3.86Å; K12-W32 HydrophobicContact CG-CE3 4.47Å; K12-W32 HydrophobicContact CG-CG 3.83Å; C15-W32 HydrophobicContact CB-CE3 3.72Å; C15-W32 HydrophobicContact CB-CZ3 4.3Å; W32-I34 PolarHBondContact NE1-O 3.46Å; W32-V35 WeakPolarHBondContact CH2-O 3.35Å; W32-V35 VanDerWaalsContact CZ2-O 3.25Å; W32-V35 WeakPolarHBondContact CZ2-O 3.28Å; W32-C37 HydrophobicContact CE3-CB 3.9Å; W32-C37 HydrophobicContact CZ3-CB 4Å
33D83.4Confident80.8Confident35 Ų3560.3 Ų60.319%0.18735%0.352CS..EExtended strand (participates in β ladder)trans-132.5115.9175.3-173.138.3000112.2M31 V35 A36 K68M31-D33 HydrophobicContact CE-CB 4.15Å; D33-V35 PolarHBondContact O-N 3.26Å; D33-A36 PolarHBondContact N-O 3.38Å; D33-A36 PolarHBondContact O-N 3.1Å; D33-K68 IonicContact OD2-NZ 2.82Å; D33-K68 PolarHBondContact OD2-NZ 3.15Å
34I79.1Confident82.2Confident80 Ų8057.5 Ų57.541%0.4135%0.347SS..THydrogen-bonded Turntrans58.1-70.9-179.1-57.2158.7000112.3W32 P80 I83W32-I34 PolarHBondContact NE1-O 3.46Å; I34-P80 HydrophobicContact CD1-CG 4.27Å; I34-I83 HydrophobicContact CD1-CD1 3.96Å
35V82.2Confident83.7Confident28 Ų2857.7 Ų57.717%0.1734%0.343CS..THydrogen-bonded Turntrans-137-8.8-177.3-70.70000113.2W32 D33 Y54 F55 I83W32-V35 WeakPolarHBondContact CH2-O 3.35Å; W32-V35 VanDerWaalsContact CZ2-O 3.25Å; W32-V35 WeakPolarHBondContact CZ2-O 3.28Å; D33-V35 PolarHBondContact O-N 3.26Å; V35-Y54 VanDerWaalsContact C-OH 3.32Å; V35-Y54 HydrophobicContact CB-CE2 4.45Å; V35-Y54 WeakPolarHBondContact CB-OH 3.36Å; V35-Y54 PolarHBondContact O-OH 3.46Å; V35-F55 HydrophobicContact CG2-CE2 4.18Å; V35-F55 HydrophobicContact CG2-CZ 4.16Å; V35-I83 HydrophobicContact CG2-CG2 3.99Å
36A86.6Confident85.2Confident3 Ų355.5 Ų55.53%0.02532%0.323CS..EExtended strand (participates in β ladder)trans-123.2146.7-174.300000113.2D33 I49 P52 L66D33-A36 PolarHBondContact N-O 3.38Å; D33-A36 PolarHBondContact O-N 3.1Å; A36-I49 HydrophobicContact CB-CD1 3.68Å; A36-P52 HydrophobicContact CB-CG 4.39Å; A36-L66 HydrophobicContact CB-CD1 4.32Å
37C88.5Confident86.2Confident39 Ų3952.5 Ų52.526%0.26430%0.297SS..EExtended strand (participates in β ladder)trans-88123.2174.2-173.80000111.4C15 W32C15-C37 VanDerWaalsContact CA-SG 3.58Å; C15-C37 HydrophobicContact CB-CB 3.58Å; C15-C37 WeakPolarHBondContact CB-SG 3.23Å; C15-C37 WeakPolarHBondContact SG-CA 3.44Å; C15-C37 WeakPolarHBondContact SG-CB 3.45Å; C15-C37 CovalentContact SG-SG 2.03Å; C15-C37 PolarHBondContact SG-SG 3.22Å; W32-C37 HydrophobicContact CE3-CB 3.9Å; W32-C37 HydrophobicContact CZ3-CB 4Å
38W88.8Confident86.7Confident4 Ų454.8 Ų54.82%0.01531%0.305CS..EExtended strand (participates in β ladder)trans-102.6124.2176.5-6594.2000110.9G30 M31 V47 I49 L66 K68 W75G30-W38 CarbonylContact C-O 3.52Å; G30-W38 WeakPolarHBondContact CA-O 3.13Å; M31-W38 HydrophobicContact CG-CB 4.38Å; M31-W38 PolarHBondContact N-O 2.9Å; M31-W38 WeakPolarHBondContact O-CB 3.38Å; M31-W38 PolarHBondContact O-N 3.23Å; W38-V47 HydrophobicContact CE3-CB 4.45Å; W38-V47 HydrophobicContact CE3-CG1 4.09Å; W38-V47 HydrophobicContact CZ3-CG1 4.26Å; W38-I49 HydrophobicContact CD2-CD1 4.19Å; W38-I49 HydrophobicContact CE3-CD1 4.19Å; W38-I49 HydrophobicContact CE3-CG2 4.4Å; W38-I49 HydrophobicContact CH2-CD1 3.87Å; W38-I49 HydrophobicContact CH2-CG1 3.91Å; W38-I49 HydrophobicContact CZ2-CD1 3.87Å; W38-I49 HydrophobicContact CZ2-CG1 4.38Å; W38-I49 HydrophobicContact CZ3-CD1 4.04Å; W38-I49 HydrophobicContact CZ3-CG1 3.99Å; W38-I49 HydrophobicContact CZ3-CG2 4.34Å; W38-L66 HydrophobicContact CH2-CB 3.95Å; W38-L66 HydrophobicContact CZ2-CB 4.25Å; W38-K68 HydrophobicContact CD2-CB 4.34Å; W38-K68 HydrophobicContact CD2-CD 3.79Å; W38-K68 HydrophobicContact CD2-CG 4.25Å; W38-K68 VanDerWaalsContact CE2-CD 3.45Å; W38-K68 HydrophobicContact CE3-CB 3.9Å; W38-K68 HydrophobicContact CE3-CD 4.2Å; W38-K68 HydrophobicContact CE3-CG 4.22Å; W38-K68 HydrophobicContact CG-CD 4.35Å; W38-K68 HydrophobicContact CH2-CB 3.76Å; W38-K68 HydrophobicContact CH2-CD 4.04Å; W38-K68 HydrophobicContact CH2-CG 3.49Å; W38-K68 VanDerWaalsContact CH2-CG 3.49Å; W38-K68 HydrophobicContact CZ2-CB 4.2Å; W38-K68 HydrophobicContact CZ2-CD 3.6Å; W38-K68 HydrophobicContact CZ2-CG 3.51Å; W38-K68 HydrophobicContact CZ3-CB 3.59Å; W38-K68 HydrophobicContact CZ3-CD 4.32Å; W38-K68 HydrophobicContact CZ3-CG 3.86Å; W38-W75 HydrophobicContact CB-CZ2 4.39Å
39P88.7Confident86.8Confident64 Ų6455.9 Ų55.942%0.41631%0.31SS..PPolyproline II helixtrans-71.7161.5173.731.6-35.9000111.2V47 W75P39-V47 HydrophobicContact CG-CG1 3.64Å; P39-W75 WeakPolarHBondContact O-CH2 3.24Å; P39-W75 WeakPolarHBondContact O-CZ2 3.43Å
40S87Confident86.9Confident37 Ų3755.4 Ų55.426%0.25932%0.315SS..PPolyproline II helixtrans-65.2143.8175.6-52.90000111.5C28 G30C28-S40 WeakPolarHBondContact O-CA 3.47Å; G30-S40 PolarHBondContact N-OG 2.93Å
41A86.7Confident86.9Confident7 Ų755.4 Ų55.46%0.05831%0.313CS..BIsolated β-bridgetrans-142.3155.9-174.900000112.4G27 C28 E45 V47 C70 W75G27-A41 CarbonylContact C-O 3.42Å; G27-A41 VanDerWaalsContact CA-O 3.24Å; G27-A41 WeakPolarHBondContact CA-O 3.4Å; C28-A41 PolarHBondContact N-O 3.48Å; C28-A41 PolarHBondContact O-N 3.08Å; A41-E45 HydrophobicContact CB-CB 4.33Å; A41-V47 HydrophobicContact CB-CG2 3.56Å; A41-C70 HydrophobicContact CB-CB 3.98Å; A41-W75 HydrophobicContact CB-CH2 3.47Å; A41-W75 VanDerWaalsContact CB-CH2 3.47Å; A41-W75 HydrophobicContact CB-CZ2 3.96Å; A41-W75 HydrophobicContact CB-CZ3 4.29Å
42R86.4Confident86.8Confident190 Ų19053.2 Ų53.272%0.71730%0.304SS*.  trans-82.5154.5175.8-61.8-179.8-176.3-1781.9110.8G44 E45 C70R42-G44 PolarHBondContact O-N 2.86Å; R42-E45 HydrophobicContact CB-CB 4.47Å; R42-E45 PolarHBondContact N-OE2 3.32Å; R42-E45 WeakPolarHBondContact O-CB 3.39Å; R42-E45 PolarHBondContact O-N 3.45Å; R42-C70 WeakPolarHBondContact O-CB 3.41Å; R42-C70 PolarHBondContact O-SG 2.88Å
43V87.8Confident86.5Confident86 Ų8654.7 Ų54.752%0.52132%0.318SS..THydrogen-bonded Turntrans-59.5126.6174.7-179.90000109.7A72V43-A72 HydrophobicContact CG1-CB 4.19Å
44G85.6Confident86.3Confident61 Ų6153.2 Ų53.263%0.62931%0.309SS*.THydrogen-bonded Turntrans91.8-4.7-175.200000114.8R42 C70R42-G44 PolarHBondContact O-N 2.86Å; G44-C70 PolarHBondContact N-O 3.49Å
45E87.9Confident86.2Confident88 Ų8850.7 Ų50.741%0.41130%0.296SS..  trans-83.2138.8178.9-169.8174.3-178.900111.8A41 R42 C70A41-E45 HydrophobicContact CB-CB 4.33Å; R42-E45 HydrophobicContact CB-CB 4.47Å; R42-E45 PolarHBondContact N-OE2 3.32Å; R42-E45 WeakPolarHBondContact O-CB 3.39Å; R42-E45 PolarHBondContact O-N 3.45Å; E45-C70 PolarHBondContact O-N 3.45Å
46V90.6Very high85.7Confident83 Ų8351.9 Ų51.950%0.50331%0.305SS..EExtended strand (participates in β ladder)trans-102.8113.6172.4-175.30000108.5T69V46-T69 HydrophobicContact CG2-CG2 4.09Å
47V90Very high84.7Confident16 Ų1658.2 Ų58.210%0.09733%0.329CS..EExtended strand (participates in β ladder)trans-94.1132.3176.61760000109W38 P39 A41 I49 S67 K68 W75W38-V47 HydrophobicContact CE3-CB 4.45Å; W38-V47 HydrophobicContact CE3-CG1 4.09Å; W38-V47 HydrophobicContact CZ3-CG1 4.26Å; P39-V47 HydrophobicContact CG-CG1 3.64Å; A41-V47 HydrophobicContact CB-CG2 3.56Å; V47-I49 HydrophobicContact CG1-CG2 4.2Å; V47-S67 CarbonylContact O-C 3.54Å; V47-S67 WeakPolarHBondContact O-CA 3.2Å; V47-K68 PolarHBondContact N-O 3.14Å; V47-K68 PolarHBondContact O-N 3.02Å; V47-W75 HydrophobicContact CB-CH2 4.18Å; V47-W75 HydrophobicContact CB-CZ3 4.27Å; V47-W75 HydrophobicContact CG2-CH2 3.81Å; V47-W75 HydrophobicContact CG2-CZ3 4.21Å
48T89.9Confident83.8Confident79 Ų7961.3 Ų61.349%0.48534%0.338SS..EExtended strand (participates in β ladder)trans-123.2125.5176.7-56.50000109.2N65 L66T48-N65 HydrophobicContact CG2-CB 3.64Å; T48-L66 CarbonylContact C-O 3.48Å; T48-L66 VanDerWaalsContact CA-O 3.29Å; T48-L66 WeakPolarHBondContact CA-O 3.48Å
49I88.3Confident82.7Confident32 Ų3262 Ų6216%0.16434%0.344CS..EExtended strand (participates in β ladder)trans-116.8150.2177.762.7177.6000109.7A36 W38 V47 N65 L66A36-I49 HydrophobicContact CB-CD1 3.68Å; W38-I49 HydrophobicContact CD2-CD1 4.19Å; W38-I49 HydrophobicContact CE3-CD1 4.19Å; W38-I49 HydrophobicContact CE3-CG2 4.4Å; W38-I49 HydrophobicContact CH2-CD1 3.87Å; W38-I49 HydrophobicContact CH2-CG1 3.91Å; W38-I49 HydrophobicContact CZ2-CD1 3.87Å; W38-I49 HydrophobicContact CZ2-CG1 4.38Å; W38-I49 HydrophobicContact CZ3-CD1 4.04Å; W38-I49 HydrophobicContact CZ3-CG1 3.99Å; W38-I49 HydrophobicContact CZ3-CG2 4.34Å; V47-I49 HydrophobicContact CG1-CG2 4.2Å; I49-N65 CarbonylContact O-C 3.45Å; I49-N65 VanDerWaalsContact O-CA 3.3Å; I49-N65 WeakPolarHBondContact O-CA 3.49Å; I49-L66 HydrophobicContact CD1-CB 4.43Å; I49-L66 HydrophobicContact CD1-CD1 4.5Å; I49-L66 HydrophobicContact CG1-CB 3.89Å; I49-L66 PolarHBondContact N-O 2.93Å; I49-L66 PolarHBondContact O-N 3.03Å
50T87.4Confident81.4Confident107 Ų10767.2 Ų67.266%0.65637%0.368SS*.EExtended strand (participates in β ladder)trans-72.6147.2171.849.60000110.1
51C86.8Confident80.1Confident12 Ų1273.4 Ų73.48%0.08139%0.391CS..PPolyproline II helixtrans-56.2133.1174.1-78.10000111.6G64 C87C51-G64 WeakPolarHBondContact CB-O 3.35Å; C51-G64 PolarHBondContact N-O 3.3Å; C51-G64 VanDerWaalsContact SG-C 3.51Å; C51-G64 PolarHBondContact SG-O 3.28Å; C51-C87 HydrophobicContact CB-CB 3.76Å; C51-C87 WeakPolarHBondContact CB-SG 3.32Å; C51-C87 WeakPolarHBondContact SG-CA 3.42Å; C51-C87 WeakPolarHBondContact SG-CB 3.44Å; C51-C87 CovalentContact SG-SG 2.04Å; C51-C87 PolarHBondContact SG-SG 3.29Å
52P85.1Confident78.9Confident23 Ų2377.3 Ų77.315%0.14941%0.408CS..PPolyproline II helixtrans-57.9154179.8-30.439.8000113.8A36 Y54 F55A36-P52 HydrophobicContact CB-CG 4.39Å; P52-Y54 VanDerWaalsContact C-N 3.34Å; P52-Y54 HydrophobicContact CB-CD1 3.9Å; P52-Y54 HydrophobicContact CB-CE1 3.23Å; P52-Y54 HydrophobicContact CB-CE2 3.94Å; P52-Y54 HydrophobicContact CB-CG 4.48Å; P52-Y54 WeakPolarHBondContact CB-OH 3.32Å; P52-Y54 HydrophobicContact CG-CE1 4.11Å; P52-Y54 WeakPolarHBondContact CG-OH 3.32Å; P52-Y54 PolarHBondContact O-N 3.48Å; P52-F55 HydrophobicContact CB-CD2 4.25Å; P52-F55 HydrophobicContact CG-CD2 4.48Å; P52-F55 PolarHBondContact O-N 3.1Å
53T80.6Confident77.6Confident74 Ų7480 Ų8045%0.45442%0.418SS..G310 helixtrans-63.8-36.2-172.641.20000113.6E7 F55 S56E7-T53 WeakPolarHBondContact OE1-CB 3.31Å; E7-T53 PolarHBondContact OE1-OG1 3.3Å; T53-F55 PolarHBondContact O-N 3.14Å; T53-F55 VanDerWaalsContact O-N 3.1Å; T53-S56 WeakPolarHBondContact O-CB 3.47Å; T53-S56 PolarHBondContact O-N 3.49Å; T53-S56 PolarHBondContact O-OG 2.89Å
54Y77.4Confident77Confident4 Ų476.5 Ų76.52%0.01640%0.399CS..G310 helixtrans-67.9-8.4-179.358.7-105.8000113.8V4 E7 I8 V35 P52 S56 Y57V4-Y54 HydrophobicContact CG1-CD2 4.31Å; V4-Y54 HydrophobicContact CG1-CG 4.48Å; E7-Y54 HydrophobicContact CG-CD1 4.34Å; I8-Y54 HydrophobicContact CD1-CD2 4.08Å; I8-Y54 HydrophobicContact CD1-CE2 4.1Å; I8-Y54 HydrophobicContact CD1-CG 4.47Å; I8-Y54 HydrophobicContact CG1-CD1 3.77Å; I8-Y54 HydrophobicContact CG1-CD2 3.89Å; I8-Y54 HydrophobicContact CG1-CE1 3.72Å; I8-Y54 HydrophobicContact CG1-CE2 3.89Å; I8-Y54 HydrophobicContact CG1-CG 3.87Å; V35-Y54 VanDerWaalsContact C-OH 3.32Å; V35-Y54 HydrophobicContact CB-CE2 4.45Å; V35-Y54 WeakPolarHBondContact CB-OH 3.36Å; V35-Y54 PolarHBondContact O-OH 3.46Å; P52-Y54 VanDerWaalsContact C-N 3.34Å; P52-Y54 HydrophobicContact CB-CD1 3.9Å; P52-Y54 HydrophobicContact CB-CE1 3.23Å; P52-Y54 HydrophobicContact CB-CE2 3.94Å; P52-Y54 HydrophobicContact CB-CG 4.48Å; P52-Y54 WeakPolarHBondContact CB-OH 3.32Å; P52-Y54 HydrophobicContact CG-CE1 4.11Å; P52-Y54 WeakPolarHBondContact CG-OH 3.32Å; P52-Y54 PolarHBondContact O-N 3.48Å; Y54-S56 PolarHBondContact O-N 3.03Å; Y54-Y57 WeakPolarHBondContact O-CD2 3.22Å; Y54-Y57 PolarHBondContact O-N 3.45Å
55F77.4Confident77Confident28 Ų2878.1 Ų78.112%0.12339%0.393CS..G310 helixtrans-71.2-18.1167.8-83.5-80.6000113V35 P52 T53 Y57 F58 S59 I83 C87V35-F55 HydrophobicContact CG2-CE2 4.18Å; V35-F55 HydrophobicContact CG2-CZ 4.16Å; P52-F55 HydrophobicContact CB-CD2 4.25Å; P52-F55 HydrophobicContact CG-CD2 4.48Å; P52-F55 PolarHBondContact O-N 3.1Å; T53-F55 PolarHBondContact O-N 3.14Å; T53-F55 VanDerWaalsContact O-N 3.1Å; F55-Y57 PolarHBondContact O-N 3.13Å; F55-F58 PolarHBondContact O-N 3.18Å; F55-S59 PolarHBondContact O-N 3.48Å; F55-I83 HydrophobicContact CZ-CG2 4.06Å; F55-C87 HydrophobicContact CB-CB 4.21Å; F55-C87 HydrophobicContact CD1-CB 3.77Å; F55-C87 HydrophobicContact CD2-CB 4.06Å; F55-C87 HydrophobicContact CE1-CB 4.11Å; F55-C87 HydrophobicContact CE2-CB 4.36Å; F55-C87 HydrophobicContact CG-CB 3.74Å; F55-C87 HydrophobicContact CZ-CB 4.39Å
56S71.3Confident77Confident52 Ų5274 Ų7436%0.36437%0.374SS..G310 helixtrans-60.9-26174.363.50000113.2T53 Y54 F58T53-S56 WeakPolarHBondContact O-CB 3.47Å; T53-S56 PolarHBondContact O-N 3.49Å; T53-S56 PolarHBondContact O-OG 2.89Å; Y54-S56 PolarHBondContact O-N 3.03Å; S56-F58 PolarHBondContact O-N 3.3Å
57Y66.6Low76.9Confident137 Ų13773 Ų7354%0.53737%0.371SS..G310 helixtrans-67.5-19.4174.5-67.4-77.9000113.6V4 Y54 F55V4-Y57 HydrophobicContact CG2-CD1 4.45Å; V4-Y57 HydrophobicContact CG2-CD2 3.61Å; V4-Y57 HydrophobicContact CG2-CE2 4.15Å; V4-Y57 HydrophobicContact CG2-CG 3.78Å; Y54-Y57 WeakPolarHBondContact O-CD2 3.22Å; Y54-Y57 PolarHBondContact O-N 3.45Å; F55-Y57 PolarHBondContact O-N 3.13Å
58F68.6Low76.8Confident103 Ų10372.6 Ų72.645%0.45237%0.368SS..THydrogen-bonded Turntrans-115.4-10-174.8-54.8-76000113.6V4 F55 S56 Y89V4-F58 HydrophobicContact CG1-CE2 3.65Å; V4-F58 HydrophobicContact CG1-CZ 3.96Å; V4-F58 HydrophobicContact CG2-CE2 4.22Å; V4-F58 HydrophobicContact CG2-CZ 4.13Å; F55-F58 PolarHBondContact O-N 3.18Å; S56-F58 PolarHBondContact O-N 3.3Å; F58-Y89 HydrophobicContact CB-CD2 4.43Å
59S65.9Low76.8Confident19 Ų1971.2 Ų71.213%0.13336%0.359CS..  trans-152.3127.4178.8-172.10000111.9F55 K61 G88F55-S59 PolarHBondContact O-N 3.48Å; S59-K61 PolarHBondContact O-N 3.02Å; S59-K61 VanDerWaalsContact O-N 3.17Å; S59-K61 PolarHBondContact OG-N 3.47Å; S59-G88 WeakPolarHBondContact CB-O 3.15Å; S59-G88 PolarHBondContact OG-O 3.35Å
60D61.4Low76.9Confident173 Ų17369.7 Ų69.793%0.92535%0.351SS*.SBendtrans-65.8-13.1172.1-63.7-44.6000112.8
61K61.1Low76.9Confident168 Ų16867.1 Ų67.173%0.7334%0.336SS*.  trans-103.169.4-178.1-67-173-177.71790111.2S59 R63S59-K61 PolarHBondContact O-N 3.02Å; S59-K61 VanDerWaalsContact O-N 3.17Å; S59-K61 PolarHBondContact OG-N 3.47Å; K61-R63 VanDerWaalsContact C-N 3.26Å; K61-R63 PolarHBondContact O-N 2.91Å
62Q60.1Low76.9Confident89 Ų8970.7 Ų70.742%0.41637%0.366SS..  trans-74.773.1174.7-169173.718.100112
63R59.8Low76.8Confident247 Ų24777.6 Ų77.693%0.93240%0.402SS*.  trans-149.770.5174.2-68.6-166.5178.3147.32.6112.3K61K61-R63 VanDerWaalsContact C-N 3.26Å; K61-R63 PolarHBondContact O-N 2.91Å
64G74.5Confident77Confident12 Ų1275.2 Ų75.212%0.12439%0.392CS..  trans-131.9154.4173.600000112.1C51 N86C51-G64 WeakPolarHBondContact CB-O 3.35Å; C51-G64 PolarHBondContact N-O 3.3Å; C51-G64 VanDerWaalsContact SG-C 3.51Å; C51-G64 PolarHBondContact SG-O 3.28Å; G64-N86 VanDerWaalsContact CA-O 3.24Å; G64-N86 WeakPolarHBondContact CA-O 3.43Å
65N86Confident77.5Confident94 Ų9476.8 Ų76.850%0.50340%0.398SS..EExtended strand (participates in β ladder)trans-121140.8169.7-68.6-10.1000108.9T48 I49T48-N65 HydrophobicContact CG2-CB 3.64Å; I49-N65 CarbonylContact O-C 3.45Å; I49-N65 VanDerWaalsContact O-CA 3.3Å; I49-N65 WeakPolarHBondContact O-CA 3.49Å
66L87.8Confident78Confident1 Ų178 Ų781%0.00541%0.407CS..EExtended strand (participates in β ladder)trans-100.7137.7170.9-59.2171.4000108A36 W38 T48 I49 M78 I83 N86A36-L66 HydrophobicContact CB-CD1 4.32Å; W38-L66 HydrophobicContact CH2-CB 3.95Å; W38-L66 HydrophobicContact CZ2-CB 4.25Å; T48-L66 CarbonylContact C-O 3.48Å; T48-L66 VanDerWaalsContact CA-O 3.29Å; T48-L66 WeakPolarHBondContact CA-O 3.48Å; I49-L66 HydrophobicContact CD1-CB 4.43Å; I49-L66 HydrophobicContact CD1-CD1 4.5Å; I49-L66 HydrophobicContact CG1-CB 3.89Å; I49-L66 PolarHBondContact N-O 2.93Å; I49-L66 PolarHBondContact O-N 3.03Å; L66-M78 HydrophobicContact CD2-CE 3.86Å; L66-M78 HydrophobicContact CD2-SD 4.38Å; L66-I83 HydrophobicContact CD1-CG2 3.92Å; L66-I83 HydrophobicContact CD2-CB 4.33Å; L66-I83 HydrophobicContact CD2-CG1 4.42Å; L66-I83 HydrophobicContact CD2-CG2 4.07Å; L66-N86 HydrophobicContact CD2-CB 3.84Å
67S88.6Confident78.6Confident64 Ų6484.7 Ų84.745%0.44843%0.433SS..EExtended strand (participates in β ladder)trans-128.4140.1176.556.10000111.4V47V47-S67 CarbonylContact O-C 3.54Å; V47-S67 WeakPolarHBondContact O-CA 3.2Å
68K89.1Confident79.2Confident6 Ų679.7 Ų79.73%0.02642%0.415CS..EExtended strand (participates in β ladder)trans-131.7149.7170.7-81.4-168.7179.8-165.30110.6D33 W38 V47 W75 T76D33-K68 IonicContact OD2-NZ 2.82Å; D33-K68 PolarHBondContact OD2-NZ 3.15Å; W38-K68 HydrophobicContact CD2-CB 4.34Å; W38-K68 HydrophobicContact CD2-CD 3.79Å; W38-K68 HydrophobicContact CD2-CG 4.25Å; W38-K68 VanDerWaalsContact CE2-CD 3.45Å; W38-K68 HydrophobicContact CE3-CB 3.9Å; W38-K68 HydrophobicContact CE3-CD 4.2Å; W38-K68 HydrophobicContact CE3-CG 4.22Å; W38-K68 HydrophobicContact CG-CD 4.35Å; W38-K68 HydrophobicContact CH2-CB 3.76Å; W38-K68 HydrophobicContact CH2-CD 4.04Å; W38-K68 HydrophobicContact CH2-CG 3.49Å; W38-K68 VanDerWaalsContact CH2-CG 3.49Å; W38-K68 HydrophobicContact CZ2-CB 4.2Å; W38-K68 HydrophobicContact CZ2-CD 3.6Å; W38-K68 HydrophobicContact CZ2-CG 3.51Å; W38-K68 HydrophobicContact CZ3-CB 3.59Å; W38-K68 HydrophobicContact CZ3-CD 4.32Å; W38-K68 HydrophobicContact CZ3-CG 3.86Å; V47-K68 PolarHBondContact N-O 3.14Å; V47-K68 PolarHBondContact O-N 3.02Å; K68-W75 HydrophobicContact CB-CE3 3.77Å; K68-W75 HydrophobicContact CB-CZ3 3.93Å; K68-W75 HydrophobicContact CD-CE3 4.31Å; K68-T76 WeakPolarHBondContact CE-O 3.43Å
69T90.1Very high79.8Confident50 Ų5081.2 Ų81.231%0.30742%0.423SS..EExtended strand (participates in β ladder)trans-107.9132.9176.8-53.20000109.4V46 T76V46-T69 HydrophobicContact CG2-CG2 4.09Å; T69-T76 PolarHBondContact N-OG1 3.4Å; T69-T76 VanDerWaalsContact N-OG1 3.16Å; T69-T76 PolarHBondContact O-N 3.2Å; T69-T76 VanDerWaalsContact O-N 3.15Å; T69-T76 PolarHBondContact O-OG1 3.1Å
70C89.3Confident80.5Confident0 Ų084 Ų840%044%0.44CS..EExtended strand (participates in β ladder)trans-85116.5170.4174.60000109.3C28 A41 R42 G44 E45 W75C28-C70 HydrophobicContact CB-CB 3.82Å; C28-C70 WeakPolarHBondContact CB-SG 3.03Å; C28-C70 PolarHBondContact N-SG 3.37Å; C28-C70 WeakPolarHBondContact SG-CA 3.45Å; C28-C70 WeakPolarHBondContact SG-CB 3.37Å; C28-C70 CovalentContact SG-SG 2.03Å; C28-C70 PolarHBondContact SG-SG 3.43Å; A41-C70 HydrophobicContact CB-CB 3.98Å; R42-C70 WeakPolarHBondContact O-CB 3.41Å; R42-C70 PolarHBondContact O-SG 2.88Å; G44-C70 PolarHBondContact N-O 3.49Å; E45-C70 PolarHBondContact O-N 3.45Å; C70-W75 HydrophobicContact CB-CE3 4.3Å; C70-W75 HydrophobicContact CB-CH2 4.47Å; C70-W75 HydrophobicContact CB-CZ3 4.16Å
71T88.6Confident81.3Confident54 Ų5480.6 Ų80.633%0.33142%0.422SS..EExtended strand (participates in β ladder)trans-104172.9176.970.40000110.9D73 G74 T76T71-D73 PolarHBondContact O-N 3.33Å; T71-D73 PolarHBondContact OG1-N 3.1Å; T71-G74 PolarHBondContact N-O 3.4Å; T71-G74 PolarHBondContact O-N 2.91Å; T71-G74 VanDerWaalsContact O-N 3.14Å; T71-G74 PolarHBondContact OG1-N 3.17Å; T71-G74 PolarHBondContact OG1-O 3.32Å; T71-T76 HydrophobicContact CG2-CG2 4.16Å
72A85.4Confident82.2Confident86 Ų8676.3 Ų76.371%0.71141%0.407SS*.THydrogen-bonded Turntrans-62.4-26.8176.100000112.3V43V43-A72 HydrophobicContact CG1-CB 4.19Å
73D83.9Confident83.2Confident168 Ų16872.5 Ų72.590%0.89839%0.389SS*.THydrogen-bonded Turntrans-91.3-3.1179.3-56.8-47.3000112.8T71T71-D73 PolarHBondContact O-N 3.33Å; T71-D73 PolarHBondContact OG1-N 3.1Å
74G84.8Confident84Confident24 Ų2461.7 Ų61.725%0.24735%0.353CS..EExtended strand (participates in β ladder)trans120.6-161.5179.700000114.3C28 T71C28-G74 VanDerWaalsContact SG-C 3.58Å; T71-G74 PolarHBondContact N-O 3.4Å; T71-G74 PolarHBondContact O-N 2.91Å; T71-G74 VanDerWaalsContact O-N 3.14Å; T71-G74 PolarHBondContact OG1-N 3.17Å; T71-G74 PolarHBondContact OG1-O 3.32Å
75W87.1Confident84.3Confident38 Ų3864.1 Ų64.114%0.14437%0.365CS..EExtended strand (participates in β ladder)trans-71.7140.7178.9-72.2110.7000112.2C28 Q29 M31 W38 P39 A41 V47 K68 C70C28-W75 HydrophobicContact CB-CD2 3.91Å; C28-W75 VanDerWaalsContact CB-CE2 3.43Å; C28-W75 HydrophobicContact CB-CG 4.16Å; C28-W75 HydrophobicContact CB-CZ2 3.81Å; Q29-W75 PolarHBondContact O-NE1 2.93Å; M31-W75 HydrophobicContact SD-CB 4.47Å; M31-W75 HydrophobicContact SD-CG 4.13Å; W38-W75 HydrophobicContact CB-CZ2 4.39Å; P39-W75 WeakPolarHBondContact O-CH2 3.24Å; P39-W75 WeakPolarHBondContact O-CZ2 3.43Å; A41-W75 HydrophobicContact CB-CH2 3.47Å; A41-W75 VanDerWaalsContact CB-CH2 3.47Å; A41-W75 HydrophobicContact CB-CZ2 3.96Å; A41-W75 HydrophobicContact CB-CZ3 4.29Å; V47-W75 HydrophobicContact CB-CH2 4.18Å; V47-W75 HydrophobicContact CB-CZ3 4.27Å; V47-W75 HydrophobicContact CG2-CH2 3.81Å; V47-W75 HydrophobicContact CG2-CZ3 4.21Å; K68-W75 HydrophobicContact CB-CE3 3.77Å; K68-W75 HydrophobicContact CB-CZ3 3.93Å; K68-W75 HydrophobicContact CD-CE3 4.31Å; C70-W75 HydrophobicContact CB-CE3 4.3Å; C70-W75 HydrophobicContact CB-CH2 4.47Å; C70-W75 HydrophobicContact CB-CZ3 4.16Å
76T88.4Confident84.2Confident52 Ų5263 Ų6332%0.31936%0.359SS..PPolyproline II helixtrans-63.6133.7169.650.20000111.6K68 T69 T71K68-T76 WeakPolarHBondContact CE-O 3.43Å; T69-T76 PolarHBondContact N-OG1 3.4Å; T69-T76 VanDerWaalsContact N-OG1 3.16Å; T69-T76 PolarHBondContact O-N 3.2Å; T69-T76 VanDerWaalsContact O-N 3.15Å; T69-T76 PolarHBondContact O-OG1 3.1Å; T71-T76 HydrophobicContact CG2-CG2 4.16Å
77E83Confident83.9Confident193 Ų19363.1 Ų63.190%0.90236%0.36SS*.PPolyproline II helixtrans-68.2142.5171.7-67.5-173.4175.900110.9
78M80.7Confident83.2Confident32 Ų3261.3 Ų61.316%0.15835%0.351CS..  trans-128.5132.6176.9-167.8171-172.900108.7L66 D82 I83L66-M78 HydrophobicContact CD2-CE 3.86Å; L66-M78 HydrophobicContact CD2-SD 4.38Å; M78-D82 HydrophobicContact CE-CB 3.94Å; M78-D82 HydrophobicContact CG-CB 4.4Å; M78-I83 HydrophobicContact CE-CG1 4.04Å; M78-I83 HydrophobicContact CG-CD1 4.39Å; M78-I83 HydrophobicContact CG-CG1 3.86Å; M78-I83 HydrophobicContact SD-CD1 4.43Å; M78-I83 HydrophobicContact SD-CG1 3.67Å
79H81Confident82.5Confident136 Ų13666.5 Ų66.563%0.6337%0.371SS*.  trans-74.9142.5178.5-88.7-58.9000111.1I81 D82 I83H79-I81 PolarHBondContact O-N 2.91Å; H79-I81 VanDerWaalsContact O-N 3.1Å; H79-D82 PolarHBondContact O-N 3.42Å; H79-I83 PolarHBondContact O-N 3.07Å
80P79.8Confident81.6Confident76 Ų7669.1 Ų69.149%0.49438%0.383SS..Hα-helixtrans-54.9-31.6178.9-26.633.2000114.1I34 I83 A84I34-P80 HydrophobicContact CD1-CG 4.27Å; P80-I83 PolarHBondContact O-N 2.98Å; P80-A84 PolarHBondContact O-N 3.12Å; P80-A84 VanDerWaalsContact O-N 3.11Å
81I77.6Confident80.5Confident103 Ų10374.2 Ų74.253%0.52841%0.41SS..Hα-helixtrans-67.5-41.7179-60.3171.2000110.8H79 I83 A84 V85 L91H79-I81 PolarHBondContact O-N 2.91Å; H79-I81 VanDerWaalsContact O-N 3.1Å; I81-I83 VanDerWaalsContact C-N 3.31Å; I81-I83 PolarHBondContact O-N 2.92Å; I81-A84 PolarHBondContact O-N 2.64Å; I81-V85 HydrophobicContact CG2-CG2 4.38Å; I81-V85 WeakPolarHBondContact O-CG2 3.18Å; I81-V85 PolarHBondContact O-N 3.01Å; I81-L91 HydrophobicContact CG2-CD1 3.93Å; I81-L91 HydrophobicContact CG2-CD2 4.29Å
82D81.6Confident79.4Confident78 Ų7878.8 Ų78.842%0.41743%0.433SS..Hα-helixtrans-66.4-36.5178.9-60.6-39.1000110.9M78 H79 N86M78-D82 HydrophobicContact CE-CB 3.94Å; M78-D82 HydrophobicContact CG-CB 4.4Å; H79-D82 PolarHBondContact O-N 3.42Å; D82-N86 WeakPolarHBondContact O-CB 3.27Å; D82-N86 PolarHBondContact O-N 2.94Å; D82-N86 PolarHBondContact O-OD1 3.48Å
83I80.2Confident78.1Confident8 Ų876.6 Ų76.64%0.04142%0.419CS..Hα-helixtrans-61.3-49.2173.8-61.2172.5000110.3I34 V35 F55 L66 M78 H79 P80 I81 N86 C87I34-I83 HydrophobicContact CD1-CD1 3.96Å; V35-I83 HydrophobicContact CG2-CG2 3.99Å; F55-I83 HydrophobicContact CZ-CG2 4.06Å; L66-I83 HydrophobicContact CD1-CG2 3.92Å; L66-I83 HydrophobicContact CD2-CB 4.33Å; L66-I83 HydrophobicContact CD2-CG1 4.42Å; L66-I83 HydrophobicContact CD2-CG2 4.07Å; M78-I83 HydrophobicContact CE-CG1 4.04Å; M78-I83 HydrophobicContact CG-CD1 4.39Å; M78-I83 HydrophobicContact CG-CG1 3.86Å; M78-I83 HydrophobicContact SD-CD1 4.43Å; M78-I83 HydrophobicContact SD-CG1 3.67Å; H79-I83 PolarHBondContact O-N 3.07Å; P80-I83 PolarHBondContact O-N 2.98Å; I81-I83 VanDerWaalsContact C-N 3.31Å; I81-I83 PolarHBondContact O-N 2.92Å; I83-N86 PolarHBondContact O-N 2.92Å; I83-C87 WeakPolarHBondContact O-CB 3.5Å; I83-C87 PolarHBondContact O-N 2.81Å; I83-C87 PolarHBondContact O-SG 3.37Å
84A77.3Confident76.7Confident21 Ų2174.1 Ų74.117%0.17441%0.41CS..Hα-helixtrans-61.4-47.4-179.200000111.7P80 I81 C87 G88 Y89P80-A84 PolarHBondContact O-N 3.12Å; P80-A84 VanDerWaalsContact O-N 3.11Å; I81-A84 PolarHBondContact O-N 2.64Å; A84-C87 CarbonylContact O-C 3.11Å; A84-C87 PolarHBondContact O-N 3.41Å; A84-G88 PolarHBondContact O-N 3.32Å; A84-Y89 HydrophobicContact CB-CD1 4.32Å; A84-Y89 HydrophobicContact CB-CG 4.31Å; A84-Y89 WeakPolarHBondContact O-CB 3.29Å; A84-Y89 PolarHBondContact O-N 3.32Å
85V81.1Confident75.4Confident63 Ų6377 Ų7738%0.38243%0.426SS..Hα-helixtrans-65-44.8-180173.70000111.3I81 C87 G88 L91I81-V85 HydrophobicContact CG2-CG2 4.38Å; I81-V85 WeakPolarHBondContact O-CG2 3.18Å; I81-V85 PolarHBondContact O-N 3.01Å; V85-C87 PolarHBondContact O-N 3.48Å; V85-G88 PolarHBondContact O-N 2.92Å; V85-L91 HydrophobicContact CG2-CD1 3.48Å; V85-L91 VanDerWaalsContact CG2-CD1 3.48Å; V85-L91 HydrophobicContact CG2-CG 3.91Å
86N83.1Confident73.9Confident71 Ų7180.6 Ų80.638%0.3845%0.448SS..Hα-helixtrans-63.2-31.7178-75.434000111.9G64 L66 D82 I83 G88G64-N86 VanDerWaalsContact CA-O 3.24Å; G64-N86 WeakPolarHBondContact CA-O 3.43Å; L66-N86 HydrophobicContact CD2-CB 3.84Å; D82-N86 WeakPolarHBondContact O-CB 3.27Å; D82-N86 PolarHBondContact O-N 2.94Å; D82-N86 PolarHBondContact O-OD1 3.48Å; I83-N86 PolarHBondContact O-N 2.92Å; N86-G88 VanDerWaalsContact C-N 3.26Å; N86-G88 PolarHBondContact O-N 3.47Å
87C81Confident72.6Confident3 Ų383.4 Ų83.42%0.0246%0.461CS..THydrogen-bonded Turntrans-87.114.5173.8-63.10000114.7C51 F55 I83 A84 V85C51-C87 HydrophobicContact CB-CB 3.76Å; C51-C87 WeakPolarHBondContact CB-SG 3.32Å; C51-C87 WeakPolarHBondContact SG-CA 3.42Å; C51-C87 WeakPolarHBondContact SG-CB 3.44Å; C51-C87 CovalentContact SG-SG 2.04Å; C51-C87 PolarHBondContact SG-SG 3.29Å; F55-C87 HydrophobicContact CB-CB 4.21Å; F55-C87 HydrophobicContact CD1-CB 3.77Å; F55-C87 HydrophobicContact CD2-CB 4.06Å; F55-C87 HydrophobicContact CE1-CB 4.11Å; F55-C87 HydrophobicContact CE2-CB 4.36Å; F55-C87 HydrophobicContact CG-CB 3.74Å; F55-C87 HydrophobicContact CZ-CB 4.39Å; I83-C87 WeakPolarHBondContact O-CB 3.5Å; I83-C87 PolarHBondContact O-N 2.81Å; I83-C87 PolarHBondContact O-SG 3.37Å; A84-C87 CarbonylContact O-C 3.11Å; A84-C87 PolarHBondContact O-N 3.41Å; V85-C87 PolarHBondContact O-N 3.48Å
88G74.9Confident71.7Confident26 Ų2676.2 Ų76.227%0.26844%0.439SS..THydrogen-bonded Turntrans92.410.2167.800000115S59 A84 V85 N86S59-G88 WeakPolarHBondContact CB-O 3.15Å; S59-G88 PolarHBondContact OG-O 3.35Å; A84-G88 PolarHBondContact O-N 3.32Å; V85-G88 PolarHBondContact O-N 2.92Å; N86-G88 VanDerWaalsContact C-N 3.26Å; N86-G88 PolarHBondContact O-N 3.47Å
89Y73.8Confident71.2Confident114 Ų11480.7 Ų80.745%0.44746%0.457SS..  trans-71.9127.2173.8-170.2-102.9000110.8F58 A84 L91F58-Y89 HydrophobicContact CB-CD2 4.43Å; A84-Y89 HydrophobicContact CB-CD1 4.32Å; A84-Y89 HydrophobicContact CB-CG 4.31Å; A84-Y89 WeakPolarHBondContact O-CB 3.29Å; A84-Y89 PolarHBondContact O-N 3.32Å; Y89-L91 HydrophobicContact CD1-CD2 4.3Å; Y89-L91 HydrophobicContact CE1-CD2 4.26Å
90N70.6Confident71Confident105 Ų10580.1 Ų80.156%0.56145%0.454SS*.  trans-96104.3179-171.9-11.3000110.7N92 G93N90-N92 PolarHBondContact O-N 3.44Å; N90-N92 VanDerWaalsContact O-N 3.15Å; N90-N92 PolarHBondContact OD1-N 3.18Å; N90-G93 PolarHBondContact O-N 3.39Å; N90-G93 PolarHBondContact OD1-N 3.19Å
91L66.6Low70.6Confident107 Ų10783.3 Ų83.356%0.5646%0.46SS*.THydrogen-bonded Turntrans-58-26.2178-70.5164.7000113.9I81 V85 Y89I81-L91 HydrophobicContact CG2-CD1 3.93Å; I81-L91 HydrophobicContact CG2-CD2 4.29Å; V85-L91 HydrophobicContact CG2-CD1 3.48Å; V85-L91 VanDerWaalsContact CG2-CD1 3.48Å; V85-L91 HydrophobicContact CG2-CG 3.91Å; Y89-L91 HydrophobicContact CD1-CD2 4.3Å; Y89-L91 HydrophobicContact CE1-CD2 4.26Å
92N66.4Low70.5Confident150 Ų15086 Ų8680%0.80246%0.463SS*.THydrogen-bonded Turntrans-101.31.3-179.6-70.8-15000113.1N90 T94N90-N92 PolarHBondContact O-N 3.44Å; N90-N92 VanDerWaalsContact O-N 3.15Å; N90-N92 PolarHBondContact OD1-N 3.18Å; N92-T94 PolarHBondContact O-N 3.46Å; N92-T94 VanDerWaalsContact O-N 3.1Å
93G58.1Low70.5Confident41 Ų4188.7 Ų88.742%0.42347%0.474SS..  trans-74.997174.400000109.5N90 S95N90-G93 PolarHBondContact O-N 3.39Å; N90-G93 PolarHBondContact OD1-N 3.19Å; G93-S95 VanDerWaalsContact C-N 3.29Å; G93-S95 PolarHBondContact O-N 3.25Å
94T53.8Low70.8Confident115 Ų11591.6 Ų91.671%0.70649%0.492SS*.  trans-64.698.8157.545.70000106.8N92 D96N92-T94 PolarHBondContact O-N 3.46Å; N92-T94 VanDerWaalsContact O-N 3.1Å; T94-D96 PolarHBondContact O-N 2.84Å
95S56.6Low71Confident85 Ų8593.2 Ų93.259%0.59450%0.495SS*.  trans-58.999.1172.152.30000108.5G93 D97 G98G93-S95 VanDerWaalsContact C-N 3.29Å; G93-S95 PolarHBondContact O-N 3.25Å; S95-D97 PolarHBondContact O-N 3.43Å; S95-G98 PolarHBondContact O-N 2.87Å
96D56.5Low71.2Confident114 Ų11493 Ų9361%0.6149%0.493SS*.Hα-helixtrans-60.6-24.5-178.9-156.228.4000111.4T94 G98 K99 F100T94-D96 PolarHBondContact O-N 2.84Å; D96-G98 VanDerWaalsContact C-N 3.3Å; D96-G98 PolarHBondContact O-N 2.86Å; D96-K99 PolarHBondContact O-N 2.88Å; D96-K99 VanDerWaalsContact O-N 3.09Å; D96-F100 PolarHBondContact O-N 2.98Å
97D60.3Low71.5Confident111 Ų11191.7 Ų91.759%0.59450%0.497SS*.Hα-helixtrans-54.1-42.5175.8-56.6-38.3000112.5S95 K99 F100 F101S95-D97 PolarHBondContact O-N 3.43Å; D97-K99 VanDerWaalsContact C-N 3.3Å; D97-K99 PolarHBondContact O-N 3.49Å; D97-F100 PolarHBondContact O-N 2.95Å; D97-F101 HydrophobicContact CB-CD2 4.43Å; D97-F101 HydrophobicContact CB-CE2 4.26Å; D97-F101 WeakPolarHBondContact O-CD2 3.48Å; D97-F101 PolarHBondContact O-N 3.39Å
98G64.6Low71.9Confident42 Ų4295.1 Ų95.143%0.43351%0.51SS..Hα-helixtrans-63.5-35.718000000112.9S95 D96 W102S95-G98 PolarHBondContact O-N 2.87Å; D96-G98 VanDerWaalsContact C-N 3.3Å; D96-G98 PolarHBondContact O-N 2.86Å; G98-W102 WeakPolarHBondContact O-CB 3.32Å; G98-W102 PolarHBondContact O-N 3.23Å; G98-W102 VanDerWaalsContact O-N 3.11Å
99K71.2Confident72.5Confident125 Ų12595.9 Ų95.954%0.54351%0.51SS..Hα-helixtrans-70.8-41.6177.1-67.6179.6-178.3172.80111.2D96 D97 W102 Q103D96-K99 PolarHBondContact O-N 2.88Å; D96-K99 VanDerWaalsContact O-N 3.09Å; D97-K99 VanDerWaalsContact C-N 3.3Å; D97-K99 PolarHBondContact O-N 3.49Å; K99-W102 PolarHBondContact O-N 3.43Å; K99-Q103 VanDerWaalsContact O-CG 3.31Å; K99-Q103 WeakPolarHBondContact O-CG 3.19Å; K99-Q103 PolarHBondContact O-N 3.48Å
100F75.6Confident73.4Confident125 Ų12595.3 Ų95.355%0.54851%0.513SS..Hα-helixtrans-61.6-49.6176.7176.8-99.9000111.8D96 D97 W102 Q103 V104D96-F100 PolarHBondContact O-N 2.98Å; D97-F100 PolarHBondContact O-N 2.95Å; F100-W102 VanDerWaalsContact C-N 3.31Å; F100-W102 PolarHBondContact O-N 2.97Å; F100-Q103 PolarHBondContact O-N 3.48Å; F100-V104 HydrophobicContact CD1-CG2 4.32Å; F100-V104 HydrophobicContact CD2-CG2 4.43Å; F100-V104 HydrophobicContact CE1-CG2 3.91Å; F100-V104 HydrophobicContact CE2-CG2 4.03Å; F100-V104 HydrophobicContact CZ-CG2 3.75Å; F100-V104 WeakPolarHBondContact O-CG2 3.28Å; F100-V104 PolarHBondContact O-N 2.95Å
101F72.9Confident74.5Confident142 Ų14292.2 Ų92.262%0.62351%0.506SS*.Hα-helixtrans-61.8-38.9178.3-74.2-65.5000112.4D97 V104 K105D97-F101 HydrophobicContact CB-CD2 4.43Å; D97-F101 HydrophobicContact CB-CE2 4.26Å; D97-F101 WeakPolarHBondContact O-CD2 3.48Å; D97-F101 PolarHBondContact O-N 3.39Å; F101-V104 PolarHBondContact O-N 3.4Å; F101-K105 VanDerWaalsContact O-CB 3.24Å; F101-K105 WeakPolarHBondContact O-CB 3.18Å; F101-K105 PolarHBondContact O-N 2.91Å
102W74.9Confident75.7Confident159 Ų15989.2 Ų89.260%0.60249%0.489SS*.Hα-helixtrans-62.3-45.9174.7179-102.4000112.5G98 K99 F100 K105 V106G98-W102 WeakPolarHBondContact O-CB 3.32Å; G98-W102 PolarHBondContact O-N 3.23Å; G98-W102 VanDerWaalsContact O-N 3.11Å; K99-W102 PolarHBondContact O-N 3.43Å; F100-W102 VanDerWaalsContact C-N 3.31Å; F100-W102 PolarHBondContact O-N 2.97Å; W102-K105 WeakPolarHBondContact O-CB 3.25Å; W102-K105 PolarHBondContact O-N 3.35Å; W102-V106 HydrophobicContact CD2-CG2 4.3Å; W102-V106 HydrophobicContact CZ2-CG2 4.07Å; W102-V106 WeakPolarHBondContact O-CG2 3.49Å; W102-V106 PolarHBondContact O-N 2.98Å
103Q81.9Confident77Confident136 Ų13684.1 Ų84.164%0.63647%0.466SS*.Hα-helixtrans-62.5-45.3178.1-74.7176.8-20.600112.1K99 F100 K105 V106 G107K99-Q103 VanDerWaalsContact O-CG 3.31Å; K99-Q103 WeakPolarHBondContact O-CG 3.19Å; K99-Q103 PolarHBondContact O-N 3.48Å; F100-Q103 PolarHBondContact O-N 3.48Å; Q103-K105 VanDerWaalsContact C-N 3.27Å; Q103-K105 PolarHBondContact O-N 3.38Å; Q103-V106 PolarHBondContact O-N 2.73Å; Q103-G107 PolarHBondContact O-N 3.31Å
104V85.4Confident78.7Confident69 Ų6986.8 Ų86.842%0.41847%0.473SS..Hα-helixtrans-59.9-41.9174.9173.20000110.2F100 F101 G107 Y108F100-V104 HydrophobicContact CD1-CG2 4.32Å; F100-V104 HydrophobicContact CD2-CG2 4.43Å; F100-V104 HydrophobicContact CE1-CG2 3.91Å; F100-V104 HydrophobicContact CE2-CG2 4.03Å; F100-V104 HydrophobicContact CZ-CG2 3.75Å; F100-V104 WeakPolarHBondContact O-CG2 3.28Å; F100-V104 PolarHBondContact O-N 2.95Å; F101-V104 PolarHBondContact O-N 3.4Å; V104-G107 PolarHBondContact O-N 2.89Å; V104-Y108 HydrophobicContact CG1-CD1 4.25Å; V104-Y108 WeakPolarHBondContact O-CD1 3.44Å; V104-Y108 PolarHBondContact O-N 2.91Å
105K81.3Confident80.7Confident55 Ų5583.8 Ų83.824%0.23946%0.457CS..Hα-helixtrans-59.2-51.8177.4179.3164.3-174.3-1780113.5F101 W102 Q103 G107 Y108 T109F101-K105 VanDerWaalsContact O-CB 3.24Å; F101-K105 WeakPolarHBondContact O-CB 3.18Å; F101-K105 PolarHBondContact O-N 2.91Å; W102-K105 WeakPolarHBondContact O-CB 3.25Å; W102-K105 PolarHBondContact O-N 3.35Å; Q103-K105 VanDerWaalsContact C-N 3.27Å; Q103-K105 PolarHBondContact O-N 3.38Å; K105-G107 VanDerWaalsContact C-N 3.3Å; K105-G107 PolarHBondContact O-N 3.48Å; K105-Y108 HydrophobicContact CB-CE1 3.93Å; K105-Y108 HydrophobicContact CG-CE1 4.12Å; K105-Y108 WeakPolarHBondContact CG-OH 3.35Å; K105-T109 WeakPolarHBondContact O-CB 3.4Å; K105-T109 PolarHBondContact O-N 3.01Å; K105-T109 PolarHBondContact O-OG1 2.99Å
106V85.8Confident82.5Confident57 Ų5781.3 Ų81.335%0.34544%0.437SS..Hα-helixtrans-60.7-43.5176.8173.20000110.5W102 Q103 T109 I110W102-V106 HydrophobicContact CD2-CG2 4.3Å; W102-V106 HydrophobicContact CZ2-CG2 4.07Å; W102-V106 WeakPolarHBondContact O-CG2 3.49Å; W102-V106 PolarHBondContact O-N 2.98Å; Q103-V106 PolarHBondContact O-N 2.73Å; V106-T109 PolarHBondContact O-N 3Å; V106-I110 HydrophobicContact CG1-CD1 3.69Å; V106-I110 HydrophobicContact CG1-CG1 4.42Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.5Å; V106-I110 PolarHBondContact O-N 3.46Å
107G89.1Confident84.4Confident45 Ų4581.2 Ų81.246%0.46444%0.435SS..Hα-helixtrans-59.1-53179.600000113.1Q103 V104 K105 T109 G111Q103-G107 PolarHBondContact O-N 3.31Å; V104-G107 PolarHBondContact O-N 2.89Å; K105-G107 VanDerWaalsContact C-N 3.3Å; K105-G107 PolarHBondContact O-N 3.48Å; G107-T109 VanDerWaalsContact C-N 3.31Å; G107-T109 PolarHBondContact O-N 3.5Å; G107-G111 PolarHBondContact O-N 3.34Å; G107-G111 VanDerWaalsContact O-N 3.1Å
108Y89.9Confident86.1Confident74 Ų7479.6 Ų79.629%0.2943%0.433SS..Hα-helixtrans-68.3-32.9179.476.7-118000111.9V104 K105 G111 H112 V154 D158V104-Y108 HydrophobicContact CG1-CD1 4.25Å; V104-Y108 WeakPolarHBondContact O-CD1 3.44Å; V104-Y108 PolarHBondContact O-N 2.91Å; K105-Y108 HydrophobicContact CB-CE1 3.93Å; K105-Y108 HydrophobicContact CG-CE1 4.12Å; K105-Y108 WeakPolarHBondContact CG-OH 3.35Å; Y108-G111 PolarHBondContact O-N 2.93Å; Y108-H112 WeakPolarHBondContact O-CB 3.1Å; Y108-H112 PolarHBondContact O-CD2 3.49Å; Y108-H112 VanDerWaalsContact O-CD2 3.3Å; Y108-H112 PolarHBondContact O-N 2.93Å; Y108-V154 HydrophobicContact CD2-CG1 4.19Å; Y108-V154 HydrophobicContact CE2-CG1 3.9Å; Y108-D158 WeakPolarHBondContact CE2-OD2 3.42Å; Y108-D158 VanDerWaalsContact CZ-OD2 3.27Å; Y108-D158 PolarHBondContact OH-OD1 3.37Å; Y108-D158 PolarHBondContact OH-OD2 3.04Å
109T88.2Confident87.5Confident43 Ų4378.6 Ų78.626%0.26442%0.417SS..Hα-helixtrans-63.9-46.8179.7-670000111.2K105 V106 G107 H112 S113 F155K105-T109 WeakPolarHBondContact O-CB 3.4Å; K105-T109 PolarHBondContact O-N 3.01Å; K105-T109 PolarHBondContact O-OG1 2.99Å; V106-T109 PolarHBondContact O-N 3Å; G107-T109 VanDerWaalsContact C-N 3.31Å; G107-T109 PolarHBondContact O-N 3.5Å; T109-H112 PolarHBondContact O-N 2.99Å; T109-S113 WeakPolarHBondContact O-CB 3.48Å; T109-S113 PolarHBondContact O-N 3.26Å; T109-S113 PolarHBondContact O-OG 3.18Å; T109-F155 HydrophobicContact CG2-CE1 4.14Å
110I92.5Very high88.6Confident101 Ų10176.4 Ų76.452%0.51841%0.411SS..Hα-helixtrans-61.9-46.6175.1-66.4167.6000109.8V106 H112 S113 V114V106-I110 HydrophobicContact CG1-CD1 3.69Å; V106-I110 HydrophobicContact CG1-CG1 4.42Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.5Å; V106-I110 PolarHBondContact O-N 3.46Å; I110-H112 PolarHBondContact O-N 3.43Å; I110-S113 PolarHBondContact O-N 3.48Å; I110-V114 HydrophobicContact CG2-CG2 4.43Å; I110-V114 WeakPolarHBondContact O-CG2 3.39Å; I110-V114 PolarHBondContact O-N 3.18Å
111G93.4Very high89.5Confident41 Ų4174.3 Ų74.342%0.42341%0.408SS..Hα-helixtrans-58.6-47.5179.200000113.2G107 Y108 S113 S115G107-G111 PolarHBondContact O-N 3.34Å; G107-G111 VanDerWaalsContact O-N 3.1Å; Y108-G111 PolarHBondContact O-N 2.93Å; G111-S113 PolarHBondContact O-N 2.95Å; G111-S115 VanDerWaalsContact O-CB 3.3Å; G111-S115 WeakPolarHBondContact O-CB 3.35Å; G111-S115 PolarHBondContact O-N 3.42Å
112H91.9Very high90.5Very high44 Ų4469.1 Ų69.120%0.20439%0.391CS..Hα-helixtrans-66-36.5177.7-84.6-64.9000112.6Y108 T109 I110 L116 A151 F155Y108-H112 WeakPolarHBondContact O-CB 3.1Å; Y108-H112 PolarHBondContact O-CD2 3.49Å; Y108-H112 VanDerWaalsContact O-CD2 3.3Å; Y108-H112 PolarHBondContact O-N 2.93Å; T109-H112 PolarHBondContact O-N 2.99Å; I110-H112 PolarHBondContact O-N 3.43Å; H112-L116 WeakPolarHBondContact O-CB 3.18Å; H112-L116 PolarHBondContact O-N 3Å; H112-A151 HydrophobicContact CB-CB 4.45Å; H112-F155 HydrophobicContact CB-CE2 4.38Å; H112-F155 HydrophobicContact CB-CZ 3.93Å
113S92.6Very high91.3Very high43 Ų4363 Ų6330%0.30137%0.37SS..Hα-helixtrans-64.8-48.6177.2-58.20000111.9T109 I110 G111 S115 L116 I117 F155T109-S113 WeakPolarHBondContact O-CB 3.48Å; T109-S113 PolarHBondContact O-N 3.26Å; T109-S113 PolarHBondContact O-OG 3.18Å; I110-S113 PolarHBondContact O-N 3.48Å; G111-S113 PolarHBondContact O-N 2.95Å; S113-S115 PolarHBondContact O-N 3.3Å; S113-L116 PolarHBondContact O-N 3.43Å; S113-I117 WeakPolarHBondContact O-CG1 3.37Å; S113-I117 PolarHBondContact O-N 3.31Å; S113-I117 VanDerWaalsContact O-N 3.1Å; S113-F155 WeakPolarHBondContact OG-CZ 3.38Å
114V94.8Very high91.8Very high96 Ų9660 Ų6058%0.58236%0.361SS*.Hα-helixtrans-63-44.2178.3173.80000110.9I110 L116 I117 S118I110-V114 HydrophobicContact CG2-CG2 4.43Å; I110-V114 WeakPolarHBondContact O-CG2 3.39Å; I110-V114 PolarHBondContact O-N 3.18Å; V114-L116 VanDerWaalsContact C-N 3.35Å; V114-L116 PolarHBondContact O-N 3.46Å; V114-I117 PolarHBondContact O-N 2.85Å; V114-S118 WeakPolarHBondContact O-CB 3.36Å; V114-S118 PolarHBondContact O-N 3.45Å; V114-S118 VanDerWaalsContact O-N 3.1Å
115S95.2Very high92.2Very high53 Ų5359.8 Ų59.837%0.37136%0.36SS..Hα-helixtrans-60.4-44.4176.7-174.50000111.7G111 S113 I117 S118 L119G111-S115 VanDerWaalsContact O-CB 3.3Å; G111-S115 WeakPolarHBondContact O-CB 3.35Å; G111-S115 PolarHBondContact O-N 3.42Å; S113-S115 PolarHBondContact O-N 3.3Å; S115-I117 PolarHBondContact O-N 3.22Å; S115-S118 PolarHBondContact O-N 2.9Å; S115-L119 WeakPolarHBondContact O-CB 3.13Å; S115-L119 VanDerWaalsContact O-CG 3.22Å; S115-L119 WeakPolarHBondContact O-CG 3.3Å; S115-L119 PolarHBondContact O-N 3.33Å
116L94.4Very high92.5Very high32 Ų3258.3 Ų58.317%0.16836%0.355CS..Hα-helixtrans-59.6-49.2178.9-176.868000111.8H112 S113 V114 S118 L119 I120 I148 A151 I152 F155H112-L116 WeakPolarHBondContact O-CB 3.18Å; H112-L116 PolarHBondContact O-N 3Å; S113-L116 PolarHBondContact O-N 3.43Å; V114-L116 VanDerWaalsContact C-N 3.35Å; V114-L116 PolarHBondContact O-N 3.46Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 2.95Å; L116-L119 PolarHBondContact O-N 3.4Å; L116-I120 HydrophobicContact CD1-CD1 3.94Å; L116-I120 HydrophobicContact CD1-CG1 4.35Å; L116-I120 HydrophobicContact CG-CD1 3.81Å; L116-I120 WeakPolarHBondContact O-CB 3.29Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.27Å; L116-I120 PolarHBondContact O-N 2.99Å; L116-I148 HydrophobicContact CD1-CB 4.21Å; L116-I148 HydrophobicContact CD1-CG1 4.13Å; L116-I148 HydrophobicContact CD1-CG2 3.79Å; L116-A151 HydrophobicContact CD1-CB 4.26Å; L116-I152 HydrophobicContact CD1-CG1 4.41Å; L116-F155 HydrophobicContact CD2-CE2 4.24Å
117I95.9Very high92.6Very high113 Ų11358.8 Ų58.858%0.57936%0.36SS*.Hα-helixtrans-60.3-44.9179.2-65.5165.7000110.8S113 V114 S115 T121S113-I117 WeakPolarHBondContact O-CG1 3.37Å; S113-I117 PolarHBondContact O-N 3.31Å; S113-I117 VanDerWaalsContact O-N 3.1Å; V114-I117 PolarHBondContact O-N 2.85Å; S115-I117 PolarHBondContact O-N 3.22Å; I117-T121 WeakPolarHBondContact O-CB 3.35Å; I117-T121 PolarHBondContact O-N 3.41Å; I117-T121 VanDerWaalsContact O-N 3.08Å; I117-T121 PolarHBondContact O-OG1 3.12Å
118S95.9Very high92.7Very high77 Ų7762.2 Ų62.254%0.53837%0.366SS..Hα-helixtrans-62.5-48.1178.6-177.20000112.1V114 S115 L116 T121 A122V114-S118 WeakPolarHBondContact O-CB 3.36Å; V114-S118 PolarHBondContact O-N 3.45Å; V114-S118 VanDerWaalsContact O-N 3.1Å; S115-S118 PolarHBondContact O-N 2.9Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 2.95Å; S118-T121 WeakPolarHBondContact O-CB 3.31Å; S118-T121 PolarHBondContact O-N 3.32Å; S118-A122 PolarHBondContact O-N 3.45Å
119L94.8Very high92.7Very high20 Ų2064.3 Ų64.311%0.10538%0.377CS..Hα-helixtrans-65.9-40.7-179.2-71.3168.9000112.5S115 L116 T121 A122 I123 F144 F147 I148S115-L119 WeakPolarHBondContact O-CB 3.13Å; S115-L119 VanDerWaalsContact O-CG 3.22Å; S115-L119 WeakPolarHBondContact O-CG 3.3Å; S115-L119 PolarHBondContact O-N 3.33Å; L116-L119 PolarHBondContact O-N 3.4Å; L119-T121 VanDerWaalsContact C-N 3.32Å; L119-T121 PolarHBondContact O-N 3.43Å; L119-A122 PolarHBondContact O-N 2.87Å; L119-I123 WeakPolarHBondContact O-CG1 3.24Å; L119-I123 PolarHBondContact O-N 3.34Å; L119-F144 HydrophobicContact CD2-CB 4.07Å; L119-F144 HydrophobicContact CD2-CD1 3.56Å; L119-F144 HydrophobicContact CD2-CE1 4.2Å; L119-F144 HydrophobicContact CD2-CG 3.91Å; L119-F147 HydrophobicContact CD1-CB 3.54Å; L119-I148 HydrophobicContact CB-CD1 4.01Å; L119-I148 HydrophobicContact CB-CG1 3.77Å; L119-I148 HydrophobicContact CD1-CG1 4.26Å
120I94.6Very high92.4Very high80 Ų8072.5 Ų72.541%0.4140%0.403SS..Hα-helixtrans-60.4-46.7174.8-70.4169000109.7L116 A122 I123 V124 I148L116-I120 HydrophobicContact CD1-CD1 3.94Å; L116-I120 HydrophobicContact CD1-CG1 4.35Å; L116-I120 HydrophobicContact CG-CD1 3.81Å; L116-I120 WeakPolarHBondContact O-CB 3.29Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.27Å; L116-I120 PolarHBondContact O-N 2.99Å; I120-A122 VanDerWaalsContact C-N 3.31Å; I120-A122 PolarHBondContact O-N 2.96Å; I120-I123 PolarHBondContact O-N 2.97Å; I120-V124 HydrophobicContact CG2-CG2 4.38Å; I120-V124 VanDerWaalsContact O-CG2 3.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 2.92Å; I120-I148 HydrophobicContact CG1-CD1 3.98Å; I120-I148 HydrophobicContact CG1-CG1 4.49Å
121T94.4Very high92Very high80 Ų8077.4 Ų77.449%0.49142%0.421SS..Hα-helixtrans-59.2-43.9177.2-54.70000111I117 S118 L119 V124 V125I117-T121 WeakPolarHBondContact O-CB 3.35Å; I117-T121 PolarHBondContact O-N 3.41Å; I117-T121 VanDerWaalsContact O-N 3.08Å; I117-T121 PolarHBondContact O-OG1 3.12Å; S118-T121 WeakPolarHBondContact O-CB 3.31Å; S118-T121 PolarHBondContact O-N 3.32Å; L119-T121 VanDerWaalsContact C-N 3.32Å; L119-T121 PolarHBondContact O-N 3.43Å; T121-V124 PolarHBondContact O-N 3.37Å; T121-V125 WeakPolarHBondContact O-CG2 3.31Å; T121-V125 PolarHBondContact O-N 3.22Å
122A93.7Very high91.4Very high33 Ų3379 Ų7927%0.27342%0.419SS..Hα-helixtrans-61.8-44.3177.700000112.7S118 L119 I120 V125 L126 F144S118-A122 PolarHBondContact O-N 3.45Å; L119-A122 PolarHBondContact O-N 2.87Å; I120-A122 VanDerWaalsContact C-N 3.31Å; I120-A122 PolarHBondContact O-N 2.96Å; A122-V125 PolarHBondContact O-N 2.88Å; A122-L126 WeakPolarHBondContact O-CB 2.91Å; A122-L126 WeakPolarHBondContact O-CG 3.27Å; A122-L126 PolarHBondContact O-N 3.32Å; A122-F144 HydrophobicContact CB-CD2 4.37Å; A122-F144 HydrophobicContact CB-CE2 4.23Å
123I92.7Very high91Very high31 Ų3181.9 Ų81.916%0.15943%0.432CS..Hα-helixtrans-62.7-45.8175.9-70.4-178.1000110.7L119 I120 V125 L126 C127 F144 V145 I148L119-I123 WeakPolarHBondContact O-CG1 3.24Å; L119-I123 PolarHBondContact O-N 3.34Å; I120-I123 PolarHBondContact O-N 2.97Å; I123-V125 VanDerWaalsContact C-N 3.33Å; I123-V125 PolarHBondContact O-N 3.4Å; I123-L126 PolarHBondContact O-N 2.94Å; I123-C127 WeakPolarHBondContact O-CB 3.46Å; I123-C127 PolarHBondContact O-N 2.86Å; I123-C127 PolarHBondContact O-SG 3.2Å; I123-F144 HydrophobicContact CD1-CB 3.83Å; I123-F144 HydrophobicContact CG1-CB 3.81Å; I123-F144 HydrophobicContact CG1-CD2 4.21Å; I123-V145 HydrophobicContact CD1-CG2 3.74Å; I123-I148 HydrophobicContact CD1-CD1 3.35Å; I123-I148 HydrophobicContact CG1-CD1 4.36Å
124V92.1Very high90.6Very high74 Ų7483.2 Ų83.245%0.44844%0.441SS..Hα-helixtrans-58.3-46.4179.2169.90000110.7I120 T121 C127 I128I120-V124 HydrophobicContact CG2-CG2 4.38Å; I120-V124 VanDerWaalsContact O-CG2 3.29Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 2.92Å; T121-V124 PolarHBondContact O-N 3.37Å; V124-C127 PolarHBondContact O-N 3.46Å; V124-I128 HydrophobicContact CG1-CD1 3.6Å; V124-I128 HydrophobicContact CG1-CG1 4.42Å; V124-I128 VanDerWaalsContact O-CG1 3.25Å; V124-I128 WeakPolarHBondContact O-CG1 3.44Å; V124-I128 PolarHBondContact O-N 2.93Å
125V92.6Very high90.1Very high63 Ų6381.2 Ų81.238%0.38243%0.429SS..Hα-helixtrans-58.9-51.6175.7169.40000110.9T121 A122 I123 C127 I128 F129T121-V125 WeakPolarHBondContact O-CG2 3.31Å; T121-V125 PolarHBondContact O-N 3.22Å; A122-V125 PolarHBondContact O-N 2.88Å; I123-V125 VanDerWaalsContact C-N 3.33Å; I123-V125 PolarHBondContact O-N 3.4Å; V125-C127 VanDerWaalsContact C-N 3.28Å; V125-C127 PolarHBondContact O-N 3.41Å; V125-I128 PolarHBondContact O-N 3.3Å; V125-F129 HydrophobicContact CG1-CD2 3.76Å; V125-F129 HydrophobicContact CG1-CE2 3.95Å; V125-F129 WeakPolarHBondContact O-CD2 3.39Å; V125-F129 PolarHBondContact O-N 3.4Å; V125-F129 VanDerWaalsContact O-N 3.11Å
126L89.1Confident89.6Confident25 Ų2584.3 Ų84.313%0.13143%0.433CS..Hα-helixtrans-63.9-31.8-178.3-70.5176.4000113A122 I123 L132 H133 M141 F144A122-L126 WeakPolarHBondContact O-CB 2.91Å; A122-L126 WeakPolarHBondContact O-CG 3.27Å; A122-L126 PolarHBondContact O-N 3.32Å; I123-L126 PolarHBondContact O-N 2.94Å; L126-L132 HydrophobicContact CD2-CB 4.36Å; L126-L132 HydrophobicContact CD2-CD1 4.15Å; L126-H133 PolarHBondContact O-CD2 2.8Å; L126-H133 PolarHBondContact O-NE2 3.27Å; L126-H133 VanDerWaalsContact O-NE2 3.15Å; L126-M141 HydrophobicContact CB-CE 3.44Å; L126-M141 VanDerWaalsContact CB-CE 3.44Å; L126-M141 HydrophobicContact CB-CG 4.41Å; L126-M141 HydrophobicContact CD1-CG 4.21Å; L126-M141 WeakPolarHBondContact O-CE 3.44Å; L126-F144 HydrophobicContact CD1-CD2 4.26Å; L126-F144 HydrophobicContact CD1-CE2 3.84Å
127C86.8Confident89.3Confident67 Ų6784.4 Ų84.445%0.45343%0.433SS..Hα-helixtrans-76-35.4177.2-730000113.4I123 V124 V125I123-C127 WeakPolarHBondContact O-CB 3.46Å; I123-C127 PolarHBondContact O-N 2.86Å; I123-C127 PolarHBondContact O-SG 3.2Å; V124-C127 PolarHBondContact O-N 3.46Å; V125-C127 VanDerWaalsContact C-N 3.28Å; V125-C127 PolarHBondContact O-N 3.41Å
128I90.6Very high89.1Confident117 Ų11784 Ų8460%0.643%0.425SS*.Hα-helixtrans-72.3-45.2179.5-70.8168.8000110.3V124 V125 R130V124-I128 HydrophobicContact CG1-CD1 3.6Å; V124-I128 HydrophobicContact CG1-CG1 4.42Å; V124-I128 VanDerWaalsContact O-CG1 3.25Å; V124-I128 WeakPolarHBondContact O-CG1 3.44Å; V124-I128 PolarHBondContact O-N 2.93Å; V125-I128 PolarHBondContact O-N 3.3Å; I128-R130 PolarHBondContact O-N 3.42Å
129F90.4Very high88.8Confident118 Ų11880.4 Ų80.452%0.51840%0.4SS..  trans-83.183.3-177-66.1-68.2000111V125 K131 L132V125-F129 HydrophobicContact CG1-CD2 3.76Å; V125-F129 HydrophobicContact CG1-CE2 3.95Å; V125-F129 WeakPolarHBondContact O-CD2 3.39Å; V125-F129 PolarHBondContact O-N 3.4Å; V125-F129 VanDerWaalsContact O-N 3.11Å; F129-K131 PolarHBondContact O-N 3.41Å; F129-L132 HydrophobicContact CB-CB 4.39Å; F129-L132 HydrophobicContact CB-CD1 3.74Å; F129-L132 HydrophobicContact CB-CG 3.87Å; F129-L132 HydrophobicContact CD2-CD1 4.4Å; F129-L132 HydrophobicContact CG-CD1 4.36Å; F129-L132 WeakPolarHBondContact O-CB 3.33Å; F129-L132 PolarHBondContact O-N 2.97Å
130R82.4Confident88.7Confident214 Ų21481.7 Ų81.781%0.80841%0.405SS*.G310 helixtrans-49.7-28.4173.9-84.4-177.5159.2162-4.1114.2I128 L132 H133I128-R130 PolarHBondContact O-N 3.42Å; R130-L132 PolarHBondContact O-N 3.42Å; R130-H133 WeakPolarHBondContact O-CB 3.27Å; R130-H133 PolarHBondContact O-N 3.22Å; R130-H133 VanDerWaalsContact O-N 3.17Å
131K83.1Confident88.5Confident205 Ų20579.1 Ų79.189%0.89139%0.392SS*.G310 helixtrans-66.4-19.7175.4-69.6-136.5-179.4-176.40114F129F129-K131 PolarHBondContact O-N 3.41Å
132L82.4Confident88.6Confident73 Ų7376.9 Ų76.938%0.38238%0.375SS..G310 helixtrans-90.52.6175.8-58.8179.3000112.3L126 F129 R130 C134 N137L126-L132 HydrophobicContact CD2-CB 4.36Å; L126-L132 HydrophobicContact CD2-CD1 4.15Å; F129-L132 HydrophobicContact CB-CB 4.39Å; F129-L132 HydrophobicContact CB-CD1 3.74Å; F129-L132 HydrophobicContact CB-CG 3.87Å; F129-L132 HydrophobicContact CD2-CD1 4.4Å; F129-L132 HydrophobicContact CG-CD1 4.36Å; F129-L132 WeakPolarHBondContact O-CB 3.33Å; F129-L132 PolarHBondContact O-N 2.97Å; R130-L132 PolarHBondContact O-N 3.42Å; L132-C134 PolarHBondContact O-N 2.97Å; L132-N137 VanDerWaalsContact O-CB 3.31Å; L132-N137 WeakPolarHBondContact O-CB 3.5Å; L132-N137 PolarHBondContact O-ND2 3.47Å
133H83.6Confident88.6Confident105 Ų10575.6 Ų75.649%0.48636%0.364SS..  trans-75.593.1178.5-73.3-155.7000110.4L126 R130L126-H133 PolarHBondContact O-CD2 2.8Å; L126-H133 PolarHBondContact O-NE2 3.27Å; L126-H133 VanDerWaalsContact O-NE2 3.15Å; R130-H133 WeakPolarHBondContact O-CB 3.27Å; R130-H133 PolarHBondContact O-N 3.22Å; R130-H133 VanDerWaalsContact O-N 3.17Å
134C84.3Confident88.7Confident71 Ų7176.3 Ų76.348%0.4837%0.366SS..  trans-120.9160.4171.2-59.40000109.7L132 R136 N137 Y138L132-C134 PolarHBondContact O-N 2.97Å; C134-R136 PolarHBondContact O-N 3.37Å; C134-N137 PolarHBondContact O-N 3.11Å; C134-Y138 PolarHBondContact O-N 3.01Å
135T83.1Confident88.9Confident55 Ų5575.3 Ų75.334%0.33736%0.36SS..Hα-helixtrans-53.1-42.4176.447.30000112Y138 I139 Y201T135-Y138 WeakPolarHBondContact O-CB 3.41Å; T135-Y138 PolarHBondContact O-N 3.12Å; T135-I139 PolarHBondContact O-N 2.97Å; T135-I139 VanDerWaalsContact O-N 3.15Å; T135-Y201 PolarHBondContact OG1-OH 2.66Å
136R85.2Confident89.1Confident118 Ų11872.3 Ų72.345%0.44534%0.342SS..Hα-helixtrans-57.7-50.6173.1-174.3-171.6-54.8132.75.3112.8C134 Y138 I139 H140 Y201C134-R136 PolarHBondContact O-N 3.37Å; R136-Y138 PolarHBondContact O-N 3.4Å; R136-I139 PolarHBondContact O-N 3.23Å; R136-I139 VanDerWaalsContact O-N 3.14Å; R136-H140 WeakPolarHBondContact CG-NE2 3.45Å; R136-H140 PolarHBondContact O-CD2 3.39Å; R136-H140 PolarHBondContact O-N 3.12Å; R136-Y201 HydrophobicContact CB-CE1 4.06Å; R136-Y201 HydrophobicContact CG-CE1 4.2Å; R136-Y201 PolarHBondContact N-OH 3.35Å
137N88.9Confident89.4Confident33 Ų3374.1 Ų74.118%0.17635%0.349CS..Hα-helixtrans-66.9-27.4-177.9-71.36.2000111.6L132 C134 H140 M141L132-N137 VanDerWaalsContact O-CB 3.31Å; L132-N137 WeakPolarHBondContact O-CB 3.5Å; L132-N137 PolarHBondContact O-ND2 3.47Å; C134-N137 PolarHBondContact O-N 3.11Å; N137-H140 PolarHBondContact O-N 2.89Å; N137-M141 VanDerWaalsContact O-CG 3.29Å; N137-M141 WeakPolarHBondContact O-CG 3.38Å; N137-M141 PolarHBondContact O-N 3.35Å
138Y89.7Confident89.8Confident105 Ų10572 Ų7241%0.41233%0.333SS..Hα-helixtrans-70-39172.5-163.8-87.6000113C134 T135 R136 M141 H142 F217 I221C134-Y138 PolarHBondContact O-N 3.01Å; T135-Y138 WeakPolarHBondContact O-CB 3.41Å; T135-Y138 PolarHBondContact O-N 3.12Å; R136-Y138 PolarHBondContact O-N 3.4Å; Y138-M141 WeakPolarHBondContact O-CB 3.29Å; Y138-M141 PolarHBondContact O-N 3.25Å; Y138-H142 AromaticContact CD1-CD2 3.48Å; Y138-H142 VanDerWaalsContact CD1-CD2 3.48Å; Y138-H142 WeakPolarHBondContact CD1-CD2 3.31Å; Y138-H142 AromaticContact CD1-NE2 3.75Å; Y138-H142 AromaticContact CE1-CD2 3.24Å; Y138-H142 WeakPolarHBondContact CE1-CD2 3.44Å; Y138-H142 AromaticContact CE1-NE2 2.97Å; Y138-H142 WeakPolarHBondContact CE1-NE2 3.34Å; Y138-H142 AromaticContact CZ-NE2 3.46Å; Y138-H142 PolarHBondContact O-CD2 3.35Å; Y138-H142 PolarHBondContact O-N 2.87Å; Y138-H142 VanDerWaalsContact O-N 3.1Å; Y138-H142 PolarHBondContact OH-NE2 3.27Å; Y138-F217 HydrophobicContact CD1-CE1 4.12Å; Y138-F217 AromaticContact CD1-CE2 3.79Å; Y138-F217 HydrophobicContact CD1-CE2 3.79Å; Y138-F217 AromaticContact CD1-CZ 3.15Å; Y138-F217 HydrophobicContact CD1-CZ 3.15Å; Y138-F217 AromaticContact CE1-CE1 3.97Å; Y138-F217 HydrophobicContact CE1-CE1 3.97Å; Y138-F217 HydrophobicContact CE1-CE2 4.43Å; Y138-F217 AromaticContact CE1-CZ 3.46Å; Y138-F217 HydrophobicContact CE1-CZ 3.46Å; Y138-F217 VanDerWaalsContact CE1-CZ 3.46Å; Y138-F217 HydrophobicContact CG-CE2 4.42Å; Y138-F217 AromaticContact CG-CZ 3.84Å; Y138-F217 HydrophobicContact CG-CZ 3.84Å; Y138-I221 HydrophobicContact CE1-CD1 4.09Å
139I91.3Very high90Very high1 Ų168.9 Ų68.91%0.00532%0.317CS..Hα-helixtrans-62.8-44.5171.8-63.2-63.5000110.3T135 R136 M141 H142 L143 W194 E198 Y201 F217T135-I139 PolarHBondContact O-N 2.97Å; T135-I139 VanDerWaalsContact O-N 3.15Å; R136-I139 PolarHBondContact O-N 3.23Å; R136-I139 VanDerWaalsContact O-N 3.14Å; I139-M141 VanDerWaalsContact C-N 3.34Å; I139-M141 PolarHBondContact O-N 3.1Å; I139-H142 PolarHBondContact O-N 2.86Å; I139-L143 PolarHBondContact O-N 3Å; I139-W194 HydrophobicContact CD1-CZ3 4.24Å; I139-W194 HydrophobicContact CG2-CZ3 4.4Å; I139-E198 HydrophobicContact CG2-CB 4.35Å; I139-Y201 HydrophobicContact CG1-CD1 4.41Å; I139-Y201 HydrophobicContact CG1-CD2 4.45Å; I139-Y201 HydrophobicContact CG1-CG 4.33Å; I139-F217 HydrophobicContact CD1-CD2 4.2Å; I139-F217 HydrophobicContact CD1-CE2 3.98Å; I139-F217 HydrophobicContact CG1-CE2 4.37Å
140H91.4Very high90.2Very high47 Ų4765.6 Ų65.622%0.21830%0.303CS..Hα-helixtrans-62.3-38.7174.7-65.6-61000112.5R136 N137 H142 L143 F144 E198R136-H140 WeakPolarHBondContact CG-NE2 3.45Å; R136-H140 PolarHBondContact O-CD2 3.39Å; R136-H140 PolarHBondContact O-N 3.12Å; N137-H140 PolarHBondContact O-N 2.89Å; H140-H142 PolarHBondContact O-N 3.37Å; H140-L143 WeakPolarHBondContact O-CB 3.29Å; H140-L143 PolarHBondContact O-N 3.18Å; H140-F144 HydrophobicContact CB-CE2 4.27Å; H140-F144 HydrophobicContact CB-CZ 4.25Å; H140-F144 WeakPolarHBondContact O-CD2 3.33Å; H140-F144 WeakPolarHBondContact O-CG 3.3Å; H140-F144 PolarHBondContact O-N 2.98Å; H140-E198 IonicContact CE1-OE1 3.52Å; H140-E198 PolarHBondContact CE1-OE1 3.25Å; H140-E198 IonicContact ND1-OE1 2.7Å; H140-E198 PolarHBondContact ND1-OE1 3.13Å
141M91.8Very high90.8Very high26 Ų2655.5 Ų55.513%0.12827%0.265CS..Hα-helixtrans-57.8-47.8173.9-79.4178.5174.300111.3L126 N137 Y138 I139 L143 F144 V145L126-M141 HydrophobicContact CB-CE 3.44Å; L126-M141 VanDerWaalsContact CB-CE 3.44Å; L126-M141 HydrophobicContact CB-CG 4.41Å; L126-M141 HydrophobicContact CD1-CG 4.21Å; L126-M141 WeakPolarHBondContact O-CE 3.44Å; N137-M141 VanDerWaalsContact O-CG 3.29Å; N137-M141 WeakPolarHBondContact O-CG 3.38Å; N137-M141 PolarHBondContact O-N 3.35Å; Y138-M141 WeakPolarHBondContact O-CB 3.29Å; Y138-M141 PolarHBondContact O-N 3.25Å; I139-M141 VanDerWaalsContact C-N 3.34Å; I139-M141 PolarHBondContact O-N 3.1Å; M141-L143 PolarHBondContact O-N 3.25Å; M141-F144 PolarHBondContact O-N 3.33Å; M141-V145 VanDerWaalsContact O-CG2 3.31Å; M141-V145 WeakPolarHBondContact O-CG2 3.37Å; M141-V145 PolarHBondContact O-N 3.29Å
142H94.7Very high91.3Very high33 Ų3349.1 Ų49.115%0.15324%0.24CC..Hα-helixtrans-64.7-38.2178-85.2-70.7000113.2Y138 I139 H140 V145 S146 W194 W225Y138-H142 AromaticContact CD1-CD2 3.48Å; Y138-H142 VanDerWaalsContact CD1-CD2 3.48Å; Y138-H142 WeakPolarHBondContact CD1-CD2 3.31Å; Y138-H142 AromaticContact CD1-NE2 3.75Å; Y138-H142 AromaticContact CE1-CD2 3.24Å; Y138-H142 WeakPolarHBondContact CE1-CD2 3.44Å; Y138-H142 AromaticContact CE1-NE2 2.97Å; Y138-H142 WeakPolarHBondContact CE1-NE2 3.34Å; Y138-H142 AromaticContact CZ-NE2 3.46Å; Y138-H142 PolarHBondContact O-CD2 3.35Å; Y138-H142 PolarHBondContact O-N 2.87Å; Y138-H142 VanDerWaalsContact O-N 3.1Å; Y138-H142 PolarHBondContact OH-NE2 3.27Å; I139-H142 PolarHBondContact O-N 2.86Å; H140-H142 PolarHBondContact O-N 3.37Å; H142-V145 PolarHBondContact O-N 2.98Å; H142-S146 PolarHBondContact O-N 3.35Å; H142-W194 HydrophobicContact CB-CD2 3.85Å; H142-W194 HydrophobicContact CB-CE3 3.58Å; H142-W194 HydrophobicContact CB-CH2 3.25Å; H142-W194 HydrophobicContact CB-CZ2 3.54Å; H142-W194 HydrophobicContact CB-CZ3 3.27Å; H142-W194 AromaticContact CD2-CH2 3.86Å; H142-W194 AromaticContact CG-CH2 3.48Å; H142-W194 VanDerWaalsContact CG-CH2 3.48Å; H142-W194 AromaticContact CG-CZ2 3.7Å; H142-W194 AromaticContact CG-CZ3 3.99Å; H142-W194 AromaticContact ND1-CZ2 3.88Å; H142-W225 AromaticContact CE1-NE1 3.63Å; H142-W225 AromaticContact ND1-CE2 3.8Å; H142-W225 AromaticContact ND1-CZ2 3.8Å; H142-W225 AromaticContact ND1-NE1 3.18Å; H142-W225 PolarHBondContact ND1-NE1 3.02Å; H142-W225 VanDerWaalsContact ND1-NE1 3.18Å
143L94.3Very high91.7Very high7 Ų745.7 Ų45.74%0.03722%0.222CC..Hα-helixtrans-59-47.6171.5179.179.7000111.1I139 H140 M141 V145 S146 F147 W194 L195 E198I139-L143 PolarHBondContact O-N 3Å; H140-L143 WeakPolarHBondContact O-CB 3.29Å; H140-L143 PolarHBondContact O-N 3.18Å; M141-L143 PolarHBondContact O-N 3.25Å; L143-V145 VanDerWaalsContact C-N 3.35Å; L143-V145 PolarHBondContact O-N 3.49Å; L143-S146 WeakPolarHBondContact O-CB 3.23Å; L143-S146 PolarHBondContact O-N 2.88Å; L143-S146 VanDerWaalsContact O-N 3.12Å; L143-S146 PolarHBondContact O-OG 3.1Å; L143-F147 HydrophobicContact CD1-CD2 4.35Å; L143-F147 HydrophobicContact CD1-CE2 3.68Å; L143-F147 HydrophobicContact CD1-CZ 4.2Å; L143-F147 HydrophobicContact CD2-CE2 4.05Å; L143-F147 HydrophobicContact CG-CD2 3.99Å; L143-F147 HydrophobicContact CG-CE2 3.63Å; L143-F147 WeakPolarHBondContact O-CD2 3.44Å; L143-F147 PolarHBondContact O-N 2.96Å; L143-W194 HydrophobicContact CD1-CB 3.9Å; L143-L195 HydrophobicContact CD1-CB 4.23Å; L143-L195 HydrophobicContact CD1-CD1 4.46Å; L143-E198 WeakPolarHBondContact CD2-OE2 3.38Å
144F96.2Very high92Very high46 Ų4641.3 Ų41.320%0.20220%0.202CC..Hα-helixtrans-62.6-41.9178.4-61.5-21.8000111.8L119 A122 I123 L126 H140 M141 S146 F147 I148L119-F144 HydrophobicContact CD2-CB 4.07Å; L119-F144 HydrophobicContact CD2-CD1 3.56Å; L119-F144 HydrophobicContact CD2-CE1 4.2Å; L119-F144 HydrophobicContact CD2-CG 3.91Å; A122-F144 HydrophobicContact CB-CD2 4.37Å; A122-F144 HydrophobicContact CB-CE2 4.23Å; I123-F144 HydrophobicContact CD1-CB 3.83Å; I123-F144 HydrophobicContact CG1-CB 3.81Å; I123-F144 HydrophobicContact CG1-CD2 4.21Å; L126-F144 HydrophobicContact CD1-CD2 4.26Å; L126-F144 HydrophobicContact CD1-CE2 3.84Å; H140-F144 HydrophobicContact CB-CE2 4.27Å; H140-F144 HydrophobicContact CB-CZ 4.25Å; H140-F144 WeakPolarHBondContact O-CD2 3.33Å; H140-F144 WeakPolarHBondContact O-CG 3.3Å; H140-F144 PolarHBondContact O-N 2.98Å; M141-F144 PolarHBondContact O-N 3.33Å; F144-S146 VanDerWaalsContact C-N 3.29Å; F144-S146 PolarHBondContact O-N 3.38Å; F144-F147 PolarHBondContact O-N 2.94Å; F144-I148 VanDerWaalsContact O-CG1 3.32Å; F144-I148 WeakPolarHBondContact O-CG1 3.21Å; F144-I148 PolarHBondContact O-N 2.85Å
145V95.6Very high92.3Very high53 Ų5340.5 Ų40.532%0.32119%0.191SC..Hα-helixtrans-58.8-41.9173.21730000110.8I123 M141 H142 L143 F147 I148 L149 W225I123-V145 HydrophobicContact CD1-CG2 3.74Å; M141-V145 VanDerWaalsContact O-CG2 3.31Å; M141-V145 WeakPolarHBondContact O-CG2 3.37Å; M141-V145 PolarHBondContact O-N 3.29Å; H142-V145 PolarHBondContact O-N 2.98Å; L143-V145 VanDerWaalsContact C-N 3.35Å; L143-V145 PolarHBondContact O-N 3.49Å; V145-F147 VanDerWaalsContact C-N 3.34Å; V145-F147 PolarHBondContact O-N 3.42Å; V145-I148 PolarHBondContact O-N 3.44Å; V145-L149 HydrophobicContact CG1-CD1 4.08Å; V145-L149 HydrophobicContact CG1-CG 4.36Å; V145-L149 WeakPolarHBondContact O-CB 3.42Å; V145-L149 WeakPolarHBondContact O-CG 3.48Å; V145-L149 PolarHBondContact O-N 2.85Å; V145-W225 HydrophobicContact CG1-CH2 4.05Å; V145-W225 HydrophobicContact CG1-CZ2 4.2Å
146S96.5Very high92.5Very high0 Ų040.6 Ų40.60%019%0.191CC..Hα-helixtrans-62.2-39.3177.782.90000112.5H142 L143 F144 K150H142-S146 PolarHBondContact O-N 3.35Å; L143-S146 WeakPolarHBondContact O-CB 3.23Å; L143-S146 PolarHBondContact O-N 2.88Å; L143-S146 VanDerWaalsContact O-N 3.12Å; L143-S146 PolarHBondContact O-OG 3.1Å; F144-S146 VanDerWaalsContact C-N 3.29Å; F144-S146 PolarHBondContact O-N 3.38Å; S146-K150 WeakPolarHBondContact O-CB 3.48Å; S146-K150 PolarHBondContact O-N 3.28Å
147F95.6Very high92.5Very high62 Ų6236.6 Ų36.627%0.27218%0.177SC..Hα-helixtrans-72.2-36.2176.6-74.7-52.3000113.1L119 L143 F144 V145 K150 A151L119-F147 HydrophobicContact CD1-CB 3.54Å; L143-F147 HydrophobicContact CD1-CD2 4.35Å; L143-F147 HydrophobicContact CD1-CE2 3.68Å; L143-F147 HydrophobicContact CD1-CZ 4.2Å; L143-F147 HydrophobicContact CD2-CE2 4.05Å; L143-F147 HydrophobicContact CG-CD2 3.99Å; L143-F147 HydrophobicContact CG-CE2 3.63Å; L143-F147 WeakPolarHBondContact O-CD2 3.44Å; L143-F147 PolarHBondContact O-N 2.96Å; F144-F147 PolarHBondContact O-N 2.94Å; V145-F147 VanDerWaalsContact C-N 3.34Å; V145-F147 PolarHBondContact O-N 3.42Å; F147-K150 PolarHBondContact O-N 3.48Å; F147-A151 PolarHBondContact O-N 3.33Å
148I95.4Very high92.2Very high23 Ų2336 Ų3612%0.11817%0.174CC..Hα-helixtrans-62.4-48.6172.6-70.9171000110.1L116 L119 I120 I123 F144 V145 K150 A151 I152L116-I148 HydrophobicContact CD1-CB 4.21Å; L116-I148 HydrophobicContact CD1-CG1 4.13Å; L116-I148 HydrophobicContact CD1-CG2 3.79Å; L119-I148 HydrophobicContact CB-CD1 4.01Å; L119-I148 HydrophobicContact CB-CG1 3.77Å; L119-I148 HydrophobicContact CD1-CG1 4.26Å; I120-I148 HydrophobicContact CG1-CD1 3.98Å; I120-I148 HydrophobicContact CG1-CG1 4.49Å; I123-I148 HydrophobicContact CD1-CD1 3.35Å; I123-I148 HydrophobicContact CG1-CD1 4.36Å; F144-I148 VanDerWaalsContact O-CG1 3.32Å; F144-I148 WeakPolarHBondContact O-CG1 3.21Å; F144-I148 PolarHBondContact O-N 2.85Å; V145-I148 PolarHBondContact O-N 3.44Å; I148-K150 VanDerWaalsContact C-N 3.31Å; I148-K150 PolarHBondContact O-N 2.92Å; I148-A151 PolarHBondContact O-N 3.37Å; I148-I152 HydrophobicContact CG2-CD1 3.66Å; I148-I152 HydrophobicContact CG2-CG1 4.41Å; I148-I152 VanDerWaalsContact O-CG1 3.32Å; I148-I152 WeakPolarHBondContact O-CG1 3.46Å; I148-I152 PolarHBondContact O-N 3.03Å
149L95Very high91.7Very high52 Ų5234.7 Ų34.727%0.27218%0.176SC..Hα-helixtrans-59.5-42.2176.7-72.5174.4000111.6V145 I152 A153 C187 W225V145-L149 HydrophobicContact CG1-CD1 4.08Å; V145-L149 HydrophobicContact CG1-CG 4.36Å; V145-L149 WeakPolarHBondContact O-CB 3.42Å; V145-L149 WeakPolarHBondContact O-CG 3.48Å; V145-L149 PolarHBondContact O-N 2.85Å; L149-I152 PolarHBondContact O-N 3.49Å; L149-A153 VanDerWaalsContact O-CB 3.27Å; L149-A153 WeakPolarHBondContact O-CB 3.45Å; L149-A153 PolarHBondContact O-N 3.37Å; L149-C187 HydrophobicContact CB-CB 4.49Å; L149-W225 HydrophobicContact CD1-CH2 3.75Å; L149-W225 HydrophobicContact CD1-CZ3 3.85Å
150K94.9Very high90.9Very high49 Ų4935.8 Ų35.821%0.21318%0.183CC..Hα-helixtrans-58.6-47.8173.6178.9-175.3175.3-179.20112.1S146 F147 I148 A153 V154 V188S146-K150 WeakPolarHBondContact O-CB 3.48Å; S146-K150 PolarHBondContact O-N 3.28Å; F147-K150 PolarHBondContact O-N 3.48Å; I148-K150 VanDerWaalsContact C-N 3.31Å; I148-K150 PolarHBondContact O-N 2.92Å; K150-A153 PolarHBondContact O-N 2.93Å; K150-V154 WeakPolarHBondContact O-CG2 3.35Å; K150-V154 PolarHBondContact O-N 3.21Å; K150-V188 HydrophobicContact CG-CG2 4.36Å
151A93.7Very high89.8Confident1 Ų136.4 Ų36.41%0.00819%0.188CC..Hα-helixtrans-63.2-44.4179.800000111.7H112 L116 F147 I148 A153 V154 F155H112-A151 HydrophobicContact CB-CB 4.45Å; L116-A151 HydrophobicContact CD1-CB 4.26Å; F147-A151 PolarHBondContact O-N 3.33Å; I148-A151 PolarHBondContact O-N 3.37Å; A151-A153 VanDerWaalsContact C-N 3.33Å; A151-A153 PolarHBondContact O-N 3.47Å; A151-V154 PolarHBondContact O-N 3.01Å; A151-F155 WeakPolarHBondContact O-CD2 3.41Å; A151-F155 PolarHBondContact O-N 3.46Å
152I93.4Very high88.5Confident71 Ų7141.3 Ų41.336%0.36421%0.206SC..Hα-helixtrans-60.2-44.4174.9-66.8167.5000110.5L116 I148 L149 V154 F155 V156L116-I152 HydrophobicContact CD1-CG1 4.41Å; I148-I152 HydrophobicContact CG2-CD1 3.66Å; I148-I152 HydrophobicContact CG2-CG1 4.41Å; I148-I152 VanDerWaalsContact O-CG1 3.32Å; I148-I152 WeakPolarHBondContact O-CG1 3.46Å; I148-I152 PolarHBondContact O-N 3.03Å; L149-I152 PolarHBondContact O-N 3.49Å; I152-V154 VanDerWaalsContact C-N 3.33Å; I152-V154 PolarHBondContact O-N 2.8Å; I152-F155 PolarHBondContact O-N 3.25Å; I152-V156 HydrophobicContact CG2-CG2 4.25Å; I152-V156 WeakPolarHBondContact O-CG2 3.43Å; I152-V156 PolarHBondContact O-N 3Å
153A92.2Very high86.7Confident1 Ų145.7 Ų45.71%0.00823%0.227CC..Hα-helixtrans-64.3-35.9179.600000112.9L149 K150 A151 K157 F183 F184 C187L149-A153 VanDerWaalsContact O-CB 3.27Å; L149-A153 WeakPolarHBondContact O-CB 3.45Å; L149-A153 PolarHBondContact O-N 3.37Å; K150-A153 PolarHBondContact O-N 2.93Å; A151-A153 VanDerWaalsContact C-N 3.33Å; A151-A153 PolarHBondContact O-N 3.47Å; A153-K157 VanDerWaalsContact O-CB 3.29Å; A153-K157 WeakPolarHBondContact O-CB 3.29Å; A153-K157 PolarHBondContact O-N 3.1Å; A153-F183 HydrophobicContact CB-CD1 3.95Å; A153-F183 HydrophobicContact CB-CE1 3.71Å; A153-F184 HydrophobicContact CB-CB 4.5Å; A153-F184 HydrophobicContact CB-CD2 4.18Å; A153-C187 HydrophobicContact CB-CB 3.77Å
154V89.8Confident84.6Confident13 Ų1352.2 Ų52.28%0.07926%0.255CS..Hα-helixtrans-60-48.1172.1171.90000110.3Y108 K150 A151 I152 K157 D158 F184Y108-V154 HydrophobicContact CD2-CG1 4.19Å; Y108-V154 HydrophobicContact CE2-CG1 3.9Å; K150-V154 WeakPolarHBondContact O-CG2 3.35Å; K150-V154 PolarHBondContact O-N 3.21Å; A151-V154 PolarHBondContact O-N 3.01Å; I152-V154 VanDerWaalsContact C-N 3.33Å; I152-V154 PolarHBondContact O-N 2.8Å; V154-K157 PolarHBondContact O-N 3.3Å; V154-D158 WeakPolarHBondContact O-CB 3.38Å; V154-D158 VanDerWaalsContact O-CG 3.3Å; V154-D158 PolarHBondContact O-N 2.88Å; V154-F184 HydrophobicContact CG2-CD2 4.5Å; V154-F184 HydrophobicContact CG2-CE2 3.77Å
155F89.7Confident82.3Confident55 Ų5552.3 Ų52.324%0.24127%0.269CS..Hα-helixtrans-63.6-44179-67.3-51.6000112.8T109 H112 S113 L116 A151 I152 K157 D158 V159T109-F155 HydrophobicContact CG2-CE1 4.14Å; H112-F155 HydrophobicContact CB-CE2 4.38Å; H112-F155 HydrophobicContact CB-CZ 3.93Å; S113-F155 WeakPolarHBondContact OG-CZ 3.38Å; L116-F155 HydrophobicContact CD2-CE2 4.24Å; A151-F155 WeakPolarHBondContact O-CD2 3.41Å; A151-F155 PolarHBondContact O-N 3.46Å; I152-F155 PolarHBondContact O-N 3.25Å; F155-K157 VanDerWaalsContact C-N 3.34Å; F155-K157 PolarHBondContact O-N 3.36Å; F155-D158 PolarHBondContact O-N 2.74Å; F155-V159 WeakPolarHBondContact O-CG2 3.14Å; F155-V159 PolarHBondContact O-N 3.49Å
156V87.7Confident79.7Confident56 Ų5656.4 Ų56.434%0.33928%0.284SS..Hα-helixtrans-61.9-43.9177.3174.60000110.6I152 D158 V159 V160 V180I152-V156 HydrophobicContact CG2-CG2 4.25Å; I152-V156 WeakPolarHBondContact O-CG2 3.43Å; I152-V156 PolarHBondContact O-N 3Å; V156-D158 VanDerWaalsContact C-N 3.32Å; V156-D158 PolarHBondContact O-N 3.45Å; V156-V159 PolarHBondContact O-N 2.85Å; V156-V160 HydrophobicContact CG1-CG2 4.32Å; V156-V160 WeakPolarHBondContact O-CB 3.21Å; V156-V160 WeakPolarHBondContact O-CG2 3.48Å; V156-V160 PolarHBondContact O-N 3.32Å; V156-V180 HydrophobicContact CG1-CG1 3.97Å; V156-V180 HydrophobicContact CG1-CG2 4.14Å
157K85.2Confident77.2Confident34 Ų3460.7 Ų60.715%0.14831%0.31CS..Hα-helixtrans-58.7-44.8176-167.5-165.282.582.20111.4A153 V154 F155 V160 L161 V180 I181 F184 D249A153-K157 VanDerWaalsContact O-CB 3.29Å; A153-K157 WeakPolarHBondContact O-CB 3.29Å; A153-K157 PolarHBondContact O-N 3.1Å; V154-K157 PolarHBondContact O-N 3.3Å; F155-K157 VanDerWaalsContact C-N 3.34Å; F155-K157 PolarHBondContact O-N 3.36Å; K157-V160 PolarHBondContact O-N 2.89Å; K157-L161 HydrophobicContact CD-CD1 4.16Å; K157-L161 HydrophobicContact CG-CD1 3.71Å; K157-L161 WeakPolarHBondContact O-CB 3.31Å; K157-L161 WeakPolarHBondContact O-CG 3.38Å; K157-L161 PolarHBondContact O-N 3.43Å; K157-V180 HydrophobicContact CB-CG1 4.44Å; K157-I181 HydrophobicContact CD-CD1 4.37Å; K157-I181 HydrophobicContact CG-CD1 4.07Å; K157-F184 HydrophobicContact CB-CD2 4.32Å; K157-F184 HydrophobicContact CD-CD1 3.81Å; K157-F184 HydrophobicContact CD-CD2 3.96Å; K157-F184 HydrophobicContact CD-CE1 3.93Å; K157-F184 HydrophobicContact CD-CE2 4.07Å; K157-F184 HydrophobicContact CD-CG 3.82Å; K157-F184 HydrophobicContact CD-CZ 4.06Å; K157-F184 HydrophobicContact CG-CG 4.46Å; K157-D249 IonicContact NZ-OD1 2.57Å
158D81.5Confident74.8Confident21 Ų2165.5 Ų65.511%0.11234%0.339CS..Hα-helixtrans-68.8-40.5-177.7-74.4-6.5000112.9Y108 V154 F155 V156 Y162Y108-D158 WeakPolarHBondContact CE2-OD2 3.42Å; Y108-D158 VanDerWaalsContact CZ-OD2 3.27Å; Y108-D158 PolarHBondContact OH-OD1 3.37Å; Y108-D158 PolarHBondContact OH-OD2 3.04Å; V154-D158 WeakPolarHBondContact O-CB 3.38Å; V154-D158 VanDerWaalsContact O-CG 3.3Å; V154-D158 PolarHBondContact O-N 2.88Å; F155-D158 PolarHBondContact O-N 2.74Å; V156-D158 VanDerWaalsContact C-N 3.32Å; V156-D158 PolarHBondContact O-N 3.45Å; D158-Y162 WeakPolarHBondContact O-CB 3.32Å; D158-Y162 PolarHBondContact O-N 2.6Å
159V79.9Confident72.3Confident77 Ų7769.6 Ų69.647%0.46736%0.361SS..Hα-helixtrans-63.2-45.6174.3171.90000110F155 V156 Y162 E163F155-V159 WeakPolarHBondContact O-CG2 3.14Å; F155-V159 PolarHBondContact O-N 3.49Å; V156-V159 PolarHBondContact O-N 2.85Å; V159-Y162 PolarHBondContact O-N 3.28Å; V159-E163 HydrophobicContact CG1-CG 4.29Å; V159-E163 WeakPolarHBondContact O-CB 3.38Å; V159-E163 PolarHBondContact O-N 3.01Å
160V74.6Confident70.4Confident25 Ų2570.1 Ų70.115%0.15237%0.369CS..Hα-helixtrans-68.1-41.1-177.7171.90000111.9V156 K157 Y162 F164 V180V156-V160 HydrophobicContact CG1-CG2 4.32Å; V156-V160 WeakPolarHBondContact O-CB 3.21Å; V156-V160 WeakPolarHBondContact O-CG2 3.48Å; V156-V160 PolarHBondContact O-N 3.32Å; K157-V160 PolarHBondContact O-N 2.89Å; V160-Y162 VanDerWaalsContact C-N 3.34Å; V160-F164 HydrophobicContact CB-CD2 4.49Å; V160-F164 HydrophobicContact CG1-CD2 4.06Å; V160-F164 HydrophobicContact CG1-CE2 4.48Å; V160-F164 WeakPolarHBondContact O-CB 3.03Å; V160-F164 VanDerWaalsContact O-CD2 3.31Å; V160-F164 WeakPolarHBondContact O-CD2 3.48Å; V160-F164 PolarHBondContact O-N 2.03Å; V160-V180 HydrophobicContact CB-CG1 4.28Å; V160-V180 HydrophobicContact CG1-CG1 4.43Å; V160-V180 HydrophobicContact CG1-CG2 4.46Å; V160-V180 HydrophobicContact CG2-CG1 4.27Å; V160-V180 HydrophobicContact CG2-CG2 4.03Å
161L68.8Low68.1Low59 Ų5971.2 Ų71.231%0.30938%0.383SS..Hα-helixtrans-71.9-28.8177.4-76.9163.1000113.1K157 G165 D249K157-L161 HydrophobicContact CD-CD1 4.16Å; K157-L161 HydrophobicContact CG-CD1 3.71Å; K157-L161 WeakPolarHBondContact O-CB 3.31Å; K157-L161 WeakPolarHBondContact O-CG 3.38Å; K157-L161 PolarHBondContact O-N 3.43Å; L161-G165 PolarHBondContact O-N 3.16Å; L161-D249 WeakPolarHBondContact CD1-OD2 3.48Å; L161-D249 HydrophobicContact CD2-CB 4.14Å; L161-D249 WeakPolarHBondContact CD2-OD2 3.47Å
162Y64.3Low65.9Low129 Ų12978.2 Ų78.251%0.50642%0.419SS..Hα-helixtrans-86.5-49-177-167.4-93.8000112.1D158 V159 V160 G165D158-Y162 WeakPolarHBondContact O-CB 3.32Å; D158-Y162 PolarHBondContact O-N 2.6Å; V159-Y162 PolarHBondContact O-N 3.28Å; V160-Y162 VanDerWaalsContact C-N 3.34Å; Y162-G165 PolarHBondContact O-N 2.96Å
163E55.9Low64.1Low126 Ų12675.7 Ų75.759%0.58941%0.411SS*.Hα-helixtrans-71.5-34.6-178.5-68.4-161.6170.100112.9V159 V167V159-E163 HydrophobicContact CG1-CG 4.29Å; V159-E163 WeakPolarHBondContact O-CB 3.38Å; V159-E163 PolarHBondContact O-N 3.01Å; E163-V167 WeakPolarHBondContact O-CG2 3.33Å
164F51.4Low62.8Low143 Ų14378.8 Ų78.863%0.62743%0.432SS*.Hα-helixtrans-88-7.1176.1-66.2-81.4000113.7V160V160-F164 HydrophobicContact CB-CD2 4.49Å; V160-F164 HydrophobicContact CG1-CD2 4.06Å; V160-F164 HydrophobicContact CG1-CE2 4.48Å; V160-F164 WeakPolarHBondContact O-CB 3.03Å; V160-F164 VanDerWaalsContact O-CD2 3.31Å; V160-F164 WeakPolarHBondContact O-CD2 3.48Å; V160-F164 PolarHBondContact O-N 2.03Å
165G46.9Very low62.2Low49 Ų4983.8 Ų83.851%0.50546%0.462SS..Hα-helixtrans-84.1-21.9175.100000113.7L161 Y162L161-G165 PolarHBondContact O-N 3.16Å; Y162-G165 PolarHBondContact O-N 2.96Å
166E41.6Very low61.7Low138 Ų13883.1 Ų83.165%0.64547%0.471SS*.Hα-helixtrans-106.9-16.2-173.2-157166.5-171.300113.3
167V43.5Very low61.4Low90 Ų9081.7 Ų81.755%0.54546%0.463SS..SBendtrans-104.793.2-178.9-171.50000110E163 N169E163-V167 WeakPolarHBondContact O-CG2 3.33Å; V167-N169 PolarHBondContact O-N 3.23Å
168D45.7Very low61.3Low164 Ų16481.8 Ų81.888%0.87746%0.463SS*.SBendtrans24.6-1.3151.6-71.9-27.5000123
169N43.5Very low61.6Low108 Ų10883.3 Ų83.358%0.57848%0.479SS*.  trans-117.886.1177.1-62.6-59.2000105.9V167 S171V167-N169 PolarHBondContact O-N 3.23Å; N169-S171 WeakPolarHBondContact CB-OG 3.36Å; N169-S171 PolarHBondContact O-N 3.01Å; N169-S171 PolarHBondContact O-OG 2.91Å
170C53.4Low62Low64 Ų6480.9 Ų80.943%0.43246%0.464SS..  trans-57.672.9154.5-85.70000107.9L172C170-L172 PolarHBondContact O-N 2.92Å
171S46.6Very low62.6Low72 Ų7279.9 Ų79.950%0.50346%0.458SS..  trans-75.883.5-178.4-52.80000105.3N169 G173 S174N169-S171 WeakPolarHBondContact CB-OG 3.36Å; N169-S171 PolarHBondContact O-N 3.01Å; N169-S171 PolarHBondContact O-OG 2.91Å; S171-G173 PolarHBondContact O-N 3.5Å; S171-S174 PolarHBondContact O-N 3.13Å
172L47.7Very low63.7Low148 Ų14878.7 Ų78.778%0.77545%0.453SS*.THydrogen-bonded Turntrans-34.1105.1176.9-146100.2000109.7C170 S174C170-L172 PolarHBondContact O-N 2.92Å; L172-S174 PolarHBondContact O-N 3.33Å; L172-S174 VanDerWaalsContact O-N 3.16Å
173G55.3Low65Low18 Ų1876.6 Ų76.619%0.18645%0.447CS..THydrogen-bonded Turntrans5343.1170.800000115.9S171 V175S171-G173 PolarHBondContact O-N 3.5Å; G173-V175 PolarHBondContact O-N 2.93Å; G173-V175 VanDerWaalsContact O-N 3.12Å
174S66.7Low66.8Low65 Ų6572.2 Ų72.246%0.45543%0.426SS..  trans-48.8125.7170.3176.40000109.4S171 L172 G176 C177 K178S171-S174 PolarHBondContact O-N 3.13Å; L172-S174 PolarHBondContact O-N 3.33Å; L172-S174 VanDerWaalsContact O-N 3.16Å; S174-G176 PolarHBondContact O-N 3.49Å; S174-G176 PolarHBondContact OG-N 3.37Å; S174-C177 PolarHBondContact O-N 3.27Å; S174-K178 PolarHBondContact O-N 3.29Å
175V77.1Confident68.7Low119 Ų11966 Ų6672%0.72140%0.399SS*.Hα-helixtrans-51.2-29.2179178.70000110.6G173 A179G173-V175 PolarHBondContact O-N 2.93Å; G173-V175 VanDerWaalsContact O-N 3.12Å; V175-A179 VanDerWaalsContact O-CB 3.27Å; V175-A179 WeakPolarHBondContact O-CB 3.46Å; V175-A179 PolarHBondContact O-N 3.3Å
176G78.1Confident71Confident40 Ų4066.5 Ų66.541%0.41239%0.386SS..Hα-helixtrans-61.1-46.8173.200000114.1S174 A179 V180S174-G176 PolarHBondContact O-N 3.49Å; S174-G176 PolarHBondContact OG-N 3.37Å; G176-A179 PolarHBondContact O-N 2.89Å; G176-V180 VanDerWaalsContact O-CG2 3.24Å; G176-V180 WeakPolarHBondContact O-CG2 3.3Å; G176-V180 PolarHBondContact O-N 3.45Å
177C82.1Confident73.6Confident26 Ų2660 Ų6018%0.17636%0.355CS..Hα-helixtrans-64.3-45.4178.8-166.10000110.8S174 A179 V180 I181 C247S174-C177 PolarHBondContact O-N 3.27Å; C177-A179 VanDerWaalsContact C-N 3.34Å; C177-A179 PolarHBondContact O-N 3.23Å; C177-V180 PolarHBondContact O-N 2.67Å; C177-I181 WeakPolarHBondContact O-CG1 3.46Å; C177-I181 PolarHBondContact O-N 2.82Å; C177-C247 VanDerWaalsContact C-SG 3.54Å; C177-C247 HydrophobicContact CB-CB 3.95Å; C177-C247 WeakPolarHBondContact CB-SG 3.12Å; C177-C247 WeakPolarHBondContact SG-CB 3.4Å; C177-C247 CovalentContact SG-SG 2.03Å; C177-C247 PolarHBondContact SG-SG 3.47Å
178K83.5Confident76Confident36 Ų3656.6 Ų56.616%0.15734%0.335CS..Hα-helixtrans-58.9-45.3176.3-62.1-179-174.51780111.3S174 V180 I181 V182 D244 G246 W248S174-K178 PolarHBondContact O-N 3.29Å; K178-V180 PolarHBondContact O-N 3.25Å; K178-I181 PolarHBondContact O-N 3.02Å; K178-V182 VanDerWaalsContact O-CG2 3.31Å; K178-V182 WeakPolarHBondContact O-CG2 3.33Å; K178-V182 PolarHBondContact O-N 3.43Å; K178-D244 WeakPolarHBondContact CE-OD1 3.44Å; K178-D244 IonicContact NZ-OD1 3Å; K178-D244 PolarHBondContact NZ-OD1 3.48Å; K178-D244 IonicContact NZ-OD2 2.92Å; K178-D244 PolarHBondContact NZ-OD2 3.05Å; K178-G246 WeakPolarHBondContact CE-O 3.42Å; K178-W248 HydrophobicContact CD-CZ2 4.36Å
179A87Confident78.4Confident54 Ų5448.8 Ų48.845%0.44629%0.294SS..Hα-helixtrans-62-41.4177.600000112.6V175 G176 C177 V182 F183V175-A179 VanDerWaalsContact O-CB 3.27Å; V175-A179 WeakPolarHBondContact O-CB 3.46Å; V175-A179 PolarHBondContact O-N 3.3Å; G176-A179 PolarHBondContact O-N 2.89Å; C177-A179 VanDerWaalsContact C-N 3.34Å; C177-A179 PolarHBondContact O-N 3.23Å; A179-V182 PolarHBondContact O-N 3.42Å; A179-F183 VanDerWaalsContact O-CB 3.27Å; A179-F183 WeakPolarHBondContact O-CB 3.3Å; A179-F183 PolarHBondContact O-N 3.5Å
180V88.6Confident80.9Confident26 Ų2643.8 Ų43.816%0.15827%0.267CS..Hα-helixtrans-63.6-42.7177.3168.70000111.1V156 K157 V160 G176 C177 K178 F183 F184V156-V180 HydrophobicContact CG1-CG1 3.97Å; V156-V180 HydrophobicContact CG1-CG2 4.14Å; K157-V180 HydrophobicContact CB-CG1 4.44Å; V160-V180 HydrophobicContact CB-CG1 4.28Å; V160-V180 HydrophobicContact CG1-CG1 4.43Å; V160-V180 HydrophobicContact CG1-CG2 4.46Å; V160-V180 HydrophobicContact CG2-CG1 4.27Å; V160-V180 HydrophobicContact CG2-CG2 4.03Å; G176-V180 VanDerWaalsContact O-CG2 3.24Å; G176-V180 WeakPolarHBondContact O-CG2 3.3Å; G176-V180 PolarHBondContact O-N 3.45Å; C177-V180 PolarHBondContact O-N 2.67Å; K178-V180 PolarHBondContact O-N 3.25Å; V180-F183 PolarHBondContact O-N 3.24Å; V180-F184 WeakPolarHBondContact O-CB 3.39Å; V180-F184 PolarHBondContact O-N 2.99Å
181I87.5Confident82.9Confident3 Ų340.8 Ų40.82%0.01525%0.247CC..Hα-helixtrans-65.2-46.2176.3-63.1-57.8000111.4K157 C177 K178 F183 F184 Q185 W235 W248 D249K157-I181 HydrophobicContact CD-CD1 4.37Å; K157-I181 HydrophobicContact CG-CD1 4.07Å; C177-I181 WeakPolarHBondContact O-CG1 3.46Å; C177-I181 PolarHBondContact O-N 2.82Å; K178-I181 PolarHBondContact O-N 3.02Å; I181-F183 VanDerWaalsContact C-N 3.3Å; I181-F183 PolarHBondContact O-N 2.89Å; I181-F184 WeakPolarHBondContact O-CB 3.37Å; I181-F184 PolarHBondContact O-N 2.97Å; I181-Q185 HydrophobicContact CG2-CG 4.33Å; I181-Q185 WeakPolarHBondContact O-CG 3.34Å; I181-Q185 PolarHBondContact O-N 3.4Å; I181-W235 HydrophobicContact CG2-CH2 4.36Å; I181-W248 HydrophobicContact CG2-CB 4.1Å; I181-W248 WeakPolarHBondContact CG2-O 3.4Å; I181-D249 HydrophobicContact CD1-CB 3.74Å; I181-D249 HydrophobicContact CG1-CB 4.28Å
182V91Very high85.3Confident35 Ų3539.6 Ų39.621%0.21223%0.233CC..Hα-helixtrans-58.6-45176.6171.10000110.8K178 A179 Q185 Y186 I232 W235 W248K178-V182 VanDerWaalsContact O-CG2 3.31Å; K178-V182 WeakPolarHBondContact O-CG2 3.33Å; K178-V182 PolarHBondContact O-N 3.43Å; A179-V182 PolarHBondContact O-N 3.42Å; V182-Q185 PolarHBondContact O-N 3.36Å; V182-Y186 WeakPolarHBondContact O-CB 3.43Å; V182-Y186 PolarHBondContact O-N 3.5Å; V182-I232 HydrophobicContact CG1-CG2 3.81Å; V182-W235 HydrophobicContact CG2-CZ3 4.16Å; V182-W248 HydrophobicContact CG2-CE3 3.81Å; V182-W248 HydrophobicContact CG2-CZ3 3.55Å
183F92.9Very high87.6Confident85 Ų8533.8 Ų33.837%0.37320%0.201SC..Hα-helixtrans-61.4-44.7176.3178-105.7000111.9A153 A179 V180 I181 Y186 C187A153-F183 HydrophobicContact CB-CD1 3.95Å; A153-F183 HydrophobicContact CB-CE1 3.71Å; A179-F183 VanDerWaalsContact O-CB 3.27Å; A179-F183 WeakPolarHBondContact O-CB 3.3Å; A179-F183 PolarHBondContact O-N 3.5Å; V180-F183 PolarHBondContact O-N 3.24Å; I181-F183 VanDerWaalsContact C-N 3.3Å; I181-F183 PolarHBondContact O-N 2.89Å; F183-Y186 WeakPolarHBondContact O-CB 3.4Å; F183-Y186 PolarHBondContact O-N 3.5Å; F183-C187 VanDerWaalsContact CZ-SG 3.5Å; F183-C187 PolarHBondContact O-N 3.46Å; F183-C187 PolarHBondContact O-SG 2.92Å; F183-C187 VanDerWaalsContact O-SG 3.32Å
184F92.4Very high89.6Confident33 Ų3332.9 Ų32.915%0.14519%0.192CC..Hα-helixtrans-58.6-50175.9170.6-102.3000112.3A153 V154 K157 V180 I181 Y186 C187 V188A153-F184 HydrophobicContact CB-CB 4.5Å; A153-F184 HydrophobicContact CB-CD2 4.18Å; V154-F184 HydrophobicContact CG2-CD2 4.5Å; V154-F184 HydrophobicContact CG2-CE2 3.77Å; K157-F184 HydrophobicContact CB-CD2 4.32Å; K157-F184 HydrophobicContact CD-CD1 3.81Å; K157-F184 HydrophobicContact CD-CD2 3.96Å; K157-F184 HydrophobicContact CD-CE1 3.93Å; K157-F184 HydrophobicContact CD-CE2 4.07Å; K157-F184 HydrophobicContact CD-CG 3.82Å; K157-F184 HydrophobicContact CD-CZ 4.06Å; K157-F184 HydrophobicContact CG-CG 4.46Å; V180-F184 WeakPolarHBondContact O-CB 3.39Å; V180-F184 PolarHBondContact O-N 2.99Å; I181-F184 WeakPolarHBondContact O-CB 3.37Å; I181-F184 PolarHBondContact O-N 2.97Å; F184-Y186 VanDerWaalsContact C-N 3.29Å; F184-Y186 PolarHBondContact O-N 2.92Å; F184-C187 PolarHBondContact O-N 3.28Å; F184-V188 HydrophobicContact CD2-CG2 4.22Å; F184-V188 HydrophobicContact CE1-CG2 4.14Å; F184-V188 HydrophobicContact CE2-CG2 3.77Å; F184-V188 HydrophobicContact CZ-CG2 3.73Å; F184-V188 WeakPolarHBondContact O-CG2 3.3Å; F184-V188 PolarHBondContact O-N 3.16Å
185Q92.3Very high90.9Very high14 Ų1432.5 Ų32.57%0.06519%0.185CC..Hα-helixtrans-62-38.6178.8-63.9-62.1-11.200111.7I181 V182 M189 I232 W235 I261I181-Q185 HydrophobicContact CG2-CG 4.33Å; I181-Q185 WeakPolarHBondContact O-CG 3.34Å; I181-Q185 PolarHBondContact O-N 3.4Å; V182-Q185 PolarHBondContact O-N 3.36Å; Q185-M189 WeakPolarHBondContact O-CB 3.32Å; Q185-M189 PolarHBondContact O-N 3.39Å; Q185-I232 HydrophobicContact CB-CD1 3.72Å; Q185-W235 HydrophobicContact CG-CH2 4.44Å; Q185-W235 HydrophobicContact CG-CZ3 4.44Å; Q185-I261 HydrophobicContact CB-CD1 4.14Å; Q185-I261 HydrophobicContact CG-CD1 4.01Å
186Y95.1Very high91.8Very high58 Ų5827.9 Ų27.923%0.22716%0.156CC..Hα-helixtrans-60.4-50.5172.7173.2-102.1000112.7V182 F183 F184 V188 M189 A190 P228 A229V182-Y186 WeakPolarHBondContact O-CB 3.43Å; V182-Y186 PolarHBondContact O-N 3.5Å; F183-Y186 WeakPolarHBondContact O-CB 3.4Å; F183-Y186 PolarHBondContact O-N 3.5Å; F184-Y186 VanDerWaalsContact C-N 3.29Å; F184-Y186 PolarHBondContact O-N 2.92Å; Y186-V188 VanDerWaalsContact C-N 3.33Å; Y186-V188 PolarHBondContact O-N 3.04Å; Y186-M189 PolarHBondContact O-N 3.46Å; Y186-A190 VanDerWaalsContact O-CB 3.27Å; Y186-A190 WeakPolarHBondContact O-CB 3.37Å; Y186-A190 PolarHBondContact O-N 3.34Å; Y186-P228 HydrophobicContact CD2-CB 4.05Å; Y186-P228 HydrophobicContact CE2-CB 3.96Å; Y186-A229 HydrophobicContact CE2-CB 3.95Å
187C95.9Very high92.6Very high1 Ų126 Ų261%0.00714%0.136CC..Hα-helixtrans-63.8-38.9-179.2-67.20000112.3L149 A153 F183 F184 S191L149-C187 HydrophobicContact CB-CB 4.49Å; A153-C187 HydrophobicContact CB-CB 3.77Å; F183-C187 VanDerWaalsContact CZ-SG 3.5Å; F183-C187 PolarHBondContact O-N 3.46Å; F183-C187 PolarHBondContact O-SG 2.92Å; F183-C187 VanDerWaalsContact O-SG 3.32Å; F184-C187 PolarHBondContact O-N 3.28Å; C187-S191 PolarHBondContact O-N 3.45Å; C187-S191 VanDerWaalsContact O-N 3.11Å
188V94.3Very high93.2Very high20 Ų2026.9 Ų26.912%0.12114%0.138CC..Hα-helixtrans-61.5-51.3173.9172.20000110.3K150 F184 Y186 A190 S191 F192K150-V188 HydrophobicContact CG-CG2 4.36Å; F184-V188 HydrophobicContact CD2-CG2 4.22Å; F184-V188 HydrophobicContact CE1-CG2 4.14Å; F184-V188 HydrophobicContact CE2-CG2 3.77Å; F184-V188 HydrophobicContact CZ-CG2 3.73Å; F184-V188 WeakPolarHBondContact O-CG2 3.3Å; F184-V188 PolarHBondContact O-N 3.16Å; Y186-V188 VanDerWaalsContact C-N 3.33Å; Y186-V188 PolarHBondContact O-N 3.04Å; V188-A190 PolarHBondContact O-N 2.95Å; V188-S191 PolarHBondContact O-N 2.83Å; V188-S191 PolarHBondContact O-OG 3.01Å; V188-F192 HydrophobicContact CG1-CD2 4.18Å; V188-F192 HydrophobicContact CG1-CE2 3.85Å; V188-F192 VanDerWaalsContact O-CD2 3.27Å; V188-F192 WeakPolarHBondContact O-CD2 3.33Å; V188-F192 PolarHBondContact O-N 3.37Å
189M94.8Very high93.6Very high0 Ų025.5 Ų25.50%013%0.134CC..Hα-helixtrans-64-41.5-178.9-170.3172.9-69.500112.2Q185 Y186 S191 F192 F193 P228 I231 I232 I261 I265Q185-M189 WeakPolarHBondContact O-CB 3.32Å; Q185-M189 PolarHBondContact O-N 3.39Å; Y186-M189 PolarHBondContact O-N 3.46Å; M189-S191 VanDerWaalsContact C-N 3.29Å; M189-S191 PolarHBondContact O-N 3.18Å; M189-F192 PolarHBondContact O-N 3.2Å; M189-F192 VanDerWaalsContact O-N 3.12Å; M189-F193 HydrophobicContact CG-CD2 3.81Å; M189-F193 HydrophobicContact CG-CE2 3.75Å; M189-F193 WeakPolarHBondContact O-CD2 3.48Å; M189-F193 PolarHBondContact O-N 3.01Å; M189-F193 HydrophobicContact SD-CE2 4.22Å; M189-P228 HydrophobicContact CB-CB 4.08Å; M189-P228 HydrophobicContact CG-CB 3.85Å; M189-P228 HydrophobicContact CG-CG 4.26Å; M189-P228 HydrophobicContact SD-CB 4.2Å; M189-I231 HydrophobicContact CE-CB 4.35Å; M189-I231 HydrophobicContact CE-CG2 3.64Å; M189-I231 HydrophobicContact SD-CB 3.71Å; M189-I231 HydrophobicContact SD-CD1 4Å; M189-I231 HydrophobicContact SD-CG1 4.47Å; M189-I231 HydrophobicContact SD-CG2 3.68Å; M189-I232 HydrophobicContact CE-CD1 3.7Å; M189-I232 HydrophobicContact CE-CG1 4.27Å; M189-I232 HydrophobicContact SD-CD1 4.14Å; M189-I232 HydrophobicContact SD-CG1 4.03Å; M189-I261 HydrophobicContact CE-CB 4.16Å; M189-I261 HydrophobicContact CE-CG1 4.22Å; M189-I261 HydrophobicContact CE-CG2 3.85Å; M189-I265 HydrophobicContact CE-CG1 4.47Å
190A96.5Very high93.9Very high2 Ų225.6 Ų25.62%0.01713%0.126CC..Hα-helixtrans-58.3-39.6175.400000112.4Y186 V188 F192 F193 W194 W225 P228Y186-A190 VanDerWaalsContact O-CB 3.27Å; Y186-A190 WeakPolarHBondContact O-CB 3.37Å; Y186-A190 PolarHBondContact O-N 3.34Å; V188-A190 PolarHBondContact O-N 2.95Å; A190-F192 VanDerWaalsContact C-N 3.31Å; A190-F192 PolarHBondContact O-N 3.42Å; A190-F193 PolarHBondContact O-N 3.27Å; A190-W194 WeakPolarHBondContact O-CB 3.32Å; A190-W194 PolarHBondContact O-N 3.44Å; A190-W225 HydrophobicContact CB-CE3 4.34Å; A190-W225 HydrophobicContact CB-CZ3 4.16Å; A190-P228 HydrophobicContact CB-CB 4.29Å; A190-P228 HydrophobicContact CB-CG 4.14Å
191S96.2Very high94Very high2 Ų225.9 Ų25.91%0.01413%0.125CC..Hα-helixtrans-61.7-37.8176.176.60000113C187 V188 M189 L195C187-S191 PolarHBondContact O-N 3.45Å; C187-S191 VanDerWaalsContact O-N 3.11Å; V188-S191 PolarHBondContact O-N 2.83Å; V188-S191 PolarHBondContact O-OG 3.01Å; M189-S191 VanDerWaalsContact C-N 3.29Å; M189-S191 PolarHBondContact O-N 3.18Å; S191-L195 WeakPolarHBondContact O-CB 3.36Å; S191-L195 PolarHBondContact O-N 3.39Å; S191-L195 VanDerWaalsContact O-N 3.12Å
192F96.1Very high94.1Very high47 Ų4729.1 Ų29.121%0.20614%0.142CC..Hα-helixtrans-72.5-41.2177.1-75.3-70.6000112.4V188 M189 A190 L195 L196 I265 S268 I269V188-F192 HydrophobicContact CG1-CD2 4.18Å; V188-F192 HydrophobicContact CG1-CE2 3.85Å; V188-F192 VanDerWaalsContact O-CD2 3.27Å; V188-F192 WeakPolarHBondContact O-CD2 3.33Å; V188-F192 PolarHBondContact O-N 3.37Å; M189-F192 PolarHBondContact O-N 3.2Å; M189-F192 VanDerWaalsContact O-N 3.12Å; A190-F192 VanDerWaalsContact C-N 3.31Å; A190-F192 PolarHBondContact O-N 3.42Å; F192-L195 WeakPolarHBondContact O-CB 3.46Å; F192-L195 PolarHBondContact O-N 3.43Å; F192-L196 PolarHBondContact O-N 2.98Å; F192-I265 HydrophobicContact CD1-CG2 4.34Å; F192-I265 HydrophobicContact CD2-CD1 4.44Å; F192-I265 HydrophobicContact CD2-CG1 4.17Å; F192-I265 HydrophobicContact CD2-CG2 3.77Å; F192-I265 HydrophobicContact CE1-CG2 4.27Å; F192-I265 HydrophobicContact CE2-CG2 3.69Å; F192-I265 HydrophobicContact CG-CG2 4.1Å; F192-I265 HydrophobicContact CZ-CG2 3.96Å; F192-S268 PolarHBondContact O-OG 2.93Å; F192-I269 HydrophobicContact CD1-CD1 4.31Å; F192-I269 HydrophobicContact CD1-CG1 3.98Å; F192-I269 HydrophobicContact CE1-CD1 3.79Å; F192-I269 HydrophobicContact CE1-CG1 3.88Å; F192-I269 HydrophobicContact CZ-CD1 4.36Å
193F96Very high94.1Very high25 Ų2529.9 Ų29.911%0.1114%0.143CC..Hα-helixtrans-66.4-38.8177-88.5-108.4000111.9M189 A190 L196 V197 I223 P228 I231 P264M189-F193 HydrophobicContact CG-CD2 3.81Å; M189-F193 HydrophobicContact CG-CE2 3.75Å; M189-F193 WeakPolarHBondContact O-CD2 3.48Å; M189-F193 PolarHBondContact O-N 3.01Å; M189-F193 HydrophobicContact SD-CE2 4.22Å; A190-F193 PolarHBondContact O-N 3.27Å; F193-L196 WeakPolarHBondContact O-CB 3.27Å; F193-L196 PolarHBondContact O-N 2.62Å; F193-V197 VanDerWaalsContact O-CG2 3.32Å; F193-V197 WeakPolarHBondContact O-CG2 3.37Å; F193-V197 PolarHBondContact O-N 2.62Å; F193-I223 HydrophobicContact CD1-CG2 4.45Å; F193-I223 WeakPolarHBondContact CD1-O 3.29Å; F193-P228 HydrophobicContact CB-CG 3.7Å; F193-P228 HydrophobicContact CD1-CG 4.19Å; F193-P228 HydrophobicContact CD2-CG 3.83Å; F193-P228 HydrophobicContact CE2-CG 4.5Å; F193-P228 HydrophobicContact CG-CG 3.64Å; F193-I231 HydrophobicContact CE2-CD1 4.08Å; F193-I231 HydrophobicContact CZ-CD1 3.57Å; F193-P264 HydrophobicContact CE2-CB 4.34Å; F193-P264 HydrophobicContact CZ-CB 4.45Å
194W96.9Very high93.8Very high0 Ų026.4 Ų26.40%013%0.13CC..Hα-helixtrans-66.2-37.8174.2-88.9102.1000112.8I139 H142 L143 A190 L196 V197 E198 I221 W225I139-W194 HydrophobicContact CD1-CZ3 4.24Å; I139-W194 HydrophobicContact CG2-CZ3 4.4Å; H142-W194 HydrophobicContact CB-CD2 3.85Å; H142-W194 HydrophobicContact CB-CE3 3.58Å; H142-W194 HydrophobicContact CB-CH2 3.25Å; H142-W194 HydrophobicContact CB-CZ2 3.54Å; H142-W194 HydrophobicContact CB-CZ3 3.27Å; H142-W194 AromaticContact CD2-CH2 3.86Å; H142-W194 AromaticContact CG-CH2 3.48Å; H142-W194 VanDerWaalsContact CG-CH2 3.48Å; H142-W194 AromaticContact CG-CZ2 3.7Å; H142-W194 AromaticContact CG-CZ3 3.99Å; H142-W194 AromaticContact ND1-CZ2 3.88Å; L143-W194 HydrophobicContact CD1-CB 3.9Å; A190-W194 WeakPolarHBondContact O-CB 3.32Å; A190-W194 PolarHBondContact O-N 3.44Å; W194-L196 VanDerWaalsContact C-N 3.31Å; W194-L196 PolarHBondContact O-N 3.3Å; W194-V197 HydrophobicContact CE3-CB 4.34Å; W194-V197 HydrophobicContact CE3-CG1 4.16Å; W194-V197 HydrophobicContact CZ3-CG1 3.94Å; W194-V197 PolarHBondContact O-N 3.33Å; W194-E198 PolarHBondContact O-N 3.37Å; W194-I221 HydrophobicContact CH2-CG1 4.22Å; W194-W225 AromaticContact CE2-CD1 3.94Å; W194-W225 AromaticContact CE2-CE2 3.68Å; W194-W225 AromaticContact CE2-NE1 3.53Å; W194-W225 AromaticContact CZ2-CD1 3.46Å; W194-W225 VanDerWaalsContact CZ2-CD1 3.46Å; W194-W225 HydrophobicContact CZ2-CD2 4.43Å; W194-W225 AromaticContact CZ2-CE2 3.82Å; W194-W225 HydrophobicContact CZ2-CG 4.22Å; W194-W225 HydrophobicContact CZ2-CZ2 4.47Å; W194-W225 AromaticContact CZ2-NE1 3.16Å; W194-W225 AromaticContact NE1-CD1 3.82Å; W194-W225 AromaticContact NE1-CD2 3.33Å; W194-W225 VanDerWaalsContact NE1-CD2 3.33Å; W194-W225 AromaticContact NE1-CE2 3.14Å; W194-W225 AromaticContact NE1-CE3 3.81Å; W194-W225 AromaticContact NE1-CG 3.77Å; W194-W225 AromaticContact NE1-CH2 3.92Å; W194-W225 AromaticContact NE1-CZ2 3.45Å; W194-W225 AromaticContact NE1-NE1 3.46Å
195L95.4Very high93.5Very high56 Ų5628.5 Ų28.529%0.29314%0.142SC..Hα-helixtrans-62-40.1172-173.875.1000111.5L143 S191 F192 G199 N272L143-L195 HydrophobicContact CD1-CB 4.23Å; L143-L195 HydrophobicContact CD1-CD1 4.46Å; S191-L195 WeakPolarHBondContact O-CB 3.36Å; S191-L195 PolarHBondContact O-N 3.39Å; S191-L195 VanDerWaalsContact O-N 3.12Å; F192-L195 WeakPolarHBondContact O-CB 3.46Å; F192-L195 PolarHBondContact O-N 3.43Å; L195-G199 PolarHBondContact O-N 2.93Å; L195-G199 VanDerWaalsContact O-N 3.1Å; L195-N272 VanDerWaalsContact CD2-ND2 3.3Å; L195-N272 WeakPolarHBondContact CD2-ND2 3.4Å; L195-N272 VanDerWaalsContact CG-ND2 3.31Å; L195-N272 WeakPolarHBondContact CG-ND2 3.49Å
196L95.4Very high93.2Very high22 Ų2230.2 Ų30.212%0.11515%0.151CC..Hα-helixtrans-65.1-43.4173.717665.2000112.3F192 F193 W194 E198 G199 L200 S268 V271 L275F192-L196 PolarHBondContact O-N 2.98Å; F193-L196 WeakPolarHBondContact O-CB 3.27Å; F193-L196 PolarHBondContact O-N 2.62Å; W194-L196 VanDerWaalsContact C-N 3.31Å; W194-L196 PolarHBondContact O-N 3.3Å; L196-E198 VanDerWaalsContact C-N 3.33Å; L196-E198 PolarHBondContact O-N 3.13Å; L196-G199 PolarHBondContact O-N 2.99Å; L196-L200 HydrophobicContact CD1-CD1 4.21Å; L196-L200 HydrophobicContact CD1-CG 4.2Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.38Å; L196-L200 WeakPolarHBondContact O-CB 3.45Å; L196-L200 WeakPolarHBondContact O-CG 2.99Å; L196-L200 PolarHBondContact O-N 3.43Å; L196-S268 WeakPolarHBondContact CB-OG 3.28Å; L196-V271 HydrophobicContact CD1-CB 3.93Å; L196-V271 HydrophobicContact CD1-CG1 3.55Å; L196-L275 HydrophobicContact CD1-CD1 4.13Å
197V95.1Very high92.6Very high0 Ų029.8 Ų29.80%016%0.16CC..Hα-helixtrans-61.3-42.4177.8166.20000111.1F193 W194 L200 Y201 Y220 I223F193-V197 VanDerWaalsContact O-CG2 3.32Å; F193-V197 WeakPolarHBondContact O-CG2 3.37Å; F193-V197 PolarHBondContact O-N 2.62Å; W194-V197 HydrophobicContact CE3-CB 4.34Å; W194-V197 HydrophobicContact CE3-CG1 4.16Å; W194-V197 HydrophobicContact CZ3-CG1 3.94Å; W194-V197 PolarHBondContact O-N 3.33Å; V197-L200 PolarHBondContact O-N 2.82Å; V197-Y201 VanDerWaalsContact O-CB 3.25Å; V197-Y201 WeakPolarHBondContact O-CB 3.26Å; V197-Y201 PolarHBondContact O-N 2.81Å; V197-Y220 HydrophobicContact CG1-CD1 4.16Å; V197-Y220 HydrophobicContact CG1-CG 4.27Å; V197-I223 HydrophobicContact CG2-CB 4.27Å; V197-I223 HydrophobicContact CG2-CG2 3.89Å
198E94.1Very high91.5Very high45 Ų4533.1 Ų33.121%0.2118%0.18CC..Hα-helixtrans-60.1-47.8173.9-177.5-177-15200111.6I139 H140 L143 W194 L196 L200 Y201 L202I139-E198 HydrophobicContact CG2-CB 4.35Å; H140-E198 IonicContact CE1-OE1 3.52Å; H140-E198 PolarHBondContact CE1-OE1 3.25Å; H140-E198 IonicContact ND1-OE1 2.7Å; H140-E198 PolarHBondContact ND1-OE1 3.13Å; L143-E198 WeakPolarHBondContact CD2-OE2 3.38Å; W194-E198 PolarHBondContact O-N 3.37Å; L196-E198 VanDerWaalsContact C-N 3.33Å; L196-E198 PolarHBondContact O-N 3.13Å; E198-L200 PolarHBondContact O-N 2.7Å; E198-Y201 PolarHBondContact O-N 3Å; E198-L202 WeakPolarHBondContact O-CB 3.27Å; E198-L202 PolarHBondContact O-N 2.89Å
199G93Very high89.9Confident7 Ų736.7 Ų36.77%0.07221%0.206CC..Hα-helixtrans-60.2-4417700000112.9L195 L196 H203L195-G199 PolarHBondContact O-N 2.93Å; L195-G199 VanDerWaalsContact O-N 3.1Å; L196-G199 PolarHBondContact O-N 2.99Å; G199-H203 WeakPolarHBondContact O-CB 3.11Å; G199-H203 PolarHBondContact O-N 3.42Å
200L92.3Very high88Confident56 Ų5645.6 Ų45.629%0.29325%0.245SC..Hα-helixtrans-64.6-43.6176.8-74.8171.3000111.7L196 V197 E198 H203 A204 Y220 L275L196-L200 HydrophobicContact CD1-CD1 4.21Å; L196-L200 HydrophobicContact CD1-CG 4.2Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.38Å; L196-L200 WeakPolarHBondContact O-CB 3.45Å; L196-L200 WeakPolarHBondContact O-CG 2.99Å; L196-L200 PolarHBondContact O-N 3.43Å; V197-L200 PolarHBondContact O-N 2.82Å; E198-L200 PolarHBondContact O-N 2.7Å; L200-H203 PolarHBondContact O-N 3.03Å; L200-A204 WeakPolarHBondContact O-CB 3.24Å; L200-A204 PolarHBondContact O-N 3.46Å; L200-Y220 HydrophobicContact CB-CE1 4.31Å; L200-L275 HydrophobicContact CD2-CD1 3.65Å; L200-L275 HydrophobicContact CD2-CD2 4.19Å; L200-L275 HydrophobicContact CG-CD1 3.81Å
201Y90.8Very high86.3Confident33 Ų3349.6 Ų49.613%0.12926%0.262CS..Hα-helixtrans-62.7-46.1178.1174.9-100.6000111.3T135 R136 I139 V197 E198 A204 L205 Y220T135-Y201 PolarHBondContact OG1-OH 2.66Å; R136-Y201 HydrophobicContact CB-CE1 4.06Å; R136-Y201 HydrophobicContact CG-CE1 4.2Å; R136-Y201 PolarHBondContact N-OH 3.35Å; I139-Y201 HydrophobicContact CG1-CD1 4.41Å; I139-Y201 HydrophobicContact CG1-CD2 4.45Å; I139-Y201 HydrophobicContact CG1-CG 4.33Å; V197-Y201 VanDerWaalsContact O-CB 3.25Å; V197-Y201 WeakPolarHBondContact O-CB 3.26Å; V197-Y201 PolarHBondContact O-N 2.81Å; E198-Y201 PolarHBondContact O-N 3Å; Y201-A204 PolarHBondContact O-N 3.04Å; Y201-L205 WeakPolarHBondContact O-CB 3.34Å; Y201-L205 PolarHBondContact O-N 3.42Å; Y201-Y220 HydrophobicContact CD2-CE2 4.28Å
202L90.3Very high84.6Confident70 Ų7053.5 Ų53.537%0.36629%0.289SS..Hα-helixtrans-64.7-43.5178.8-174.165.4000111.8E198 L205 L206 I279E198-L202 WeakPolarHBondContact O-CB 3.27Å; E198-L202 PolarHBondContact O-N 2.89Å; L202-L205 PolarHBondContact O-N 2.97Å; L202-L206 HydrophobicContact CG-CD1 4.39Å; L202-L206 WeakPolarHBondContact O-CG 3.11Å; L202-L206 PolarHBondContact O-N 3.29Å; L202-I279 HydrophobicContact CB-CD1 4.21Å; L202-I279 HydrophobicContact CD2-CD1 3.87Å; L202-I279 HydrophobicContact CD2-CG2 4.32Å; L202-I279 HydrophobicContact CG-CD1 4.04Å
203H89.3Confident83.2Confident52 Ų5257.4 Ų57.424%0.24131%0.308CS..Hα-helixtrans-63-45.7175.9179.8-87.9000111.7G199 L200 L205 L206 A207 L275 I279G199-H203 WeakPolarHBondContact O-CB 3.11Å; G199-H203 PolarHBondContact O-N 3.42Å; L200-H203 PolarHBondContact O-N 3.03Å; H203-L205 VanDerWaalsContact C-N 3.34Å; H203-L205 PolarHBondContact O-N 3.07Å; H203-L206 PolarHBondContact O-N 2.99Å; H203-A207 VanDerWaalsContact O-CB 3.28Å; H203-A207 WeakPolarHBondContact O-CB 3.36Å; H203-A207 PolarHBondContact O-N 3.41Å; H203-L275 HydrophobicContact CB-CD2 3.97Å; H203-I279 HydrophobicContact CB-CD1 4.21Å; H203-I279 HydrophobicContact CB-CG1 4.19Å
204A88Confident81.9Confident12 Ų1266.8 Ų66.810%0.09934%0.343CS..Hα-helixtrans-58-45.3177.300000111.7L200 Y201 L206 V208 F211L200-A204 WeakPolarHBondContact O-CB 3.24Å; L200-A204 PolarHBondContact O-N 3.46Å; Y201-A204 PolarHBondContact O-N 3.04Å; A204-L206 VanDerWaalsContact C-N 3.32Å; A204-L206 PolarHBondContact O-N 3.28Å; A204-V208 CarbonylContact O-C 3.57Å; A204-V208 PolarHBondContact O-N 3.44Å; A204-V208 VanDerWaalsContact O-O 3.08Å; A204-F211 HydrophobicContact CB-CD2 4.42Å; A204-F211 HydrophobicContact CB-CE2 3.78Å
205L85.7Confident80.9Confident76 Ų7675.1 Ų75.140%0.39838%0.379SS..Hα-helixtrans-60.5-38.5177.9-175.970.3000112.8Y201 L202 H203Y201-L205 WeakPolarHBondContact O-CB 3.34Å; Y201-L205 PolarHBondContact O-N 3.42Å; L202-L205 PolarHBondContact O-N 2.97Å; H203-L205 VanDerWaalsContact C-N 3.34Å; H203-L205 PolarHBondContact O-N 3.07Å
206L86.1Confident80.1Confident50 Ų5078.1 Ų78.126%0.26239%0.388SS..Hα-helixtrans-83.7-34.7-176.8-69.9175.6000113.6L202 H203 A204 I279 I282L202-L206 HydrophobicContact CG-CD1 4.39Å; L202-L206 WeakPolarHBondContact O-CG 3.11Å; L202-L206 PolarHBondContact O-N 3.29Å; H203-L206 PolarHBondContact O-N 2.99Å; A204-L206 VanDerWaalsContact C-N 3.32Å; A204-L206 PolarHBondContact O-N 3.28Å; L206-I279 HydrophobicContact CD1-CG1 4.42Å; L206-I279 HydrophobicContact CD1-CG2 3.82Å; L206-I282 HydrophobicContact CB-CG2 4.29Å
207A81.6Confident79.4Confident49 Ų4979.1 Ų79.141%0.40539%0.391SS..Hα-helixtrans-94-32-173.600000113.7H203 I282H203-A207 VanDerWaalsContact O-CB 3.28Å; H203-A207 WeakPolarHBondContact O-CB 3.36Å; H203-A207 PolarHBondContact O-N 3.41Å; A207-I282 HydrophobicContact CB-CD1 4.1Å
208V73.6Confident79Confident72 Ų7287.2 Ų87.244%0.43642%0.422SS..  trans-128.297.8-172.5179.60000108.7A204 F210 F211A204-V208 CarbonylContact O-C 3.57Å; A204-V208 PolarHBondContact O-N 3.44Å; A204-V208 VanDerWaalsContact O-O 3.08Å; V208-F210 VanDerWaalsContact C-N 3.26Å; V208-F210 PolarHBondContact O-N 3.25Å; V208-F210 VanDerWaalsContact O-N 3.15Å; V208-F211 HydrophobicContact CB-CD2 4.13Å; V208-F211 HydrophobicContact CB-CE2 3.36Å; V208-F211 HydrophobicContact CB-CZ 3.81Å; V208-F211 HydrophobicContact CG1-CD2 3.93Å; V208-F211 HydrophobicContact CG1-CE1 4.16Å; V208-F211 HydrophobicContact CG1-CE2 3.35Å; V208-F211 HydrophobicContact CG1-CZ 3.45Å; V208-F211 VanDerWaalsContact CG1-CZ 3.45Å; V208-F211 HydrophobicContact CG2-CE2 4.24Å; V208-F211 HydrophobicContact CG2-CZ 4.34Å; V208-F211 WeakPolarHBondContact O-CD2 3.33Å
209S61Low78.8Confident95 Ų9587.3 Ų87.366%0.66443%0.431SS*.  trans-76.67.5-168.3570000116.2
210F55.4Low78.7Confident187 Ų18788.9 Ų88.982%0.8243%0.434SS*.  trans-139.262.7-169.8-67.1-77.7000113.7V208V208-F210 VanDerWaalsContact C-N 3.26Å; V208-F210 PolarHBondContact O-N 3.25Å; V208-F210 VanDerWaalsContact O-N 3.15Å
211F60.1Low78.7Confident86 Ų8687.2 Ų87.238%0.37743%0.426SS..  trans-100.7139.8176.8-78.6-66.5000114A204 V208 E213 Y216A204-F211 HydrophobicContact CB-CD2 4.42Å; A204-F211 HydrophobicContact CB-CE2 3.78Å; V208-F211 HydrophobicContact CB-CD2 4.13Å; V208-F211 HydrophobicContact CB-CE2 3.36Å; V208-F211 HydrophobicContact CB-CZ 3.81Å; V208-F211 HydrophobicContact CG1-CD2 3.93Å; V208-F211 HydrophobicContact CG1-CE1 4.16Å; V208-F211 HydrophobicContact CG1-CE2 3.35Å; V208-F211 HydrophobicContact CG1-CZ 3.45Å; V208-F211 VanDerWaalsContact CG1-CZ 3.45Å; V208-F211 HydrophobicContact CG2-CE2 4.24Å; V208-F211 HydrophobicContact CG2-CZ 4.34Å; V208-F211 WeakPolarHBondContact O-CD2 3.33Å; F211-E213 PolarHBondContact O-N 3.2Å; F211-Y216 HydrophobicContact CD1-CD2 4.46Å; F211-Y216 HydrophobicContact CD1-CE2 4.4Å
212S61.1Low78.8Confident83 Ų8391.2 Ų91.258%0.5845%0.447SS*.  trans-72.488.6167.1-175.70000109.7R214 Y216S212-R214 PolarHBondContact O-N 2.95Å; S212-Y216 WeakPolarHBondContact O-CD2 3.5Å
213E66.2Low78.9Confident129 Ų12991.4 Ų91.460%0.60345%0.447SS*.Hα-helixtrans-51.3-34.9-165.7-64.2-173.3148.300115F211 F217F211-E213 PolarHBondContact O-N 3.2Å; E213-F217 WeakPolarHBondContact O-CB 3.44Å; E213-F217 PolarHBondContact O-N 2.7Å
214R68.8Low79.2Confident223 Ų22388.9 Ų88.984%0.84244%0.436SS*.Hα-helixtrans-78.4-37.5-167-155.1173.7-173.5-175.91.2115.3S212S212-R214 PolarHBondContact O-N 2.95Å
215K75Confident79.6Confident174 Ų17490.8 Ų90.876%0.75744%0.44SS*.Hα-helixtrans-79.9-40.1-177.9-172.2178.21781800111.8F217 A219K215-F217 VanDerWaalsContact C-N 3.32Å; K215-A219 PolarHBondContact O-N 3.07Å
216Y78.7Confident80Confident120 Ų12088 Ų8847%0.47143%0.43SS..Hα-helixtrans-70.7-30.1178.6-69.3-88.4000112.2F211 S212 W218 A219 Y220F211-Y216 HydrophobicContact CD1-CD2 4.46Å; F211-Y216 HydrophobicContact CD1-CE2 4.4Å; S212-Y216 WeakPolarHBondContact O-CD2 3.5Å; Y216-W218 PolarHBondContact O-N 2.92Å; Y216-A219 WeakPolarHBondContact O-CB 3.43Å; Y216-A219 PolarHBondContact O-N 3.11Å; Y216-A219 VanDerWaalsContact O-N 3.14Å; Y216-Y220 WeakPolarHBondContact O-CD2 3.44Å; Y216-Y220 PolarHBondContact O-N 2.89Å
217F82.1Confident80.4Confident42 Ų4286.5 Ų86.518%0.18443%0.427CS..Hα-helixtrans-58.5-45.9174.2-179-101.1000113.5Y138 I139 E213 K215 A219 Y220 I221Y138-F217 HydrophobicContact CD1-CE1 4.12Å; Y138-F217 AromaticContact CD1-CE2 3.79Å; Y138-F217 HydrophobicContact CD1-CE2 3.79Å; Y138-F217 AromaticContact CD1-CZ 3.15Å; Y138-F217 HydrophobicContact CD1-CZ 3.15Å; Y138-F217 AromaticContact CE1-CE1 3.97Å; Y138-F217 HydrophobicContact CE1-CE1 3.97Å; Y138-F217 HydrophobicContact CE1-CE2 4.43Å; Y138-F217 AromaticContact CE1-CZ 3.46Å; Y138-F217 HydrophobicContact CE1-CZ 3.46Å; Y138-F217 VanDerWaalsContact CE1-CZ 3.46Å; Y138-F217 HydrophobicContact CG-CE2 4.42Å; Y138-F217 AromaticContact CG-CZ 3.84Å; Y138-F217 HydrophobicContact CG-CZ 3.84Å; I139-F217 HydrophobicContact CD1-CD2 4.2Å; I139-F217 HydrophobicContact CD1-CE2 3.98Å; I139-F217 HydrophobicContact CG1-CE2 4.37Å; E213-F217 WeakPolarHBondContact O-CB 3.44Å; E213-F217 PolarHBondContact O-N 2.7Å; K215-F217 VanDerWaalsContact C-N 3.32Å; F217-A219 VanDerWaalsContact C-N 3.28Å; F217-A219 PolarHBondContact O-N 3.22Å; F217-Y220 PolarHBondContact O-N 2.99Å; F217-I221 HydrophobicContact CD1-CD1 3.88Å; F217-I221 HydrophobicContact CE1-CD1 3.54Å; F217-I221 HydrophobicContact CZ-CD1 4.09Å; F217-I221 PolarHBondContact O-N 3.2Å
218W86.6Confident81Confident170 Ų17084.1 Ų84.164%0.64441%0.407SS*.Hα-helixtrans-62.4-36.4174.5-99.3103.1000112.3Y216 I221 M222Y216-W218 PolarHBondContact O-N 2.92Å; W218-I221 PolarHBondContact O-N 2.96Å; W218-M222 WeakPolarHBondContact O-CG 3.49Å; W218-M222 PolarHBondContact O-N 3.46Å
219A89.9Confident82.1Confident48 Ų4882.3 Ų82.340%0.39740%0.4SS..Hα-helixtrans-63.2-41.4175.300000112K215 Y216 F217 I221 M222 I223K215-A219 PolarHBondContact O-N 3.07Å; Y216-A219 WeakPolarHBondContact O-CB 3.43Å; Y216-A219 PolarHBondContact O-N 3.11Å; Y216-A219 VanDerWaalsContact O-N 3.14Å; F217-A219 VanDerWaalsContact C-N 3.28Å; F217-A219 PolarHBondContact O-N 3.22Å; A219-I221 PolarHBondContact O-N 3.19Å; A219-M222 PolarHBondContact O-N 3.28Å; A219-I223 VanDerWaalsContact O-CG1 3.28Å; A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 3.37Å
220Y91.2Very high83.7Confident39 Ų3983.5 Ų83.515%0.15340%0.397CS..Hα-helixtrans-61.4-41.7175.3-71.2-56.1000112.8V197 L200 Y201 Y216 F217 I223 G224V197-Y220 HydrophobicContact CG1-CD1 4.16Å; V197-Y220 HydrophobicContact CG1-CG 4.27Å; L200-Y220 HydrophobicContact CB-CE1 4.31Å; Y201-Y220 HydrophobicContact CD2-CE2 4.28Å; Y216-Y220 WeakPolarHBondContact O-CD2 3.44Å; Y216-Y220 PolarHBondContact O-N 2.89Å; F217-Y220 PolarHBondContact O-N 2.99Å; Y220-I223 PolarHBondContact O-N 3.5Å; Y220-G224 PolarHBondContact O-N 3.42Å
221I91.4Very high85.5Confident22 Ų2276.2 Ų76.211%0.11337%0.367CS..Hα-helixtrans-63.3-43.1176.2-65.1173.6000110.8Y138 W194 F217 W218 A219 I223 G224 W225Y138-I221 HydrophobicContact CE1-CD1 4.09Å; W194-I221 HydrophobicContact CH2-CG1 4.22Å; F217-I221 HydrophobicContact CD1-CD1 3.88Å; F217-I221 HydrophobicContact CE1-CD1 3.54Å; F217-I221 HydrophobicContact CZ-CD1 4.09Å; F217-I221 PolarHBondContact O-N 3.2Å; W218-I221 PolarHBondContact O-N 2.96Å; A219-I221 PolarHBondContact O-N 3.19Å; I221-I223 VanDerWaalsContact C-N 3.33Å; I221-I223 PolarHBondContact O-N 3.34Å; I221-G224 PolarHBondContact O-N 3.44Å; I221-W225 PolarHBondContact O-N 2.92Å
222M92.1Very high87.1Confident117 Ų11772.4 Ų72.458%0.57635%0.35SS*.Iπ-helixtrans-64.1-37.3176.8-70.7-59.6-64.100112.2W218 A219 G226 G227W218-M222 WeakPolarHBondContact O-CG 3.49Å; W218-M222 PolarHBondContact O-N 3.46Å; A219-M222 PolarHBondContact O-N 3.28Å; M222-G226 WeakPolarHBondContact O-CA 3.31Å; M222-G226 PolarHBondContact O-N 2.95Å; M222-G227 PolarHBondContact O-N 3.32Å
223I93.6Very high88.6Confident73 Ų7372.1 Ų72.137%0.37435%0.345SS..Iπ-helixtrans-66.6-45.9174.4-68.4164.3000110.4F193 V197 A219 Y220 I221 G227F193-I223 HydrophobicContact CD1-CG2 4.45Å; F193-I223 WeakPolarHBondContact CD1-O 3.29Å; V197-I223 HydrophobicContact CG2-CB 4.27Å; V197-I223 HydrophobicContact CG2-CG2 3.89Å; A219-I223 VanDerWaalsContact O-CG1 3.28Å; A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 3.37Å; Y220-I223 PolarHBondContact O-N 3.5Å; I221-I223 VanDerWaalsContact C-N 3.33Å; I221-I223 PolarHBondContact O-N 3.34Å; I223-G227 PolarHBondContact O-N 3.48Å
224G94.3Very high89.8Confident0 Ų068.5 Ų68.50%034%0.337CS..Iπ-helixtrans-64.6-44.5-176.300000114.2Y220 I221 P228Y220-G224 PolarHBondContact O-N 3.42Å; I221-G224 PolarHBondContact O-N 3.44Å; G224-P228 WeakPolarHBondContact O-CD 3.49Å; G224-P228 VanDerWaalsContact O-CG 3.29Å; G224-P228 WeakPolarHBondContact O-CG 3.29Å
225W96.1Very high90.9Very high51 Ų5158 Ų5819%0.19330%0.298CS..Iπ-helixtrans-98.6-37.3-179.2-65.7114.8000114H142 V145 L149 A190 W194 I221 A229H142-W225 AromaticContact CE1-NE1 3.63Å; H142-W225 AromaticContact ND1-CE2 3.8Å; H142-W225 AromaticContact ND1-CZ2 3.8Å; H142-W225 AromaticContact ND1-NE1 3.18Å; H142-W225 PolarHBondContact ND1-NE1 3.02Å; H142-W225 VanDerWaalsContact ND1-NE1 3.18Å; V145-W225 HydrophobicContact CG1-CH2 4.05Å; V145-W225 HydrophobicContact CG1-CZ2 4.2Å; L149-W225 HydrophobicContact CD1-CH2 3.75Å; L149-W225 HydrophobicContact CD1-CZ3 3.85Å; A190-W225 HydrophobicContact CB-CE3 4.34Å; A190-W225 HydrophobicContact CB-CZ3 4.16Å; W194-W225 AromaticContact CE2-CD1 3.94Å; W194-W225 AromaticContact CE2-CE2 3.68Å; W194-W225 AromaticContact CE2-NE1 3.53Å; W194-W225 AromaticContact CZ2-CD1 3.46Å; W194-W225 VanDerWaalsContact CZ2-CD1 3.46Å; W194-W225 HydrophobicContact CZ2-CD2 4.43Å; W194-W225 AromaticContact CZ2-CE2 3.82Å; W194-W225 HydrophobicContact CZ2-CG 4.22Å; W194-W225 HydrophobicContact CZ2-CZ2 4.47Å; W194-W225 AromaticContact CZ2-NE1 3.16Å; W194-W225 AromaticContact NE1-CD1 3.82Å; W194-W225 AromaticContact NE1-CD2 3.33Å; W194-W225 VanDerWaalsContact NE1-CD2 3.33Å; W194-W225 AromaticContact NE1-CE2 3.14Å; W194-W225 AromaticContact NE1-CE3 3.81Å; W194-W225 AromaticContact NE1-CG 3.77Å; W194-W225 AromaticContact NE1-CH2 3.92Å; W194-W225 AromaticContact NE1-CZ2 3.45Å; W194-W225 AromaticContact NE1-NE1 3.46Å; I221-W225 PolarHBondContact O-N 2.92Å; W225-A229 PolarHBondContact O-N 3Å
226G95.1Very high91.5Very high18 Ų1851.1 Ų51.119%0.18627%0.271CS..Iπ-helixtrans-78.6-38.5-175.300000113.1M222 A229 I230M222-G226 WeakPolarHBondContact O-CA 3.31Å; M222-G226 PolarHBondContact O-N 2.95Å; G226-A229 WeakPolarHBondContact O-CB 3.37Å; G226-A229 PolarHBondContact O-N 3.26Å; G226-I230 WeakPolarHBondContact O-CG1 3.45Å; G226-I230 PolarHBondContact O-N 3.44Å
227G94Very high92Very high18 Ų1850 Ų5019%0.18627%0.272CS..Hα-helixtrans-54.1-55.7176.200000112.9M222 I223 A229 I230 I231M222-G227 PolarHBondContact O-N 3.32Å; I223-G227 PolarHBondContact O-N 3.48Å; G227-A229 VanDerWaalsContact C-N 3.32Å; G227-A229 PolarHBondContact O-N 3.18Å; G227-I230 PolarHBondContact O-N 3.5Å; G227-I231 WeakPolarHBondContact O-CG1 2.95Å; G227-I231 PolarHBondContact O-N 3.22Å
228P95.5Very high92.2Very high0 Ų048.5 Ų48.50%027%0.269CS..Hα-helixtrans-57.3-41.2174.2-24.632.2000113.6Y186 M189 A190 F193 G224 I230 I231 I232Y186-P228 HydrophobicContact CD2-CB 4.05Å; Y186-P228 HydrophobicContact CE2-CB 3.96Å; M189-P228 HydrophobicContact CB-CB 4.08Å; M189-P228 HydrophobicContact CG-CB 3.85Å; M189-P228 HydrophobicContact CG-CG 4.26Å; M189-P228 HydrophobicContact SD-CB 4.2Å; A190-P228 HydrophobicContact CB-CB 4.29Å; A190-P228 HydrophobicContact CB-CG 4.14Å; F193-P228 HydrophobicContact CB-CG 3.7Å; F193-P228 HydrophobicContact CD1-CG 4.19Å; F193-P228 HydrophobicContact CD2-CG 3.83Å; F193-P228 HydrophobicContact CE2-CG 4.5Å; F193-P228 HydrophobicContact CG-CG 3.64Å; G224-P228 WeakPolarHBondContact O-CD 3.49Å; G224-P228 VanDerWaalsContact O-CG 3.29Å; G224-P228 WeakPolarHBondContact O-CG 3.29Å; P228-I230 PolarHBondContact O-N 3.16Å; P228-I231 PolarHBondContact O-N 3Å; P228-I232 WeakPolarHBondContact O-CB 3.4Å; P228-I232 VanDerWaalsContact O-CG1 3.29Å; P228-I232 WeakPolarHBondContact O-CG1 3.35Å; P228-I232 PolarHBondContact O-N 3.43Å
229A95.5Very high92Very high34 Ų3441.3 Ų41.328%0.28124%0.242SC..Hα-helixtrans-61.2-46.6-179.600000111.4Y186 W225 G226 G227 I231 I232 T233Y186-A229 HydrophobicContact CE2-CB 3.95Å; W225-A229 PolarHBondContact O-N 3Å; G226-A229 WeakPolarHBondContact O-CB 3.37Å; G226-A229 PolarHBondContact O-N 3.26Å; G227-A229 VanDerWaalsContact C-N 3.32Å; G227-A229 PolarHBondContact O-N 3.18Å; A229-I231 PolarHBondContact O-N 3.35Å; A229-I232 PolarHBondContact O-N 3.09Å; A229-T233 WeakPolarHBondContact O-CB 3.31Å; A229-T233 WeakPolarHBondContact O-CG2 3.2Å; A229-T233 PolarHBondContact O-N 3.28Å; A229-T233 PolarHBondContact O-OG1 3.24Å
230I95Very high91.7Very high119 Ų11941.2 Ų41.261%0.6124%0.241SC*.Hα-helixtrans-62.2-46.5179.9-66.3165.3000110.9G226 G227 P228 T233 A234G226-I230 WeakPolarHBondContact O-CG1 3.45Å; G226-I230 PolarHBondContact O-N 3.44Å; G227-I230 PolarHBondContact O-N 3.5Å; P228-I230 PolarHBondContact O-N 3.16Å; I230-T233 WeakPolarHBondContact CA-OG1 3.45Å; I230-T233 PolarHBondContact O-N 3.26Å; I230-T233 PolarHBondContact O-OG1 3.43Å; I230-A234 WeakPolarHBondContact O-CB 3.37Å; I230-A234 PolarHBondContact O-N 2.97Å
231I93.9Very high91.3Very high35 Ų3548.5 Ų48.518%0.17927%0.27CS..Hα-helixtrans-65.9-44.6-177.7-64.4163.8000111M189 F193 G227 P228 A229 A234 W235 I260 P264M189-I231 HydrophobicContact CE-CB 4.35Å; M189-I231 HydrophobicContact CE-CG2 3.64Å; M189-I231 HydrophobicContact SD-CB 3.71Å; M189-I231 HydrophobicContact SD-CD1 4Å; M189-I231 HydrophobicContact SD-CG1 4.47Å; M189-I231 HydrophobicContact SD-CG2 3.68Å; F193-I231 HydrophobicContact CE2-CD1 4.08Å; F193-I231 HydrophobicContact CZ-CD1 3.57Å; G227-I231 WeakPolarHBondContact O-CG1 2.95Å; G227-I231 PolarHBondContact O-N 3.22Å; P228-I231 PolarHBondContact O-N 3Å; A229-I231 PolarHBondContact O-N 3.35Å; I231-A234 PolarHBondContact O-N 3.3Å; I231-W235 WeakPolarHBondContact O-CB 3.44Å; I231-W235 PolarHBondContact O-N 2.92Å; I231-I260 HydrophobicContact CG2-CG2 4.22Å; I231-P264 HydrophobicContact CD1-CB 3.79Å; I231-P264 HydrophobicContact CD1-CG 3.89Å; I231-P264 HydrophobicContact CG2-CG 4.11Å
232I93.6Very high90.6Very high5 Ų554.4 Ų54.43%0.02630%0.295CS..Hα-helixtrans-68.9-38.2-179.6-66.8-59.5000111.8V182 Q185 M189 P228 A229 W235 S236 I261V182-I232 HydrophobicContact CG1-CG2 3.81Å; Q185-I232 HydrophobicContact CB-CD1 3.72Å; M189-I232 HydrophobicContact CE-CD1 3.7Å; M189-I232 HydrophobicContact CE-CG1 4.27Å; M189-I232 HydrophobicContact SD-CD1 4.14Å; M189-I232 HydrophobicContact SD-CG1 4.03Å; P228-I232 WeakPolarHBondContact O-CB 3.4Å; P228-I232 VanDerWaalsContact O-CG1 3.29Å; P228-I232 WeakPolarHBondContact O-CG1 3.35Å; P228-I232 PolarHBondContact O-N 3.43Å; A229-I232 PolarHBondContact O-N 3.09Å; I232-W235 PolarHBondContact O-N 3.1Å; I232-S236 VanDerWaalsContact O-CB 3.23Å; I232-S236 WeakPolarHBondContact O-CB 3.1Å; I232-S236 PolarHBondContact O-N 3.41Å; I232-I261 HydrophobicContact CD1-CD1 3.93Å; I232-I261 HydrophobicContact CD1-CG1 3.96Å
233T91.7Very high89.4Confident77 Ų7752.1 Ų52.147%0.47229%0.285SS..Hα-helixtrans-62.6-44.1173.755.40000111.4A229 I230 W235 S236 I237A229-T233 WeakPolarHBondContact O-CB 3.31Å; A229-T233 WeakPolarHBondContact O-CG2 3.2Å; A229-T233 PolarHBondContact O-N 3.28Å; A229-T233 PolarHBondContact O-OG1 3.24Å; I230-T233 WeakPolarHBondContact CA-OG1 3.45Å; I230-T233 PolarHBondContact O-N 3.26Å; I230-T233 PolarHBondContact O-OG1 3.43Å; T233-W235 PolarHBondContact O-N 2.92Å; T233-S236 PolarHBondContact O-N 2.96Å; T233-I237 WeakPolarHBondContact O-CB 3.47Å; T233-I237 WeakPolarHBondContact O-CD1 3.49Å; T233-I237 WeakPolarHBondContact O-CG1 3.02Å; T233-I237 PolarHBondContact O-N 3.36Å
234A92Very high88.4Confident53 Ų5352.5 Ų52.544%0.43829%0.288SS..Hα-helixtrans-61.3-43.5175.600000112.3I230 I231 G238I230-A234 WeakPolarHBondContact O-CB 3.37Å; I230-A234 PolarHBondContact O-N 2.97Å; I231-A234 PolarHBondContact O-N 3.3Å; A234-G238 PolarHBondContact O-N 3.05Å
235W90.7Very high87.1Confident4 Ų457.3 Ų57.32%0.01532%0.317CS..Hα-helixtrans-62.9-46.4175172.979.2000112.4I181 V182 Q185 I231 I232 T233 I237 G238 K239 W248 F257 I260 I261I181-W235 HydrophobicContact CG2-CH2 4.36Å; V182-W235 HydrophobicContact CG2-CZ3 4.16Å; Q185-W235 HydrophobicContact CG-CH2 4.44Å; Q185-W235 HydrophobicContact CG-CZ3 4.44Å; I231-W235 WeakPolarHBondContact O-CB 3.44Å; I231-W235 PolarHBondContact O-N 2.92Å; I232-W235 PolarHBondContact O-N 3.1Å; T233-W235 PolarHBondContact O-N 2.92Å; W235-I237 VanDerWaalsContact C-N 3.32Å; W235-I237 PolarHBondContact O-N 2.99Å; W235-G238 PolarHBondContact O-N 2.95Å; W235-K239 HydrophobicContact CZ2-CG 3.9Å; W235-K239 PolarHBondContact O-N 3.35Å; W235-W248 HydrophobicContact CH2-CB 4.15Å; W235-W248 AromaticContact CH2-CE3 3.89Å; W235-W248 HydrophobicContact CH2-CE3 3.89Å; W235-W248 AromaticContact CZ3-CE3 3.85Å; W235-W248 HydrophobicContact CZ3-CE3 3.85Å; W235-W248 HydrophobicContact CZ3-CZ3 4.29Å; W235-F257 PolarHBondContact NE1-O 3.48Å; W235-I260 HydrophobicContact CB-CG2 4.07Å; W235-I261 HydrophobicContact CB-CD1 4.49Å; W235-I261 HydrophobicContact CB-CG1 4.22Å; W235-I261 HydrophobicContact CD2-CD1 3.43Å; W235-I261 VanDerWaalsContact CD2-CD1 3.43Å; W235-I261 HydrophobicContact CD2-CG1 4.09Å; W235-I261 VanDerWaalsContact CE2-CD1 3.48Å; W235-I261 HydrophobicContact CE3-CD1 3.87Å; W235-I261 HydrophobicContact CG-CD1 3.7Å; W235-I261 HydrophobicContact CG-CG1 3.78Å; W235-I261 HydrophobicContact CH2-CD1 4.34Å; W235-I261 HydrophobicContact CZ2-CD1 3.96Å; W235-I261 HydrophobicContact CZ3-CD1 4.3Å
236S88.8Confident85.8Confident28 Ų2856.2 Ų56.220%0.19632%0.322CS..Hα-helixtrans-61.7-41179.7177.30000111.6I232 T233 A240 W248I232-S236 VanDerWaalsContact O-CB 3.23Å; I232-S236 WeakPolarHBondContact O-CB 3.1Å; I232-S236 PolarHBondContact O-N 3.41Å; T233-S236 PolarHBondContact O-N 2.96Å; S236-A240 VanDerWaalsContact O-CB 3.28Å; S236-A240 WeakPolarHBondContact O-CB 3.47Å; S236-A240 PolarHBondContact O-N 3.46Å; S236-W248 VanDerWaalsContact O-CH2 3.3Å; S236-W248 WeakPolarHBondContact O-CH2 3.41Å; S236-W248 WeakPolarHBondContact OG-CZ3 3.34Å
237I88.4Confident84.7Confident97 Ų9756.8 Ų56.850%0.49732%0.322SS..Hα-helixtrans-64-47.3174.6-70.2167.2000109.7T233 W235 K239 A240 Y241T233-I237 WeakPolarHBondContact O-CB 3.47Å; T233-I237 WeakPolarHBondContact O-CD1 3.49Å; T233-I237 WeakPolarHBondContact O-CG1 3.02Å; T233-I237 PolarHBondContact O-N 3.36Å; W235-I237 VanDerWaalsContact C-N 3.32Å; W235-I237 PolarHBondContact O-N 2.99Å; I237-K239 PolarHBondContact O-N 2.89Å; I237-A240 PolarHBondContact O-N 3.05Å; I237-Y241 HydrophobicContact CG2-CD2 3.63Å; I237-Y241 HydrophobicContact CG2-CE2 3.72Å; I237-Y241 VanDerWaalsContact O-CD2 3.27Å; I237-Y241 WeakPolarHBondContact O-CD2 3.31Å; I237-Y241 PolarHBondContact O-N 3.3Å
238G85.8Confident83.8Confident10 Ų1056.8 Ų56.810%0.10332%0.317CS..Hα-helixtrans-57.1-48176.300000112.8A234 W235 Y241 F242A234-G238 PolarHBondContact O-N 3.05Å; W235-G238 PolarHBondContact O-N 2.95Å; G238-Y241 PolarHBondContact O-N 3.43Å; G238-F242 WeakPolarHBondContact O-CB 3.43Å; G238-F242 VanDerWaalsContact O-CD2 3.31Å; G238-F242 WeakPolarHBondContact O-CD2 3.38Å; G238-F242 PolarHBondContact O-N 3.42Å
239K82.9Confident82.6Confident19 Ų1959.5 Ų59.58%0.08333%0.331CS..Hα-helixtrans-62.6-43.5176.5-95.9-67-163-177.30112.1W235 I237 Y241 N243 D244 W248 D255 F257W235-K239 HydrophobicContact CZ2-CG 3.9Å; W235-K239 PolarHBondContact O-N 3.35Å; I237-K239 PolarHBondContact O-N 2.89Å; K239-Y241 VanDerWaalsContact C-N 3.34Å; K239-Y241 PolarHBondContact O-N 2.74Å; K239-N243 HydrophobicContact CD-CB 4.15Å; K239-N243 CarbonylContact O-C 3.55Å; K239-N243 PolarHBondContact O-N 3.19Å; K239-D244 PolarHBondContact O-N 3Å; K239-W248 HydrophobicContact CB-CD2 4.12Å; K239-W248 HydrophobicContact CB-CE3 4.29Å; K239-W248 HydrophobicContact CB-CH2 4.21Å; K239-W248 HydrophobicContact CB-CZ2 4.02Å; K239-W248 HydrophobicContact CB-CZ3 4.34Å; K239-D255 IonicContact NZ-OD1 2.67Å; K239-D255 PolarHBondContact NZ-OD1 3.07Å; K239-D255 IonicContact NZ-OD2 2.81Å; K239-D255 PolarHBondContact NZ-OD2 3.03Å; K239-F257 HydrophobicContact CG-CB 4.49Å
240A83.8Confident81Confident47 Ų4761.9 Ų61.939%0.38834%0.339SS..Hα-helixtrans-63.6-35.2179.300000113.9S236 I237 W248S236-A240 VanDerWaalsContact O-CB 3.28Å; S236-A240 WeakPolarHBondContact O-CB 3.47Å; S236-A240 PolarHBondContact O-N 3.46Å; I237-A240 PolarHBondContact O-N 3.05Å; A240-W248 HydrophobicContact CB-CH2 4.03Å; A240-W248 HydrophobicContact CB-CZ2 3.98Å
241Y83.4Confident79.3Confident191 Ų19160.2 Ų60.275%0.74933%0.33SS*.Hα-helixtrans-83.3-36.2-179.4-84.2-71.9000113.8I237 G238 K239I237-Y241 HydrophobicContact CG2-CD2 3.63Å; I237-Y241 HydrophobicContact CG2-CE2 3.72Å; I237-Y241 VanDerWaalsContact O-CD2 3.27Å; I237-Y241 WeakPolarHBondContact O-CD2 3.31Å; I237-Y241 PolarHBondContact O-N 3.3Å; G238-Y241 PolarHBondContact O-N 3.43Å; K239-Y241 VanDerWaalsContact C-N 3.34Å; K239-Y241 PolarHBondContact O-N 2.74Å
242F75.9Confident77.5Confident146 Ų14664 Ų6464%0.6435%0.347SS*.Hα-helixtrans-103.2-35.4-169.7-68.5-78.2000113.9G238 F257G238-F242 WeakPolarHBondContact O-CB 3.43Å; G238-F242 VanDerWaalsContact O-CD2 3.31Å; G238-F242 WeakPolarHBondContact O-CD2 3.38Å; G238-F242 PolarHBondContact O-N 3.42Å; F242-F257 HydrophobicContact CB-CE2 3.62Å; F242-F257 HydrophobicContact CB-CZ 3.53Å; F242-F257 HydrophobicContact CD1-CZ 4.45Å; F242-F257 AromaticContact CD2-CE1 3.83Å; F242-F257 HydrophobicContact CD2-CE1 3.83Å; F242-F257 HydrophobicContact CD2-CE2 4.37Å; F242-F257 AromaticContact CD2-CZ 3.4Å; F242-F257 HydrophobicContact CD2-CZ 3.4Å; F242-F257 VanDerWaalsContact CD2-CZ 3.4Å; F242-F257 HydrophobicContact CE2-CE1 4.44Å; F242-F257 HydrophobicContact CE2-CZ 4.23Å; F242-F257 HydrophobicContact CG-CE1 4.41Å; F242-F257 HydrophobicContact CG-CE2 4.16Å; F242-F257 AromaticContact CG-CZ 3.54Å; F242-F257 HydrophobicContact CG-CZ 3.54Å
243N67.7Low75.4Confident70 Ų7071.1 Ų71.137%0.37439%0.391SS..  trans-145.267.5-172.8-78.7-21.9000111K239 V245 D255K239-N243 HydrophobicContact CD-CB 4.15Å; K239-N243 CarbonylContact O-C 3.55Å; K239-N243 PolarHBondContact O-N 3.19Å; N243-V245 VanDerWaalsContact C-N 3.26Å; N243-V245 PolarHBondContact O-N 3.19Å; N243-V245 VanDerWaalsContact O-N 3.13Å; N243-D255 PolarHBondContact ND2-OD1 2.71Å
244D71.8Confident73.5Confident80 Ų8072.8 Ų72.843%0.42840%0.401SS..  trans-87.156178.5-163.938.2000113.1K178 K239 W248K178-D244 WeakPolarHBondContact CE-OD1 3.44Å; K178-D244 IonicContact NZ-OD1 3Å; K178-D244 PolarHBondContact NZ-OD1 3.48Å; K178-D244 IonicContact NZ-OD2 2.92Å; K178-D244 PolarHBondContact NZ-OD2 3.05Å; K239-D244 PolarHBondContact O-N 3Å; D244-W248 PolarHBondContact OD1-NE1 3.48Å
245V66.5Low72.3Confident101 Ų10171 Ų7161%0.61238%0.384SS*.  trans-104.3129.7-179.7-174.10000110.1N243N243-V245 VanDerWaalsContact C-N 3.26Å; N243-V245 PolarHBondContact O-N 3.19Å; N243-V245 VanDerWaalsContact O-N 3.13Å
246G69.6Low71.5Confident28 Ų2876.2 Ų76.229%0.28942%0.416SS..SBendtrans59-144.3172.600000114.7K178K178-G246 WeakPolarHBondContact CE-O 3.42Å
247C71.8Confident70.9Confident30 Ų3076.9 Ų76.920%0.20342%0.415CS..  trans-97.5137.7168.5-170.10000109.4C177 D249C177-C247 VanDerWaalsContact C-SG 3.54Å; C177-C247 HydrophobicContact CB-CB 3.95Å; C177-C247 WeakPolarHBondContact CB-SG 3.12Å; C177-C247 WeakPolarHBondContact SG-CB 3.4Å; C177-C247 CovalentContact SG-SG 2.03Å; C177-C247 PolarHBondContact SG-SG 3.47Å; C247-D249 PolarHBondContact O-N 2.93Å
248W75.9Confident70.6Confident19 Ų1975.3 Ų75.37%0.07240%0.403CS..THydrogen-bonded Turntrans-72.325.9-173.8-57.6-17000114.8K178 I181 V182 W235 S236 K239 A240 D244K178-W248 HydrophobicContact CD-CZ2 4.36Å; I181-W248 HydrophobicContact CG2-CB 4.1Å; I181-W248 WeakPolarHBondContact CG2-O 3.4Å; V182-W248 HydrophobicContact CG2-CE3 3.81Å; V182-W248 HydrophobicContact CG2-CZ3 3.55Å; W235-W248 HydrophobicContact CH2-CB 4.15Å; W235-W248 AromaticContact CH2-CE3 3.89Å; W235-W248 HydrophobicContact CH2-CE3 3.89Å; W235-W248 AromaticContact CZ3-CE3 3.85Å; W235-W248 HydrophobicContact CZ3-CE3 3.85Å; W235-W248 HydrophobicContact CZ3-CZ3 4.29Å; S236-W248 VanDerWaalsContact O-CH2 3.3Å; S236-W248 WeakPolarHBondContact O-CH2 3.41Å; S236-W248 WeakPolarHBondContact OG-CZ3 3.34Å; K239-W248 HydrophobicContact CB-CD2 4.12Å; K239-W248 HydrophobicContact CB-CE3 4.29Å; K239-W248 HydrophobicContact CB-CH2 4.21Å; K239-W248 HydrophobicContact CB-CZ2 4.02Å; K239-W248 HydrophobicContact CB-CZ3 4.34Å; A240-W248 HydrophobicContact CB-CH2 4.03Å; A240-W248 HydrophobicContact CB-CZ2 3.98Å; D244-W248 PolarHBondContact OD1-NE1 3.48Å
249D69.4Low70.6Confident56 Ų5681.6 Ų81.630%0.29942%0.424SS..THydrogen-bonded Turntrans-81.9-25.4177.3-169.354.6000112.4K157 L161 I181 C247 I251K157-D249 IonicContact NZ-OD1 2.57Å; L161-D249 WeakPolarHBondContact CD1-OD2 3.48Å; L161-D249 HydrophobicContact CD2-CB 4.14Å; L161-D249 WeakPolarHBondContact CD2-OD2 3.47Å; I181-D249 HydrophobicContact CD1-CB 3.74Å; I181-D249 HydrophobicContact CG1-CB 4.28Å; C247-D249 PolarHBondContact O-N 2.93Å; D249-I251 PolarHBondContact O-N 2.94Å
250I62.3Low70.8Confident85 Ų8583.8 Ų83.844%0.43644%0.436SS..  trans-81115.3-177.9-51.7179000109.2D3 E252D3-I250 WeakPolarHBondContact OD2-CD1 3.39Å; I250-E252 HydrophobicContact CG2-CG 4.25Å
251I58.9Low71Confident84 Ų8481.6 Ų81.643%0.43142%0.418SS..  trans-95.892175.4-56.9158.2000106.8D249 W258D249-I251 PolarHBondContact O-N 2.94Å; I251-W258 HydrophobicContact CD1-CD2 4.26Å; I251-W258 HydrophobicContact CD1-CE3 4.12Å; I251-W258 HydrophobicContact CD1-CH2 3.33Å; I251-W258 HydrophobicContact CD1-CZ2 3.47Å; I251-W258 VanDerWaalsContact CD1-CZ2 3.47Å; I251-W258 HydrophobicContact CD1-CZ3 3.67Å; I251-W258 HydrophobicContact CG1-CD2 4.12Å; I251-W258 HydrophobicContact CG1-CE3 3.84Å; I251-W258 HydrophobicContact CG1-CH2 3.97Å; I251-W258 HydrophobicContact CG1-CZ2 4.23Å; I251-W258 HydrophobicContact CG1-CZ3 3.76Å; I251-W258 HydrophobicContact CG2-CB 4.32Å; I251-W258 HydrophobicContact CG2-CD2 3.67Å; I251-W258 HydrophobicContact CG2-CE3 4.17Å; I251-W258 HydrophobicContact CG2-CG 3.7Å
252E56.3Low71.3Confident113 Ų11376.5 Ų76.553%0.52840%0.4SS..  trans-69.3137.3169.9-70.4-173.9-173.500109.3I250 T254 D255I250-E252 HydrophobicContact CG2-CG 4.25Å; E252-T254 PolarHBondContact O-N 2.98Å; E252-D255 WeakPolarHBondContact O-CB 3.44Å; E252-D255 PolarHBondContact O-N 2.5Å
253T48.8Very low72Confident155 Ų15573 Ų7395%0.95139%0.39SS*.THydrogen-bonded Turntrans-59.8-18.2179.939.90000113.1
254T53.4Low73.2Confident112 Ų11271 Ų7169%0.68738%0.381SS*.THydrogen-bonded Turntrans-88.7-7.4176.30.20000114.5E252 V256E252-T254 PolarHBondContact O-N 2.98Å; T254-V256 PolarHBondContact O-N 3.1Å
255D66.8Low74.2Confident16 Ų1668.4 Ų68.49%0.08637%0.367CS..  trans-73.197.3-178.4-92.9-45000111.6K239 N243 E252 F257 W258K239-D255 IonicContact NZ-OD1 2.67Å; K239-D255 PolarHBondContact NZ-OD1 3.07Å; K239-D255 IonicContact NZ-OD2 2.81Å; K239-D255 PolarHBondContact NZ-OD2 3.03Å; N243-D255 PolarHBondContact ND2-OD1 2.71Å; E252-D255 WeakPolarHBondContact O-CB 3.44Å; E252-D255 PolarHBondContact O-N 2.5Å; D255-F257 PolarHBondContact O-N 3.26Å; D255-F257 VanDerWaalsContact O-N 3.16Å; D255-W258 HydrophobicContact CB-CB 4.36Å; D255-W258 WeakPolarHBondContact O-CB 3.31Å; D255-W258 PolarHBondContact O-N 3.45Å
256V73.1Confident75.5Confident113 Ų11367.7 Ų67.769%0.68536%0.359SS*.THydrogen-bonded Turntrans-55.9-32.4173.8-1800000111.5T254 W258 W259T254-V256 PolarHBondContact O-N 3.1Å; V256-W258 VanDerWaalsContact C-N 3.25Å; V256-W258 PolarHBondContact O-N 3.5Å; V256-W259 WeakPolarHBondContact O-CB 3.41Å; V256-W259 PolarHBondContact O-N 2.03Å
257F76.9Confident76.8Confident42 Ų4268.7 Ų68.718%0.18437%0.365CS..THydrogen-bonded Turntrans-64.4-26.7178.8-62-75000113.2W235 K239 F242 D255 W259 I260W235-F257 PolarHBondContact NE1-O 3.48Å; K239-F257 HydrophobicContact CG-CB 4.49Å; F242-F257 HydrophobicContact CB-CE2 3.62Å; F242-F257 HydrophobicContact CB-CZ 3.53Å; F242-F257 HydrophobicContact CD1-CZ 4.45Å; F242-F257 AromaticContact CD2-CE1 3.83Å; F242-F257 HydrophobicContact CD2-CE1 3.83Å; F242-F257 HydrophobicContact CD2-CE2 4.37Å; F242-F257 AromaticContact CD2-CZ 3.4Å; F242-F257 HydrophobicContact CD2-CZ 3.4Å; F242-F257 VanDerWaalsContact CD2-CZ 3.4Å; F242-F257 HydrophobicContact CE2-CE1 4.44Å; F242-F257 HydrophobicContact CE2-CZ 4.23Å; F242-F257 HydrophobicContact CG-CE1 4.41Å; F242-F257 HydrophobicContact CG-CE2 4.16Å; F242-F257 AromaticContact CG-CZ 3.54Å; F242-F257 HydrophobicContact CG-CZ 3.54Å; D255-F257 PolarHBondContact O-N 3.26Å; D255-F257 VanDerWaalsContact O-N 3.16Å; F257-W259 PolarHBondContact O-N 3.38Å; F257-I260 HydrophobicContact CD1-CD1 3.9Å; F257-I260 VanDerWaalsContact O-CB 3.29Å; F257-I260 WeakPolarHBondContact O-CB 3.26Å; F257-I260 WeakPolarHBondContact O-CG1 3.25Å; F257-I260 PolarHBondContact O-N 2.64Å; F257-I260 VanDerWaalsContact O-N 3.07Å
258W81.5Confident77.8Confident64 Ų6467.6 Ų67.624%0.24236%0.357CS..Hα-helixtrans-61.3-30.9176.6-178.1-114000112.6I251 D255 V256 I260 I261 K262I251-W258 HydrophobicContact CD1-CD2 4.26Å; I251-W258 HydrophobicContact CD1-CE3 4.12Å; I251-W258 HydrophobicContact CD1-CH2 3.33Å; I251-W258 HydrophobicContact CD1-CZ2 3.47Å; I251-W258 VanDerWaalsContact CD1-CZ2 3.47Å; I251-W258 HydrophobicContact CD1-CZ3 3.67Å; I251-W258 HydrophobicContact CG1-CD2 4.12Å; I251-W258 HydrophobicContact CG1-CE3 3.84Å; I251-W258 HydrophobicContact CG1-CH2 3.97Å; I251-W258 HydrophobicContact CG1-CZ2 4.23Å; I251-W258 HydrophobicContact CG1-CZ3 3.76Å; I251-W258 HydrophobicContact CG2-CB 4.32Å; I251-W258 HydrophobicContact CG2-CD2 3.67Å; I251-W258 HydrophobicContact CG2-CE3 4.17Å; I251-W258 HydrophobicContact CG2-CG 3.7Å; D255-W258 HydrophobicContact CB-CB 4.36Å; D255-W258 WeakPolarHBondContact O-CB 3.31Å; D255-W258 PolarHBondContact O-N 3.45Å; V256-W258 VanDerWaalsContact C-N 3.25Å; V256-W258 PolarHBondContact O-N 3.5Å; W258-I260 PolarHBondContact O-N 3.3Å; W258-I261 HydrophobicContact CZ3-CD1 4.4Å; W258-I261 PolarHBondContact O-N 3.03Å; W258-I261 VanDerWaalsContact O-N 3.13Å; W258-K262 PolarHBondContact O-N 3.25Å
259W85.1Confident78.8Confident142 Ų14270.4 Ų70.454%0.53837%0.373SS..Hα-helixtrans-64.4-23.6176.5-82.993.5000113.6V256 F257 I261 K262 T263V256-W259 WeakPolarHBondContact O-CB 3.41Å; V256-W259 PolarHBondContact O-N 2.03Å; F257-W259 PolarHBondContact O-N 3.38Å; W259-I261 VanDerWaalsContact C-N 3.26Å; W259-I261 PolarHBondContact O-N 3.02Å; W259-K262 PolarHBondContact O-N 3.47Å; W259-T263 VanDerWaalsContact O-CB 3.29Å; W259-T263 WeakPolarHBondContact O-CB 3.17Å; W259-T263 PolarHBondContact O-N 3.01Å; W259-T263 PolarHBondContact O-OG1 3.28Å
260I87.1Confident80Confident66 Ų6673 Ų7334%0.33839%0.387SS..Hα-helixtrans-63.7-35.5175.3-58.5175000110.5I231 W235 F257 W258 P264I231-I260 HydrophobicContact CG2-CG2 4.22Å; W235-I260 HydrophobicContact CB-CG2 4.07Å; F257-I260 HydrophobicContact CD1-CD1 3.9Å; F257-I260 VanDerWaalsContact O-CB 3.29Å; F257-I260 WeakPolarHBondContact O-CB 3.26Å; F257-I260 WeakPolarHBondContact O-CG1 3.25Å; F257-I260 PolarHBondContact O-N 2.64Å; F257-I260 VanDerWaalsContact O-N 3.07Å; W258-I260 PolarHBondContact O-N 3.3Å; I260-P264 WeakPolarHBondContact O-CD 3.36Å; I260-P264 VanDerWaalsContact O-CG 3.26Å; I260-P264 WeakPolarHBondContact O-CG 3.2Å
261I88.4Confident81.6Confident1 Ų172.1 Ų72.11%0.00539%0.385CS..Hα-helixtrans-83.2-45.2175.3-67.6-179.8000111Q185 M189 I232 W235 W258 W259 T263 P264 I265Q185-I261 HydrophobicContact CB-CD1 4.14Å; Q185-I261 HydrophobicContact CG-CD1 4.01Å; M189-I261 HydrophobicContact CE-CB 4.16Å; M189-I261 HydrophobicContact CE-CG1 4.22Å; M189-I261 HydrophobicContact CE-CG2 3.85Å; I232-I261 HydrophobicContact CD1-CD1 3.93Å; I232-I261 HydrophobicContact CD1-CG1 3.96Å; W235-I261 HydrophobicContact CB-CD1 4.49Å; W235-I261 HydrophobicContact CB-CG1 4.22Å; W235-I261 HydrophobicContact CD2-CD1 3.43Å; W235-I261 VanDerWaalsContact CD2-CD1 3.43Å; W235-I261 HydrophobicContact CD2-CG1 4.09Å; W235-I261 VanDerWaalsContact CE2-CD1 3.48Å; W235-I261 HydrophobicContact CE3-CD1 3.87Å; W235-I261 HydrophobicContact CG-CD1 3.7Å; W235-I261 HydrophobicContact CG-CG1 3.78Å; W235-I261 HydrophobicContact CH2-CD1 4.34Å; W235-I261 HydrophobicContact CZ2-CD1 3.96Å; W235-I261 HydrophobicContact CZ3-CD1 4.3Å; W258-I261 HydrophobicContact CZ3-CD1 4.4Å; W258-I261 PolarHBondContact O-N 3.03Å; W258-I261 VanDerWaalsContact O-N 3.13Å; W259-I261 VanDerWaalsContact C-N 3.26Å; W259-I261 PolarHBondContact O-N 3.02Å; I261-T263 PolarHBondContact O-N 3.13Å; I261-P264 WeakPolarHBondContact O-CD 3.06Å; I261-I265 HydrophobicContact CG2-CD1 3.77Å; I261-I265 WeakPolarHBondContact O-CD1 2.98Å; I261-I265 WeakPolarHBondContact O-CG1 3.31Å
262K89.3Confident83.4Confident84 Ų8469.8 Ų69.837%0.36537%0.373SS..Hα-helixtrans-66.4-41-172.5-167.9-176.7-179.9-172.50112.6W258 W259 I265 L266W258-K262 PolarHBondContact O-N 3.25Å; W259-K262 PolarHBondContact O-N 3.47Å; K262-I265 PolarHBondContact O-N 2.89Å; K262-L266 HydrophobicContact CD-CD1 4.45Å; K262-L266 HydrophobicContact CG-CD1 3.96Å; K262-L266 HydrophobicContact CG-CG 4.4Å; K262-L266 WeakPolarHBondContact O-CG 3.34Å; K262-L266 PolarHBondContact O-N 2.96Å
263T91.4Very high85.2Confident71 Ų7170.3 Ų70.344%0.43637%0.374SS..Hα-helixtrans-63.2-50.5-175.1-50.40000112.4W259 I261 I265 L266 A267W259-T263 VanDerWaalsContact O-CB 3.29Å; W259-T263 WeakPolarHBondContact O-CB 3.17Å; W259-T263 PolarHBondContact O-N 3.01Å; W259-T263 PolarHBondContact O-OG1 3.28Å; I261-T263 PolarHBondContact O-N 3.13Å; T263-I265 VanDerWaalsContact C-N 3.3Å; T263-I265 PolarHBondContact O-N 3.01Å; T263-L266 PolarHBondContact O-N 3.03Å; T263-A267 WeakPolarHBondContact O-CB 2.97Å; T263-A267 PolarHBondContact O-N 2.88Å
264P93.1Very high87.4Confident30 Ų3066.7 Ų66.720%0.19535%0.351CS..Hα-helixtrans-62.4-35.5178.7-25.738000113.2F193 I231 I260 I261 S268F193-P264 HydrophobicContact CE2-CB 4.34Å; F193-P264 HydrophobicContact CZ-CB 4.45Å; I231-P264 HydrophobicContact CD1-CB 3.79Å; I231-P264 HydrophobicContact CD1-CG 3.89Å; I231-P264 HydrophobicContact CG2-CG 4.11Å; I260-P264 WeakPolarHBondContact O-CD 3.36Å; I260-P264 VanDerWaalsContact O-CG 3.26Å; I260-P264 WeakPolarHBondContact O-CG 3.2Å; I261-P264 WeakPolarHBondContact O-CD 3.06Å; P264-S268 VanDerWaalsContact O-CB 3.27Å; P264-S268 WeakPolarHBondContact O-CB 3.46Å; P264-S268 PolarHBondContact O-N 3.28Å
265I93.4Very high89.3Confident24 Ų2462.1 Ų62.112%0.12332%0.323CS..Hα-helixtrans-63.6-50.4175.9-66.7171.6000110.4M189 F192 I261 K262 T263 A267 S268 I269M189-I265 HydrophobicContact CE-CG1 4.47Å; F192-I265 HydrophobicContact CD1-CG2 4.34Å; F192-I265 HydrophobicContact CD2-CD1 4.44Å; F192-I265 HydrophobicContact CD2-CG1 4.17Å; F192-I265 HydrophobicContact CD2-CG2 3.77Å; F192-I265 HydrophobicContact CE1-CG2 4.27Å; F192-I265 HydrophobicContact CE2-CG2 3.69Å; F192-I265 HydrophobicContact CG-CG2 4.1Å; F192-I265 HydrophobicContact CZ-CG2 3.96Å; I261-I265 HydrophobicContact CG2-CD1 3.77Å; I261-I265 WeakPolarHBondContact O-CD1 2.98Å; I261-I265 WeakPolarHBondContact O-CG1 3.31Å; K262-I265 PolarHBondContact O-N 2.89Å; T263-I265 VanDerWaalsContact C-N 3.3Å; T263-I265 PolarHBondContact O-N 3.01Å; I265-A267 VanDerWaalsContact C-N 3.35Å; I265-A267 PolarHBondContact O-N 3.32Å; I265-S268 WeakPolarHBondContact O-CB 3.31Å; I265-S268 PolarHBondContact O-N 3.02Å; I265-I269 HydrophobicContact CG2-CD1 3.94Å; I265-I269 WeakPolarHBondContact O-CG1 3.35Å; I265-I269 PolarHBondContact O-N 3.04Å
266L93.9Very high90.6Very high87 Ų8766.8 Ų66.846%0.45534%0.342SS..Hα-helixtrans-62.4-41.8178.7-72.1175000112.1K262 T263 S268 I269 L270K262-L266 HydrophobicContact CD-CD1 4.45Å; K262-L266 HydrophobicContact CG-CD1 3.96Å; K262-L266 HydrophobicContact CG-CG 4.4Å; K262-L266 WeakPolarHBondContact O-CG 3.34Å; K262-L266 PolarHBondContact O-N 2.96Å; T263-L266 PolarHBondContact O-N 3.03Å; L266-S268 PolarHBondContact O-N 3.1Å; L266-I269 PolarHBondContact O-N 3.27Å; L266-L270 WeakPolarHBondContact O-CB 3.49Å; L266-L270 PolarHBondContact O-N 3.15Å
267A95.1Very high91.7Very high48 Ų4864.2 Ų64.240%0.39732%0.324SS..Hα-helixtrans-60.9-44.4175.200000111.5T263 I265 I269 L270 V271T263-A267 WeakPolarHBondContact O-CB 2.97Å; T263-A267 PolarHBondContact O-N 2.88Å; I265-A267 VanDerWaalsContact C-N 3.35Å; I265-A267 PolarHBondContact O-N 3.32Å; A267-I269 PolarHBondContact O-N 3.46Å; A267-L270 PolarHBondContact O-N 3.1Å; A267-V271 VanDerWaalsContact O-CG2 3.32Å; A267-V271 WeakPolarHBondContact O-CG2 3.34Å; A267-V271 PolarHBondContact O-N 2.96Å
268S94.7Very high92.4Very high7 Ų764.1 Ų64.15%0.04933%0.328CS..Hα-helixtrans-60.4-43.2177-172.40000112.1F192 L196 P264 I265 L266 N272F192-S268 PolarHBondContact O-OG 2.93Å; L196-S268 WeakPolarHBondContact CB-OG 3.28Å; P264-S268 VanDerWaalsContact O-CB 3.27Å; P264-S268 WeakPolarHBondContact O-CB 3.46Å; P264-S268 PolarHBondContact O-N 3.28Å; I265-S268 WeakPolarHBondContact O-CB 3.31Å; I265-S268 PolarHBondContact O-N 3.02Å; L266-S268 PolarHBondContact O-N 3.1Å; S268-N272 VanDerWaalsContact O-CB 3.3Å; S268-N272 WeakPolarHBondContact O-CB 3.42Å; S268-N272 PolarHBondContact O-N 3.11Å
269I95.2Very high92.9Very high79 Ų7962.1 Ų62.141%0.40532%0.322SS..Hα-helixtrans-62.5-47.2176.3-67.4165.6000110.6F192 I265 L266 A267 N272 F273F192-I269 HydrophobicContact CD1-CD1 4.31Å; F192-I269 HydrophobicContact CD1-CG1 3.98Å; F192-I269 HydrophobicContact CE1-CD1 3.79Å; F192-I269 HydrophobicContact CE1-CG1 3.88Å; F192-I269 HydrophobicContact CZ-CD1 4.36Å; I265-I269 HydrophobicContact CG2-CD1 3.94Å; I265-I269 WeakPolarHBondContact O-CG1 3.35Å; I265-I269 PolarHBondContact O-N 3.04Å; L266-I269 PolarHBondContact O-N 3.27Å; A267-I269 PolarHBondContact O-N 3.46Å; I269-N272 PolarHBondContact O-N 3.45Å; I269-F273 WeakPolarHBondContact O-CB 3.09Å; I269-F273 PolarHBondContact O-N 3Å
270L96.4Very high93.2Very high111 Ų11159.2 Ų59.258%0.58132%0.316SS*.Hα-helixtrans-60.8-48.1179.7179.165.3000111.7L266 A267 F273 V274L266-L270 WeakPolarHBondContact O-CB 3.49Å; L266-L270 PolarHBondContact O-N 3.15Å; A267-L270 PolarHBondContact O-N 3.1Å; L270-F273 WeakPolarHBondContact O-CB 3.32Å; L270-F273 PolarHBondContact O-N 2.88Å; L270-V274 WeakPolarHBondContact O-CG2 3.04Å; L270-V274 PolarHBondContact O-N 2.81Å
271V95.9Very high93.5Very high66 Ų6664 Ų6440%0.433%0.33SS..Hα-helixtrans-63.1-45.2179.3175.30000110.4L196 A267 F273 V274 L275L196-V271 HydrophobicContact CD1-CB 3.93Å; L196-V271 HydrophobicContact CD1-CG1 3.55Å; A267-V271 VanDerWaalsContact O-CG2 3.32Å; A267-V271 WeakPolarHBondContact O-CG2 3.34Å; A267-V271 PolarHBondContact O-N 2.96Å; V271-F273 VanDerWaalsContact C-N 3.29Å; V271-F273 PolarHBondContact O-N 3.25Å; V271-V274 PolarHBondContact O-N 2.04Å; V271-V274 VanDerWaalsContact O-N 3.16Å; V271-L275 HydrophobicContact CG1-CD1 4.03Å; V271-L275 HydrophobicContact CG1-CG 4.3Å; V271-L275 VanDerWaalsContact O-CG 3.3Å; V271-L275 WeakPolarHBondContact O-CG 3.02Å; V271-L275 PolarHBondContact O-N 3.17Å
272N94.9Very high93.5Very high34 Ų3465.3 Ų65.318%0.18234%0.337CS..Hα-helixtrans-61.5-39.2178.1-168.925.5000112.2L195 S268 I269 V274 L275 F276L195-N272 VanDerWaalsContact CD2-ND2 3.3Å; L195-N272 WeakPolarHBondContact CD2-ND2 3.4Å; L195-N272 VanDerWaalsContact CG-ND2 3.31Å; L195-N272 WeakPolarHBondContact CG-ND2 3.49Å; S268-N272 VanDerWaalsContact O-CB 3.3Å; S268-N272 WeakPolarHBondContact O-CB 3.42Å; S268-N272 PolarHBondContact O-N 3.11Å; I269-N272 PolarHBondContact O-N 3.45Å; N272-V274 PolarHBondContact O-N 2.57Å; N272-L275 PolarHBondContact O-N 3.47Å; N272-F276 WeakPolarHBondContact O-CB 3.49Å; N272-F276 PolarHBondContact O-N 3.44Å
273F95.6Very high93.5Very high125 Ų12565.8 Ų65.855%0.54834%0.343SS..Hα-helixtrans-61.3-44.1174.2-177.8-102.5000112.2I269 L270 V271 L275 F276 I277I269-F273 WeakPolarHBondContact O-CB 3.09Å; I269-F273 PolarHBondContact O-N 3Å; L270-F273 WeakPolarHBondContact O-CB 3.32Å; L270-F273 PolarHBondContact O-N 2.88Å; V271-F273 VanDerWaalsContact C-N 3.29Å; V271-F273 PolarHBondContact O-N 3.25Å; F273-L275 PolarHBondContact O-N 3.28Å; F273-F276 WeakPolarHBondContact O-CB 3.22Å; F273-F276 PolarHBondContact O-N 2.68Å; F273-I277 HydrophobicContact CE1-CG1 4.23Å; F273-I277 HydrophobicContact CZ-CD1 4.3Å; F273-I277 HydrophobicContact CZ-CG1 4.27Å; F273-I277 WeakPolarHBondContact O-CG1 3.01Å; F273-I277 PolarHBondContact O-N 3.3Å; F273-I277 VanDerWaalsContact O-N 3.13Å
274V95.3Very high93.4Very high78 Ų7870.6 Ų70.647%0.47335%0.353SS..Hα-helixtrans-61.4-45.2175.1173.40000111.1L270 V271 N272 F276 I277 C278L270-V274 WeakPolarHBondContact O-CG2 3.04Å; L270-V274 PolarHBondContact O-N 2.81Å; V271-V274 PolarHBondContact O-N 2.04Å; V271-V274 VanDerWaalsContact O-N 3.16Å; N272-V274 PolarHBondContact O-N 2.57Å; V274-F276 VanDerWaalsContact C-N 3.32Å; V274-F276 PolarHBondContact O-N 3.17Å; V274-I277 PolarHBondContact O-N 3Å; V274-C278 PolarHBondContact O-N 2.65Å; V274-C278 PolarHBondContact O-SG 2.73Å; V274-C278 VanDerWaalsContact O-SG 3.37Å
275L93.1Very high93.2Very high17 Ų1775.2 Ų75.29%0.08937%0.372CS..Hα-helixtrans-59.6-43.4177.3-67.5171.7000111.6L196 L200 H203 V271 N272 F273 I277 C278 I279L196-L275 HydrophobicContact CD1-CD1 4.13Å; L200-L275 HydrophobicContact CD2-CD1 3.65Å; L200-L275 HydrophobicContact CD2-CD2 4.19Å; L200-L275 HydrophobicContact CG-CD1 3.81Å; H203-L275 HydrophobicContact CB-CD2 3.97Å; V271-L275 HydrophobicContact CG1-CD1 4.03Å; V271-L275 HydrophobicContact CG1-CG 4.3Å; V271-L275 VanDerWaalsContact O-CG 3.3Å; V271-L275 WeakPolarHBondContact O-CG 3.02Å; V271-L275 PolarHBondContact O-N 3.17Å; N272-L275 PolarHBondContact O-N 3.47Å; F273-L275 PolarHBondContact O-N 3.28Å; L275-I277 PolarHBondContact O-N 2.84Å; L275-C278 WeakPolarHBondContact O-CB 3.24Å; L275-C278 PolarHBondContact O-N 3.3Å; L275-I279 WeakPolarHBondContact O-CD1 2.99Å; L275-I279 VanDerWaalsContact O-CG1 3.29Å; L275-I279 WeakPolarHBondContact O-CG1 3.24Å; L275-I279 PolarHBondContact O-N 2.83Å
276F94.3Very high92.7Very high114 Ų11480 Ų8050%0.539%0.392SS..Hα-helixtrans-57.5-47176.7178.3-104.2000112N272 F273 V274 C278 I279 I280N272-F276 WeakPolarHBondContact O-CB 3.49Å; N272-F276 PolarHBondContact O-N 3.44Å; F273-F276 WeakPolarHBondContact O-CB 3.22Å; F273-F276 PolarHBondContact O-N 2.68Å; V274-F276 VanDerWaalsContact C-N 3.32Å; V274-F276 PolarHBondContact O-N 3.17Å; F276-C278 PolarHBondContact O-N 2.96Å; F276-I279 PolarHBondContact O-N 3.38Å; F276-I280 HydrophobicContact CD1-CD1 3.9Å; F276-I280 HydrophobicContact CE1-CD1 3.34Å; F276-I280 HydrophobicContact CE1-CG1 4.49Å; F276-I280 HydrophobicContact CE2-CD1 4.05Å; F276-I280 HydrophobicContact CG-CD1 4.47Å; F276-I280 HydrophobicContact CZ-CD1 3.44Å; F276-I280 VanDerWaalsContact CZ-CD1 3.44Å; F276-I280 HydrophobicContact CZ-CG1 4.4Å; F276-I280 WeakPolarHBondContact O-CG1 3.4Å; F276-I280 PolarHBondContact O-N 2.99Å
277I94.3Very high92.3Very high59 Ų5980.7 Ų80.730%0.30340%0.395SS..Hα-helixtrans-62.6-42.2176.2-62.2-59000111.5F273 V274 L275 I280 R281F273-I277 HydrophobicContact CE1-CG1 4.23Å; F273-I277 HydrophobicContact CZ-CD1 4.3Å; F273-I277 HydrophobicContact CZ-CG1 4.27Å; F273-I277 WeakPolarHBondContact O-CG1 3.01Å; F273-I277 PolarHBondContact O-N 3.3Å; F273-I277 VanDerWaalsContact O-N 3.13Å; V274-I277 PolarHBondContact O-N 3Å; L275-I277 PolarHBondContact O-N 2.84Å; I277-I280 PolarHBondContact O-N 3.44Å; I277-R281 WeakPolarHBondContact O-CG 3.21Å; I277-R281 PolarHBondContact O-N 3.15Å
278C92.5Very high91.5Very high39 Ų3982.8 Ų82.826%0.26440%0.399SS..Hα-helixtrans-61.7-44.6176.5-70.90000112.1V274 L275 F276 I280 R281 I282V274-C278 PolarHBondContact O-N 2.65Å; V274-C278 PolarHBondContact O-SG 2.73Å; V274-C278 VanDerWaalsContact O-SG 3.37Å; L275-C278 WeakPolarHBondContact O-CB 3.24Å; L275-C278 PolarHBondContact O-N 3.3Å; F276-C278 PolarHBondContact O-N 2.96Å; C278-I280 PolarHBondContact O-N 3.28Å; C278-R281 PolarHBondContact O-N 3.46Å; C278-I282 WeakPolarHBondContact O-CG1 3.49Å; C278-I282 PolarHBondContact O-N 3.16Å
279I91.4Very high90.2Very high23 Ų2386.9 Ų86.912%0.11843%0.427CS..Hα-helixtrans-61.1-46.1177.6-70.7158.7000110.7L202 H203 L206 L275 F276 R281 I282 L283L202-I279 HydrophobicContact CB-CD1 4.21Å; L202-I279 HydrophobicContact CD2-CD1 3.87Å; L202-I279 HydrophobicContact CD2-CG2 4.32Å; L202-I279 HydrophobicContact CG-CD1 4.04Å; H203-I279 HydrophobicContact CB-CD1 4.21Å; H203-I279 HydrophobicContact CB-CG1 4.19Å; L206-I279 HydrophobicContact CD1-CG1 4.42Å; L206-I279 HydrophobicContact CD1-CG2 3.82Å; L275-I279 WeakPolarHBondContact O-CD1 2.99Å; L275-I279 VanDerWaalsContact O-CG1 3.29Å; L275-I279 WeakPolarHBondContact O-CG1 3.24Å; L275-I279 PolarHBondContact O-N 2.83Å; F276-I279 PolarHBondContact O-N 3.38Å; I279-R281 VanDerWaalsContact C-N 3.3Å; I279-R281 PolarHBondContact O-N 3.14Å; I279-I282 PolarHBondContact O-N 3Å; I279-L283 WeakPolarHBondContact O-CB 3.38Å; I279-L283 PolarHBondContact O-N 2.93Å
280I92.6Very high88.4Confident80 Ų8086.9 Ų86.941%0.4143%0.432SS..Hα-helixtrans-59.2-42.5176.8-72.4176.2000111.1F276 I277 C278 L283 R284F276-I280 HydrophobicContact CD1-CD1 3.9Å; F276-I280 HydrophobicContact CE1-CD1 3.34Å; F276-I280 HydrophobicContact CE1-CG1 4.49Å; F276-I280 HydrophobicContact CE2-CD1 4.05Å; F276-I280 HydrophobicContact CG-CD1 4.47Å; F276-I280 HydrophobicContact CZ-CD1 3.44Å; F276-I280 VanDerWaalsContact CZ-CD1 3.44Å; F276-I280 HydrophobicContact CZ-CG1 4.4Å; F276-I280 WeakPolarHBondContact O-CG1 3.4Å; F276-I280 PolarHBondContact O-N 2.99Å; I277-I280 PolarHBondContact O-N 3.44Å; C278-I280 PolarHBondContact O-N 3.28Å; I280-L283 PolarHBondContact O-N 3.45Å; I280-R284 WeakPolarHBondContact O-CB 3.03Å; I280-R284 PolarHBondContact O-N 3.45Å
281R91.9Very high86.4Confident166 Ų16686.4 Ų86.463%0.62643%0.43SS*.Hα-helixtrans-61.8-47177.7-74.8176.7175.8171.5-0.5111.8I277 C278 I279 L283 R284 Q285I277-R281 WeakPolarHBondContact O-CG 3.21Å; I277-R281 PolarHBondContact O-N 3.15Å; C278-R281 PolarHBondContact O-N 3.46Å; I279-R281 VanDerWaalsContact C-N 3.3Å; I279-R281 PolarHBondContact O-N 3.14Å; R281-L283 VanDerWaalsContact C-N 3.34Å; R281-R284 PolarHBondContact O-N 3.23Å; R281-Q285 WeakPolarHBondContact O-CG 3.17Å; R281-Q285 PolarHBondContact O-N 2.82Å
282I88.9Confident84.3Confident30 Ų3089.9 Ų89.915%0.15445%0.445CS..Hα-helixtrans-62.2-43.6177.4-66.4166.4000110.5L206 A207 C278 I279 R284 Q285 K286L206-I282 HydrophobicContact CB-CG2 4.29Å; A207-I282 HydrophobicContact CB-CD1 4.1Å; C278-I282 WeakPolarHBondContact O-CG1 3.49Å; C278-I282 PolarHBondContact O-N 3.16Å; I279-I282 PolarHBondContact O-N 3Å; I282-R284 PolarHBondContact O-N 2.9Å; I282-Q285 PolarHBondContact O-N 2.84Å; I282-K286 PolarHBondContact O-N 3.32Å
283L89.2Confident82.1Confident93 Ų9390.9 Ų90.949%0.48746%0.463SS..Hα-helixtrans-61.7-45.2178.3-173.169.4000111.1I279 I280 R281 Q285 K286 I287I279-L283 WeakPolarHBondContact O-CB 3.38Å; I279-L283 PolarHBondContact O-N 2.93Å; I280-L283 PolarHBondContact O-N 3.45Å; R281-L283 VanDerWaalsContact C-N 3.34Å; L283-Q285 VanDerWaalsContact C-N 3.35Å; L283-Q285 PolarHBondContact O-N 2.98Å; L283-K286 PolarHBondContact O-N 3.31Å; L283-I287 HydrophobicContact CD1-CD1 4.32Å; L283-I287 HydrophobicContact CD2-CD1 4.4Å; L283-I287 HydrophobicContact CG-CD1 3.86Å; L283-I287 VanDerWaalsContact O-CG1 3.31Å; L283-I287 WeakPolarHBondContact O-CG1 3.24Å; L283-I287 PolarHBondContact O-N 2.03Å
284R90.8Very high79.7Confident173 Ų17393.6 Ų93.665%0.65347%0.47SS*.Hα-helixtrans-61.3-42176.2-172.7-176.3-179.4-135.30.9111.9I280 R281 I282 I287 N288I280-R284 WeakPolarHBondContact O-CB 3.03Å; I280-R284 PolarHBondContact O-N 3.45Å; R281-R284 PolarHBondContact O-N 3.23Å; I282-R284 PolarHBondContact O-N 2.9Å; R284-I287 PolarHBondContact O-N 3.03Å; R284-N288 WeakPolarHBondContact O-CB 3.29Å; R284-N288 PolarHBondContact O-N 3.23Å
285Q87.3Confident77.2Confident126 Ų12695.7 Ų95.759%0.58948%0.478SS*.Hα-helixtrans-61.1-45.4174.9-73.4172.3-16.200111.1R281 I282 L283 I287 N288 C289R281-Q285 WeakPolarHBondContact O-CG 3.17Å; R281-Q285 PolarHBondContact O-N 2.82Å; I282-Q285 PolarHBondContact O-N 2.84Å; L283-Q285 VanDerWaalsContact C-N 3.35Å; L283-Q285 PolarHBondContact O-N 2.98Å; Q285-I287 VanDerWaalsContact C-N 3.33Å; Q285-I287 PolarHBondContact O-N 2.86Å; Q285-N288 PolarHBondContact O-N 2.83Å; Q285-C289 PolarHBondContact O-N 2.99Å; Q285-C289 VanDerWaalsContact O-N 3.1Å; Q285-C289 PolarHBondContact O-SG 2.79Å
286K84.2Confident75.1Confident125 Ų125101.3 Ų101.354%0.54350%0.504SS..Hα-helixtrans-65.7-30.5176.7-74.9-165.9178.9-170.90114I282 L283 P290I282-K286 PolarHBondContact O-N 3.32Å; L283-K286 PolarHBondContact O-N 3.31Å; K286-P290 WeakPolarHBondContact O-CD 3.49Å; K286-P290 VanDerWaalsContact O-CG 3.24Å; K286-P290 WeakPolarHBondContact O-CG 3.39Å
287I84.5Confident73Confident101 Ų10199.5 Ų99.552%0.51851%0.506SS..Hα-helixtrans-78.9-28.4177-69.4168.3000112.2L283 R284 Q285 P290L283-I287 HydrophobicContact CD1-CD1 4.32Å; L283-I287 HydrophobicContact CD2-CD1 4.4Å; L283-I287 HydrophobicContact CG-CD1 3.86Å; L283-I287 VanDerWaalsContact O-CG1 3.31Å; L283-I287 WeakPolarHBondContact O-CG1 3.24Å; L283-I287 PolarHBondContact O-N 2.03Å; R284-I287 PolarHBondContact O-N 3.03Å; Q285-I287 VanDerWaalsContact C-N 3.33Å; Q285-I287 PolarHBondContact O-N 2.86Å; I287-P290 WeakPolarHBondContact O-CD 3.3Å; I287-P290 WeakPolarHBondContact O-CG 3.21Å
288N78.9Confident70.8Confident93 Ų93102.8 Ų102.850%0.49752%0.524SS..Hα-helixtrans-87.7-22.8179.6-72.8-5.1000113.7R284 Q285R284-N288 WeakPolarHBondContact O-CB 3.29Å; R284-N288 PolarHBondContact O-N 3.23Å; Q285-N288 PolarHBondContact O-N 2.83Å
289C66.9Low68.7Low93 Ų93108.5 Ų108.563%0.62855%0.546SS*.SBendtrans-78.2-14.3174.6-67.80000118.4Q285 D291Q285-C289 PolarHBondContact O-N 2.99Å; Q285-C289 VanDerWaalsContact O-N 3.1Å; Q285-C289 PolarHBondContact O-SG 2.79Å; C289-D291 VanDerWaalsContact C-N 3.27Å; C289-D291 PolarHBondContact O-N 3.26Å
290P58Low66.7Low79 Ų79117.1 Ų117.151%0.51358%0.579SS.*THydrogen-bonded Turntrans-68.8-24.5175.5-1228.3000112.9K286 I287K286-P290 WeakPolarHBondContact O-CD 3.49Å; K286-P290 VanDerWaalsContact O-CG 3.24Å; K286-P290 WeakPolarHBondContact O-CG 3.39Å; I287-P290 WeakPolarHBondContact O-CD 3.3Å; I287-P290 WeakPolarHBondContact O-CG 3.21Å
291D53.5Low64.2Low101 Ų101124.2 Ų124.254%0.5462%0.616SS.*THydrogen-bonded Turntrans-82.9-11-173.3-78.4-34.6000114.3C289C289-D291 VanDerWaalsContact C-N 3.27Å; C289-D291 PolarHBondContact O-N 3.26Å
292I53.3Low62.8Low139 Ų139122.1 Ų122.171%0.71362%0.616SS**Hα-helixtrans-78.9-23.9176.8-11672.6000112.6
293G47.3Very low61.4Low54 Ų54126.9 Ų126.956%0.55764%0.64SS**Hα-helixtrans-86.1-18.3-179.200000115S297G293-S297 PolarHBondContact O-OG 2.98Å; G293-S297 VanDerWaalsContact O-OG 3.13Å
294R44.8Very low59.9Low183 Ų183128.8 Ų128.869%0.69165%0.649SS**Hα-helixtrans-93.9-16.3-178.2-165.215770.4108.7-1.5113.8S297R294-S297 PolarHBondContact O-OG 2.83Å
295N42.9Very low58.1Low122 Ų122126.2 Ų126.265%0.65265%0.649SS**Hα-helixtrans-86.5-24.4177.8-11912.4000113.3
296E50.2Low56.2Low134 Ų134126.3 Ų126.363%0.62665%0.652SS**G310 helixtrans-79.3-21.8175.3-63.5-151.715700113.2N298 Q299 Y300E296-N298 VanDerWaalsContact C-N 3.25Å; E296-N298 PolarHBondContact O-N 2.88Å; E296-Q299 PolarHBondContact O-N 2.93Å; E296-Y300 WeakPolarHBondContact O-CD2 3.14Å
297S50.6Low54.4Low77 Ų77126.3 Ų126.354%0.53866%0.66SS.*G310 helixtrans-74.2-14.3176.77.50000113.5G293 R294G293-S297 PolarHBondContact O-OG 2.98Å; G293-S297 VanDerWaalsContact O-OG 3.13Å; R294-S297 PolarHBondContact O-OG 2.83Å
298N48.2Very low52.2Low127 Ų127128.1 Ų128.168%0.67967%0.67SS**G310 helixtrans-102.35.6176.7-77.8-13.9000113.5E296E296-N298 VanDerWaalsContact C-N 3.25Å; E296-N298 PolarHBondContact O-N 2.88Å
299Q47.7Very low50.2Low159 Ų159130.8 Ų130.874%0.74368%0.683SS**SBendtrans-103.62.1175.7-104.7-178.7-31.800113.9E296E296-Q299 PolarHBondContact O-N 2.93Å
300Y49.1Very low48.8Very low205 Ų205134 Ų13480%0.80469%0.687SS**  trans-123.227.2176.2-65.3-74.7000113.6E296E296-Y300 WeakPolarHBondContact O-CD2 3.14Å
301L39.6Very low47.9Very low228 Ų228139 Ų139100%1.19470%0.703SS**  trans-129.50169.4-143.3124.6000111.6

Retrieved 301 of 301 residues in 637.7 ms (Link to these results)

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