G4LZA8_SCHMA Loading...

Prohormone-4

AlphaFold DB , UniProt , Accession G4LZA8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 214 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
1M41.5Very low53Low234 Ų234150.7 Ų150.7100%1.15378%0.78SS**  0830-158.1165.878.200106.1
2I46.1Very low54.7Low137 Ų137149.9 Ų149.970%0.70377%0.769SS**  -173.179.899.4-72.7145.3000108.1
3I47.7Very low56.4Low170 Ų170144.3 Ų144.387%0.87275%0.746SS**SBendtrans-140.925.1160.8-47173.5000111.4
4L47.9Very low58Low165 Ų165141.1 Ų141.186%0.86473%0.73SS**  trans-103.117.1172.2-79.7171.4000113.5
5L48.3Very low59.4Low151 Ų151136.9 Ų136.979%0.79171%0.713SS**  trans-111.238.4-177.3-68.1177.1000114.6
6M51Low60.7Low163 Ų163134.7 Ų134.780%0.80370%0.702SS**  trans-127.34.6172.5-65.9-153.483.800116.4G8M6-G8 VanDerWaalsContact C-N 3.35Å; M6-G8 PolarHBondContact O-N 3.49Å
7K53.7Low61.9Low193 Ų193132.3 Ų132.384%0.83969%0.689SS**SBendtrans-79.8-9.8176.1-76.6-175.2174.3-179.60114.9
8G54.9Low62.7Low60 Ų60128.8 Ų128.862%0.61968%0.678SS**SBendtrans-80.4-27.8-176.300000115.4M6M6-G8 VanDerWaalsContact C-N 3.35Å; M6-G8 PolarHBondContact O-N 3.49Å
9S60.1Low63.3Low85 Ų85126.9 Ų126.959%0.59467%0.668SS**Hα-helixtrans-84.3-21.4-172-154.40000113.8V13S9-V13 WeakPolarHBondContact O-CG2 3.33Å
10Y62.8Low63.8Low183 Ų183125.5 Ų125.572%0.71866%0.66SS**Hα-helixtrans-73.4-34.8-175.2-124.6-89.5000112.9L14Y10-L14 HydrophobicContact CD1-CD1 4.39Å; Y10-L14 PolarHBondContact O-N 3.46Å
11N69.2Low64.2Low117 Ų117125.2 Ų125.263%0.62666%0.657SS**Hα-helixtrans-70.8-39.4-178.1-116.1-18.5000112.2L14 V15N11-L14 PolarHBondContact O-N 3.03Å; N11-V15 WeakPolarHBondContact O-CG2 3.46Å; N11-V15 PolarHBondContact O-N 3.45Å; N11-V15 VanDerWaalsContact O-N 3.13Å
12H73.2Confident65.9Low141 Ų141122.5 Ų122.565%0.65364%0.635SS**Hα-helixtrans-66.6-37.8177.3-87.8-81.4000112.8V15 L16H12-V15 PolarHBondContact O-N 3.13Å; H12-L16 WeakPolarHBondContact O-CB 3.37Å; H12-L16 WeakPolarHBondContact O-CG 3.47Å; H12-L16 PolarHBondContact O-N 3.49Å
13V77.4Confident67Low77 Ų77120.8 Ų120.847%0.46763%0.631SS.*Hα-helixtrans-65.6-41177.8175.80000110.9S9 L16 L17S9-V13 WeakPolarHBondContact O-CG2 3.33Å; V13-L16 PolarHBondContact O-N 3.32Å; V13-L17 HydrophobicContact CG1-CD1 4Å; V13-L17 HydrophobicContact CG1-CG 4.49Å; V13-L17 WeakPolarHBondContact O-CB 3.3Å; V13-L17 VanDerWaalsContact O-CG 3.3Å; V13-L17 WeakPolarHBondContact O-CG 3.49Å; V13-L17 PolarHBondContact O-N 3.28Å
14L77.5Confident67.9Low100 Ų100117.2 Ų117.252%0.52462%0.621SS.*Hα-helixtrans-63.5-43.7176.2-86.6160.3000112.7Y10 N11 L17 S18Y10-L14 HydrophobicContact CD1-CD1 4.39Å; Y10-L14 PolarHBondContact O-N 3.46Å; N11-L14 PolarHBondContact O-N 3.03Å; L14-L17 PolarHBondContact O-N 3.48Å; L14-S18 PolarHBondContact O-N 3Å
15V79.6Confident68.6Low78 Ų78119.1 Ų119.147%0.47362%0.617SS.*Hα-helixtrans-64.5-44178.3174.60000110.8N11 H12 L17 S18 L19N11-V15 WeakPolarHBondContact O-CG2 3.46Å; N11-V15 PolarHBondContact O-N 3.45Å; N11-V15 VanDerWaalsContact O-N 3.13Å; H12-V15 PolarHBondContact O-N 3.13Å; V15-L17 PolarHBondContact O-N 3.42Å; V15-S18 PolarHBondContact O-N 3.25Å; V15-S18 PolarHBondContact O-OG 2.98Å; V15-L19 HydrophobicContact CG1-CD1 4.24Å; V15-L19 PolarHBondContact O-N 3.48Å
16L79.7Confident69.1Low101 Ų101119.9 Ų119.953%0.52962%0.617SS.*Hα-helixtrans-62.9-41.5177.3-79.2164.1000112.6H12 V13 S18 L19 I20H12-L16 WeakPolarHBondContact O-CB 3.37Å; H12-L16 WeakPolarHBondContact O-CG 3.47Å; H12-L16 PolarHBondContact O-N 3.49Å; V13-L16 PolarHBondContact O-N 3.32Å; L16-S18 VanDerWaalsContact C-N 3.35Å; L16-S18 PolarHBondContact O-N 3.03Å; L16-L19 PolarHBondContact O-N 3.48Å; L16-I20 VanDerWaalsContact O-CG1 3.32Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.72Å
17L80.9Confident69.5Low94 Ų94116.6 Ų116.649%0.49261%0.609SS.*Hα-helixtrans-63.9-40.5176-72.9170.5000111.8V13 L14 V15 L19 I20 I21V13-L17 HydrophobicContact CG1-CD1 4Å; V13-L17 HydrophobicContact CG1-CG 4.49Å; V13-L17 WeakPolarHBondContact O-CB 3.3Å; V13-L17 VanDerWaalsContact O-CG 3.3Å; V13-L17 WeakPolarHBondContact O-CG 3.49Å; V13-L17 PolarHBondContact O-N 3.28Å; L14-L17 PolarHBondContact O-N 3.48Å; V15-L17 PolarHBondContact O-N 3.42Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 3.03Å; L17-I20 PolarHBondContact O-N 3.28Å; L17-I21 WeakPolarHBondContact O-CD1 3.41Å; L17-I21 VanDerWaalsContact O-CG1 3.25Å; L17-I21 WeakPolarHBondContact O-CG1 3.48Å; L17-I21 PolarHBondContact O-N 3.22Å
18S76.9Confident69.5Low69 Ų69113.9 Ų113.948%0.48361%0.61SS.*Hα-helixtrans-64.4-37.9176.371.90000112.8L14 V15 L16 I21 Y22L14-S18 PolarHBondContact O-N 3Å; V15-S18 PolarHBondContact O-N 3.25Å; V15-S18 PolarHBondContact O-OG 2.98Å; L16-S18 VanDerWaalsContact C-N 3.35Å; L16-S18 PolarHBondContact O-N 3.03Å; S18-I21 PolarHBondContact O-N 3.42Å; S18-Y22 WeakPolarHBondContact O-CB 3.47Å; S18-Y22 PolarHBondContact O-N 3.45Å
19L74.5Confident69.7Low93 Ų93116.7 Ų116.749%0.48761%0.614SS.*Hα-helixtrans-66.8-42.5175.1-87.8163.1000112V15 L16 L17 Y22 V23V15-L19 HydrophobicContact CG1-CD1 4.24Å; V15-L19 PolarHBondContact O-N 3.48Å; L16-L19 PolarHBondContact O-N 3.48Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 3.03Å; L19-Y22 PolarHBondContact O-N 2.87Å; L19-V23 WeakPolarHBondContact O-CG2 3.25Å; L19-V23 PolarHBondContact O-N 3.29Å
20I73.4Confident69.6Low99 Ų99117.7 Ų117.751%0.50862%0.621SS.*Hα-helixtrans-63.3-44.3176.8-67165.2000110.1L16 L17 Y22 V23 S24L16-I20 VanDerWaalsContact O-CG1 3.32Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.72Å; L17-I20 PolarHBondContact O-N 3.28Å; I20-Y22 VanDerWaalsContact C-N 3.29Å; I20-Y22 PolarHBondContact O-N 2.92Å; I20-V23 PolarHBondContact O-N 2.99Å; I20-S24 WeakPolarHBondContact O-CB 3.32Å; I20-S24 PolarHBondContact O-N 2.91Å; I20-S24 PolarHBondContact O-OG 3.39Å
21I72Confident69.4Low119 Ų119113.3 Ų113.361%0.6162%0.617SS**Hα-helixtrans-61.7-38.4175.8-65.1163.9000111.2L17 S18 R25L17-I21 WeakPolarHBondContact O-CD1 3.41Å; L17-I21 VanDerWaalsContact O-CG1 3.25Å; L17-I21 WeakPolarHBondContact O-CG1 3.48Å; L17-I21 PolarHBondContact O-N 3.22Å; S18-I21 PolarHBondContact O-N 3.42Å; I21-R25 PolarHBondContact O-N 2.95Å
22Y76.2Confident68.9Low177 Ų177111.6 Ų111.669%0.69462%0.619SS**Hα-helixtrans-65.5-43.6176.9-171.5-96.3000112.1S18 L19 I20 R25S18-Y22 WeakPolarHBondContact O-CB 3.47Å; S18-Y22 PolarHBondContact O-N 3.45Å; L19-Y22 PolarHBondContact O-N 2.87Å; I20-Y22 VanDerWaalsContact C-N 3.29Å; I20-Y22 PolarHBondContact O-N 2.92Å; Y22-R25 PolarHBondContact O-N 3.36Å
23V70.4Confident68.5Low101 Ų101110.6 Ų110.661%0.61262%0.623SS**Hα-helixtrans-68.2-39.6178.4174.90000111.5L19 I20 R25 Q26L19-V23 WeakPolarHBondContact O-CG2 3.25Å; L19-V23 PolarHBondContact O-N 3.29Å; I20-V23 PolarHBondContact O-N 2.99Å; V23-R25 PolarHBondContact O-N 3.37Å; V23-R25 VanDerWaalsContact O-N 3.09Å; V23-Q26 PolarHBondContact O-N 3.13Å
24S66.9Low68Low95 Ų95116 Ų11666%0.66464%0.643SS**THydrogen-bonded Turntrans-63.7-14.4176.4-55.40000113.9I20I20-S24 WeakPolarHBondContact O-CB 3.32Å; I20-S24 PolarHBondContact O-N 2.91Å; I20-S24 PolarHBondContact O-OG 3.39Å
25R62.2Low67.6Low205 Ų205117 Ų11777%0.77464%0.64SS**THydrogen-bonded Turntrans-89.83.2-178.2-158.1171.1176-174.7-1.6113.8I21 Y22 V23 S27I21-R25 PolarHBondContact O-N 2.95Å; Y22-R25 PolarHBondContact O-N 3.36Å; V23-R25 PolarHBondContact O-N 3.37Å; V23-R25 VanDerWaalsContact O-N 3.09Å; R25-S27 PolarHBondContact O-N 2.99Å; R25-S27 PolarHBondContact O-OG 3.45Å
26Q57.7Low67.5Low168 Ų168117.3 Ų117.379%0.78566%0.659SS**  trans-74.882.1164.3-85174.19.200109.5V23 T28V23-Q26 PolarHBondContact O-N 3.13Å; Q26-T28 PolarHBondContact O-N 3.09Å
27S59.5Low67.9Low93 Ų93115.1 Ų115.165%0.6565%0.648SS**  trans-39.5127.7166.3-53.60000110.8R25 V29R25-S27 PolarHBondContact O-N 2.99Å; R25-S27 PolarHBondContact O-OG 3.45Å; S27-V29 PolarHBondContact O-N 3.3Å
28T54.2Low68.3Low137 Ų137118.9 Ų118.984%0.8467%0.668SS**  trans-58.393.6155.850.60000107.4Q26 S30Q26-T28 PolarHBondContact O-N 3.09Å; T28-S30 PolarHBondContact O-N 3.46Å
29V60.1Low69.1Low119 Ų119115.8 Ų115.872%0.72165%0.647SS**  trans-68.485.5160.7-179.20000104.9S27 S31S27-V29 PolarHBondContact O-N 3.3Å; V29-S31 PolarHBondContact O-N 2.85Å
30S57.7Low70Confident106 Ų106114 Ų11474%0.74164%0.64SS**  trans-68.690.7161.1-179.20000104.9T28 A32T28-S30 PolarHBondContact O-N 3.46Å; S30-A32 PolarHBondContact O-N 3.3Å
31S57.4Low70.9Confident90 Ų90117.3 Ų117.363%0.62965%0.654SS**  trans-62.480.2166.3-56.40000107.4V29 V33V29-S31 PolarHBondContact O-N 2.85Å; S31-V33 PolarHBondContact O-N 2.9Å
32A59.7Low71.9Confident81 Ų81115.9 Ų115.967%0.66965%0.654SS**  trans-62.788.3147.900000103.9S30 E34S30-A32 PolarHBondContact O-N 3.3Å; A32-E34 PolarHBondContact O-N 3.48Å
33V65.6Low72.8Confident120 Ų120111.1 Ų111.173%0.72764%0.639SS**  trans-54.5111.6169.6175.20000104.2S31 R35S31-V33 PolarHBondContact O-N 2.9Å; V33-R35 PolarHBondContact O-N 3.28Å
34E66.5Low74Confident190 Ų190108.1 Ų108.189%0.88862%0.621SS**  trans-59.696.8172.9-73.3-169.2164.900106.7A32 G36A32-E34 PolarHBondContact O-N 3.48Å; E34-G36 PolarHBondContact O-N 3.03Å
35R67.6Low75.3Confident122 Ų122105.7 Ų105.746%0.4660%0.598SS.*  trans-70.4124-178.3-163.4-175.1-176.5121.229.4107V33 N37 C39 P40 E41V33-R35 PolarHBondContact O-N 3.28Å; R35-N37 WeakPolarHBondContact CD-O 3.47Å; R35-N37 VanDerWaalsContact CG-O 3.28Å; R35-N37 WeakPolarHBondContact CG-O 3.3Å; R35-N37 PolarHBondContact O-N 3.19Å; R35-N37 VanDerWaalsContact O-N 3.08Å; R35-C39 PolarHBondContact NE-O 2.96Å; R35-C39 PolarHBondContact NH2-O 3.07Å; R35-P40 VanDerWaalsContact NH2-CA 3.35Å; R35-P40 PolarHBondContact NH2-O 3.39Å; R35-E41 VanDerWaalsContact NH2-CA 3.26Å
36G78.3Confident76.9Confident85 Ų8598.6 Ų98.688%0.87658%0.578SS**SBendtrans-64.7-12.7-174.700000115.1E34E34-G36 PolarHBondContact O-N 3.03Å
37N87.7Confident78.7Confident54 Ų5491 Ų9129%0.28954%0.543SS..SBendtrans-159175.1177.162.237.2000111.5R35 C39 P44R35-N37 WeakPolarHBondContact CD-O 3.47Å; R35-N37 VanDerWaalsContact CG-O 3.28Å; R35-N37 WeakPolarHBondContact CG-O 3.3Å; R35-N37 PolarHBondContact O-N 3.19Å; R35-N37 VanDerWaalsContact O-N 3.08Å; N37-C39 VanDerWaalsContact C-N 3.28Å; N37-C39 PolarHBondContact O-N 3.45Å; N37-C39 VanDerWaalsContact OD1-CB 3.29Å; N37-C39 WeakPolarHBondContact OD1-CB 3.23Å; N37-C39 PolarHBondContact OD1-N 3.36Å; N37-P44 PolarHBondContact ND2-O 3.29Å
38D89.7Confident80.3Confident173 Ų17394.3 Ų94.393%0.92554%0.541SS*.SBendtrans-83.44.2179.6-64.2-37.7000114.2
39C94.3Very high82.1Confident5 Ų590.2 Ų90.23%0.03452%0.516CS..  trans-81.5139.7-175.4-73.60000111.9R35 N37 Q43 C53R35-C39 PolarHBondContact NE-O 2.96Å; R35-C39 PolarHBondContact NH2-O 3.07Å; N37-C39 VanDerWaalsContact C-N 3.28Å; N37-C39 PolarHBondContact O-N 3.45Å; N37-C39 VanDerWaalsContact OD1-CB 3.29Å; N37-C39 WeakPolarHBondContact OD1-CB 3.23Å; N37-C39 PolarHBondContact OD1-N 3.36Å; C39-Q43 VanDerWaalsContact CB-O 3.27Å; C39-Q43 WeakPolarHBondContact CB-O 3.41Å; C39-C53 WeakPolarHBondContact CA-SG 3.38Å; C39-C53 HydrophobicContact CB-CB 3.63Å; C39-C53 WeakPolarHBondContact CB-SG 3.42Å; C39-C53 WeakPolarHBondContact SG-CB 3.19Å; C39-C53 CovalentContact SG-SG 2.04Å; C39-C53 PolarHBondContact SG-SG 3Å
40P93.2Very high83.6Confident54 Ų5489.2 Ų89.235%0.35151%0.513SS..  trans-67.4163.1-176.731-36.6000112.8R35 S42 Q43 P44R35-P40 VanDerWaalsContact NH2-CA 3.35Å; R35-P40 PolarHBondContact NH2-O 3.39Å; P40-S42 PolarHBondContact O-N 3.47Å; P40-Q43 HydrophobicContact CG-CB 4.15Å; P40-Q43 CarbonylContact O-C 3.1Å; P40-Q43 PolarHBondContact O-N 2.89Å; P40-P44 WeakPolarHBondContact O-CA 3.24Å
41E91.9Very high85.1Confident169 Ų16995.4 Ų95.479%0.7952%0.52SS*.THydrogen-bonded Turntrans-67.9-29-171-70.3-176179.500111.8R35 Q43R35-E41 VanDerWaalsContact NH2-CA 3.26Å; E41-Q43 VanDerWaalsContact C-N 3.29Å; E41-Q43 PolarHBondContact O-N 3.4Å
42S93.9Very high86.9Confident89 Ų8993.9 Ų93.962%0.62250%0.504SS*.THydrogen-bonded Turntrans-71.1-21.7175.154.50000113.8P40P40-S42 PolarHBondContact O-N 3.47Å
43Q95.2Very high88.7Confident78 Ų7890.9 Ų90.936%0.36448%0.478SS..SBendtrans-142.172.1-178.8-67.4176.3-41.400108.5C39 P40 E41 W45 C53 L54C39-Q43 VanDerWaalsContact CB-O 3.27Å; C39-Q43 WeakPolarHBondContact CB-O 3.41Å; P40-Q43 HydrophobicContact CG-CB 4.15Å; P40-Q43 CarbonylContact O-C 3.1Å; P40-Q43 PolarHBondContact O-N 2.89Å; E41-Q43 VanDerWaalsContact C-N 3.29Å; E41-Q43 PolarHBondContact O-N 3.4Å; Q43-W45 VanDerWaalsContact C-N 3.32Å; Q43-W45 PolarHBondContact O-N 3.21Å; Q43-C53 HydrophobicContact CB-CB 4.08Å; Q43-C53 VanDerWaalsContact O-CB 3.23Å; Q43-C53 WeakPolarHBondContact O-CB 3.4Å; Q43-L54 CarbonylContact C-O 3.53Å; Q43-L54 WeakPolarHBondContact CA-O 3.12Å
44P94.1Very high90.1Very high37 Ų3785.7 Ų85.724%0.2445%0.446CS..  trans-80.5-8.8-166.731.9-36.5000114.3N37 P40 F56N37-P44 PolarHBondContact ND2-O 3.29Å; P40-P44 WeakPolarHBondContact O-CA 3.24Å; P44-F56 HydrophobicContact CG-CD2 4.02Å; P44-F56 HydrophobicContact CG-CE2 3.48Å; P44-F56 VanDerWaalsContact CG-CE2 3.48Å; P44-F56 HydrophobicContact CG-CZ 3.96Å
45W94.7Very high91.6Very high45 Ų4577.8 Ų77.817%0.1741%0.412CS..EExtended strand (participates in β ladder)trans-97.4118-172.8-165.894000111.6Q43 C53 L54 F56 I59 Y70 D71 M76Q43-W45 VanDerWaalsContact C-N 3.32Å; Q43-W45 PolarHBondContact O-N 3.21Å; W45-C53 CarbonylContact O-C 3.49Å; W45-C53 WeakPolarHBondContact O-CA 3.41Å; W45-L54 HydrophobicContact CE3-CB 4.46Å; W45-L54 HydrophobicContact CE3-CD1 4.34Å; W45-L54 HydrophobicContact CZ3-CD1 4.31Å; W45-L54 PolarHBondContact N-O 3.08Å; W45-L54 PolarHBondContact O-N 3.12Å; W45-F56 HydrophobicContact CB-CE1 4.42Å; W45-I59 HydrophobicContact CD2-CD1 3.49Å; W45-I59 VanDerWaalsContact CD2-CD1 3.49Å; W45-I59 HydrophobicContact CD2-CG1 4.21Å; W45-I59 HydrophobicContact CE3-CD1 3.27Å; W45-I59 HydrophobicContact CE3-CG1 4.41Å; W45-I59 HydrophobicContact CG-CD1 4.07Å; W45-I59 HydrophobicContact CG-CG1 4.34Å; W45-I59 HydrophobicContact CH2-CD1 3.95Å; W45-I59 HydrophobicContact CZ2-CD1 4.2Å; W45-I59 HydrophobicContact CZ3-CD1 3.51Å; W45-Y70 AromaticContact CH2-CD1 3.31Å; W45-Y70 HydrophobicContact CH2-CD1 3.31Å; W45-Y70 AromaticContact CH2-CE1 3.34Å; W45-Y70 HydrophobicContact CH2-CE1 3.34Å; W45-Y70 HydrophobicContact CH2-CG 4.28Å; W45-Y70 HydrophobicContact CZ2-CD1 4.03Å; W45-Y70 AromaticContact CZ2-CE1 3.55Å; W45-Y70 HydrophobicContact CZ2-CE1 3.55Å; W45-Y70 HydrophobicContact CZ3-CD1 4.11Å; W45-Y70 HydrophobicContact CZ3-CE1 4.36Å; W45-D71 HydrophobicContact CH2-CB 4.35Å; W45-D71 HydrophobicContact CZ3-CB 4.29Å; W45-M76 HydrophobicContact CZ2-CE 4.29Å; W45-M76 HydrophobicContact CZ2-CG 4.31Å; W45-M76 HydrophobicContact CZ2-SD 4.04Å
46P95.3Very high92.8Very high55 Ų5577.5 Ų77.536%0.35741%0.414SS..EExtended strand (participates in β ladder)trans-84.6131.5-178.230.6-30.7000112.2
47C95.4Very high93.6Very high9 Ų979.4 Ų79.46%0.06140%0.404CS..PPolyproline II helixtrans-65.1164.1160.8-66.10000110.6T49 I52 C66C47-T49 PolarHBondContact O-N 2.96Å; C47-I52 HydrophobicContact CB-CB 4.06Å; C47-I52 HydrophobicContact CB-CG2 4.2Å; C47-I52 PolarHBondContact N-O 3.21Å; C47-I52 VanDerWaalsContact SG-CG2 3.54Å; C47-C66 HydrophobicContact CB-CB 3.87Å; C47-C66 WeakPolarHBondContact CB-SG 3.5Å; C47-C66 VanDerWaalsContact SG-CA 3.57Å; C47-C66 WeakPolarHBondContact SG-CB 3.47Å; C47-C66 CovalentContact SG-SG 2.04Å; C47-C66 PolarHBondContact SG-SG 2.84Å
48R93.9Very high94Very high162 Ų16280.9 Ų80.961%0.61141%0.408SS*.SBendtrans-65.4-30.4171.2-56.4-173.8-172.81782.1111.7P50 D68 Y70R48-P50 WeakPolarHBondContact O-CD 3.29Å; R48-D68 WeakPolarHBondContact CB-OD2 3.33Å; R48-D68 WeakPolarHBondContact CD-OD2 3.31Å; R48-Y70 HydrophobicContact CG-CD1 3.6Å; R48-Y70 HydrophobicContact CG-CE1 4.08Å; R48-Y70 HydrophobicContact CG-CG 3.84Å; R48-Y70 VanDerWaalsContact CZ-CD2 3.44Å; R48-Y70 VanDerWaalsContact NE-CG 3.34Å
49T92.3Very high94.2Very high51 Ų5172.8 Ų72.831%0.31337%0.365SS..SBendtrans-68.9122.3170.6-61.80000109.5C47 I52 P67C47-T49 PolarHBondContact O-N 2.96Å; T49-I52 HydrophobicContact CG2-CD1 3.64Å; T49-I52 HydrophobicContact CG2-CG1 4.21Å; T49-I52 PolarHBondContact O-N 3.01Å; T49-P67 HydrophobicContact CG2-CG 4.47Å
50P90.4Very high94.2Very high99 Ų9974.2 Ų74.264%0.64337%0.374SS*.THydrogen-bonded Turntrans-57.5144.2-176.4-25.533.7000113.1R48 I52R48-P50 WeakPolarHBondContact O-CD 3.29Å; P50-I52 PolarHBondContact O-N 3.26Å
51R89.8Confident94.3Very high236 Ų23675.1 Ų75.189%0.89138%0.376SS*.THydrogen-bonded Turntrans65.911.2175.4-52178.2-70.81090.9115.5
52I95.5Very high94.3Very high57 Ų5769.9 Ų69.929%0.29237%0.368SS..  trans-103.2121.2167.7-56.7-179.3000107C47 T49 P50 P67C47-I52 HydrophobicContact CB-CB 4.06Å; C47-I52 HydrophobicContact CB-CG2 4.2Å; C47-I52 PolarHBondContact N-O 3.21Å; C47-I52 VanDerWaalsContact SG-CG2 3.54Å; T49-I52 HydrophobicContact CG2-CD1 3.64Å; T49-I52 HydrophobicContact CG2-CG1 4.21Å; T49-I52 PolarHBondContact O-N 3.01Å; P50-I52 PolarHBondContact O-N 3.26Å; I52-P67 HydrophobicContact CD1-CG 3.39Å
53C96.9Very high94.5Very high19 Ų1972 Ų7213%0.12837%0.368CS..EExtended strand (participates in β ladder)trans-131.5141.9-176.9-53.40000109.7C39 Q43 W45C39-C53 WeakPolarHBondContact CA-SG 3.38Å; C39-C53 HydrophobicContact CB-CB 3.63Å; C39-C53 WeakPolarHBondContact CB-SG 3.42Å; C39-C53 WeakPolarHBondContact SG-CB 3.19Å; C39-C53 CovalentContact SG-SG 2.04Å; C39-C53 PolarHBondContact SG-SG 3Å; Q43-C53 HydrophobicContact CB-CB 4.08Å; Q43-C53 VanDerWaalsContact O-CB 3.23Å; Q43-C53 WeakPolarHBondContact O-CB 3.4Å; W45-C53 CarbonylContact O-C 3.49Å; W45-C53 WeakPolarHBondContact O-CA 3.41Å
54L96.5Very high94.5Very high10 Ų1072 Ų725%0.05237%0.374CS..EExtended strand (participates in β ladder)trans-118.5154.4-174.1-59.6-178.1000111.5Q43 W45 F58 I59 D65 D71Q43-L54 CarbonylContact C-O 3.53Å; Q43-L54 WeakPolarHBondContact CA-O 3.12Å; W45-L54 HydrophobicContact CE3-CB 4.46Å; W45-L54 HydrophobicContact CE3-CD1 4.34Å; W45-L54 HydrophobicContact CZ3-CD1 4.31Å; W45-L54 PolarHBondContact N-O 3.08Å; W45-L54 PolarHBondContact O-N 3.12Å; L54-F58 HydrophobicContact CB-CB 4.27Å; L54-I59 HydrophobicContact CB-CD1 3.94Å; L54-I59 HydrophobicContact CD1-CD1 3.6Å; L54-I59 HydrophobicContact CG-CD1 4.38Å; L54-D65 HydrophobicContact CD1-CB 3.63Å; L54-D65 HydrophobicContact CD2-CB 3.79Å; L54-D65 HydrophobicContact CG-CB 4.38Å; L54-D71 HydrophobicContact CD1-CB 3.91Å
55S96.3Very high94.7Very high25 Ų2572.9 Ų72.918%0.17538%0.377CS..  trans-69.6154.7161.1-177.50000108.6D57 F58S55-D57 PolarHBondContact O-N 3.21Å; S55-D57 VanDerWaalsContact O-N 3.14Å; S55-D57 PolarHBondContact OG-N 3.1Å; S55-D57 PolarHBondContact OG-OD2 3.4Å; S55-F58 PolarHBondContact O-N 3.37Å; S55-F58 VanDerWaalsContact O-N 3.15Å
56F93.9Very high94.8Very high115 Ų11571 Ų7150%0.50437%0.371SS..G310 helixtrans-62-18.8172.8-72.2-64.5000113.6P44 W45 F58 K80P44-F56 HydrophobicContact CG-CD2 4.02Å; P44-F56 HydrophobicContact CG-CE2 3.48Å; P44-F56 VanDerWaalsContact CG-CE2 3.48Å; P44-F56 HydrophobicContact CG-CZ 3.96Å; W45-F56 HydrophobicContact CB-CE1 4.42Å; F56-F58 VanDerWaalsContact C-N 3.29Å; F56-K80 PolarHBondContact O-NZ 2.86Å
57D94.1Very high94.8Very high126 Ų12672.6 Ų72.667%0.67438%0.381SS*.G310 helixtrans-68.6-27.9177.3-53.9-50.4000112.4S55 I59S55-D57 PolarHBondContact O-N 3.21Å; S55-D57 VanDerWaalsContact O-N 3.14Å; S55-D57 PolarHBondContact OG-N 3.1Å; S55-D57 PolarHBondContact OG-OD2 3.4Å; D57-I59 VanDerWaalsContact C-N 3.33Å; D57-I59 PolarHBondContact O-N 3.46Å
58F96.3Very high94.8Very high85 Ų8575.4 Ų75.437%0.37340%0.395SS..G310 helixtrans-94.927.1-177.9-64-36.9000112.9L54 S55 F56 D65L54-F58 HydrophobicContact CB-CB 4.27Å; S55-F58 PolarHBondContact O-N 3.37Å; S55-F58 VanDerWaalsContact O-N 3.15Å; F56-F58 VanDerWaalsContact C-N 3.29Å; F58-D65 HydrophobicContact CB-CB 4.41Å; F58-D65 VanDerWaalsContact CB-OD2 3.29Å; F58-D65 WeakPolarHBondContact CB-OD2 3.21Å
59I95.3Very high94.9Very high3 Ų373.3 Ų73.32%0.01539%0.393CS..SBendtrans-126.4120.8-178.5-52.1-69000106.6W45 L54 D57 D61 D71 M76 K80W45-I59 HydrophobicContact CD2-CD1 3.49Å; W45-I59 VanDerWaalsContact CD2-CD1 3.49Å; W45-I59 HydrophobicContact CD2-CG1 4.21Å; W45-I59 HydrophobicContact CE3-CD1 3.27Å; W45-I59 HydrophobicContact CE3-CG1 4.41Å; W45-I59 HydrophobicContact CG-CD1 4.07Å; W45-I59 HydrophobicContact CG-CG1 4.34Å; W45-I59 HydrophobicContact CH2-CD1 3.95Å; W45-I59 HydrophobicContact CZ2-CD1 4.2Å; W45-I59 HydrophobicContact CZ3-CD1 3.51Å; L54-I59 HydrophobicContact CB-CD1 3.94Å; L54-I59 HydrophobicContact CD1-CD1 3.6Å; L54-I59 HydrophobicContact CG-CD1 4.38Å; D57-I59 VanDerWaalsContact C-N 3.33Å; D57-I59 PolarHBondContact O-N 3.46Å; I59-D61 VanDerWaalsContact C-N 3.3Å; I59-D71 HydrophobicContact CD1-CB 3.77Å; I59-M76 HydrophobicContact CG2-CE 3.47Å; I59-M76 VanDerWaalsContact CG2-CE 3.47Å; I59-M76 HydrophobicContact CG2-SD 3.87Å; I59-K80 HydrophobicContact CB-CD 4.06Å; I59-K80 HydrophobicContact CG2-CD 3.61Å; I59-K80 PolarHBondContact O-NZ 3.25Å
60C94Very high95.1Very high34 Ų3473.8 Ų73.823%0.2339%0.389CS..SBendtrans60.539.2-175.4-450000112.6D71 E72 C77C60-D71 PolarHBondContact N-O 3.49Å; C60-E72 WeakPolarHBondContact CA-OE1 3.43Å; C60-E72 PolarHBondContact N-OE1 2.82Å; C60-C77 VanDerWaalsContact CA-SG 3.6Å; C60-C77 HydrophobicContact CB-CB 3.82Å; C60-C77 WeakPolarHBondContact CB-SG 3.48Å; C60-C77 WeakPolarHBondContact SG-CA 3.5Å; C60-C77 WeakPolarHBondContact SG-CB 3.3Å; C60-C77 CovalentContact SG-SG 2.02Å; C60-C77 PolarHBondContact SG-SG 2.93Å
61D94.2Very high95.3Very high74 Ų7469.1 Ų69.140%0.39636%0.358SS..SBendtrans-99.3-6176.274.1-6.6000112.6I59 E63 E72I59-D61 VanDerWaalsContact C-N 3.3Å; D61-E63 PolarHBondContact OD1-N 3.32Å; D61-E72 PolarHBondContact N-OE1 3.26Å
62G92.8Very high95.6Very high59 Ų5960 Ų6061%0.60833%0.326SS*.SBendtrans93.90.8178.500000114.4E72G62-E72 VanDerWaalsContact CA-OE2 3.27Å; G62-E72 WeakPolarHBondContact CA-OE2 3.3Å; G62-E72 PolarHBondContact N-OE2 3.43Å
63E96.9Very high95.5Very high134 Ų13459.8 Ų59.863%0.62633%0.325SS*.SBendtrans-114132.6175.3-64.9-169.1175.300110.4D61 D65 E72D61-E63 PolarHBondContact OD1-N 3.32Å; E63-D65 PolarHBondContact O-N 3.1Å; E63-E72 WeakPolarHBondContact O-CG 3.16Å
64P97Very high95.1Very high76 Ų7662.1 Ų62.149%0.49434%0.34SS..  trans-74.2110177.2-15.129000112.3E69P64-E69 HydrophobicContact CB-CB 4.11Å; P64-E69 HydrophobicContact CB-CG 3.77Å; P64-E69 HydrophobicContact CG-CG 4.28Å
65D97.1Very high94.7Very high57 Ų5769.2 Ų69.231%0.30537%0.373SS..  trans-101.1-27.7176.8-76.6-64.3000113.1L54 F58 E63 D71L54-D65 HydrophobicContact CD1-CB 3.63Å; L54-D65 HydrophobicContact CD2-CB 3.79Å; L54-D65 HydrophobicContact CG-CB 4.38Å; F58-D65 HydrophobicContact CB-CB 4.41Å; F58-D65 VanDerWaalsContact CB-OD2 3.29Å; F58-D65 WeakPolarHBondContact CB-OD2 3.21Å; E63-D65 PolarHBondContact O-N 3.1Å; D65-D71 WeakPolarHBondContact CA-OD2 3.23Å; D65-D71 WeakPolarHBondContact CB-OD2 3.39Å; D65-D71 PolarHBondContact N-OD2 3.01Å
66C97Very high94.4Very high5 Ų569 Ų693%0.03437%0.37CS..SBendtrans-83.5144.9166.7-63.10000111.2C47 D68 E69 D71C47-C66 HydrophobicContact CB-CB 3.87Å; C47-C66 WeakPolarHBondContact CB-SG 3.5Å; C47-C66 VanDerWaalsContact SG-CA 3.57Å; C47-C66 WeakPolarHBondContact SG-CB 3.47Å; C47-C66 CovalentContact SG-SG 2.04Å; C47-C66 PolarHBondContact SG-SG 2.84Å; C66-D68 WeakPolarHBondContact CB-OD1 3.45Å; C66-D68 PolarHBondContact O-N 2.79Å; C66-D68 VanDerWaalsContact O-N 3.08Å; C66-E69 PolarHBondContact O-N 2.94Å; C66-D71 WeakPolarHBondContact CB-OD1 3.43Å; C66-D71 PolarHBondContact N-OD1 2.83Å; C66-D71 PolarHBondContact N-OD2 3.45Å
67P95.8Very high94.3Very high88 Ų8864.3 Ų64.357%0.57135%0.351SS*.THydrogen-bonded Turntrans-60.4-22.2177.3-2533.9000115.2T49 I52T49-P67 HydrophobicContact CG2-CG 4.47Å; I52-P67 HydrophobicContact CD1-CG 3.39Å
68D94.9Very high94.1Very high68 Ų6859.1 Ų59.136%0.36432%0.324SS..THydrogen-bonded Turntrans-103.89.7176.764.3-30.1000113R48 C66 Y70R48-D68 WeakPolarHBondContact CB-OD2 3.33Å; R48-D68 WeakPolarHBondContact CD-OD2 3.31Å; C66-D68 WeakPolarHBondContact CB-OD1 3.45Å; C66-D68 PolarHBondContact O-N 2.79Å; C66-D68 VanDerWaalsContact O-N 3.08Å; D68-Y70 PolarHBondContact O-N 2.85Å; D68-Y70 VanDerWaalsContact O-N 3.08Å
69E96.1Very high93.7Very high119 Ų11958.5 Ų58.556%0.55633%0.334SS*.  trans56.621.4179.7-39-172.7166.300113.4P64 C66 D71 E72 D73P64-E69 HydrophobicContact CB-CB 4.11Å; P64-E69 HydrophobicContact CB-CG 3.77Å; P64-E69 HydrophobicContact CG-CG 4.28Å; C66-E69 PolarHBondContact O-N 2.94Å; E69-D71 VanDerWaalsContact C-OD1 3.24Å; E69-D71 WeakPolarHBondContact CA-OD1 3.44Å; E69-D71 PolarHBondContact O-N 3.33Å; E69-E72 PolarHBondContact O-N 3.06Å; E69-D73 PolarHBondContact O-N 3.4Å
70Y95.4Very high93.4Very high61 Ų6161.7 Ų61.724%0.23935%0.348CS..G310 helixtrans-64.3-30.8-175.8170.8-123000113.2W45 R48 D68 E72 D73 M76W45-Y70 AromaticContact CH2-CD1 3.31Å; W45-Y70 HydrophobicContact CH2-CD1 3.31Å; W45-Y70 AromaticContact CH2-CE1 3.34Å; W45-Y70 HydrophobicContact CH2-CE1 3.34Å; W45-Y70 HydrophobicContact CH2-CG 4.28Å; W45-Y70 HydrophobicContact CZ2-CD1 4.03Å; W45-Y70 AromaticContact CZ2-CE1 3.55Å; W45-Y70 HydrophobicContact CZ2-CE1 3.55Å; W45-Y70 HydrophobicContact CZ3-CD1 4.11Å; W45-Y70 HydrophobicContact CZ3-CE1 4.36Å; R48-Y70 HydrophobicContact CG-CD1 3.6Å; R48-Y70 HydrophobicContact CG-CE1 4.08Å; R48-Y70 HydrophobicContact CG-CG 3.84Å; R48-Y70 VanDerWaalsContact CZ-CD2 3.44Å; R48-Y70 VanDerWaalsContact NE-CG 3.34Å; D68-Y70 PolarHBondContact O-N 2.85Å; D68-Y70 VanDerWaalsContact O-N 3.08Å; Y70-E72 PolarHBondContact O-N 3.36Å; Y70-D73 HydrophobicContact CD2-CB 4.15Å; Y70-D73 WeakPolarHBondContact O-CB 3.49Å; Y70-D73 PolarHBondContact O-N 3.15Å; Y70-M76 HydrophobicContact CE2-CB 3.97Å; Y70-M76 HydrophobicContact CE2-CG 3.87Å; Y70-M76 WeakPolarHBondContact O-CE 3.31Å
71D95.9Very high93.3Very high0 Ų062.1 Ų62.10%035%0.348CS..G310 helixtrans-58.9-20.7170.754.4-53.6000113.8W45 L54 I59 C60 D65 C66 E69 M76W45-D71 HydrophobicContact CH2-CB 4.35Å; W45-D71 HydrophobicContact CZ3-CB 4.29Å; L54-D71 HydrophobicContact CD1-CB 3.91Å; I59-D71 HydrophobicContact CD1-CB 3.77Å; C60-D71 PolarHBondContact N-O 3.49Å; D65-D71 WeakPolarHBondContact CA-OD2 3.23Å; D65-D71 WeakPolarHBondContact CB-OD2 3.39Å; D65-D71 PolarHBondContact N-OD2 3.01Å; C66-D71 WeakPolarHBondContact CB-OD1 3.43Å; C66-D71 PolarHBondContact N-OD1 2.83Å; C66-D71 PolarHBondContact N-OD2 3.45Å; E69-D71 VanDerWaalsContact C-OD1 3.24Å; E69-D71 WeakPolarHBondContact CA-OD1 3.44Å; E69-D71 PolarHBondContact O-N 3.33Å; D71-M76 WeakPolarHBondContact O-CE 3.32Å
72E95.7Very high93.4Very high46 Ų4658.9 Ų58.922%0.21533%0.33CS..G310 helixtrans-110.38178.4-63.3-55.512200112.8C60 D61 G62 E63 E69 Y70 P74C60-E72 WeakPolarHBondContact CA-OE1 3.43Å; C60-E72 PolarHBondContact N-OE1 2.82Å; D61-E72 PolarHBondContact N-OE1 3.26Å; G62-E72 VanDerWaalsContact CA-OE2 3.27Å; G62-E72 WeakPolarHBondContact CA-OE2 3.3Å; G62-E72 PolarHBondContact N-OE2 3.43Å; E63-E72 WeakPolarHBondContact O-CG 3.16Å; E69-E72 PolarHBondContact O-N 3.06Å; Y70-E72 PolarHBondContact O-N 3.36Å; E72-P74 WeakPolarHBondContact O-CD 3.48Å
73D93.6Very high93.5Very high51 Ų5156.3 Ų56.327%0.27330%0.303SS..  trans-62.4126.9178.3176.6-93.2000111.2E69 Y70 E75 M76 C77E69-D73 PolarHBondContact O-N 3.4Å; Y70-D73 HydrophobicContact CD2-CB 4.15Å; Y70-D73 WeakPolarHBondContact O-CB 3.49Å; Y70-D73 PolarHBondContact O-N 3.15Å; D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 3.09Å; D73-E75 WeakPolarHBondContact OD1-CA 3.49Å; D73-E75 WeakPolarHBondContact OD1-CB 3.42Å; D73-E75 PolarHBondContact OD1-N 3.22Å; D73-M76 HydrophobicContact CB-CB 4Å; D73-M76 PolarHBondContact O-N 2.78Å; D73-M76 PolarHBondContact OD1-N 3.48Å; D73-C77 WeakPolarHBondContact O-CB 3.3Å; D73-C77 PolarHBondContact O-N 3.16Å; D73-C77 PolarHBondContact O-SG 3.32Å; D73-C77 VanDerWaalsContact O-SG 3.39Å
74P88.3Confident93.4Very high68 Ų6852.5 Ų52.544%0.44229%0.294SS..Hα-helixtrans-61.2-31.6-175.8-27.234.9000115.2E72 T78E72-P74 WeakPolarHBondContact O-CD 3.48Å; P74-T78 WeakPolarHBondContact O-CB 3.38Å; P74-T78 PolarHBondContact O-N 3.34Å; P74-T78 PolarHBondContact O-OG1 3.47Å
75E88.2Confident93.4Very high160 Ų16053 Ų5375%0.74829%0.29SS*.Hα-helixtrans-72.8-44.2178.3-60-173.8167.400110D73 T78 A79D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 3.09Å; D73-E75 WeakPolarHBondContact OD1-CA 3.49Å; D73-E75 WeakPolarHBondContact OD1-CB 3.42Å; D73-E75 PolarHBondContact OD1-N 3.22Å; E75-T78 PolarHBondContact O-N 3.3Å; E75-A79 PolarHBondContact O-N 3.34Å
76M90.5Very high93.4Very high21 Ų2158.1 Ų58.110%0.10331%0.312CS..Hα-helixtrans-60.5-46.2174.3-171.2-71.4-6500111.3W45 I59 Y70 D71 D73 T78 A79 K80W45-M76 HydrophobicContact CZ2-CE 4.29Å; W45-M76 HydrophobicContact CZ2-CG 4.31Å; W45-M76 HydrophobicContact CZ2-SD 4.04Å; I59-M76 HydrophobicContact CG2-CE 3.47Å; I59-M76 VanDerWaalsContact CG2-CE 3.47Å; I59-M76 HydrophobicContact CG2-SD 3.87Å; Y70-M76 HydrophobicContact CE2-CB 3.97Å; Y70-M76 HydrophobicContact CE2-CG 3.87Å; Y70-M76 WeakPolarHBondContact O-CE 3.31Å; D71-M76 WeakPolarHBondContact O-CE 3.32Å; D73-M76 HydrophobicContact CB-CB 4Å; D73-M76 PolarHBondContact O-N 2.78Å; D73-M76 PolarHBondContact OD1-N 3.48Å; M76-T78 VanDerWaalsContact C-N 3.34Å; M76-T78 PolarHBondContact O-N 2.92Å; M76-A79 WeakPolarHBondContact O-CB 3.44Å; M76-A79 PolarHBondContact O-N 2.78Å; M76-A79 VanDerWaalsContact O-N 3.09Å; M76-K80 PolarHBondContact O-N 3.3Å; M76-K80 HydrophobicContact SD-CB 4.41Å
77C92.4Very high93.5Very high16 Ų1664 Ų6411%0.10834%0.339CS..Hα-helixtrans-64.3-37.4178.6-70.90000113.6C60 D73 A79 K80 L81C60-C77 VanDerWaalsContact CA-SG 3.6Å; C60-C77 HydrophobicContact CB-CB 3.82Å; C60-C77 WeakPolarHBondContact CB-SG 3.48Å; C60-C77 WeakPolarHBondContact SG-CA 3.5Å; C60-C77 WeakPolarHBondContact SG-CB 3.3Å; C60-C77 CovalentContact SG-SG 2.02Å; C60-C77 PolarHBondContact SG-SG 2.93Å; D73-C77 WeakPolarHBondContact O-CB 3.3Å; D73-C77 PolarHBondContact O-N 3.16Å; D73-C77 PolarHBondContact O-SG 3.32Å; D73-C77 VanDerWaalsContact O-SG 3.39Å; C77-A79 VanDerWaalsContact C-N 3.35Å; C77-K80 PolarHBondContact O-N 2.72Å; C77-L81 WeakPolarHBondContact O-CB 3.44Å; C77-L81 VanDerWaalsContact O-CG 3.32Å; C77-L81 WeakPolarHBondContact O-CG 3.3Å; C77-L81 PolarHBondContact O-N 3.27Å
78T88.7Confident93.6Very high16 Ų1659.8 Ų59.810%0.09831%0.311CS..Hα-helixtrans-59-49.7170.9-580000109.8P74 E75 M76 K80 L81 R82P74-T78 WeakPolarHBondContact O-CB 3.38Å; P74-T78 PolarHBondContact O-N 3.34Å; P74-T78 PolarHBondContact O-OG1 3.47Å; E75-T78 PolarHBondContact O-N 3.3Å; M76-T78 VanDerWaalsContact C-N 3.34Å; M76-T78 PolarHBondContact O-N 2.92Å; T78-K80 PolarHBondContact O-N 3.01Å; T78-L81 PolarHBondContact O-N 3.13Å; T78-R82 HydrophobicContact CG2-CG 4Å; T78-R82 WeakPolarHBondContact O-CB 3.26Å; T78-R82 WeakPolarHBondContact O-CG 3.43Å; T78-R82 PolarHBondContact O-N 3.42Å
79A88.4Confident93.7Very high72 Ų7257 Ų5760%0.59530%0.297SS*.Hα-helixtrans-61.3-41.1179.500000113.3E75 M76 C77E75-A79 PolarHBondContact O-N 3.34Å; M76-A79 WeakPolarHBondContact O-CB 3.44Å; M76-A79 PolarHBondContact O-N 2.78Å; M76-A79 VanDerWaalsContact O-N 3.09Å; C77-A79 VanDerWaalsContact C-N 3.35Å
80K89.6Confident93.8Very high71 Ų7153 Ų5331%0.30929%0.289SS..Hα-helixtrans-63.5-47.8177.1176.5-175.7169.7-171.30112.1F56 I59 M76 C77 T78 R173F56-K80 PolarHBondContact O-NZ 2.86Å; I59-K80 HydrophobicContact CB-CD 4.06Å; I59-K80 HydrophobicContact CG2-CD 3.61Å; I59-K80 PolarHBondContact O-NZ 3.25Å; M76-K80 PolarHBondContact O-N 3.3Å; M76-K80 HydrophobicContact SD-CB 4.41Å; C77-K80 PolarHBondContact O-N 2.72Å; T78-K80 PolarHBondContact O-N 3.01Å; K80-R173 PolarHBondContact O-NH2 3.05Å; K80-R173 VanDerWaalsContact O-NH2 3.13Å
81L91.4Very high94Very high43 Ų4350.1 Ų50.123%0.22528%0.277CS..Hα-helixtrans-77.9-29-170.9-68.6172.8000112.3C77 T78 R173 I176C77-L81 WeakPolarHBondContact O-CB 3.44Å; C77-L81 VanDerWaalsContact O-CG 3.32Å; C77-L81 WeakPolarHBondContact O-CG 3.3Å; C77-L81 PolarHBondContact O-N 3.27Å; T78-L81 PolarHBondContact O-N 3.13Å; L81-R173 WeakPolarHBondContact O-CB 3.45Å; L81-R173 VanDerWaalsContact O-CZ 3.23Å; L81-R173 PolarHBondContact O-NH1 2.89Å; L81-R173 PolarHBondContact O-NH2 3.41Å; L81-I176 HydrophobicContact CD2-CD1 4.44Å
82R95.1Very high94.1Very high6 Ų650.1 Ų50.12%0.02328%0.277CS..SBendtrans-65.8147.4-179.9-67.9-78.4162.2126.211.2112T78 L116 V117 S119 K120 R173 S177 F179T78-R82 HydrophobicContact CG2-CG 4Å; T78-R82 WeakPolarHBondContact O-CB 3.26Å; T78-R82 WeakPolarHBondContact O-CG 3.43Å; T78-R82 PolarHBondContact O-N 3.42Å; R82-L116 PolarHBondContact NH1-O 3.15Å; R82-V117 HydrophobicContact CB-CG1 4.06Å; R82-S119 VanDerWaalsContact CZ-O 3.26Å; R82-S119 PolarHBondContact NH1-O 2.87Å; R82-S119 PolarHBondContact NH2-O 3.02Å; R82-K120 PolarHBondContact NH2-O 3.05Å; R82-R173 PolarHBondContact O-NH1 3.09Å; R82-S177 PolarHBondContact NE-OG 3.28Å; R82-S177 PolarHBondContact NH2-OG 2.75Å; R82-F179 VanDerWaalsContact NH1-CD2 3.26Å
83P95.4Very high94.2Very high5 Ų553.1 Ų53.13%0.03229%0.291CS..PPolyproline II helixtrans-64.8153171.129.1-34.6000111.1Q85 L88 V117 L170 I174P83-Q85 PolarHBondContact O-N 3.32Å; P83-L88 HydrophobicContact CG-CB 4.31Å; P83-L88 HydrophobicContact CG-CD1 4.41Å; P83-L88 HydrophobicContact CG-CD2 4.12Å; P83-V117 VanDerWaalsContact O-CG2 3.29Å; P83-V117 WeakPolarHBondContact O-CG2 3.14Å; P83-L170 HydrophobicContact CB-CD2 3.72Å; P83-I174 HydrophobicContact CG-CD1 4.25Å; P83-I174 HydrophobicContact CG-CG1 4.03Å
84A95.5Very high94.5Very high54 Ų5458.3 Ų58.345%0.44631%0.307SS..PPolyproline II helixtrans-57.3134.9171.100000110.1E86 H87 L88A84-E86 PolarHBondContact O-N 3.14Å; A84-H87 HydrophobicContact CB-CB 4.48Å; A84-H87 PolarHBondContact O-N 3.22Å; A84-H87 VanDerWaalsContact O-N 3.14Å; A84-L88 PolarHBondContact O-N 2.89Å
85Q96.3Very high94.9Very high86 Ų8656.8 Ų56.840%0.40229%0.293SS..Hα-helixtrans-54.6-41.6-177.1179.6-179.3-33.400111.9P83 L88 A89 A113 A114 V117P83-Q85 PolarHBondContact O-N 3.32Å; Q85-L88 PolarHBondContact O-N 3.47Å; Q85-A89 VanDerWaalsContact O-CB 3.28Å; Q85-A89 WeakPolarHBondContact O-CB 3.32Å; Q85-A89 PolarHBondContact O-N 2.97Å; Q85-A113 HydrophobicContact CG-CB 4.1Å; Q85-A114 HydrophobicContact CG-CB 4.47Å; Q85-V117 HydrophobicContact CB-CG2 4.37Å
86E97.6Very high95.4Very high164 Ų16452.9 Ų52.977%0.76627%0.274SS*.Hα-helixtrans-62.9-43.7-179.6-63.1179.8-175.200112.4A84 A89 G90A84-E86 PolarHBondContact O-N 3.14Å; E86-A89 PolarHBondContact O-N 3.43Å; E86-G90 PolarHBondContact O-N 3.5Å
87H97.7Very high95.7Very high129 Ų12959.4 Ų59.460%0.59731%0.31SS*.Hα-helixtrans-65-42.7177-68.8-179.2000111A84 G90 F91 L170A84-H87 HydrophobicContact CB-CB 4.48Å; A84-H87 PolarHBondContact O-N 3.22Å; A84-H87 VanDerWaalsContact O-N 3.14Å; H87-G90 PolarHBondContact O-N 2.8Å; H87-F91 PolarHBondContact O-N 3.21Å; H87-F91 VanDerWaalsContact O-N 3.1Å; H87-L170 HydrophobicContact CB-CD2 4.38Å
88L98Very high95.9Very high0 Ų059.5 Ų59.50%031%0.308CS..Hα-helixtrans-66.2-41.8177.9-173.661.5000111.8P83 A84 Q85 F91 I92 A113 L116 V117 L170 F171 I174P83-L88 HydrophobicContact CG-CB 4.31Å; P83-L88 HydrophobicContact CG-CD1 4.41Å; P83-L88 HydrophobicContact CG-CD2 4.12Å; A84-L88 PolarHBondContact O-N 2.89Å; Q85-L88 PolarHBondContact O-N 3.47Å; L88-F91 PolarHBondContact O-N 3.22Å; L88-I92 HydrophobicContact CD1-CD1 4.46Å; L88-I92 HydrophobicContact CG-CD1 4.05Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 3.4Å; L88-A113 HydrophobicContact CB-CB 4.13Å; L88-A113 HydrophobicContact CD2-CB 4.18Å; L88-A113 HydrophobicContact CG-CB 4.05Å; L88-L116 HydrophobicContact CD2-CB 3.65Å; L88-L116 HydrophobicContact CD2-CD1 3.88Å; L88-L116 HydrophobicContact CD2-CG 4.44Å; L88-L116 HydrophobicContact CG-CD1 4.47Å; L88-V117 HydrophobicContact CD2-CG2 4.05Å; L88-L170 HydrophobicContact CD1-CB 4.35Å; L88-L170 HydrophobicContact CD1-CD1 4.41Å; L88-F171 HydrophobicContact CD1-CD2 4.48Å; L88-F171 HydrophobicContact CD1-CE2 3.84Å; L88-F171 HydrophobicContact CD1-CZ 4.42Å; L88-I174 HydrophobicContact CD1-CD1 4.34Å; L88-I174 HydrophobicContact CD2-CD1 4.13Å
89A98.6Very high96.4Very high8 Ų858.7 Ų58.77%0.06630%0.303CS..Hα-helixtrans-62.2-43.2175.800000111.5Q85 E86 F91 I92 H93 E110 A113Q85-A89 VanDerWaalsContact O-CB 3.28Å; Q85-A89 WeakPolarHBondContact O-CB 3.32Å; Q85-A89 PolarHBondContact O-N 2.97Å; E86-A89 PolarHBondContact O-N 3.43Å; A89-F91 VanDerWaalsContact C-N 3.34Å; A89-F91 PolarHBondContact O-N 3.22Å; A89-I92 PolarHBondContact O-N 3.02Å; A89-H93 WeakPolarHBondContact O-CB 3.31Å; A89-H93 PolarHBondContact O-N 2.85Å; A89-E110 HydrophobicContact CB-CG 4.42Å; A89-A113 HydrophobicContact CB-CB 3.78Å
90G98.5Very high96.9Very high36 Ų3657 Ų5737%0.37129%0.285SS..Hα-helixtrans-59.2-42.6175.300000112.9E86 H87 H93 R94E86-G90 PolarHBondContact O-N 3.5Å; H87-G90 PolarHBondContact O-N 2.8Å; G90-H93 PolarHBondContact O-N 2.96Å; G90-R94 PolarHBondContact O-N 3.09Å; G90-R94 VanDerWaalsContact O-N 3.1Å
91F98.4Very high97.2Very high0 Ų055.9 Ų55.90%029%0.285CS..Hα-helixtrans-63.8-47.6173.9174.7-97000112.2H87 L88 A89 H93 R94 Y95 L99 E166 L167 L170 F171H87-F91 PolarHBondContact O-N 3.21Å; H87-F91 VanDerWaalsContact O-N 3.1Å; L88-F91 PolarHBondContact O-N 3.22Å; A89-F91 VanDerWaalsContact C-N 3.34Å; A89-F91 PolarHBondContact O-N 3.22Å; F91-H93 VanDerWaalsContact C-N 3.29Å; F91-H93 PolarHBondContact O-N 2.78Å; F91-R94 PolarHBondContact O-N 3.22Å; F91-Y95 AromaticContact CD2-CD2 3.58Å; F91-Y95 HydrophobicContact CD2-CD2 3.58Å; F91-Y95 AromaticContact CD2-CE2 3.71Å; F91-Y95 HydrophobicContact CD2-CE2 3.71Å; F91-Y95 HydrophobicContact CE1-CD2 4.38Å; F91-Y95 AromaticContact CE2-CD2 3.26Å; F91-Y95 HydrophobicContact CE2-CD2 3.26Å; F91-Y95 AromaticContact CE2-CE2 3.38Å; F91-Y95 HydrophobicContact CE2-CE2 3.38Å; F91-Y95 HydrophobicContact CE2-CG 4.45Å; F91-Y95 HydrophobicContact CG-CD2 4.29Å; F91-Y95 AromaticContact CZ-CD2 3.69Å; F91-Y95 HydrophobicContact CZ-CD2 3.69Å; F91-Y95 HydrophobicContact CZ-CE2 4.2Å; F91-Y95 PolarHBondContact O-N 2.93Å; F91-Y95 VanDerWaalsContact O-N 3.08Å; F91-L99 HydrophobicContact CD1-CD1 4.14Å; F91-L99 HydrophobicContact CE1-CD1 3.66Å; F91-L99 HydrophobicContact CZ-CD1 4.48Å; F91-E166 HydrophobicContact CD2-CB 3.97Å; F91-E166 HydrophobicContact CD2-CG 3.57Å; F91-E166 HydrophobicContact CE2-CB 4.03Å; F91-E166 HydrophobicContact CE2-CG 4.16Å; F91-E166 HydrophobicContact CG-CG 4.47Å; F91-L167 HydrophobicContact CE1-CD1 3.66Å; F91-L167 HydrophobicContact CE2-CB 4.02Å; F91-L167 HydrophobicContact CZ-CB 3.63Å; F91-L167 HydrophobicContact CZ-CD1 3.47Å; F91-L167 VanDerWaalsContact CZ-CD1 3.47Å; F91-L167 HydrophobicContact CZ-CG 4.14Å; F91-L170 HydrophobicContact CB-CD1 3.4Å; F91-L170 VanDerWaalsContact CB-CD1 3.4Å; F91-L170 HydrophobicContact CD1-CD1 4.19Å; F91-L170 HydrophobicContact CD2-CD1 4.04Å; F91-L170 HydrophobicContact CG-CD1 3.61Å; F91-F171 AromaticContact CD1-CE2 3.79Å; F91-F171 HydrophobicContact CD1-CE2 3.79Å; F91-F171 HydrophobicContact CE1-CD2 4.24Å; F91-F171 AromaticContact CE1-CE2 3.53Å; F91-F171 HydrophobicContact CE1-CE2 3.53Å; F91-F171 HydrophobicContact CE1-CZ 4.24Å
92I98.6Very high97.5Very high0 Ų058.3 Ų58.30%029%0.294CS..Hα-helixtrans-61.2-41.5178.7-66.9167.6000110.4L88 A89 R94 Y95 Q96 L99 V100 L104 P109 L112 A113 L116L88-I92 HydrophobicContact CD1-CD1 4.46Å; L88-I92 HydrophobicContact CG-CD1 4.05Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 3.4Å; A89-I92 PolarHBondContact O-N 3.02Å; I92-R94 PolarHBondContact O-N 3.21Å; I92-Y95 CarbonylContact O-C 3.54Å; I92-Y95 PolarHBondContact O-N 3.3Å; I92-Q96 WeakPolarHBondContact O-CA 3.38Å; I92-Q96 VanDerWaalsContact O-CB 3.3Å; I92-Q96 WeakPolarHBondContact O-CB 3.46Å; I92-Q96 PolarHBondContact O-N 3.47Å; I92-L99 HydrophobicContact CG1-CD1 4.35Å; I92-V100 HydrophobicContact CG2-CG2 4.01Å; I92-L104 HydrophobicContact CD1-CD1 3.77Å; I92-L104 HydrophobicContact CG1-CD1 3.83Å; I92-L104 HydrophobicContact CG2-CD1 4.17Å; I92-P109 HydrophobicContact CB-CB 4.06Å; I92-P109 HydrophobicContact CG2-CB 3.81Å; I92-P109 HydrophobicContact CG2-CG 4.23Å; I92-L112 HydrophobicContact CD1-CB 4.39Å; I92-A113 HydrophobicContact CD1-CB 4.04Å; I92-L116 HydrophobicContact CD1-CD1 4.06Å
93H98.3Very high97.6Very high110 Ų11058 Ų5851%0.50929%0.293SS..Hα-helixtrans-59.1-46.2176.5-179.185.3000111.8A89 G90 F91 Y95 Q96 P109A89-H93 WeakPolarHBondContact O-CB 3.31Å; A89-H93 PolarHBondContact O-N 2.85Å; G90-H93 PolarHBondContact O-N 2.96Å; F91-H93 VanDerWaalsContact C-N 3.29Å; F91-H93 PolarHBondContact O-N 2.78Å; H93-Y95 PolarHBondContact O-N 3.27Å; H93-Q96 WeakPolarHBondContact O-CG 3.47Å; H93-Q96 PolarHBondContact O-NE2 3.22Å; H93-P109 HydrophobicContact CB-CB 4.06Å; H93-P109 HydrophobicContact CB-CG 3.96Å
94R98.2Very high97.8Very high159 Ų15957.8 Ų57.860%0.629%0.291SS*.Hα-helixtrans-62.5-40179.8-168.9-171.4-52.6-72-2.3112.5G90 F91 I92 E166G90-R94 PolarHBondContact O-N 3.09Å; G90-R94 VanDerWaalsContact O-N 3.1Å; F91-R94 PolarHBondContact O-N 3.22Å; I92-R94 PolarHBondContact O-N 3.21Å; R94-E166 IonicContact NE-OE2 3.65Å
95Y98Very high97.9Very high37 Ų3755.2 Ų55.215%0.14527%0.27CS..THydrogen-bonded Turntrans-11123.9-175.5-60.2-65.1000113.9F91 I92 H93 N97 W98 L99 P160 A163F91-Y95 AromaticContact CD2-CD2 3.58Å; F91-Y95 HydrophobicContact CD2-CD2 3.58Å; F91-Y95 AromaticContact CD2-CE2 3.71Å; F91-Y95 HydrophobicContact CD2-CE2 3.71Å; F91-Y95 HydrophobicContact CE1-CD2 4.38Å; F91-Y95 AromaticContact CE2-CD2 3.26Å; F91-Y95 HydrophobicContact CE2-CD2 3.26Å; F91-Y95 AromaticContact CE2-CE2 3.38Å; F91-Y95 HydrophobicContact CE2-CE2 3.38Å; F91-Y95 HydrophobicContact CE2-CG 4.45Å; F91-Y95 HydrophobicContact CG-CD2 4.29Å; F91-Y95 AromaticContact CZ-CD2 3.69Å; F91-Y95 HydrophobicContact CZ-CD2 3.69Å; F91-Y95 HydrophobicContact CZ-CE2 4.2Å; F91-Y95 PolarHBondContact O-N 2.93Å; F91-Y95 VanDerWaalsContact O-N 3.08Å; I92-Y95 CarbonylContact O-C 3.54Å; I92-Y95 PolarHBondContact O-N 3.3Å; H93-Y95 PolarHBondContact O-N 3.27Å; Y95-N97 VanDerWaalsContact C-N 3.28Å; Y95-N97 PolarHBondContact O-N 2.97Å; Y95-W98 PolarHBondContact O-N 3.27Å; Y95-L99 PolarHBondContact O-N 2.94Å; Y95-P160 HydrophobicContact CD1-CB 4.11Å; Y95-P160 HydrophobicContact CD1-CG 3.82Å; Y95-P160 HydrophobicContact CE1-CB 4.02Å; Y95-P160 HydrophobicContact CE1-CG 4.26Å; Y95-A163 HydrophobicContact CD1-CB 4.15Å; Y95-A163 HydrophobicContact CD2-CB 4.27Å; Y95-A163 HydrophobicContact CE1-CB 3.66Å; Y95-A163 HydrophobicContact CE2-CB 3.79Å; Y95-A163 HydrophobicContact CG-CB 4.42Å; Y95-A163 VanDerWaalsContact CZ-CB 3.46Å; Y95-A163 WeakPolarHBondContact OH-CA 3.4Å
96Q97.6Very high97.9Very high78 Ų7859.3 Ų59.336%0.36428%0.283SS..Hα-helixtrans-57.2-39.1-174.366.4-173.4-66.700112.8I92 H93 W98 L99 V100I92-Q96 WeakPolarHBondContact O-CA 3.38Å; I92-Q96 VanDerWaalsContact O-CB 3.3Å; I92-Q96 WeakPolarHBondContact O-CB 3.46Å; I92-Q96 PolarHBondContact O-N 3.47Å; H93-Q96 WeakPolarHBondContact O-CG 3.47Å; H93-Q96 PolarHBondContact O-NE2 3.22Å; Q96-W98 PolarHBondContact O-N 3.35Å; Q96-W98 VanDerWaalsContact O-N 3.12Å; Q96-L99 PolarHBondContact O-N 3.14Å; Q96-V100 WeakPolarHBondContact O-CA 3.36Å; Q96-V100 WeakPolarHBondContact O-CB 2.9Å; Q96-V100 PolarHBondContact O-N 3.23Å; Q96-V100 VanDerWaalsContact O-O 3.06Å
97N97.3Very high97.9Very high158 Ų15852.9 Ų52.985%0.84526%0.261SS*.Hα-helixtrans-62.1-24.2-179.8-67.8-17.6000113Y95Y95-N97 VanDerWaalsContact C-N 3.28Å; Y95-N97 PolarHBondContact O-N 2.97Å
98W97.5Very high98Very high17 Ų1749.4 Ų49.46%0.06425%0.249CC..Hα-helixtrans-93.2-43.2176.2171.350.5000111.8Y95 Q96 F103 L142 L157 G158 M159 P160 L167Y95-W98 PolarHBondContact O-N 3.27Å; Q96-W98 PolarHBondContact O-N 3.35Å; Q96-W98 VanDerWaalsContact O-N 3.12Å; W98-F103 AromaticContact CD1-CE2 3.84Å; W98-F103 AromaticContact CE2-CE2 3.97Å; W98-F103 HydrophobicContact CZ2-CZ 4.44Å; W98-F103 AromaticContact NE1-CE2 3.44Å; W98-F103 AromaticContact NE1-CZ 3.72Å; W98-F103 VanDerWaalsContact O-CD2 3.3Å; W98-F103 WeakPolarHBondContact O-CD2 2.92Å; W98-F103 VanDerWaalsContact O-CE2 3.31Å; W98-F103 WeakPolarHBondContact O-CE2 3.33Å; W98-L142 HydrophobicContact CH2-CD1 3.99Å; W98-L142 HydrophobicContact CZ2-CD1 4.14Å; W98-L157 PolarHBondContact NE1-O 3Å; W98-G158 PolarHBondContact NE1-O 3.45Å; W98-M159 HydrophobicContact CE3-CG 4.4Å; W98-M159 HydrophobicContact CH2-CB 3.5Å; W98-M159 VanDerWaalsContact CH2-CB 3.5Å; W98-M159 HydrophobicContact CH2-CG 3.44Å; W98-M159 VanDerWaalsContact CH2-CG 3.44Å; W98-M159 HydrophobicContact CH2-SD 4Å; W98-M159 VanDerWaalsContact CZ2-CA 3.42Å; W98-M159 HydrophobicContact CZ2-CB 3.43Å; W98-M159 VanDerWaalsContact CZ2-CB 3.43Å; W98-M159 HydrophobicContact CZ2-CG 3.95Å; W98-M159 HydrophobicContact CZ3-CB 4.1Å; W98-M159 HydrophobicContact CZ3-CG 3.7Å; W98-M159 HydrophobicContact CZ3-SD 4.47Å; W98-P160 HydrophobicContact CB-CG 4.22Å; W98-P160 VanDerWaalsContact CE3-CD 3.43Å; W98-P160 HydrophobicContact CE3-CG 4.46Å; W98-P160 HydrophobicContact CG-CG 4.48Å; W98-L167 HydrophobicContact CH2-CD1 4.46Å; W98-L167 HydrophobicContact CH2-CD2 3.78Å; W98-L167 HydrophobicContact CZ3-CD1 4.4Å; W98-L167 HydrophobicContact CZ3-CD2 4.23Å
99L98.2Very high98Very high0 Ų050.2 Ų50.20%025%0.254CS..Hα-helixtrans-81.9-38.3-173-69.3169.4000113.8F91 I92 Y95 Q96 K102 F103 L104 L142F91-L99 HydrophobicContact CD1-CD1 4.14Å; F91-L99 HydrophobicContact CE1-CD1 3.66Å; F91-L99 HydrophobicContact CZ-CD1 4.48Å; I92-L99 HydrophobicContact CG1-CD1 4.35Å; Y95-L99 PolarHBondContact O-N 2.94Å; Q96-L99 PolarHBondContact O-N 3.14Å; L99-K102 PolarHBondContact O-N 3.36Å; L99-F103 HydrophobicContact CD2-CD2 4.47Å; L99-F103 PolarHBondContact O-N 2.92Å; L99-L104 HydrophobicContact CB-CD1 4.03Å; L99-L104 HydrophobicContact CB-CG 4.3Å; L99-L104 HydrophobicContact CD1-CD1 4.39Å; L99-L104 PolarHBondContact O-N 3.48Å; L99-L104 VanDerWaalsContact O-N 3.13Å; L99-L142 HydrophobicContact CD2-CD2 4.16Å
100V98.3Very high98Very high35 Ų3554.3 Ų54.321%0.21227%0.272CS..THydrogen-bonded Turntrans-115125.7-167.2-177.60000109.7I92 Q96 L104 G105 L112I92-V100 HydrophobicContact CG2-CG2 4.01Å; Q96-V100 WeakPolarHBondContact O-CA 3.36Å; Q96-V100 WeakPolarHBondContact O-CB 2.9Å; Q96-V100 PolarHBondContact O-N 3.23Å; Q96-V100 VanDerWaalsContact O-O 3.06Å; V100-L104 HydrophobicContact CG2-CB 4.39Å; V100-G105 WeakPolarHBondContact CG1-O 3.39Å; V100-L112 HydrophobicContact CG1-CD1 4.17Å; V100-L112 HydrophobicContact CG2-CD1 3.63Å
101P97.7Very high98Very high49 Ų4957.1 Ų57.132%0.31828%0.275SS..THydrogen-bonded Turncis-90.35.3-0.537.9-36.6000113.5F103 G105 Y106 Q135P101-F103 VanDerWaalsContact C-N 3.33Å; P101-F103 PolarHBondContact O-N 3.46Å; P101-G105 VanDerWaalsContact CA-O 3.26Å; P101-G105 WeakPolarHBondContact CA-O 3.42Å; P101-G105 WeakPolarHBondContact CB-O 3.41Å; P101-G105 PolarHBondContact O-N 3.33Å; P101-Y106 HydrophobicContact CB-CD1 3.79Å; P101-Y106 HydrophobicContact CB-CD2 4.41Å; P101-Y106 HydrophobicContact CB-CE1 3.71Å; P101-Y106 HydrophobicContact CB-CE2 4.35Å; P101-Y106 HydrophobicContact CB-CG 4.15Å; P101-Y106 HydrophobicContact CG-CD1 4.29Å; P101-Y106 HydrophobicContact CG-CE1 3.77Å; P101-Q135 WeakPolarHBondContact O-CG 3.46Å; P101-Q135 PolarHBondContact O-NE2 3.37Å
102K97.2Very high98Very high93 Ų9357.1 Ų57.140%0.40428%0.275SS..THydrogen-bonded Turntrans-58.6-37.9-164.6-177.3177.3173.5-169.30114.2L99 N138 L157L99-K102 PolarHBondContact O-N 3.36Å; K102-N138 WeakPolarHBondContact O-CB 3.32Å; K102-N138 PolarHBondContact O-ND2 3.25Å; K102-L157 PolarHBondContact NZ-O 2.7Å
103F97.4Very high98Very high0 Ų057.1 Ų57.10%028%0.275CS..THydrogen-bonded Turntrans-113.6-46.1-178.1-60.4-95.4000111.3W98 L99 P101 N138 L142 L157W98-F103 AromaticContact CD1-CE2 3.84Å; W98-F103 AromaticContact CE2-CE2 3.97Å; W98-F103 HydrophobicContact CZ2-CZ 4.44Å; W98-F103 AromaticContact NE1-CE2 3.44Å; W98-F103 AromaticContact NE1-CZ 3.72Å; W98-F103 VanDerWaalsContact O-CD2 3.3Å; W98-F103 WeakPolarHBondContact O-CD2 2.92Å; W98-F103 VanDerWaalsContact O-CE2 3.31Å; W98-F103 WeakPolarHBondContact O-CE2 3.33Å; L99-F103 HydrophobicContact CD2-CD2 4.47Å; L99-F103 PolarHBondContact O-N 2.92Å; P101-F103 VanDerWaalsContact C-N 3.33Å; P101-F103 PolarHBondContact O-N 3.46Å; F103-N138 HydrophobicContact CD1-CB 3.68Å; F103-N138 VanDerWaalsContact CD1-O 3.32Å; F103-N138 WeakPolarHBondContact CD1-O 3.49Å; F103-N138 HydrophobicContact CE1-CB 3.96Å; F103-N138 HydrophobicContact CG-CB 4.3Å; F103-L142 HydrophobicContact CB-CD2 4.32Å; F103-L142 HydrophobicContact CD1-CB 3.8Å; F103-L142 HydrophobicContact CD1-CD2 3.98Å; F103-L142 HydrophobicContact CD1-CG 4.41Å; F103-L142 HydrophobicContact CE1-CB 4.02Å; F103-L142 HydrophobicContact CG-CD2 4.26Å; F103-L157 HydrophobicContact CZ-CB 4.23Å
104L98.2Very high98Very high0 Ų052.6 Ų52.60%026%0.257CS..THydrogen-bonded Turntrans-94.4-6.3-167.1-61.5-174.1000114.4I92 L99 V100 L112 L116 Y125 L131 L139I92-L104 HydrophobicContact CD1-CD1 3.77Å; I92-L104 HydrophobicContact CG1-CD1 3.83Å; I92-L104 HydrophobicContact CG2-CD1 4.17Å; L99-L104 HydrophobicContact CB-CD1 4.03Å; L99-L104 HydrophobicContact CB-CG 4.3Å; L99-L104 HydrophobicContact CD1-CD1 4.39Å; L99-L104 PolarHBondContact O-N 3.48Å; L99-L104 VanDerWaalsContact O-N 3.13Å; V100-L104 HydrophobicContact CG2-CB 4.39Å; L104-L112 HydrophobicContact CB-CD1 3.94Å; L104-L112 WeakPolarHBondContact O-CD2 3.47Å; L104-L116 HydrophobicContact CD1-CD1 4.26Å; L104-L116 HydrophobicContact CD2-CD1 3.98Å; L104-L116 HydrophobicContact CD2-CD2 4.48Å; L104-Y125 WeakPolarHBondContact CB-OH 3.39Å; L104-Y125 HydrophobicContact CD2-CE1 4.49Å; L104-Y125 PolarHBondContact O-OH 2.96Å; L104-L131 WeakPolarHBondContact O-CD2 3.49Å; L104-L139 HydrophobicContact CD2-CD1 4.04Å
105G97.7Very high98Very high0 Ų047.3 Ų47.30%024%0.238CC..  trans87.2-172-175.100000112.9V100 P101V100-G105 WeakPolarHBondContact CG1-O 3.39Å; P101-G105 VanDerWaalsContact CA-O 3.26Å; P101-G105 WeakPolarHBondContact CA-O 3.42Å; P101-G105 WeakPolarHBondContact CB-O 3.41Å; P101-G105 PolarHBondContact O-N 3.33Å
106Y97.8Very high97.9Very high172 Ų17245.5 Ų45.568%0.67523%0.231SC*.SBendtrans-90.2137.7178-61.5-86.3000110.4P101P101-Y106 HydrophobicContact CB-CD1 3.79Å; P101-Y106 HydrophobicContact CB-CD2 4.41Å; P101-Y106 HydrophobicContact CB-CE1 3.71Å; P101-Y106 HydrophobicContact CB-CE2 4.35Å; P101-Y106 HydrophobicContact CB-CG 4.15Å; P101-Y106 HydrophobicContact CG-CD1 4.29Å; P101-Y106 HydrophobicContact CG-CE1 3.77Å
107G97.6Very high97.9Very high30 Ų3043.2 Ų43.231%0.30922%0.223SC..SBendtrans155.5172.3178.400000111.4E111G107-E111 VanDerWaalsContact CA-OE2 3.31Å; G107-E111 WeakPolarHBondContact CA-OE2 3.49Å
108T98.3Very high97.7Very high56 Ų5642.5 Ų42.534%0.34421%0.214SC..  trans-75.9158.7171.882.80000110.9E110 E111 L112T108-E110 VanDerWaalsContact CB-OE2 3.31Å; T108-E110 WeakPolarHBondContact CB-OE2 3.47Å; T108-E110 PolarHBondContact O-N 3.14Å; T108-E110 PolarHBondContact OG1-N 2.95Å; T108-E110 PolarHBondContact OG1-OE2 3.18Å; T108-E111 HydrophobicContact CG2-CG 4.46Å; T108-E111 PolarHBondContact N-OE2 3.42Å; T108-E111 PolarHBondContact O-N 2.93Å; T108-E111 WeakPolarHBondContact OG1-CG 3.39Å; T108-E111 PolarHBondContact OG1-N 3.37Å; T108-L112 VanDerWaalsContact O-CG 3.32Å; T108-L112 WeakPolarHBondContact O-CG 3.5Å; T108-L112 PolarHBondContact O-N 3.46Å
109P98.5Very high97.5Very high16 Ų1642.2 Ų42.210%0.10421%0.214CC..Hα-helixtrans-51.1-39.1173.2-29.137.4000113.7I92 H93 A113I92-P109 HydrophobicContact CB-CB 4.06Å; I92-P109 HydrophobicContact CG2-CB 3.81Å; I92-P109 HydrophobicContact CG2-CG 4.23Å; H93-P109 HydrophobicContact CB-CB 4.06Å; H93-P109 HydrophobicContact CB-CG 3.96Å; P109-A113 WeakPolarHBondContact O-CB 3.41Å; P109-A113 PolarHBondContact O-N 2.89Å
110E98.6Very high97.1Very high94 Ų9447.2 Ų47.244%0.43924%0.236SC..Hα-helixtrans-68.9-45.5179.7-58.170.4-151.100111.4A89 T108 L112 A113 A114A89-E110 HydrophobicContact CB-CG 4.42Å; T108-E110 VanDerWaalsContact CB-OE2 3.31Å; T108-E110 WeakPolarHBondContact CB-OE2 3.47Å; T108-E110 PolarHBondContact O-N 3.14Å; T108-E110 PolarHBondContact OG1-N 2.95Å; T108-E110 PolarHBondContact OG1-OE2 3.18Å; E110-L112 PolarHBondContact O-N 2.98Å; E110-A113 PolarHBondContact O-N 3.36Å; E110-A114 WeakPolarHBondContact O-CB 3.49Å; E110-A114 PolarHBondContact O-N 3.26Å
111E98.5Very high96.8Very high96 Ų9646.5 Ų46.545%0.44923%0.232SC..Hα-helixtrans-63.6-41177.8-70.1175.5160.100112.2G107 T108 K115G107-E111 VanDerWaalsContact CA-OE2 3.31Å; G107-E111 WeakPolarHBondContact CA-OE2 3.49Å; T108-E111 HydrophobicContact CG2-CG 4.46Å; T108-E111 PolarHBondContact N-OE2 3.42Å; T108-E111 PolarHBondContact O-N 2.93Å; T108-E111 WeakPolarHBondContact OG1-CG 3.39Å; T108-E111 PolarHBondContact OG1-N 3.37Å; E111-K115 WeakPolarHBondContact O-CD 3.33Å; E111-K115 VanDerWaalsContact O-CG 3.26Å; E111-K115 WeakPolarHBondContact O-CG 3.46Å; E111-K115 PolarHBondContact O-N 3.49Å
112L98.6Very high96.6Very high0 Ų044.2 Ų44.20%022%0.217CC..Hα-helixtrans-73.7-38.9179.9-63.8176.1000111.2I92 V100 L104 T108 E110 K115 L116 A129I92-L112 HydrophobicContact CD1-CB 4.39Å; V100-L112 HydrophobicContact CG1-CD1 4.17Å; V100-L112 HydrophobicContact CG2-CD1 3.63Å; L104-L112 HydrophobicContact CB-CD1 3.94Å; L104-L112 WeakPolarHBondContact O-CD2 3.47Å; T108-L112 VanDerWaalsContact O-CG 3.32Å; T108-L112 WeakPolarHBondContact O-CG 3.5Å; T108-L112 PolarHBondContact O-N 3.46Å; E110-L112 PolarHBondContact O-N 2.98Å; L112-K115 PolarHBondContact O-N 3.22Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 2.87Å; L112-A129 HydrophobicContact CD2-CB 4.42Å
113A98.5Very high96.2Very high0 Ų040.4 Ų40.40%020%0.202CC..Hα-helixtrans-61.5-46.9173.200000111.7Q85 L88 A89 I92 P109 E110 K115 L116 V117Q85-A113 HydrophobicContact CG-CB 4.1Å; L88-A113 HydrophobicContact CB-CB 4.13Å; L88-A113 HydrophobicContact CD2-CB 4.18Å; L88-A113 HydrophobicContact CG-CB 4.05Å; A89-A113 HydrophobicContact CB-CB 3.78Å; I92-A113 HydrophobicContact CD1-CB 4.04Å; P109-A113 WeakPolarHBondContact O-CB 3.41Å; P109-A113 PolarHBondContact O-N 2.89Å; E110-A113 PolarHBondContact O-N 3.36Å; A113-K115 PolarHBondContact O-N 3.42Å; A113-L116 PolarHBondContact O-N 3.3Å; A113-V117 WeakPolarHBondContact O-CG2 3.36Å; A113-V117 PolarHBondContact O-N 2.87Å
114A98.1Very high95.9Very high15 Ų1542.7 Ų42.712%0.12422%0.215CC..Hα-helixtrans-55.6-51.4176.800000110.8Q85 E110 L116 V117 E118Q85-A114 HydrophobicContact CG-CB 4.47Å; E110-A114 WeakPolarHBondContact O-CB 3.49Å; E110-A114 PolarHBondContact O-N 3.26Å; A114-L116 VanDerWaalsContact C-N 3.32Å; A114-L116 PolarHBondContact O-N 2.93Å; A114-V117 PolarHBondContact O-N 2.9Å; A114-V117 VanDerWaalsContact O-N 3.07Å; A114-E118 WeakPolarHBondContact O-CB 3.29Å; A114-E118 VanDerWaalsContact O-CG 3.28Å; A114-E118 WeakPolarHBondContact O-CG 3.39Å; A114-E118 PolarHBondContact O-N 3.26Å
115K97.9Very high95.7Very high47 Ų4742.7 Ų42.720%0.20422%0.215CC..Hα-helixtrans-59.1-41.1177.1-69.9165.5-173.81450112.4E111 L112 A113 V117 S119 Y125 A128 A129E111-K115 WeakPolarHBondContact O-CD 3.33Å; E111-K115 VanDerWaalsContact O-CG 3.26Å; E111-K115 WeakPolarHBondContact O-CG 3.46Å; E111-K115 PolarHBondContact O-N 3.49Å; L112-K115 PolarHBondContact O-N 3.22Å; A113-K115 PolarHBondContact O-N 3.42Å; K115-V117 VanDerWaalsContact C-N 3.32Å; K115-S119 WeakPolarHBondContact O-CB 3.29Å; K115-S119 PolarHBondContact O-N 3.03Å; K115-S119 PolarHBondContact O-OG 2.69Å; K115-Y125 HydrophobicContact CB-CD2 3.87Å; K115-Y125 HydrophobicContact CB-CE2 3.68Å; K115-A128 HydrophobicContact CB-CB 4.43Å; K115-A128 HydrophobicContact CD-CB 4.28Å; K115-A128 WeakPolarHBondContact CE-O 3.28Å; K115-A128 HydrophobicContact CG-CB 4.06Å; K115-A129 HydrophobicContact CD-CB 4.14Å
116L97.5Very high95.6Very high0 Ų043.4 Ų43.40%022%0.22CC..Hα-helixtrans-65.8-33.5176.9-83.2173.8000112.3R82 L88 I92 L104 L112 A113 A114 Y125 F171 I174 F179R82-L116 PolarHBondContact NH1-O 3.15Å; L88-L116 HydrophobicContact CD2-CB 3.65Å; L88-L116 HydrophobicContact CD2-CD1 3.88Å; L88-L116 HydrophobicContact CD2-CG 4.44Å; L88-L116 HydrophobicContact CG-CD1 4.47Å; I92-L116 HydrophobicContact CD1-CD1 4.06Å; L104-L116 HydrophobicContact CD1-CD1 4.26Å; L104-L116 HydrophobicContact CD2-CD1 3.98Å; L104-L116 HydrophobicContact CD2-CD2 4.48Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 2.87Å; A113-L116 PolarHBondContact O-N 3.3Å; A114-L116 VanDerWaalsContact C-N 3.32Å; A114-L116 PolarHBondContact O-N 2.93Å; L116-Y125 HydrophobicContact CB-CD2 4.43Å; L116-Y125 HydrophobicContact CB-CE2 4.2Å; L116-Y125 HydrophobicContact CD2-CD1 4.38Å; L116-Y125 HydrophobicContact CD2-CD2 3.67Å; L116-Y125 HydrophobicContact CD2-CE1 4.3Å; L116-Y125 HydrophobicContact CD2-CE2 3.57Å; L116-Y125 HydrophobicContact CD2-CG 4.08Å; L116-Y125 HydrophobicContact CG-CD2 3.91Å; L116-Y125 HydrophobicContact CG-CE2 3.42Å; L116-Y125 VanDerWaalsContact CG-CE2 3.42Å; L116-F171 HydrophobicContact CD1-CZ 4.4Å; L116-I174 HydrophobicContact CB-CD1 4.5Å; L116-F179 HydrophobicContact CD2-CZ 3.97Å
117V96.3Very high95.2Very high30 Ų3041 Ų4118%0.18221%0.21CC..Hα-helixtrans-75.7-43.8177.3171.70000110.8R82 P83 Q85 L88 A113 A114 K115R82-V117 HydrophobicContact CB-CG1 4.06Å; P83-V117 VanDerWaalsContact O-CG2 3.29Å; P83-V117 WeakPolarHBondContact O-CG2 3.14Å; Q85-V117 HydrophobicContact CB-CG2 4.37Å; L88-V117 HydrophobicContact CD2-CG2 4.05Å; A113-V117 WeakPolarHBondContact O-CG2 3.36Å; A113-V117 PolarHBondContact O-N 2.87Å; A114-V117 PolarHBondContact O-N 2.9Å; A114-V117 VanDerWaalsContact O-N 3.07Å; K115-V117 VanDerWaalsContact C-N 3.32Å
118E93.4Very high95Very high143 Ų14341.8 Ų41.867%0.66821%0.213SC*.Hα-helixtrans-77.1-30-174.7-67.8167.6-175.500113.7A114 K120A114-E118 WeakPolarHBondContact O-CB 3.29Å; A114-E118 VanDerWaalsContact O-CG 3.28Å; A114-E118 WeakPolarHBondContact O-CG 3.39Å; A114-E118 PolarHBondContact O-N 3.26Å; E118-K120 PolarHBondContact O-N 2.89Å
119S93.7Very high94.9Very high10 Ų1039.5 Ų39.57%0.0720%0.2CC..  trans-77.9113.3-174.8-62.30000111.8R82 K115 T121 Y125R82-S119 VanDerWaalsContact CZ-O 3.26Å; R82-S119 PolarHBondContact NH1-O 2.87Å; R82-S119 PolarHBondContact NH2-O 3.02Å; K115-S119 WeakPolarHBondContact O-CB 3.29Å; K115-S119 PolarHBondContact O-N 3.03Å; K115-S119 PolarHBondContact O-OG 2.69Å; S119-T121 PolarHBondContact O-N 3.38Å; S119-Y125 VanDerWaalsContact OG-CA 3.24Å; S119-Y125 WeakPolarHBondContact OG-CA 3.45Å; S119-Y125 PolarHBondContact OG-N 3.21Å
120K90.5Very high94.7Very high106 Ų10647.5 Ų47.546%0.46123%0.233SC..SBendtrans-54.1-51.9176.6-174175.7-179.1173.40112R82 E118R82-K120 PolarHBondContact NH2-O 3.05Å; E118-K120 PolarHBondContact O-N 2.89Å
121T91.5Very high94.4Very high19 Ų1943.9 Ų43.912%0.11722%0.217CC..SBendtrans-117.1165.1-178.470.50000112.7S119 S123 D124 Y125 F179 N182S119-T121 PolarHBondContact O-N 3.38Å; T121-S123 PolarHBondContact O-N 3.39Å; T121-S123 PolarHBondContact OG1-N 3.17Å; T121-D124 PolarHBondContact N-OD2 3.33Å; T121-D124 PolarHBondContact O-N 2.92Å; T121-D124 VanDerWaalsContact O-N 3.1Å; T121-D124 VanDerWaalsContact OG1-CG 3.32Å; T121-D124 PolarHBondContact OG1-N 3.44Å; T121-D124 PolarHBondContact OG1-OD2 3.46Å; T121-Y125 PolarHBondContact O-N 2.93Å; T121-F179 CarbonylContact C-O 3.46Å; T121-N182 HydrophobicContact CG2-CB 4.27Å
122V92.8Very high94Very high1 Ų142.9 Ų42.91%0.00622%0.215CC..Hα-helixtrans-61.4-26.9173.766.60000112.4A126 L136 L139 I140 F179 L180 N182 L183V122-A126 VanDerWaalsContact O-CB 3.24Å; V122-A126 WeakPolarHBondContact O-CB 3.46Å; V122-A126 PolarHBondContact O-N 3.44Å; V122-L136 HydrophobicContact CG2-CD1 3.85Å; V122-L139 HydrophobicContact CG2-CD2 3.83Å; V122-L139 HydrophobicContact CG2-CG 4.19Å; V122-I140 HydrophobicContact CG2-CG1 4.38Å; V122-F179 HydrophobicContact CB-CD1 4.01Å; V122-F179 HydrophobicContact CB-CE1 3.67Å; V122-F179 HydrophobicContact CB-CE2 4.45Å; V122-F179 HydrophobicContact CB-CZ 3.93Å; V122-F179 WeakPolarHBondContact CB-O 3.4Å; V122-F179 HydrophobicContact CG2-CE1 3.81Å; V122-F179 HydrophobicContact CG2-CZ 4.12Å; V122-F179 PolarHBondContact N-O 3.44Å; V122-L180 HydrophobicContact CB-CD2 4.21Å; V122-L180 HydrophobicContact CG1-CD2 4.16Å; V122-N182 WeakPolarHBondContact CG1-OD1 3.01Å; V122-L183 HydrophobicContact CG1-CD1 3.74Å; V122-L183 HydrophobicContact CG1-CD2 4.43Å; V122-L183 HydrophobicContact CG1-CG 3.87Å
123S89.2Confident93.3Very high14 Ų1447.9 Ų47.910%0.09824%0.238CC..Hα-helixtrans-70-41.3173175.10000112T121 Y125 A126 R127 N182 F212T121-S123 PolarHBondContact O-N 3.39Å; T121-S123 PolarHBondContact OG1-N 3.17Å; S123-Y125 VanDerWaalsContact C-N 3.33Å; S123-A126 PolarHBondContact O-N 2.93Å; S123-R127 PolarHBondContact O-N 2.81Å; S123-N182 WeakPolarHBondContact CB-ND2 3.48Å; S123-F212 WeakPolarHBondContact OG-CE2 3.34Å
124D90.7Very high92.9Very high48 Ų4852.2 Ų52.226%0.25727%0.265SS..Hα-helixtrans-65.5-41176.3-57.9-45.5000110.6T121 R127 A128T121-D124 PolarHBondContact N-OD2 3.33Å; T121-D124 PolarHBondContact O-N 2.92Å; T121-D124 VanDerWaalsContact O-N 3.1Å; T121-D124 VanDerWaalsContact OG1-CG 3.32Å; T121-D124 PolarHBondContact OG1-N 3.44Å; T121-D124 PolarHBondContact OG1-OD2 3.46Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 2.83Å; D124-R127 IonicContact OD1-CZ 3.78Å; D124-R127 IonicContact OD1-NH1 2.89Å; D124-R127 IonicContact OD1-NH2 3.24Å; D124-R127 PolarHBondContact OD1-NH2 2.93Å; D124-A128 WeakPolarHBondContact O-CB 3.29Å; D124-A128 PolarHBondContact O-N 2.6Å
125Y95.3Very high92.7Very high0 Ų051.9 Ų51.90%026%0.261CS..Hα-helixtrans-61.6-47172.9-179.8-98000111.6L104 K115 L116 S119 T121 S123 R127 A128 A129 L131 L139 F179L104-Y125 WeakPolarHBondContact CB-OH 3.39Å; L104-Y125 HydrophobicContact CD2-CE1 4.49Å; L104-Y125 PolarHBondContact O-OH 2.96Å; K115-Y125 HydrophobicContact CB-CD2 3.87Å; K115-Y125 HydrophobicContact CB-CE2 3.68Å; L116-Y125 HydrophobicContact CB-CD2 4.43Å; L116-Y125 HydrophobicContact CB-CE2 4.2Å; L116-Y125 HydrophobicContact CD2-CD1 4.38Å; L116-Y125 HydrophobicContact CD2-CD2 3.67Å; L116-Y125 HydrophobicContact CD2-CE1 4.3Å; L116-Y125 HydrophobicContact CD2-CE2 3.57Å; L116-Y125 HydrophobicContact CD2-CG 4.08Å; L116-Y125 HydrophobicContact CG-CD2 3.91Å; L116-Y125 HydrophobicContact CG-CE2 3.42Å; L116-Y125 VanDerWaalsContact CG-CE2 3.42Å; S119-Y125 VanDerWaalsContact OG-CA 3.24Å; S119-Y125 WeakPolarHBondContact OG-CA 3.45Å; S119-Y125 PolarHBondContact OG-N 3.21Å; T121-Y125 PolarHBondContact O-N 2.93Å; S123-Y125 VanDerWaalsContact C-N 3.33Å; Y125-R127 PolarHBondContact O-N 3.23Å; Y125-A128 PolarHBondContact O-N 2.87Å; Y125-A129 HydrophobicContact CD1-CB 4.36Å; Y125-A129 HydrophobicContact CE1-CB 3.87Å; Y125-A129 HydrophobicContact CE2-CB 4.13Å; Y125-A129 WeakPolarHBondContact O-CB 3.47Å; Y125-A129 PolarHBondContact O-N 2.74Å; Y125-L131 HydrophobicContact CD1-CD1 3.9Å; Y125-L131 HydrophobicContact CE1-CD1 3.85Å; Y125-L131 HydrophobicContact CE1-CD2 4.31Å; Y125-L131 HydrophobicContact CE1-CG 4.31Å; Y125-L139 HydrophobicContact CD1-CD2 3.43Å; Y125-L139 VanDerWaalsContact CD1-CD2 3.43Å; Y125-L139 HydrophobicContact CE1-CD2 3.66Å; Y125-F179 HydrophobicContact CD1-CZ 4.47Å; Y125-F179 HydrophobicContact CG-CE2 4.48Å; Y125-F179 HydrophobicContact CG-CZ 4.07Å
126A93.8Very high92.4Very high15 Ų1550.2 Ų50.212%0.12425%0.254CS..Hα-helixtrans-57.2-38.8179.300000111.9V122 S123 K130 L131 L136V122-A126 VanDerWaalsContact O-CB 3.24Å; V122-A126 WeakPolarHBondContact O-CB 3.46Å; V122-A126 PolarHBondContact O-N 3.44Å; S123-A126 PolarHBondContact O-N 2.93Å; A126-K130 CarbonylContact O-C 3.58Å; A126-K130 VanDerWaalsContact O-CA 3.3Å; A126-K130 WeakPolarHBondContact O-CA 3.44Å; A126-K130 PolarHBondContact O-N 3.41Å; A126-L131 HydrophobicContact CB-CB 4.23Å; A126-L131 HydrophobicContact CB-CD1 4.15Å; A126-L131 HydrophobicContact CB-CG 4.32Å; A126-L131 PolarHBondContact O-N 3.29Å; A126-L136 HydrophobicContact CB-CD1 4.03Å
127R89.5Confident92Very high121 Ų12154.1 Ų54.146%0.45727%0.271SS..Hα-helixtrans-67.5-51175.2-165.6-173.3-51.4136.818.7111.6S123 D124 Y125 A129 K130 F212S123-R127 PolarHBondContact O-N 2.81Å; D124-R127 WeakPolarHBondContact O-CB 3.37Å; D124-R127 PolarHBondContact O-N 2.83Å; D124-R127 IonicContact OD1-CZ 3.78Å; D124-R127 IonicContact OD1-NH1 2.89Å; D124-R127 IonicContact OD1-NH2 3.24Å; D124-R127 PolarHBondContact OD1-NH2 2.93Å; Y125-R127 PolarHBondContact O-N 3.23Å; R127-A129 PolarHBondContact O-N 2.93Å; R127-K130 PolarHBondContact O-N 3.5Å; R127-F212 VanDerWaalsContact NH2-CE1 3.27Å
128A94.6Very high91.9Very high46 Ų4654.1 Ų54.138%0.3827%0.27SS..Hα-helixtrans-64.7-39-177.300000112.7K115 D124 Y125K115-A128 HydrophobicContact CB-CB 4.43Å; K115-A128 HydrophobicContact CD-CB 4.28Å; K115-A128 WeakPolarHBondContact CE-O 3.28Å; K115-A128 HydrophobicContact CG-CB 4.06Å; D124-A128 WeakPolarHBondContact O-CB 3.29Å; D124-A128 PolarHBondContact O-N 2.6Å; Y125-A128 PolarHBondContact O-N 2.87Å
129A96.5Very high92Very high8 Ų847.3 Ų47.37%0.06624%0.238CC..THydrogen-bonded Turntrans-89-1.8177.900000113.6L112 K115 Y125 R127 L131L112-A129 HydrophobicContact CD2-CB 4.42Å; K115-A129 HydrophobicContact CD-CB 4.14Å; Y125-A129 HydrophobicContact CD1-CB 4.36Å; Y125-A129 HydrophobicContact CE1-CB 3.87Å; Y125-A129 HydrophobicContact CE2-CB 4.13Å; Y125-A129 WeakPolarHBondContact O-CB 3.47Å; Y125-A129 PolarHBondContact O-N 2.74Å; R127-A129 PolarHBondContact O-N 2.93Å; A129-L131 VanDerWaalsContact C-N 3.32Å; A129-L131 HydrophobicContact CB-CD2 3.92Å; A129-L131 HydrophobicContact CB-CG 4.19Å; A129-L131 PolarHBondContact O-N 3.19Å
130K93.6Very high91.9Very high184 Ų18447.2 Ų47.280%0.824%0.237SC*.THydrogen-bonded Turntrans51.448.1-178.7-57178.8-178.6177.60112.4A126 R127A126-K130 CarbonylContact O-C 3.58Å; A126-K130 VanDerWaalsContact O-CA 3.3Å; A126-K130 WeakPolarHBondContact O-CA 3.44Å; A126-K130 PolarHBondContact O-N 3.41Å; R127-K130 PolarHBondContact O-N 3.5Å
131L91.5Very high92Very high19 Ų1947.5 Ų47.510%0.09924%0.238CC..  trans-66.5137.6-179-61.2-171000111.3L104 Y125 A126 A129 Q135 L136 L139L104-L131 WeakPolarHBondContact O-CD2 3.49Å; Y125-L131 HydrophobicContact CD1-CD1 3.9Å; Y125-L131 HydrophobicContact CE1-CD1 3.85Å; Y125-L131 HydrophobicContact CE1-CD2 4.31Å; Y125-L131 HydrophobicContact CE1-CG 4.31Å; A126-L131 HydrophobicContact CB-CB 4.23Å; A126-L131 HydrophobicContact CB-CD1 4.15Å; A126-L131 HydrophobicContact CB-CG 4.32Å; A126-L131 PolarHBondContact O-N 3.29Å; A129-L131 VanDerWaalsContact C-N 3.32Å; A129-L131 HydrophobicContact CB-CD2 3.92Å; A129-L131 HydrophobicContact CB-CG 4.19Å; A129-L131 PolarHBondContact O-N 3.19Å; L131-Q135 HydrophobicContact CB-CB 4.13Å; L131-Q135 HydrophobicContact CD2-CB 4.12Å; L131-L136 HydrophobicContact CB-CB 4.47Å; L131-L136 HydrophobicContact CD1-CB 4.49Å; L131-L139 HydrophobicContact CD1-CD2 3.85Å
132N90.2Very high92.2Very high75 Ų7546.6 Ų46.640%0.40123%0.232SC..  trans-78169.1164.17052.5000111.3T134 Q135 L136N132-T134 VanDerWaalsContact C-N 3.29Å; N132-T134 PolarHBondContact O-N 2.62Å; N132-T134 WeakPolarHBondContact OD1-CA 3.32Å; N132-T134 WeakPolarHBondContact OD1-CB 3.36Å; N132-T134 PolarHBondContact OD1-N 3.13Å; N132-Q135 VanDerWaalsContact CG-OE1 3.25Å; N132-Q135 PolarHBondContact ND2-OE1 3.33Å; N132-Q135 PolarHBondContact O-N 3.48Å; N132-Q135 VanDerWaalsContact O-N 3.15Å; N132-Q135 WeakPolarHBondContact OD1-CG 3.4Å; N132-Q135 PolarHBondContact OD1-N 2.86Å; N132-L136 PolarHBondContact O-N 3.04Å
133E85.3Confident92.3Very high105 Ų10546.6 Ų46.649%0.49123%0.232SC..Hα-helixtrans-57.1-40.4-176.4-169.6-173.6160.400113.1K137E133-K137 HydrophobicContact CG-CD 4.25Å; E133-K137 WeakPolarHBondContact O-CB 3.16Å; E133-K137 VanDerWaalsContact O-CG 3.28Å; E133-K137 WeakPolarHBondContact O-CG 3.49Å; E133-K137 PolarHBondContact O-N 2.67Å; E133-K137 VanDerWaalsContact OE1-CE 3.32Å; E133-K137 WeakPolarHBondContact OE1-CE 2.99Å; E133-K137 IonicContact OE1-NZ 3.44Å; E133-K137 PolarHBondContact OE1-NZ 2.87Å
134T89.2Confident92.4Very high91 Ų9149.7 Ų49.756%0.55825%0.245SC*.Hα-helixtrans-66.9-43.1178.8-57.80000111.2N132 K137 N138N132-T134 VanDerWaalsContact C-N 3.29Å; N132-T134 PolarHBondContact O-N 2.62Å; N132-T134 WeakPolarHBondContact OD1-CA 3.32Å; N132-T134 WeakPolarHBondContact OD1-CB 3.36Å; N132-T134 PolarHBondContact OD1-N 3.13Å; T134-K137 PolarHBondContact O-N 2.72Å; T134-N138 WeakPolarHBondContact O-CB 3.24Å; T134-N138 PolarHBondContact O-N 3.28Å; T134-N138 PolarHBondContact O-ND2 3.01Å
135Q94.4Very high92.5Very high8 Ų847.5 Ų47.54%0.03723%0.234CC..Hα-helixtrans-64.2-46177.8-70.3168.8-39.500111.4P101 L131 N132 K137 N138 L139P101-Q135 WeakPolarHBondContact O-CG 3.46Å; P101-Q135 PolarHBondContact O-NE2 3.37Å; L131-Q135 HydrophobicContact CB-CB 4.13Å; L131-Q135 HydrophobicContact CD2-CB 4.12Å; N132-Q135 VanDerWaalsContact CG-OE1 3.25Å; N132-Q135 PolarHBondContact ND2-OE1 3.33Å; N132-Q135 PolarHBondContact O-N 3.48Å; N132-Q135 VanDerWaalsContact O-N 3.15Å; N132-Q135 WeakPolarHBondContact OD1-CG 3.4Å; N132-Q135 PolarHBondContact OD1-N 2.86Å; Q135-K137 PolarHBondContact O-N 2.71Å; Q135-N138 WeakPolarHBondContact O-CB 3.24Å; Q135-N138 PolarHBondContact O-N 2.81Å; Q135-L139 PolarHBondContact O-N 3.3Å
136L91.3Very high92.5Very high12 Ų1247.5 Ų47.56%0.06323%0.234CC..Hα-helixtrans-58.9-47.2175.6176.457.8000111.3V122 A126 L131 N132 N138 L139 I140 I205 V209V122-L136 HydrophobicContact CG2-CD1 3.85Å; A126-L136 HydrophobicContact CB-CD1 4.03Å; L131-L136 HydrophobicContact CB-CB 4.47Å; L131-L136 HydrophobicContact CD1-CB 4.49Å; N132-L136 PolarHBondContact O-N 3.04Å; L136-N138 VanDerWaalsContact C-N 3.29Å; L136-N138 PolarHBondContact O-N 3.18Å; L136-L139 PolarHBondContact O-N 3Å; L136-I140 HydrophobicContact CD1-CD1 3.94Å; L136-I140 HydrophobicContact CD1-CG1 4.14Å; L136-I140 HydrophobicContact CG-CD1 3.96Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.5Å; L136-I140 PolarHBondContact O-N 2.98Å; L136-I205 HydrophobicContact CD2-CG2 3.95Å; L136-V209 HydrophobicContact CD2-CG2 3.34Å
137K89.7Confident92.4Very high82 Ų8251 Ų5136%0.35725%0.246SC..Hα-helixtrans-59-40.2175.9-77.7171.7172.7171.90112.4E133 T134 Q135 K141E133-K137 HydrophobicContact CG-CD 4.25Å; E133-K137 WeakPolarHBondContact O-CB 3.16Å; E133-K137 VanDerWaalsContact O-CG 3.28Å; E133-K137 WeakPolarHBondContact O-CG 3.49Å; E133-K137 PolarHBondContact O-N 2.67Å; E133-K137 VanDerWaalsContact OE1-CE 3.32Å; E133-K137 WeakPolarHBondContact OE1-CE 2.99Å; E133-K137 IonicContact OE1-NZ 3.44Å; E133-K137 PolarHBondContact OE1-NZ 2.87Å; T134-K137 PolarHBondContact O-N 2.72Å; Q135-K137 PolarHBondContact O-N 2.71Å; K137-K141 WeakPolarHBondContact O-CG 3.39Å; K137-K141 PolarHBondContact O-N 2.88Å; K137-K141 VanDerWaalsContact O-N 3.14Å
138N93.1Very high92.5Very high30 Ų3047.8 Ų47.816%0.1624%0.242CC..Hα-helixtrans-66.2-43.9176.8-69.9-20.9000111.5K102 F103 T134 Q135 L136 K141 L142K102-N138 WeakPolarHBondContact O-CB 3.32Å; K102-N138 PolarHBondContact O-ND2 3.25Å; F103-N138 HydrophobicContact CD1-CB 3.68Å; F103-N138 VanDerWaalsContact CD1-O 3.32Å; F103-N138 WeakPolarHBondContact CD1-O 3.49Å; F103-N138 HydrophobicContact CE1-CB 3.96Å; F103-N138 HydrophobicContact CG-CB 4.3Å; T134-N138 WeakPolarHBondContact O-CB 3.24Å; T134-N138 PolarHBondContact O-N 3.28Å; T134-N138 PolarHBondContact O-ND2 3.01Å; Q135-N138 WeakPolarHBondContact O-CB 3.24Å; Q135-N138 PolarHBondContact O-N 2.81Å; L136-N138 VanDerWaalsContact C-N 3.29Å; L136-N138 PolarHBondContact O-N 3.18Å; N138-K141 PolarHBondContact O-N 3.07Å; N138-L142 WeakPolarHBondContact O-CB 3.1Å; N138-L142 PolarHBondContact O-N 2.94Å
139L95.6Very high92.3Very high0 Ų047.3 Ų47.30%024%0.242CC..Hα-helixtrans-61.1-44.5177.2179.556.9000111.6L104 V122 Y125 L131 Q135 L136 K141 L142 M143 F179L104-L139 HydrophobicContact CD2-CD1 4.04Å; V122-L139 HydrophobicContact CG2-CD2 3.83Å; V122-L139 HydrophobicContact CG2-CG 4.19Å; Y125-L139 HydrophobicContact CD1-CD2 3.43Å; Y125-L139 VanDerWaalsContact CD1-CD2 3.43Å; Y125-L139 HydrophobicContact CE1-CD2 3.66Å; L131-L139 HydrophobicContact CD1-CD2 3.85Å; Q135-L139 PolarHBondContact O-N 3.3Å; L136-L139 PolarHBondContact O-N 3Å; L139-K141 PolarHBondContact O-N 3.29Å; L139-L142 HydrophobicContact CD1-CD2 4.37Å; L139-L142 WeakPolarHBondContact O-CB 3.41Å; L139-L142 PolarHBondContact O-N 3.47Å; L139-M143 HydrophobicContact CD1-CG 4.19Å; L139-M143 WeakPolarHBondContact O-CG 3.3Å; L139-M143 PolarHBondContact O-N 3.35Å; L139-F179 HydrophobicContact CD2-CE1 4.44Å; L139-F179 HydrophobicContact CD2-CZ 4.48Å
140I92.5Very high92Very high8 Ų852 Ų524%0.04126%0.261CS..Hα-helixtrans-58.8-49.1176.6-67169.9000110.3V122 L136 L142 M143 E144 L183 I205V122-I140 HydrophobicContact CG2-CG1 4.38Å; L136-I140 HydrophobicContact CD1-CD1 3.94Å; L136-I140 HydrophobicContact CD1-CG1 4.14Å; L136-I140 HydrophobicContact CG-CD1 3.96Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.5Å; L136-I140 PolarHBondContact O-N 2.98Å; I140-L142 VanDerWaalsContact C-N 3.31Å; I140-L142 PolarHBondContact O-N 2.92Å; I140-M143 PolarHBondContact O-N 3.08Å; I140-M143 VanDerWaalsContact O-N 3.14Å; I140-E144 HydrophobicContact CG2-CG 4.28Å; I140-E144 WeakPolarHBondContact O-CG 3.28Å; I140-E144 PolarHBondContact O-N 2.85Å; I140-L183 HydrophobicContact CB-CD1 4.38Å; I140-L183 HydrophobicContact CD1-CD1 3.54Å; I140-L183 HydrophobicContact CD1-CD2 4.33Å; I140-L183 HydrophobicContact CG1-CD1 3.59Å; I140-L183 HydrophobicContact CG2-CD1 3.91Å; I140-I205 HydrophobicContact CD1-CD1 3.96Å; I140-I205 HydrophobicContact CD1-CG1 4.42Å
141K92.2Very high92Very high112 Ų11246.8 Ų46.849%0.48724%0.239SC..Hα-helixtrans-60-39.4177.2-72.5176.7179.3-176.80113.1K137 N138 L139 E144 G145 L157K137-K141 WeakPolarHBondContact O-CG 3.39Å; K137-K141 PolarHBondContact O-N 2.88Å; K137-K141 VanDerWaalsContact O-N 3.14Å; N138-K141 PolarHBondContact O-N 3.07Å; L139-K141 PolarHBondContact O-N 3.29Å; K141-E144 PolarHBondContact O-N 2.67Å; K141-G145 PolarHBondContact O-N 3.32Å; K141-L157 HydrophobicContact CB-CD1 4.11Å
142L95.6Very high91.9Very high0 Ų052 Ų520%027%0.265CS..Hα-helixtrans-59.8-49.8174.4175.167.1000110.3W98 L99 F103 N138 L139 I140 E144 G145 V146 L154 L167 F171W98-L142 HydrophobicContact CH2-CD1 3.99Å; W98-L142 HydrophobicContact CZ2-CD1 4.14Å; L99-L142 HydrophobicContact CD2-CD2 4.16Å; F103-L142 HydrophobicContact CB-CD2 4.32Å; F103-L142 HydrophobicContact CD1-CB 3.8Å; F103-L142 HydrophobicContact CD1-CD2 3.98Å; F103-L142 HydrophobicContact CD1-CG 4.41Å; F103-L142 HydrophobicContact CE1-CB 4.02Å; F103-L142 HydrophobicContact CG-CD2 4.26Å; N138-L142 WeakPolarHBondContact O-CB 3.1Å; N138-L142 PolarHBondContact O-N 2.94Å; L139-L142 HydrophobicContact CD1-CD2 4.37Å; L139-L142 WeakPolarHBondContact O-CB 3.41Å; L139-L142 PolarHBondContact O-N 3.47Å; I140-L142 VanDerWaalsContact C-N 3.31Å; I140-L142 PolarHBondContact O-N 2.92Å; L142-E144 PolarHBondContact O-N 2.78Å; L142-G145 PolarHBondContact O-N 2.96Å; L142-V146 WeakPolarHBondContact O-CG2 3.42Å; L142-V146 PolarHBondContact O-N 2.92Å; L142-L154 HydrophobicContact CD1-CD1 4.33Å; L142-L154 HydrophobicContact CD1-CD2 3.89Å; L142-L167 HydrophobicContact CD1-CD1 4.49Å; L142-L167 HydrophobicContact CD1-CD2 4.23Å; L142-F171 HydrophobicContact CD2-CD1 4.23Å; L142-F171 HydrophobicContact CD2-CE1 3.88Å
143M95.1Very high91.9Very high0 Ų052.6 Ų52.60%027%0.265CS..Hα-helixtrans-66.4-35.6179.8-63.7-57-60.400112.6L139 I140 V146 K147 F171 I174 F179 L180L139-M143 HydrophobicContact CD1-CG 4.19Å; L139-M143 WeakPolarHBondContact O-CG 3.3Å; L139-M143 PolarHBondContact O-N 3.35Å; I140-M143 PolarHBondContact O-N 3.08Å; I140-M143 VanDerWaalsContact O-N 3.14Å; M143-V146 PolarHBondContact O-N 3.41Å; M143-K147 WeakPolarHBondContact O-CB 3.48Å; M143-K147 PolarHBondContact O-N 3.5Å; M143-F171 WeakPolarHBondContact CE-O 3.14Å; M143-F171 HydrophobicContact SD-CB 4.47Å; M143-F171 HydrophobicContact SD-CD1 3.66Å; M143-F171 HydrophobicContact SD-CE1 4.45Å; M143-I174 HydrophobicContact CE-CB 4.13Å; M143-I174 HydrophobicContact CE-CG2 3.86Å; M143-F179 HydrophobicContact CE-CD1 3.92Å; M143-F179 HydrophobicContact CG-CD1 4.17Å; M143-F179 HydrophobicContact CG-CE1 4.2Å; M143-F179 HydrophobicContact SD-CD1 4.33Å; M143-F179 HydrophobicContact SD-CE1 4.42Å; M143-L180 HydrophobicContact CB-CD1 3.77Å; M143-L180 HydrophobicContact CB-CD2 3.81Å; M143-L180 HydrophobicContact CB-CG 4.11Å; M143-L180 HydrophobicContact CG-CD2 4.13Å
144E91.4Very high92.3Very high80 Ų8047.6 Ų47.637%0.37424%0.242SC..Hα-helixtrans-64.9-40.1173.1-73.9177.5155.400112.2I140 K141 L142 V146 K147 S148I140-E144 HydrophobicContact CG2-CG 4.28Å; I140-E144 WeakPolarHBondContact O-CG 3.28Å; I140-E144 PolarHBondContact O-N 2.85Å; K141-E144 PolarHBondContact O-N 2.67Å; L142-E144 PolarHBondContact O-N 2.78Å; E144-V146 VanDerWaalsContact C-N 3.34Å; E144-K147 PolarHBondContact O-N 3.16Å; E144-S148 WeakPolarHBondContact O-CB 3.07Å; E144-S148 PolarHBondContact O-N 2.79Å; E144-S148 PolarHBondContact O-OG 2.89Å
145G91.8Very high92.5Very high1 Ų145.6 Ų45.61%0.0123%0.225CC..Hα-helixtrans-64.8-3817400000112.3K141 L142 S148 G149 K150K141-G145 PolarHBondContact O-N 3.32Å; L142-G145 PolarHBondContact O-N 2.96Å; G145-S148 PolarHBondContact O-OG 3.47Å; G145-G149 PolarHBondContact O-N 2.76Å; G145-K150 PolarHBondContact O-N 3.47Å
146V95.8Very high92.4Very high0 Ų052.2 Ų52.20%026%0.26CS..Hα-helixtrans-66.7-48.6172.6173.40000111.3L142 M143 E144 S148 G149 L154 L167 Y168 F171 H172L142-V146 WeakPolarHBondContact O-CG2 3.42Å; L142-V146 PolarHBondContact O-N 2.92Å; M143-V146 PolarHBondContact O-N 3.41Å; E144-V146 VanDerWaalsContact C-N 3.34Å; V146-S148 VanDerWaalsContact C-N 3.27Å; V146-S148 PolarHBondContact O-N 2.83Å; V146-G149 PolarHBondContact O-N 3.48Å; V146-G149 VanDerWaalsContact O-N 3.09Å; V146-L154 HydrophobicContact CG2-CD1 3.88Å; V146-L167 HydrophobicContact CG2-CD2 4.43Å; V146-L167 HydrophobicContact CG2-CG 4.4Å; V146-Y168 HydrophobicContact CG1-CD2 4.38Å; V146-F171 HydrophobicContact CG1-CB 4.04Å; V146-F171 HydrophobicContact CG2-CB 3.96Å; V146-H172 HydrophobicContact CG1-CB 3.99Å
147K91.7Very high92.4Very high89 Ų8953.6 Ų53.639%0.38727%0.267SS..Hα-helixtrans-53.1-44.2176.1168.5176-175.4165.60111.7M143 E144 G149 Y175 E184M143-K147 WeakPolarHBondContact O-CB 3.48Å; M143-K147 PolarHBondContact O-N 3.5Å; E144-K147 PolarHBondContact O-N 3.16Å; K147-G149 VanDerWaalsContact C-N 3.32Å; K147-Y175 HydrophobicContact CB-CD1 4.12Å; K147-Y175 HydrophobicContact CB-CD2 4.12Å; K147-Y175 HydrophobicContact CB-CE1 3.99Å; K147-Y175 HydrophobicContact CB-CE2 4.05Å; K147-Y175 HydrophobicContact CB-CG 4.19Å; K147-Y175 HydrophobicContact CD-CD2 4.37Å; K147-Y175 HydrophobicContact CD-CE1 4.33Å; K147-Y175 HydrophobicContact CD-CE2 3.55Å; K147-Y175 WeakPolarHBondContact CD-OH 3.47Å; K147-Y175 WeakPolarHBondContact CE-OH 3.46Å; K147-Y175 HydrophobicContact CG-CD1 4.39Å; K147-Y175 HydrophobicContact CG-CD2 4.42Å; K147-Y175 HydrophobicContact CG-CE1 3.75Å; K147-Y175 HydrophobicContact CG-CE2 3.83Å; K147-Y175 VanDerWaalsContact CG-CZ 3.46Å; K147-E184 IonicContact NZ-OE1 2.6Å; K147-E184 PolarHBondContact NZ-OE1 3.38Å
148S90.9Very high92.7Very high54 Ų5451.7 Ų51.738%0.37827%0.271SS..THydrogen-bonded Turntrans-81.4-8-177.462.50000114.3E144 G145 V146 K150E144-S148 WeakPolarHBondContact O-CB 3.07Å; E144-S148 PolarHBondContact O-N 2.79Å; E144-S148 PolarHBondContact O-OG 2.89Å; G145-S148 PolarHBondContact O-OG 3.47Å; V146-S148 VanDerWaalsContact C-N 3.27Å; V146-S148 PolarHBondContact O-N 2.83Å; S148-K150 PolarHBondContact O-N 3.42Å
149G91.7Very high92.9Very high36 Ų3650.7 Ų50.737%0.37127%0.265SS..THydrogen-bonded Turntrans67.514.8-176.700000114G145 V146 K147 E151G145-G149 PolarHBondContact O-N 2.76Å; V146-G149 PolarHBondContact O-N 3.48Å; V146-G149 VanDerWaalsContact O-N 3.09Å; K147-G149 VanDerWaalsContact C-N 3.32Å; G149-E151 PolarHBondContact O-N 3.2Å
150K89.9Confident92.9Very high107 Ų10752.8 Ų52.847%0.46528%0.279SS..  trans-92.383.8-171.8-67.2179.7-178.8171.90111.7G145 S148 M152 E153G145-K150 PolarHBondContact O-N 3.47Å; S148-K150 PolarHBondContact O-N 3.42Å; K150-M152 PolarHBondContact O-N 2.86Å; K150-M152 VanDerWaalsContact O-N 3.15Å; K150-E153 HydrophobicContact CB-CB 4.22Å; K150-E153 HydrophobicContact CB-CG 3.93Å; K150-E153 HydrophobicContact CD-CG 4.06Å; K150-E153 WeakPolarHBondContact CD-OE1 3.43Å; K150-E153 WeakPolarHBondContact CE-OE1 3.46Å; K150-E153 IonicContact NZ-OE1 3.69Å; K150-E153 PolarHBondContact NZ-OE1 3.45Å; K150-E153 WeakPolarHBondContact O-CB 3.19Å; K150-E153 PolarHBondContact O-N 3.16Å
151E92.4Very high92.9Very high73 Ų7359.9 Ų59.934%0.34132%0.316SS..Hα-helixtrans-49.7-42.7179.8-169.4-177.4-176.300113.2G149 E153 L154 F155 M159 W164G149-E151 PolarHBondContact O-N 3.2Å; E151-E153 VanDerWaalsContact C-N 3.31Å; E151-E153 PolarHBondContact O-N 3.49Å; E151-L154 PolarHBondContact O-N 2.86Å; E151-L154 VanDerWaalsContact O-N 3.09Å; E151-F155 HydrophobicContact CG-CD2 3.81Å; E151-F155 HydrophobicContact CG-CE2 3.35Å; E151-F155 HydrophobicContact CG-CZ 4.07Å; E151-F155 WeakPolarHBondContact O-CD2 2.77Å; E151-F155 PolarHBondContact O-N 3.04Å; E151-F155 WeakPolarHBondContact OE1-CE2 3.26Å; E151-F155 VanDerWaalsContact OE1-CZ 3.24Å; E151-F155 WeakPolarHBondContact OE1-CZ 3.14Å; E151-M159 HydrophobicContact CG-CE 3.8Å; E151-W164 HydrophobicContact CB-CD2 3.89Å; E151-W164 HydrophobicContact CB-CE3 4.25Å; E151-W164 HydrophobicContact CB-CG 4.23Å; E151-W164 HydrophobicContact CB-CZ2 4.18Å; E151-W164 VanDerWaalsContact CD-CG 3.44Å; E151-W164 HydrophobicContact CG-CB 3.84Å; E151-W164 HydrophobicContact CG-CD2 3.59Å; E151-W164 HydrophobicContact CG-CE3 4.06Å; E151-W164 HydrophobicContact CG-CG 3.48Å; E151-W164 VanDerWaalsContact CG-CG 3.48Å; E151-W164 VanDerWaalsContact OE1-CB 3.23Å; E151-W164 WeakPolarHBondContact OE1-CB 3.12Å
152M90.8Very high92.9Very high130 Ų13057.5 Ų57.564%0.6432%0.323SS*.Hα-helixtrans-62.1-34.7-179.6-16858.462.400113.3K150 L154 F155 L156K150-M152 PolarHBondContact O-N 2.86Å; K150-M152 VanDerWaalsContact O-N 3.15Å; M152-L154 VanDerWaalsContact C-N 3.29Å; M152-L154 PolarHBondContact O-N 3.5Å; M152-F155 PolarHBondContact O-N 2.78Å; M152-F155 HydrophobicContact SD-CB 4.37Å; M152-L156 WeakPolarHBondContact O-CG 3.33Å; M152-L156 PolarHBondContact O-N 3.15Å
153E89.5Confident93Very high86 Ų8657.5 Ų57.540%0.40232%0.323SS..Hα-helixtrans-64.8-37.7176.3-68.2-173.7-174.300110.6K150 E151 L156 L157K150-E153 HydrophobicContact CB-CB 4.22Å; K150-E153 HydrophobicContact CB-CG 3.93Å; K150-E153 HydrophobicContact CD-CG 4.06Å; K150-E153 WeakPolarHBondContact CD-OE1 3.43Å; K150-E153 WeakPolarHBondContact CE-OE1 3.46Å; K150-E153 IonicContact NZ-OE1 3.69Å; K150-E153 PolarHBondContact NZ-OE1 3.45Å; K150-E153 WeakPolarHBondContact O-CB 3.19Å; K150-E153 PolarHBondContact O-N 3.16Å; E151-E153 VanDerWaalsContact C-N 3.31Å; E151-E153 PolarHBondContact O-N 3.49Å; E153-L156 PolarHBondContact O-N 3.11Å; E153-L157 WeakPolarHBondContact O-CG 3.19Å; E153-L157 PolarHBondContact O-N 2.83Å
154L92.7Very high93Very high0 Ų059.7 Ų59.70%033%0.332CS..Hα-helixtrans-73.7-34.6176.9-60-170.6000112.8L142 V146 E151 M152 L156 L157 G158 M159 W164 L167L142-L154 HydrophobicContact CD1-CD1 4.33Å; L142-L154 HydrophobicContact CD1-CD2 3.89Å; V146-L154 HydrophobicContact CG2-CD1 3.88Å; E151-L154 PolarHBondContact O-N 2.86Å; E151-L154 VanDerWaalsContact O-N 3.09Å; M152-L154 VanDerWaalsContact C-N 3.29Å; M152-L154 PolarHBondContact O-N 3.5Å; L154-L156 VanDerWaalsContact C-N 3.3Å; L154-L156 PolarHBondContact O-N 2.78Å; L154-L157 HydrophobicContact CD2-CD1 3.87Å; L154-L157 CarbonylContact O-C 3.53Å; L154-L157 WeakPolarHBondContact O-CA 3.36Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 3.44Å; L154-G158 PolarHBondContact O-N 3.36Å; L154-M159 HydrophobicContact CB-CB 4.25Å; L154-M159 HydrophobicContact CB-CE 3.9Å; L154-M159 HydrophobicContact CB-SD 3.91Å; L154-M159 HydrophobicContact CD1-SD 4.35Å; L154-M159 WeakPolarHBondContact O-CB 3.42Å; L154-M159 PolarHBondContact O-N 3.11Å; L154-W164 HydrophobicContact CD1-CE3 3.99Å; L154-W164 HydrophobicContact CD1-CZ3 3.55Å; L154-L167 HydrophobicContact CD1-CD2 3.52Å
155F93.9Very high93.3Very high50 Ų5060 Ų6022%0.21934%0.343CS..Hα-helixtrans-58.5-42.8169.3-79.1-53.7000111.9E151 M152 L157 G158 M159 L161E151-F155 HydrophobicContact CG-CD2 3.81Å; E151-F155 HydrophobicContact CG-CE2 3.35Å; E151-F155 HydrophobicContact CG-CZ 4.07Å; E151-F155 WeakPolarHBondContact O-CD2 2.77Å; E151-F155 PolarHBondContact O-N 3.04Å; E151-F155 WeakPolarHBondContact OE1-CE2 3.26Å; E151-F155 VanDerWaalsContact OE1-CZ 3.24Å; E151-F155 WeakPolarHBondContact OE1-CZ 3.14Å; M152-F155 PolarHBondContact O-N 2.78Å; M152-F155 HydrophobicContact SD-CB 4.37Å; F155-L157 PolarHBondContact O-N 2.79Å; F155-G158 WeakPolarHBondContact O-CA 3.32Å; F155-G158 PolarHBondContact O-N 3.5Å; F155-M159 HydrophobicContact CD1-CB 4.2Å; F155-M159 HydrophobicContact CD1-CE 3.8Å; F155-M159 VanDerWaalsContact CD1-O 3.29Å; F155-M159 WeakPolarHBondContact CD1-O 3.18Å; F155-M159 HydrophobicContact CD2-CE 4.1Å; F155-M159 HydrophobicContact CE1-CE 3.62Å; F155-M159 HydrophobicContact CE2-CE 4.02Å; F155-M159 HydrophobicContact CG-CE 4Å; F155-M159 HydrophobicContact CZ-CE 3.74Å; F155-L161 HydrophobicContact CD1-CD2 4.42Å; F155-L161 HydrophobicContact CE1-CD2 3.77Å; F155-L161 HydrophobicContact CZ-CD2 4.04Å
156L92Very high93.5Very high147 Ų14763 Ų6377%0.7736%0.357SS*.Hα-helixtrans-65.4-22.6174.4-66.7175000113.1M152 E153 L154 G158M152-L156 WeakPolarHBondContact O-CG 3.33Å; M152-L156 PolarHBondContact O-N 3.15Å; E153-L156 PolarHBondContact O-N 3.11Å; L154-L156 VanDerWaalsContact C-N 3.3Å; L154-L156 PolarHBondContact O-N 2.78Å; L156-G158 PolarHBondContact O-N 2.9Å
157L92.9Very high93.7Very high40 Ų4063 Ų6321%0.20936%0.357CS..THydrogen-bonded Turntrans-80.8-0.1170.1-65.4177000113.7W98 K102 F103 K141 E153 L154 F155W98-L157 PolarHBondContact NE1-O 3Å; K102-L157 PolarHBondContact NZ-O 2.7Å; F103-L157 HydrophobicContact CZ-CB 4.23Å; K141-L157 HydrophobicContact CB-CD1 4.11Å; E153-L157 WeakPolarHBondContact O-CG 3.19Å; E153-L157 PolarHBondContact O-N 2.83Å; L154-L157 HydrophobicContact CD2-CD1 3.87Å; L154-L157 CarbonylContact O-C 3.53Å; L154-L157 WeakPolarHBondContact O-CA 3.36Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 3.44Å; F155-L157 PolarHBondContact O-N 2.79Å
158G95.1Very high93.9Very high42 Ų4262.7 Ų62.743%0.43335%0.353SS..THydrogen-bonded Turntrans95.816.9176.300000114.7W98 L154 F155 L156 P160W98-G158 PolarHBondContact NE1-O 3.45Å; L154-G158 PolarHBondContact O-N 3.36Å; F155-G158 WeakPolarHBondContact O-CA 3.32Å; F155-G158 PolarHBondContact O-N 3.5Å; L156-G158 PolarHBondContact O-N 2.9Å; G158-P160 WeakPolarHBondContact O-CD 3.36Å
159M96.4Very high94.2Very high9 Ų964 Ų644%0.04436%0.36CS..PPolyproline II helixtrans-56.4129.3176.6-176.9172.567.500111.1W98 E151 L154 F155 A163 W164 L167W98-M159 HydrophobicContact CE3-CG 4.4Å; W98-M159 HydrophobicContact CH2-CB 3.5Å; W98-M159 VanDerWaalsContact CH2-CB 3.5Å; W98-M159 HydrophobicContact CH2-CG 3.44Å; W98-M159 VanDerWaalsContact CH2-CG 3.44Å; W98-M159 HydrophobicContact CH2-SD 4Å; W98-M159 VanDerWaalsContact CZ2-CA 3.42Å; W98-M159 HydrophobicContact CZ2-CB 3.43Å; W98-M159 VanDerWaalsContact CZ2-CB 3.43Å; W98-M159 HydrophobicContact CZ2-CG 3.95Å; W98-M159 HydrophobicContact CZ3-CB 4.1Å; W98-M159 HydrophobicContact CZ3-CG 3.7Å; W98-M159 HydrophobicContact CZ3-SD 4.47Å; E151-M159 HydrophobicContact CG-CE 3.8Å; L154-M159 HydrophobicContact CB-CB 4.25Å; L154-M159 HydrophobicContact CB-CE 3.9Å; L154-M159 HydrophobicContact CB-SD 3.91Å; L154-M159 HydrophobicContact CD1-SD 4.35Å; L154-M159 WeakPolarHBondContact O-CB 3.42Å; L154-M159 PolarHBondContact O-N 3.11Å; F155-M159 HydrophobicContact CD1-CB 4.2Å; F155-M159 HydrophobicContact CD1-CE 3.8Å; F155-M159 VanDerWaalsContact CD1-O 3.29Å; F155-M159 WeakPolarHBondContact CD1-O 3.18Å; F155-M159 HydrophobicContact CD2-CE 4.1Å; F155-M159 HydrophobicContact CE1-CE 3.62Å; F155-M159 HydrophobicContact CE2-CE 4.02Å; F155-M159 HydrophobicContact CG-CE 4Å; F155-M159 HydrophobicContact CZ-CE 3.74Å; M159-A163 HydrophobicContact CG-CB 3.83Å; M159-A163 HydrophobicContact SD-CB 4.35Å; M159-W164 HydrophobicContact CE-CB 3.83Å; M159-W164 HydrophobicContact CE-CE3 4.21Å; M159-W164 HydrophobicContact SD-CB 4.28Å; M159-W164 HydrophobicContact SD-CE3 4.33Å; M159-L167 HydrophobicContact SD-CD2 3.48Å; M159-L167 WeakPolarHBondContact SD-CD2 3.07Å
160P96.5Very high94.5Very high45 Ų4563.1 Ų63.129%0.29235%0.346SS..PPolyproline II helixtrans-63.5146.3174-26.137.5000112.5Y95 W98 G158 G162 A163Y95-P160 HydrophobicContact CD1-CB 4.11Å; Y95-P160 HydrophobicContact CD1-CG 3.82Å; Y95-P160 HydrophobicContact CE1-CB 4.02Å; Y95-P160 HydrophobicContact CE1-CG 4.26Å; W98-P160 HydrophobicContact CB-CG 4.22Å; W98-P160 VanDerWaalsContact CE3-CD 3.43Å; W98-P160 HydrophobicContact CE3-CG 4.46Å; W98-P160 HydrophobicContact CG-CG 4.48Å; G158-P160 WeakPolarHBondContact O-CD 3.36Å; P160-G162 PolarHBondContact O-N 2.78Å; P160-A163 HydrophobicContact CB-CB 4.48Å; P160-A163 VanDerWaalsContact O-CB 3.3Å; P160-A163 WeakPolarHBondContact O-CB 3.18Å; P160-A163 PolarHBondContact O-N 3.14Å; P160-A163 VanDerWaalsContact O-N 3.13Å
161L92.9Very high94.8Very high156 Ų15658 Ų5882%0.81732%0.324SS*.THydrogen-bonded Turntrans-56132.3172.8-66.5174.4000110.2F155 A163F155-L161 HydrophobicContact CD1-CD2 4.42Å; F155-L161 HydrophobicContact CE1-CD2 3.77Å; F155-L161 HydrophobicContact CZ-CD2 4.04Å; L161-A163 VanDerWaalsContact C-N 3.33Å
162G92.4Very high95Very high62 Ų6257 Ų5764%0.63932%0.319SS*.THydrogen-bonded Turntrans85.4-8.1-178.900000115.5P160 W164P160-G162 PolarHBondContact O-N 2.78Å; G162-W164 VanDerWaalsContact C-N 3.31Å; G162-W164 PolarHBondContact O-N 3.38Å
163A97.1Very high95.2Very high0 Ų055.3 Ų55.30%031%0.305CS..  trans-73.1-22.7177.200000113.4Y95 M159 P160 L161 S165 E166 L167Y95-A163 HydrophobicContact CD1-CB 4.15Å; Y95-A163 HydrophobicContact CD2-CB 4.27Å; Y95-A163 HydrophobicContact CE1-CB 3.66Å; Y95-A163 HydrophobicContact CE2-CB 3.79Å; Y95-A163 HydrophobicContact CG-CB 4.42Å; Y95-A163 VanDerWaalsContact CZ-CB 3.46Å; Y95-A163 WeakPolarHBondContact OH-CA 3.4Å; M159-A163 HydrophobicContact CG-CB 3.83Å; M159-A163 HydrophobicContact SD-CB 4.35Å; P160-A163 HydrophobicContact CB-CB 4.48Å; P160-A163 VanDerWaalsContact O-CB 3.3Å; P160-A163 WeakPolarHBondContact O-CB 3.18Å; P160-A163 PolarHBondContact O-N 3.14Å; P160-A163 VanDerWaalsContact O-N 3.13Å; L161-A163 VanDerWaalsContact C-N 3.33Å; A163-S165 PolarHBondContact O-N 2.81Å; A163-E166 PolarHBondContact O-N 2.62Å; A163-L167 WeakPolarHBondContact O-CB 3.13Å; A163-L167 PolarHBondContact O-N 2.99Å
164W96.1Very high95.6Very high46 Ų4651.2 Ų51.217%0.17429%0.286CS..Hα-helixtrans-55.1-51.2-170.5171.6-122.7000114.1E151 L154 M159 G162 E166 L167 Y168E151-W164 HydrophobicContact CB-CD2 3.89Å; E151-W164 HydrophobicContact CB-CE3 4.25Å; E151-W164 HydrophobicContact CB-CG 4.23Å; E151-W164 HydrophobicContact CB-CZ2 4.18Å; E151-W164 VanDerWaalsContact CD-CG 3.44Å; E151-W164 HydrophobicContact CG-CB 3.84Å; E151-W164 HydrophobicContact CG-CD2 3.59Å; E151-W164 HydrophobicContact CG-CE3 4.06Å; E151-W164 HydrophobicContact CG-CG 3.48Å; E151-W164 VanDerWaalsContact CG-CG 3.48Å; E151-W164 VanDerWaalsContact OE1-CB 3.23Å; E151-W164 WeakPolarHBondContact OE1-CB 3.12Å; L154-W164 HydrophobicContact CD1-CE3 3.99Å; L154-W164 HydrophobicContact CD1-CZ3 3.55Å; M159-W164 HydrophobicContact CE-CB 3.83Å; M159-W164 HydrophobicContact CE-CE3 4.21Å; M159-W164 HydrophobicContact SD-CB 4.28Å; M159-W164 HydrophobicContact SD-CE3 4.33Å; G162-W164 VanDerWaalsContact C-N 3.31Å; G162-W164 PolarHBondContact O-N 3.38Å; W164-E166 VanDerWaalsContact C-N 3.33Å; W164-E166 PolarHBondContact O-N 3.42Å; W164-L167 PolarHBondContact O-N 2.94Å; W164-Y168 AromaticContact CH2-CD2 3.32Å; W164-Y168 HydrophobicContact CH2-CD2 3.32Å; W164-Y168 HydrophobicContact CH2-CE2 4.02Å; W164-Y168 HydrophobicContact CH2-CG 4.07Å; W164-Y168 AromaticContact CZ2-CD2 3.55Å; W164-Y168 HydrophobicContact CZ2-CD2 3.55Å; W164-Y168 HydrophobicContact CZ2-CE2 4.15Å; W164-Y168 AromaticContact CZ2-CG 3.98Å; W164-Y168 HydrophobicContact CZ2-CG 3.98Å; W164-Y168 AromaticContact CZ3-CD2 3.97Å; W164-Y168 HydrophobicContact CZ3-CD2 3.97Å; W164-Y168 VanDerWaalsContact O-CB 3.23Å; W164-Y168 WeakPolarHBondContact O-CB 2.94Å; W164-Y168 PolarHBondContact O-N 3.25Å
165S96.4Very high95.6Very high86 Ų8653.5 Ų53.560%0.60130%0.295SS*.Hα-helixtrans-60.2-43.7-174.3-172.90000112A163 T169A163-S165 PolarHBondContact O-N 2.81Å; S165-T169 WeakPolarHBondContact O-CB 3.13Å; S165-T169 PolarHBondContact O-N 3.17Å; S165-T169 VanDerWaalsContact O-N 3.16Å; S165-T169 PolarHBondContact O-OG1 2.75Å
166E97.4Very high95.6Very high65 Ų6555 Ų5530%0.30431%0.305SS..Hα-helixtrans-74.3-43.2179.9-164.6177.6-170.300110.8F91 R94 A163 W164 Y168 T169 L170F91-E166 HydrophobicContact CD2-CB 3.97Å; F91-E166 HydrophobicContact CD2-CG 3.57Å; F91-E166 HydrophobicContact CE2-CB 4.03Å; F91-E166 HydrophobicContact CE2-CG 4.16Å; F91-E166 HydrophobicContact CG-CG 4.47Å; R94-E166 IonicContact NE-OE2 3.65Å; A163-E166 PolarHBondContact O-N 2.62Å; W164-E166 VanDerWaalsContact C-N 3.33Å; W164-E166 PolarHBondContact O-N 3.42Å; E166-Y168 PolarHBondContact O-N 3.41Å; E166-T169 PolarHBondContact O-N 3.31Å; E166-L170 HydrophobicContact CG-CD1 4.06Å; E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.21Å
167L98Very high95.6Very high0 Ų048.7 Ų48.70%027%0.273CS..Hα-helixtrans-56.6-52.5175.1179.673.4000111.1F91 W98 L142 V146 L154 M159 A163 W164 T169 L170 F171F91-L167 HydrophobicContact CE1-CD1 3.66Å; F91-L167 HydrophobicContact CE2-CB 4.02Å; F91-L167 HydrophobicContact CZ-CB 3.63Å; F91-L167 HydrophobicContact CZ-CD1 3.47Å; F91-L167 VanDerWaalsContact CZ-CD1 3.47Å; F91-L167 HydrophobicContact CZ-CG 4.14Å; W98-L167 HydrophobicContact CH2-CD1 4.46Å; W98-L167 HydrophobicContact CH2-CD2 3.78Å; W98-L167 HydrophobicContact CZ3-CD1 4.4Å; W98-L167 HydrophobicContact CZ3-CD2 4.23Å; L142-L167 HydrophobicContact CD1-CD1 4.49Å; L142-L167 HydrophobicContact CD1-CD2 4.23Å; V146-L167 HydrophobicContact CG2-CD2 4.43Å; V146-L167 HydrophobicContact CG2-CG 4.4Å; L154-L167 HydrophobicContact CD1-CD2 3.52Å; M159-L167 HydrophobicContact SD-CD2 3.48Å; M159-L167 WeakPolarHBondContact SD-CD2 3.07Å; A163-L167 WeakPolarHBondContact O-CB 3.13Å; A163-L167 PolarHBondContact O-N 2.99Å; W164-L167 PolarHBondContact O-N 2.94Å; L167-T169 VanDerWaalsContact C-N 3.35Å; L167-T169 PolarHBondContact O-N 3.46Å; L167-L170 PolarHBondContact O-N 2.73Å; L167-F171 HydrophobicContact CD1-CB 4.37Å; L167-F171 HydrophobicContact CD1-CD1 4.22Å; L167-F171 HydrophobicContact CD1-CD2 3.49Å; L167-F171 VanDerWaalsContact CD1-CD2 3.49Å; L167-F171 HydrophobicContact CD1-CE1 4.45Å; L167-F171 HydrophobicContact CD1-CE2 3.76Å; L167-F171 HydrophobicContact CD1-CG 3.77Å; L167-F171 HydrophobicContact CD1-CZ 4.24Å; L167-F171 HydrophobicContact CG-CD2 4.39Å; L167-F171 VanDerWaalsContact O-CB 3.3Å; L167-F171 WeakPolarHBondContact O-CB 3.39Å; L167-F171 PolarHBondContact O-N 3.1Å
168Y97.4Very high95.4Very high82 Ų8247.1 Ų47.132%0.32227%0.266SS..Hα-helixtrans-59.6-48-179.2-174.9-98.9000110.1V146 W164 E166 L170 H172V146-Y168 HydrophobicContact CG1-CD2 4.38Å; W164-Y168 AromaticContact CH2-CD2 3.32Å; W164-Y168 HydrophobicContact CH2-CD2 3.32Å; W164-Y168 HydrophobicContact CH2-CE2 4.02Å; W164-Y168 HydrophobicContact CH2-CG 4.07Å; W164-Y168 AromaticContact CZ2-CD2 3.55Å; W164-Y168 HydrophobicContact CZ2-CD2 3.55Å; W164-Y168 HydrophobicContact CZ2-CE2 4.15Å; W164-Y168 AromaticContact CZ2-CG 3.98Å; W164-Y168 HydrophobicContact CZ2-CG 3.98Å; W164-Y168 AromaticContact CZ3-CD2 3.97Å; W164-Y168 HydrophobicContact CZ3-CD2 3.97Å; W164-Y168 VanDerWaalsContact O-CB 3.23Å; W164-Y168 WeakPolarHBondContact O-CB 2.94Å; W164-Y168 PolarHBondContact O-N 3.25Å; E166-Y168 PolarHBondContact O-N 3.41Å; Y168-L170 VanDerWaalsContact C-N 3.32Å; Y168-L170 PolarHBondContact O-N 3.23Å; Y168-H172 HydrophobicContact CD2-CB 4.49Å; Y168-H172 HydrophobicContact CE1-CB 4.5Å; Y168-H172 HydrophobicContact CE2-CB 4.42Å; Y168-H172 AromaticContact CE2-CD2 3.87Å; Y168-H172 AromaticContact CZ-CD2 3.73Å; Y168-H172 WeakPolarHBondContact O-CA 3.1Å; Y168-H172 WeakPolarHBondContact O-CB 3.48Å; Y168-H172 PolarHBondContact O-N 3.06Å
169T95.9Very high95.4Very high83 Ų8345.1 Ų45.151%0.50925%0.246SC..Hα-helixtrans-56.9-43.8179-58.80000112.4S165 E166 L167 R173S165-T169 WeakPolarHBondContact O-CB 3.13Å; S165-T169 PolarHBondContact O-N 3.17Å; S165-T169 VanDerWaalsContact O-N 3.16Å; S165-T169 PolarHBondContact O-OG1 2.75Å; E166-T169 PolarHBondContact O-N 3.31Å; L167-T169 VanDerWaalsContact C-N 3.35Å; L167-T169 PolarHBondContact O-N 3.46Å; T169-R173 WeakPolarHBondContact O-CG 3.32Å
170L97.9Very high95.1Very high16 Ų1645.1 Ų45.18%0.08425%0.246CC..Hα-helixtrans-80.9-49.9-176.8-65.9172.3000112.7P83 H87 L88 F91 E166 L167 Y168 R173 I174P83-L170 HydrophobicContact CB-CD2 3.72Å; H87-L170 HydrophobicContact CB-CD2 4.38Å; L88-L170 HydrophobicContact CD1-CB 4.35Å; L88-L170 HydrophobicContact CD1-CD1 4.41Å; F91-L170 HydrophobicContact CB-CD1 3.4Å; F91-L170 VanDerWaalsContact CB-CD1 3.4Å; F91-L170 HydrophobicContact CD1-CD1 4.19Å; F91-L170 HydrophobicContact CD2-CD1 4.04Å; F91-L170 HydrophobicContact CG-CD1 3.61Å; E166-L170 HydrophobicContact CG-CD1 4.06Å; E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.21Å; L167-L170 PolarHBondContact O-N 2.73Å; Y168-L170 VanDerWaalsContact C-N 3.32Å; Y168-L170 PolarHBondContact O-N 3.23Å; L170-R173 WeakPolarHBondContact O-CB 3.35Å; L170-R173 PolarHBondContact O-N 3.09Å; L170-I174 PolarHBondContact O-N 3.21Å
171F97.7Very high94.6Very high0 Ų047.5 Ų47.50%026%0.256CS..Hα-helixtrans-79.7-24.9-173.2-77.2-117.2000112.3L88 F91 L116 L142 M143 V146 L167 R173 I174 Y175L88-F171 HydrophobicContact CD1-CD2 4.48Å; L88-F171 HydrophobicContact CD1-CE2 3.84Å; L88-F171 HydrophobicContact CD1-CZ 4.42Å; F91-F171 AromaticContact CD1-CE2 3.79Å; F91-F171 HydrophobicContact CD1-CE2 3.79Å; F91-F171 HydrophobicContact CE1-CD2 4.24Å; F91-F171 AromaticContact CE1-CE2 3.53Å; F91-F171 HydrophobicContact CE1-CE2 3.53Å; F91-F171 HydrophobicContact CE1-CZ 4.24Å; L116-F171 HydrophobicContact CD1-CZ 4.4Å; L142-F171 HydrophobicContact CD2-CD1 4.23Å; L142-F171 HydrophobicContact CD2-CE1 3.88Å; M143-F171 WeakPolarHBondContact CE-O 3.14Å; M143-F171 HydrophobicContact SD-CB 4.47Å; M143-F171 HydrophobicContact SD-CD1 3.66Å; M143-F171 HydrophobicContact SD-CE1 4.45Å; V146-F171 HydrophobicContact CG1-CB 4.04Å; V146-F171 HydrophobicContact CG2-CB 3.96Å; L167-F171 HydrophobicContact CD1-CB 4.37Å; L167-F171 HydrophobicContact CD1-CD1 4.22Å; L167-F171 HydrophobicContact CD1-CD2 3.49Å; L167-F171 VanDerWaalsContact CD1-CD2 3.49Å; L167-F171 HydrophobicContact CD1-CE1 4.45Å; L167-F171 HydrophobicContact CD1-CE2 3.76Å; L167-F171 HydrophobicContact CD1-CG 3.77Å; L167-F171 HydrophobicContact CD1-CZ 4.24Å; L167-F171 HydrophobicContact CG-CD2 4.39Å; L167-F171 VanDerWaalsContact O-CB 3.3Å; L167-F171 WeakPolarHBondContact O-CB 3.39Å; L167-F171 PolarHBondContact O-N 3.1Å; F171-R173 VanDerWaalsContact C-N 3.29Å; F171-R173 PolarHBondContact O-N 2.98Å; F171-I174 HydrophobicContact CG-CD1 4.46Å; F171-I174 WeakPolarHBondContact O-CB 2.74Å; F171-I174 PolarHBondContact O-N 3.43Å; F171-Y175 PolarHBondContact O-N 3.49Å
172H96Very high93.8Very high51 Ų5141.7 Ų41.724%0.23623%0.226CC..Hα-helixtrans-65.4-37.1171.9-173.9-90.4000110.7V146 Y168 I174 Y175 I176V146-H172 HydrophobicContact CG1-CB 3.99Å; Y168-H172 HydrophobicContact CD2-CB 4.49Å; Y168-H172 HydrophobicContact CE1-CB 4.5Å; Y168-H172 HydrophobicContact CE2-CB 4.42Å; Y168-H172 AromaticContact CE2-CD2 3.87Å; Y168-H172 AromaticContact CZ-CD2 3.73Å; Y168-H172 WeakPolarHBondContact O-CA 3.1Å; Y168-H172 WeakPolarHBondContact O-CB 3.48Å; Y168-H172 PolarHBondContact O-N 3.06Å; H172-I174 VanDerWaalsContact C-N 3.34Å; H172-I174 PolarHBondContact O-N 3.37Å; H172-Y175 WeakPolarHBondContact O-CB 3.45Å; H172-Y175 PolarHBondContact O-N 3.27Å; H172-I176 VanDerWaalsContact CE1-CG2 3.45Å; H172-I176 WeakPolarHBondContact CE1-CG2 3.15Å; H172-I176 WeakPolarHBondContact O-CG1 3.46Å; H172-I176 WeakPolarHBondContact O-CG2 3.28Å; H172-I176 PolarHBondContact O-N 3.24Å
173R95.6Very high92.7Very high95 Ų9539.3 Ų39.336%0.35820%0.198SC..Hα-helixtrans-62.5-39.6172.6-72.5-173.394.1-124.4-2.9112.5K80 L81 R82 T169 L170 F171 I176 S177K80-R173 PolarHBondContact O-NH2 3.05Å; K80-R173 VanDerWaalsContact O-NH2 3.13Å; L81-R173 WeakPolarHBondContact O-CB 3.45Å; L81-R173 VanDerWaalsContact O-CZ 3.23Å; L81-R173 PolarHBondContact O-NH1 2.89Å; L81-R173 PolarHBondContact O-NH2 3.41Å; R82-R173 PolarHBondContact O-NH1 3.09Å; T169-R173 WeakPolarHBondContact O-CG 3.32Å; L170-R173 WeakPolarHBondContact O-CB 3.35Å; L170-R173 PolarHBondContact O-N 3.09Å; F171-R173 VanDerWaalsContact C-N 3.29Å; F171-R173 PolarHBondContact O-N 2.98Å; R173-I176 WeakPolarHBondContact O-CG1 3.21Å; R173-S177 PolarHBondContact O-N 3.41Å
174I96.7Very high90.8Very high0 Ų044.4 Ų44.40%022%0.222CC..Hα-helixtrans-62.9-46.6171.6-62.4172.4000110P83 L88 L116 M143 L170 F171 H172 S177 F179P83-I174 HydrophobicContact CG-CD1 4.25Å; P83-I174 HydrophobicContact CG-CG1 4.03Å; L88-I174 HydrophobicContact CD1-CD1 4.34Å; L88-I174 HydrophobicContact CD2-CD1 4.13Å; L116-I174 HydrophobicContact CB-CD1 4.5Å; M143-I174 HydrophobicContact CE-CB 4.13Å; M143-I174 HydrophobicContact CE-CG2 3.86Å; L170-I174 PolarHBondContact O-N 3.21Å; F171-I174 HydrophobicContact CG-CD1 4.46Å; F171-I174 WeakPolarHBondContact O-CB 2.74Å; F171-I174 PolarHBondContact O-N 3.43Å; H172-I174 VanDerWaalsContact C-N 3.34Å; H172-I174 PolarHBondContact O-N 3.37Å; I174-S177 PolarHBondContact O-N 3.06Å; I174-S177 PolarHBondContact O-OG 3.29Å; I174-F179 HydrophobicContact CG2-CB 3.7Å; I174-F179 HydrophobicContact CG2-CD1 3.76Å; I174-F179 HydrophobicContact CG2-CD2 3.91Å; I174-F179 HydrophobicContact CG2-CE1 4.29Å; I174-F179 HydrophobicContact CG2-CE2 4.41Å; I174-F179 HydrophobicContact CG2-CG 3.53Å; I174-F179 WeakPolarHBondContact O-CB 3.21Å
175Y94.3Very high88.8Confident48 Ų4843.9 Ų43.919%0.18823%0.225CC..Iπ-helixtrans-57.1-55.3178.5164.7-116.4000112.6K147 F171 H172 S177 G178 F179 L180K147-Y175 HydrophobicContact CB-CD1 4.12Å; K147-Y175 HydrophobicContact CB-CD2 4.12Å; K147-Y175 HydrophobicContact CB-CE1 3.99Å; K147-Y175 HydrophobicContact CB-CE2 4.05Å; K147-Y175 HydrophobicContact CB-CG 4.19Å; K147-Y175 HydrophobicContact CD-CD2 4.37Å; K147-Y175 HydrophobicContact CD-CE1 4.33Å; K147-Y175 HydrophobicContact CD-CE2 3.55Å; K147-Y175 WeakPolarHBondContact CD-OH 3.47Å; K147-Y175 WeakPolarHBondContact CE-OH 3.46Å; K147-Y175 HydrophobicContact CG-CD1 4.39Å; K147-Y175 HydrophobicContact CG-CD2 4.42Å; K147-Y175 HydrophobicContact CG-CE1 3.75Å; K147-Y175 HydrophobicContact CG-CE2 3.83Å; K147-Y175 VanDerWaalsContact CG-CZ 3.46Å; F171-Y175 PolarHBondContact O-N 3.49Å; H172-Y175 WeakPolarHBondContact O-CB 3.45Å; H172-Y175 PolarHBondContact O-N 3.27Å; Y175-S177 PolarHBondContact O-N 2.69Å; Y175-S177 VanDerWaalsContact O-N 3.15Å; Y175-G178 PolarHBondContact O-N 3.4Å; Y175-G178 VanDerWaalsContact O-N 3.11Å; Y175-F179 PolarHBondContact O-N 2.93Å; Y175-L180 HydrophobicContact CD2-CD1 4.17Å; Y175-L180 HydrophobicContact CD2-CG 4.32Å; Y175-L180 HydrophobicContact CE2-CD1 4.48Å
176I91.9Very high86.7Confident83 Ų8343.5 Ų43.543%0.42623%0.227SC..Iπ-helixtrans-65.2-18.6-176.566-178.6000113.5L81 H172 R173 G178L81-I176 HydrophobicContact CD2-CD1 4.44Å; H172-I176 VanDerWaalsContact CE1-CG2 3.45Å; H172-I176 WeakPolarHBondContact CE1-CG2 3.15Å; H172-I176 WeakPolarHBondContact O-CG1 3.46Å; H172-I176 WeakPolarHBondContact O-CG2 3.28Å; H172-I176 PolarHBondContact O-N 3.24Å; R173-I176 WeakPolarHBondContact O-CG1 3.21Å; I176-G178 PolarHBondContact O-N 3.42Å; I176-G178 VanDerWaalsContact O-N 3.16Å
177S92Very high84.7Confident13 Ų1349.4 Ų49.49%0.09125%0.254CS..Iπ-helixtrans-7611.317474.80000114.2R82 R173 I174 Y175R82-S177 PolarHBondContact NE-OG 3.28Å; R82-S177 PolarHBondContact NH2-OG 2.75Å; R173-S177 PolarHBondContact O-N 3.41Å; I174-S177 PolarHBondContact O-N 3.06Å; I174-S177 PolarHBondContact O-OG 3.29Å; Y175-S177 PolarHBondContact O-N 2.69Å; Y175-S177 VanDerWaalsContact O-N 3.15Å
178G90.5Very high82.9Confident7 Ų755.4 Ų55.47%0.07229%0.287CS..Iπ-helixtrans84.518.1178.800000114.9Y175 I176 L180 D181Y175-G178 PolarHBondContact O-N 3.4Å; Y175-G178 VanDerWaalsContact O-N 3.11Å; I176-G178 PolarHBondContact O-N 3.42Å; I176-G178 VanDerWaalsContact O-N 3.16Å; G178-L180 PolarHBondContact O-N 3.05Å; G178-L180 VanDerWaalsContact O-N 3.11Å; G178-D181 WeakPolarHBondContact CA-OD1 3.49Å; G178-D181 WeakPolarHBondContact CA-OD2 3.5Å; G178-D181 WeakPolarHBondContact O-CB 3.33Å; G178-D181 PolarHBondContact O-N 3.22Å
179F93.7Very high81.4Confident0 Ų052.5 Ų52.50%028%0.276CS..Iπ-helixtrans-61.5-26-173.8-172.4-111.3000113.7R82 L116 T121 V122 Y125 L139 M143 I174 Y175R82-F179 VanDerWaalsContact NH1-CD2 3.26Å; L116-F179 HydrophobicContact CD2-CZ 3.97Å; T121-F179 CarbonylContact C-O 3.46Å; V122-F179 HydrophobicContact CB-CD1 4.01Å; V122-F179 HydrophobicContact CB-CE1 3.67Å; V122-F179 HydrophobicContact CB-CE2 4.45Å; V122-F179 HydrophobicContact CB-CZ 3.93Å; V122-F179 WeakPolarHBondContact CB-O 3.4Å; V122-F179 HydrophobicContact CG2-CE1 3.81Å; V122-F179 HydrophobicContact CG2-CZ 4.12Å; V122-F179 PolarHBondContact N-O 3.44Å; Y125-F179 HydrophobicContact CD1-CZ 4.47Å; Y125-F179 HydrophobicContact CG-CE2 4.48Å; Y125-F179 HydrophobicContact CG-CZ 4.07Å; L139-F179 HydrophobicContact CD2-CE1 4.44Å; L139-F179 HydrophobicContact CD2-CZ 4.48Å; M143-F179 HydrophobicContact CE-CD1 3.92Å; M143-F179 HydrophobicContact CG-CD1 4.17Å; M143-F179 HydrophobicContact CG-CE1 4.2Å; M143-F179 HydrophobicContact SD-CD1 4.33Å; M143-F179 HydrophobicContact SD-CE1 4.42Å; I174-F179 HydrophobicContact CG2-CB 3.7Å; I174-F179 HydrophobicContact CG2-CD1 3.76Å; I174-F179 HydrophobicContact CG2-CD2 3.91Å; I174-F179 HydrophobicContact CG2-CE1 4.29Å; I174-F179 HydrophobicContact CG2-CE2 4.41Å; I174-F179 HydrophobicContact CG2-CG 3.53Å; I174-F179 WeakPolarHBondContact O-CB 3.21Å; Y175-F179 PolarHBondContact O-N 2.93Å
180L90.8Very high80.1Confident9 Ų955.3 Ų55.35%0.04728%0.283CS..THydrogen-bonded Turntrans-101.96.5177.1-59.4-172.1000114V122 M143 Y175 G178 N182 L183 E184V122-L180 HydrophobicContact CB-CD2 4.21Å; V122-L180 HydrophobicContact CG1-CD2 4.16Å; M143-L180 HydrophobicContact CB-CD1 3.77Å; M143-L180 HydrophobicContact CB-CD2 3.81Å; M143-L180 HydrophobicContact CB-CG 4.11Å; M143-L180 HydrophobicContact CG-CD2 4.13Å; Y175-L180 HydrophobicContact CD2-CD1 4.17Å; Y175-L180 HydrophobicContact CD2-CG 4.32Å; Y175-L180 HydrophobicContact CE2-CD1 4.48Å; G178-L180 PolarHBondContact O-N 3.05Å; G178-L180 VanDerWaalsContact O-N 3.11Å; L180-N182 VanDerWaalsContact C-N 3.25Å; L180-N182 PolarHBondContact O-N 3.08Å; L180-L183 HydrophobicContact CD2-CD1 4.16Å; L180-L183 WeakPolarHBondContact O-CA 3.19Å; L180-L183 WeakPolarHBondContact O-CB 3.05Å; L180-L183 PolarHBondContact O-N 3.36Å; L180-E184 PolarHBondContact O-N 3.16Å
181D85.3Confident79.1Confident95 Ų9559.2 Ų59.251%0.50831%0.312SS..G310 helixtrans-61.4-33.9-170.6-68.9-2.4000113G178 L183 E184G178-D181 WeakPolarHBondContact CA-OD1 3.49Å; G178-D181 WeakPolarHBondContact CA-OD2 3.5Å; G178-D181 WeakPolarHBondContact O-CB 3.33Å; G178-D181 PolarHBondContact O-N 3.22Å; D181-L183 PolarHBondContact O-N 3.34Å; D181-E184 PolarHBondContact O-N 2.9Å
182N77.6Confident78Confident35 Ų3561.5 Ų61.519%0.18732%0.324CS..G310 helixtrans-72.3-5.2176.173.7-45.3000113.5T121 V122 S123 L180 H204 Q208T121-N182 HydrophobicContact CG2-CB 4.27Å; V122-N182 WeakPolarHBondContact CG1-OD1 3.01Å; S123-N182 WeakPolarHBondContact CB-ND2 3.48Å; L180-N182 VanDerWaalsContact C-N 3.25Å; L180-N182 PolarHBondContact O-N 3.08Å; N182-H204 PolarHBondContact O-CE1 3.42Å; N182-Q208 PolarHBondContact ND2-OE1 3.05Å; N182-Q208 PolarHBondContact O-NE2 3.08Å
183L68Low77.5Confident11 Ų1163 Ų636%0.05833%0.333CS..G310 helixtrans-102.2-19.2175.5-64.7-175.1000112.7V122 I140 L180 D181 P185 W201 I205V122-L183 HydrophobicContact CG1-CD1 3.74Å; V122-L183 HydrophobicContact CG1-CD2 4.43Å; V122-L183 HydrophobicContact CG1-CG 3.87Å; I140-L183 HydrophobicContact CB-CD1 4.38Å; I140-L183 HydrophobicContact CD1-CD1 3.54Å; I140-L183 HydrophobicContact CD1-CD2 4.33Å; I140-L183 HydrophobicContact CG1-CD1 3.59Å; I140-L183 HydrophobicContact CG2-CD1 3.91Å; L180-L183 HydrophobicContact CD2-CD1 4.16Å; L180-L183 WeakPolarHBondContact O-CA 3.19Å; L180-L183 WeakPolarHBondContact O-CB 3.05Å; L180-L183 PolarHBondContact O-N 3.36Å; D181-L183 PolarHBondContact O-N 3.34Å; L183-P185 WeakPolarHBondContact O-CD 3.23Å; L183-P185 WeakPolarHBondContact O-CG 3.41Å; L183-P185 VanDerWaalsContact O-N 3.1Å; L183-W201 HydrophobicContact CB-CH2 3.86Å; L183-W201 HydrophobicContact CB-CZ3 3.85Å; L183-W201 HydrophobicContact CD2-CZ3 4.08Å; L183-W201 HydrophobicContact CG-CZ3 4.38Å; L183-W201 WeakPolarHBondContact O-CH2 3.45Å; L183-W201 WeakPolarHBondContact O-CZ3 3.44Å; L183-I205 HydrophobicContact CD2-CG1 4.46Å
184E57.1Low76.5Confident108 Ų10867.9 Ų67.951%0.50535%0.352SS..  trans-62.6113.6-176.4-63.8-148.614700110.3K147 L180 D181K147-E184 IonicContact NZ-OE1 2.6Å; K147-E184 PolarHBondContact NZ-OE1 3.38Å; L180-E184 PolarHBondContact O-N 3.16Å; D181-E184 PolarHBondContact O-N 2.9Å
185P54.9Low75.9Confident35 Ų3574.5 Ų74.523%0.22738%0.383CS..  trans-73.5150.8-177.8-2238.1000111.5L183 F189 F200 W201L183-P185 WeakPolarHBondContact O-CD 3.23Å; L183-P185 WeakPolarHBondContact O-CG 3.41Å; L183-P185 VanDerWaalsContact O-N 3.1Å; P185-F189 HydrophobicContact CB-CB 3.27Å; P185-F189 HydrophobicContact CB-CD1 3.75Å; P185-F189 HydrophobicContact CB-CD2 3.52Å; P185-F189 HydrophobicContact CB-CE1 4.47Å; P185-F189 HydrophobicContact CB-CE2 4.3Å; P185-F189 HydrophobicContact CB-CG 3.21Å; P185-F189 HydrophobicContact CG-CB 4.15Å; P185-F189 HydrophobicContact CG-CD1 3.62Å; P185-F189 HydrophobicContact CG-CD2 3.77Å; P185-F189 HydrophobicContact CG-CE1 3.91Å; P185-F189 HydrophobicContact CG-CE2 4.07Å; P185-F189 HydrophobicContact CG-CG 3.57Å; P185-F189 HydrophobicContact CG-CZ 4.14Å; P185-F200 HydrophobicContact CB-CD1 4.41Å; P185-F200 HydrophobicContact CB-CE1 3.57Å; P185-F200 HydrophobicContact CB-CE2 4.25Å; P185-F200 HydrophobicContact CB-CZ 3.47Å; P185-F200 VanDerWaalsContact CB-CZ 3.47Å; P185-F200 HydrophobicContact CG-CD1 4.27Å; P185-F200 HydrophobicContact CG-CE1 3.47Å; P185-F200 VanDerWaalsContact CG-CE1 3.47Å; P185-F200 HydrophobicContact CG-CZ 3.89Å; P185-W201 HydrophobicContact CG-CH2 4.13Å; P185-W201 HydrophobicContact CG-CZ2 4.05Å
186A52.3Low75.1Confident78 Ų7876.2 Ų76.265%0.64539%0.392SS*.  trans-49.5149.9172.800000112.4N188 F189A186-N188 PolarHBondContact O-N 2.75Å; A186-F189 WeakPolarHBondContact O-CB 3.3Å; A186-F189 PolarHBondContact O-N 2.65Å
187E54.6Low74Confident188 Ų18875.1 Ų75.188%0.87938%0.384SS*.G310 helixtrans-44.1-34.3-173.4-65179.7165.100114.8F189E187-F189 PolarHBondContact O-N 3.26Å
188N60.1Low72.9Confident127 Ų12778.5 Ų78.568%0.67940%0.399SS*.G310 helixtrans-68-13.5178.1-68.7-22.6000114.7A186 Q190 S191A186-N188 PolarHBondContact O-N 2.75Å; N188-Q190 PolarHBondContact O-N 3.32Å; N188-S191 PolarHBondContact O-N 3.33Å; N188-S191 PolarHBondContact O-OG 3.34Å
189F65.5Low72.2Confident20 Ų2083 Ų839%0.08842%0.418CS..G310 helixtrans-61-32.4-179.2179.4-99.9000113.1P185 A186 E187 S191 L192 K197 F200 W201P185-F189 HydrophobicContact CB-CB 3.27Å; P185-F189 HydrophobicContact CB-CD1 3.75Å; P185-F189 HydrophobicContact CB-CD2 3.52Å; P185-F189 HydrophobicContact CB-CE1 4.47Å; P185-F189 HydrophobicContact CB-CE2 4.3Å; P185-F189 HydrophobicContact CB-CG 3.21Å; P185-F189 HydrophobicContact CG-CB 4.15Å; P185-F189 HydrophobicContact CG-CD1 3.62Å; P185-F189 HydrophobicContact CG-CD2 3.77Å; P185-F189 HydrophobicContact CG-CE1 3.91Å; P185-F189 HydrophobicContact CG-CE2 4.07Å; P185-F189 HydrophobicContact CG-CG 3.57Å; P185-F189 HydrophobicContact CG-CZ 4.14Å; A186-F189 WeakPolarHBondContact O-CB 3.3Å; A186-F189 PolarHBondContact O-N 2.65Å; E187-F189 PolarHBondContact O-N 3.26Å; F189-S191 VanDerWaalsContact C-N 3.26Å; F189-S191 PolarHBondContact O-N 2.77Å; F189-L192 HydrophobicContact CD2-CD1 3.67Å; F189-L192 HydrophobicContact CE2-CD1 4.22Å; F189-L192 HydrophobicContact CG-CD1 4.38Å; F189-L192 WeakPolarHBondContact O-CB 3.36Å; F189-L192 WeakPolarHBondContact O-CG 2.99Å; F189-L192 PolarHBondContact O-N 3.2Å; F189-L192 VanDerWaalsContact O-N 3.16Å; F189-K197 HydrophobicContact CE1-CD 4.19Å; F189-K197 HydrophobicContact CE1-CG 4.18Å; F189-K197 HydrophobicContact CE2-CB 4.08Å; F189-K197 HydrophobicContact CE2-CG 3.91Å; F189-K197 HydrophobicContact CZ-CB 3.85Å; F189-K197 HydrophobicContact CZ-CD 4.12Å; F189-K197 HydrophobicContact CZ-CG 3.68Å; F189-K197 WeakPolarHBondContact O-CE 3.47Å; F189-F200 HydrophobicContact CD2-CB 4.15Å; F189-F200 AromaticContact CD2-CD1 3.48Å; F189-F200 HydrophobicContact CD2-CD1 3.48Å; F189-F200 VanDerWaalsContact CD2-CD1 3.48Å; F189-F200 HydrophobicContact CD2-CD2 4.07Å; F189-F200 AromaticContact CD2-CE1 3.9Å; F189-F200 HydrophobicContact CD2-CE1 3.9Å; F189-F200 HydrophobicContact CD2-CE2 4.41Å; F189-F200 AromaticContact CD2-CG 3.6Å; F189-F200 HydrophobicContact CD2-CG 3.6Å; F189-F200 HydrophobicContact CD2-CZ 4.34Å; F189-F200 HydrophobicContact CE2-CB 3.79Å; F189-F200 AromaticContact CE2-CD1 3.16Å; F189-F200 HydrophobicContact CE2-CD1 3.16Å; F189-F200 HydrophobicContact CE2-CD2 4.43Å; F189-F200 AromaticContact CE2-CE1 3.89Å; F189-F200 HydrophobicContact CE2-CE1 3.89Å; F189-F200 AromaticContact CE2-CG 3.52Å; F189-F200 HydrophobicContact CE2-CG 3.52Å; F189-F200 HydrophobicContact CZ-CD1 4.17Å; F189-W201 AromaticContact CZ-CD1 3.77Å; F189-W201 AromaticContact CZ-CE2 3.94Å; F189-W201 HydrophobicContact CZ-CZ2 4.47Å; F189-W201 AromaticContact CZ-NE1 3.34Å; F189-W201 VanDerWaalsContact CZ-NE1 3.34Å
190Q70.1Confident71.1Confident143 Ų14385.5 Ų85.567%0.66843%0.429SS*.G310 helixtrans-64.5-33.4-179.6-66.8-60.6-11.700112.6N188 L192 K197N188-Q190 PolarHBondContact O-N 3.32Å; Q190-L192 VanDerWaalsContact C-N 3.25Å; Q190-L192 PolarHBondContact O-N 3.21Å; Q190-K197 PolarHBondContact O-NZ 3.03Å; Q190-K197 VanDerWaalsContact O-NZ 3.08Å
191S75.9Confident70Confident98 Ų9887.9 Ų87.969%0.68544%0.437SS*.G310 helixtrans-73.9-8.4177.269.50000115N188 F189N188-S191 PolarHBondContact O-N 3.33Å; N188-S191 PolarHBondContact O-OG 3.34Å; F189-S191 VanDerWaalsContact C-N 3.26Å; F189-S191 PolarHBondContact O-N 2.77Å
192L75Confident69.1Low48 Ų4889.6 Ų89.625%0.25144%0.437SS..SBendtrans-72.6143.2-179.8-63.3179.6000111.6F189 Q190 Q196 K197 F200F189-L192 HydrophobicContact CD2-CD1 3.67Å; F189-L192 HydrophobicContact CE2-CD1 4.22Å; F189-L192 HydrophobicContact CG-CD1 4.38Å; F189-L192 WeakPolarHBondContact O-CB 3.36Å; F189-L192 WeakPolarHBondContact O-CG 2.99Å; F189-L192 PolarHBondContact O-N 3.2Å; F189-L192 VanDerWaalsContact O-N 3.16Å; Q190-L192 VanDerWaalsContact C-N 3.25Å; Q190-L192 PolarHBondContact O-N 3.21Å; L192-Q196 HydrophobicContact CB-CB 3.78Å; L192-Q196 HydrophobicContact CD1-CB 4.37Å; L192-Q196 HydrophobicContact CD2-CB 4.04Å; L192-Q196 HydrophobicContact CG-CB 4.27Å; L192-K197 HydrophobicContact CB-CG 3.71Å; L192-K197 WeakPolarHBondContact O-CE 3.08Å; L192-F200 HydrophobicContact CD1-CB 4.28Å
193N84.7Confident68.7Low81 Ų8191.7 Ų91.743%0.43345%0.448SS..  trans-70.7170.1170.475.147000111.3Q195 Q196 K197N193-Q195 PolarHBondContact O-N 3.22Å; N193-Q195 WeakPolarHBondContact OD1-CB 3.29Å; N193-Q195 PolarHBondContact OD1-N 2.77Å; N193-Q196 VanDerWaalsContact ND2-CD 3.29Å; N193-Q196 PolarHBondContact ND2-OE1 3.15Å; N193-Q196 PolarHBondContact O-N 2.96Å; N193-Q196 VanDerWaalsContact O-N 3.16Å; N193-Q196 WeakPolarHBondContact OD1-CG 2.97Å; N193-Q196 PolarHBondContact OD1-N 3.47Å; N193-K197 WeakPolarHBondContact O-CG 3.43Å; N193-K197 PolarHBondContact O-N 2.7Å
194R76.2Confident68.6Low199 Ų19993.6 Ų93.675%0.75146%0.456SS*.Hα-helixtrans-56.4-44.3-176.9-171.3175.870.3-152.3-0.6113.4K197 E198R194-K197 PolarHBondContact O-N 3.03Å; R194-E198 WeakPolarHBondContact O-CB 3.27Å; R194-E198 VanDerWaalsContact O-CG 3.29Å; R194-E198 WeakPolarHBondContact O-CG 3.22Å; R194-E198 PolarHBondContact O-N 3.39Å
195Q82.3Confident68.9Low138 Ų13889.3 Ų89.365%0.64544%0.437SS*.Hα-helixtrans-65.7-39.9178.9-73.1179.5-32.800111.7N193 E198 E199N193-Q195 PolarHBondContact O-N 3.22Å; N193-Q195 WeakPolarHBondContact OD1-CB 3.29Å; N193-Q195 PolarHBondContact OD1-N 2.77Å; Q195-E198 PolarHBondContact O-N 3.23Å; Q195-E199 VanDerWaalsContact O-CB 3.26Å; Q195-E199 WeakPolarHBondContact O-CB 3.2Å; Q195-E199 PolarHBondContact O-N 2.81Å
196Q77.8Confident69.1Low85 Ų8593.2 Ų93.240%0.39745%0.448SS..Hα-helixtrans-68-38.2176.5-71.3172.5-4400112.2L192 N193 E199 F200L192-Q196 HydrophobicContact CB-CB 3.78Å; L192-Q196 HydrophobicContact CD1-CB 4.37Å; L192-Q196 HydrophobicContact CD2-CB 4.04Å; L192-Q196 HydrophobicContact CG-CB 4.27Å; N193-Q196 VanDerWaalsContact ND2-CD 3.29Å; N193-Q196 PolarHBondContact ND2-OE1 3.15Å; N193-Q196 PolarHBondContact O-N 2.96Å; N193-Q196 VanDerWaalsContact O-N 3.16Å; N193-Q196 WeakPolarHBondContact OD1-CG 2.97Å; N193-Q196 PolarHBondContact OD1-N 3.47Å; Q196-E199 PolarHBondContact O-N 2.85Å; Q196-F200 WeakPolarHBondContact O-CB 2.93Å; Q196-F200 PolarHBondContact O-N 3.04Å
197K68.7Low69.6Low59 Ų5994.7 Ų94.726%0.25744%0.441SS..Hα-helixtrans-65.2-43.2172.9-72.3-176.4174.2171.70111.2F189 Q190 L192 N193 R194 F200 W201F189-K197 HydrophobicContact CE1-CD 4.19Å; F189-K197 HydrophobicContact CE1-CG 4.18Å; F189-K197 HydrophobicContact CE2-CB 4.08Å; F189-K197 HydrophobicContact CE2-CG 3.91Å; F189-K197 HydrophobicContact CZ-CB 3.85Å; F189-K197 HydrophobicContact CZ-CD 4.12Å; F189-K197 HydrophobicContact CZ-CG 3.68Å; F189-K197 WeakPolarHBondContact O-CE 3.47Å; Q190-K197 PolarHBondContact O-NZ 3.03Å; Q190-K197 VanDerWaalsContact O-NZ 3.08Å; L192-K197 HydrophobicContact CB-CG 3.71Å; L192-K197 WeakPolarHBondContact O-CE 3.08Å; N193-K197 WeakPolarHBondContact O-CG 3.43Å; N193-K197 PolarHBondContact O-N 2.7Å; R194-K197 PolarHBondContact O-N 3.03Å; K197-F200 PolarHBondContact O-N 2.02Å; K197-W201 WeakPolarHBondContact O-CB 3.08Å; K197-W201 VanDerWaalsContact O-CD1 3.24Å; K197-W201 PolarHBondContact O-N 2.77Å
198E69.7Low69.8Low84 Ų8488 Ų8839%0.39341%0.41SS..Hα-helixtrans-64.1-41.3174.4-73.7173-164.800111.8R194 Q195 W201 R202R194-E198 WeakPolarHBondContact O-CB 3.27Å; R194-E198 VanDerWaalsContact O-CG 3.29Å; R194-E198 WeakPolarHBondContact O-CG 3.22Å; R194-E198 PolarHBondContact O-N 3.39Å; Q195-E198 PolarHBondContact O-N 3.23Å; E198-W201 PolarHBondContact O-N 3.22Å; E198-R202 WeakPolarHBondContact O-CB 3.01Å; E198-R202 WeakPolarHBondContact O-CG 3.23Å; E198-R202 PolarHBondContact O-N 2.68Å; E198-R202 IonicContact OE2-NH1 2.78Å; E198-R202 PolarHBondContact OE2-NH1 2.87Å
199E75Confident69.4Low101 Ų10183.4 Ų83.447%0.47239%0.387SS..Hα-helixtrans-69.9-39.8177.3-175164.6-159.500112Q195 Q196 R202 N203Q195-E199 VanDerWaalsContact O-CB 3.26Å; Q195-E199 WeakPolarHBondContact O-CB 3.2Å; Q195-E199 PolarHBondContact O-N 2.81Å; Q196-E199 PolarHBondContact O-N 2.85Å; E199-R202 PolarHBondContact O-N 3.22Å; E199-N203 VanDerWaalsContact O-CB 3.23Å; E199-N203 WeakPolarHBondContact O-CB 2.92Å; E199-N203 VanDerWaalsContact O-CG 3.27Å; E199-N203 PolarHBondContact O-N 2.96Å; E199-N203 PolarHBondContact O-ND2 2.97Å
200F72.1Confident69.2Low54 Ų5486.5 Ų86.524%0.23740%0.4CS..Hα-helixtrans-59.3-52.1170.1173.9-81.6000109.9P185 F189 L192 Q196 K197 R202 N203 H204P185-F200 HydrophobicContact CB-CD1 4.41Å; P185-F200 HydrophobicContact CB-CE1 3.57Å; P185-F200 HydrophobicContact CB-CE2 4.25Å; P185-F200 HydrophobicContact CB-CZ 3.47Å; P185-F200 VanDerWaalsContact CB-CZ 3.47Å; P185-F200 HydrophobicContact CG-CD1 4.27Å; P185-F200 HydrophobicContact CG-CE1 3.47Å; P185-F200 VanDerWaalsContact CG-CE1 3.47Å; P185-F200 HydrophobicContact CG-CZ 3.89Å; F189-F200 HydrophobicContact CD2-CB 4.15Å; F189-F200 AromaticContact CD2-CD1 3.48Å; F189-F200 HydrophobicContact CD2-CD1 3.48Å; F189-F200 VanDerWaalsContact CD2-CD1 3.48Å; F189-F200 HydrophobicContact CD2-CD2 4.07Å; F189-F200 AromaticContact CD2-CE1 3.9Å; F189-F200 HydrophobicContact CD2-CE1 3.9Å; F189-F200 HydrophobicContact CD2-CE2 4.41Å; F189-F200 AromaticContact CD2-CG 3.6Å; F189-F200 HydrophobicContact CD2-CG 3.6Å; F189-F200 HydrophobicContact CD2-CZ 4.34Å; F189-F200 HydrophobicContact CE2-CB 3.79Å; F189-F200 AromaticContact CE2-CD1 3.16Å; F189-F200 HydrophobicContact CE2-CD1 3.16Å; F189-F200 HydrophobicContact CE2-CD2 4.43Å; F189-F200 AromaticContact CE2-CE1 3.89Å; F189-F200 HydrophobicContact CE2-CE1 3.89Å; F189-F200 AromaticContact CE2-CG 3.52Å; F189-F200 HydrophobicContact CE2-CG 3.52Å; F189-F200 HydrophobicContact CZ-CD1 4.17Å; L192-F200 HydrophobicContact CD1-CB 4.28Å; Q196-F200 WeakPolarHBondContact O-CB 2.93Å; Q196-F200 PolarHBondContact O-N 3.04Å; K197-F200 PolarHBondContact O-N 2.02Å; F200-R202 PolarHBondContact O-N 2.79Å; F200-N203 CarbonylContact O-C 3.56Å; F200-N203 PolarHBondContact O-N 3.19Å; F200-H204 HydrophobicContact CD1-CB 4.11Å; F200-H204 HydrophobicContact CE1-CB 3.75Å; F200-H204 AromaticContact CE1-CG 3.8Å; F200-H204 HydrophobicContact CZ-CB 4.01Å; F200-H204 AromaticContact CZ-CD2 3.57Å; F200-H204 AromaticContact CZ-CG 3.76Å; F200-H204 WeakPolarHBondContact O-CA 3.36Å; F200-H204 WeakPolarHBondContact O-CB 3.33Å; F200-H204 PolarHBondContact O-N 2.96Å
201W66.8Low68.3Low59 Ų5989.1 Ų89.122%0.22340%0.404CS..Hα-helixtrans-65.3-40.9179.7-81.8125.2000112.1L183 P185 F189 K197 E198 H204 I205L183-W201 HydrophobicContact CB-CH2 3.86Å; L183-W201 HydrophobicContact CB-CZ3 3.85Å; L183-W201 HydrophobicContact CD2-CZ3 4.08Å; L183-W201 HydrophobicContact CG-CZ3 4.38Å; L183-W201 WeakPolarHBondContact O-CH2 3.45Å; L183-W201 WeakPolarHBondContact O-CZ3 3.44Å; P185-W201 HydrophobicContact CG-CH2 4.13Å; P185-W201 HydrophobicContact CG-CZ2 4.05Å; F189-W201 AromaticContact CZ-CD1 3.77Å; F189-W201 AromaticContact CZ-CE2 3.94Å; F189-W201 HydrophobicContact CZ-CZ2 4.47Å; F189-W201 AromaticContact CZ-NE1 3.34Å; F189-W201 VanDerWaalsContact CZ-NE1 3.34Å; K197-W201 WeakPolarHBondContact O-CB 3.08Å; K197-W201 VanDerWaalsContact O-CD1 3.24Å; K197-W201 PolarHBondContact O-N 2.77Å; E198-W201 PolarHBondContact O-N 3.22Å; W201-H204 PolarHBondContact O-N 2.04Å; W201-I205 HydrophobicContact CB-CD1 4.38Å; W201-I205 HydrophobicContact CD2-CD1 4.4Å; W201-I205 HydrophobicContact CE3-CD1 3.74Å; W201-I205 HydrophobicContact CE3-CG1 3.84Å; W201-I205 HydrophobicContact CZ3-CD1 4.44Å; W201-I205 HydrophobicContact CZ3-CG1 4.41Å; W201-I205 WeakPolarHBondContact O-CB 3.27Å; W201-I205 VanDerWaalsContact O-CG1 3.32Å; W201-I205 WeakPolarHBondContact O-CG1 3.45Å; W201-I205 PolarHBondContact O-N 2.04Å
202R67Low67.1Low131 Ų13187.9 Ų87.949%0.49439%0.386SS..Hα-helixtrans-55.9-56.4173-81.1-169.1-57.8-97.80.3109E198 E199 F200 Y206E198-R202 WeakPolarHBondContact O-CB 3.01Å; E198-R202 WeakPolarHBondContact O-CG 3.23Å; E198-R202 PolarHBondContact O-N 2.68Å; E198-R202 IonicContact OE2-NH1 2.78Å; E198-R202 PolarHBondContact OE2-NH1 2.87Å; E199-R202 PolarHBondContact O-N 3.22Å; F200-R202 PolarHBondContact O-N 2.79Å; R202-Y206 WeakPolarHBondContact O-CA 3.48Å; R202-Y206 WeakPolarHBondContact O-CB 3.46Å; R202-Y206 PolarHBondContact O-N 2.99Å
203N68.5Low65.8Low79 Ų7991.7 Ų91.742%0.42241%0.406SS..Hα-helixtrans-68.3-38.6-178.5-70.1-25.4000112.6E199 F200 Q207E199-N203 VanDerWaalsContact O-CB 3.23Å; E199-N203 WeakPolarHBondContact O-CB 2.92Å; E199-N203 VanDerWaalsContact O-CG 3.27Å; E199-N203 PolarHBondContact O-N 2.96Å; E199-N203 PolarHBondContact O-ND2 2.97Å; F200-N203 CarbonylContact O-C 3.56Å; F200-N203 PolarHBondContact O-N 3.19Å; N203-Q207 WeakPolarHBondContact O-CA 3.05Å; N203-Q207 WeakPolarHBondContact O-CB 3.22Å; N203-Q207 WeakPolarHBondContact O-CG 3.11Å; N203-Q207 PolarHBondContact O-N 2.98Å
204H65.9Low63.9Low50 Ų5099.8 Ų99.823%0.23143%0.433CS..Hα-helixtrans-71.3-50.4-176.9-166.7-100.4000110.8N182 F200 W201 Q208N182-H204 PolarHBondContact O-CE1 3.42Å; F200-H204 HydrophobicContact CD1-CB 4.11Å; F200-H204 HydrophobicContact CE1-CB 3.75Å; F200-H204 AromaticContact CE1-CG 3.8Å; F200-H204 HydrophobicContact CZ-CB 4.01Å; F200-H204 AromaticContact CZ-CD2 3.57Å; F200-H204 AromaticContact CZ-CG 3.76Å; F200-H204 WeakPolarHBondContact O-CA 3.36Å; F200-H204 WeakPolarHBondContact O-CB 3.33Å; F200-H204 PolarHBondContact O-N 2.96Å; W201-H204 PolarHBondContact O-N 2.04Å; H204-Q208 PolarHBondContact CE1-NE2 3.19Å; H204-Q208 WeakPolarHBondContact O-CB 3.27Å; H204-Q208 VanDerWaalsContact O-CG 3.3Å; H204-Q208 WeakPolarHBondContact O-CG 3.29Å; H204-Q208 PolarHBondContact O-N 2.75Å
205I62.9Low63.3Low18 Ų1894.9 Ų94.99%0.09242%0.417CS..Hα-helixtrans-65.7-43.8173.7-61.9169.7000109.5L136 I140 L183 W201 Q208 V209L136-I205 HydrophobicContact CD2-CG2 3.95Å; I140-I205 HydrophobicContact CD1-CD1 3.96Å; I140-I205 HydrophobicContact CD1-CG1 4.42Å; L183-I205 HydrophobicContact CD2-CG1 4.46Å; W201-I205 HydrophobicContact CB-CD1 4.38Å; W201-I205 HydrophobicContact CD2-CD1 4.4Å; W201-I205 HydrophobicContact CE3-CD1 3.74Å; W201-I205 HydrophobicContact CE3-CG1 3.84Å; W201-I205 HydrophobicContact CZ3-CD1 4.44Å; W201-I205 HydrophobicContact CZ3-CG1 4.41Å; W201-I205 WeakPolarHBondContact O-CB 3.27Å; W201-I205 VanDerWaalsContact O-CG1 3.32Å; W201-I205 WeakPolarHBondContact O-CG1 3.45Å; W201-I205 PolarHBondContact O-N 2.04Å; I205-Q208 PolarHBondContact O-N 2.96Å; I205-V209 HydrophobicContact CG2-CG2 4.01Å; I205-V209 VanDerWaalsContact O-CB 3.26Å; I205-V209 WeakPolarHBondContact O-CB 3.37Å; I205-V209 WeakPolarHBondContact O-CG2 3.46Å; I205-V209 PolarHBondContact O-N 3.27Å
206Y59.7Low62.3Low118 Ų11892.6 Ų92.646%0.46341%0.405SS..Hα-helixtrans-64.4-42.6178.5177.8-106.5000112.7R202 V209 K210R202-Y206 WeakPolarHBondContact O-CA 3.48Å; R202-Y206 WeakPolarHBondContact O-CB 3.46Å; R202-Y206 PolarHBondContact O-N 2.99Å; Y206-V209 PolarHBondContact O-N 3.43Å; Y206-K210 HydrophobicContact CD1-CD 4.42Å; Y206-K210 HydrophobicContact CE1-CD 3.69Å; Y206-K210 WeakPolarHBondContact O-CA 3.05Å; Y206-K210 WeakPolarHBondContact O-CB 3.11Å; Y206-K210 PolarHBondContact O-N 3.26Å
207Q63.9Low61.4Low109 Ų10993 Ų9351%0.50941%0.405SS..Hα-helixtrans-71.4-36.3178.8-68-61.9-12.900111.1N203 R211N203-Q207 WeakPolarHBondContact O-CA 3.05Å; N203-Q207 WeakPolarHBondContact O-CB 3.22Å; N203-Q207 WeakPolarHBondContact O-CG 3.11Å; N203-Q207 PolarHBondContact O-N 2.98Å; Q207-R211 VanDerWaalsContact O-CB 3.27Å; Q207-R211 WeakPolarHBondContact O-CB 3.37Å; Q207-R211 PolarHBondContact O-N 3.32Å
208Q58.1Low61Low46 Ų4695 Ų9522%0.21541%0.414CS..Hα-helixtrans-62.8-55.6170.5-72.4-155.431.100110N182 H204 I205 K210 R211 F212N182-Q208 PolarHBondContact ND2-OE1 3.05Å; N182-Q208 PolarHBondContact O-NE2 3.08Å; H204-Q208 PolarHBondContact CE1-NE2 3.19Å; H204-Q208 WeakPolarHBondContact O-CB 3.27Å; H204-Q208 VanDerWaalsContact O-CG 3.3Å; H204-Q208 WeakPolarHBondContact O-CG 3.29Å; H204-Q208 PolarHBondContact O-N 2.75Å; I205-Q208 PolarHBondContact O-N 2.96Å; Q208-K210 PolarHBondContact O-N 3.45Å; Q208-R211 WeakPolarHBondContact O-CB 3.44Å; Q208-R211 PolarHBondContact O-N 3.19Å; Q208-F212 HydrophobicContact CB-CE2 4.33Å; Q208-F212 WeakPolarHBondContact O-CD2 3.37Å; Q208-F212 WeakPolarHBondContact O-CE2 3.35Å
209V52.1Low60.4Low32 Ų3295.7 Ų95.719%0.19442%0.415CS..Hα-helixtrans-60.1-42.9179.7174.40000112.5L136 I205 Y206 R211 F212 L213L136-V209 HydrophobicContact CD2-CG2 3.34Å; I205-V209 HydrophobicContact CG2-CG2 4.01Å; I205-V209 VanDerWaalsContact O-CB 3.26Å; I205-V209 WeakPolarHBondContact O-CB 3.37Å; I205-V209 WeakPolarHBondContact O-CG2 3.46Å; I205-V209 PolarHBondContact O-N 3.27Å; Y206-V209 PolarHBondContact O-N 3.43Å; V209-R211 VanDerWaalsContact C-N 3.33Å; V209-R211 PolarHBondContact O-N 2.93Å; V209-F212 CarbonylContact O-C 3.16Å; V209-F212 PolarHBondContact O-N 3.38Å; V209-L213 HydrophobicContact CG1-CD1 3.67Å; V209-L213 HydrophobicContact CG1-CG 4.09Å; V209-L213 WeakPolarHBondContact O-CG 3.4Å; V209-L213 PolarHBondContact O-N 2.92Å; V209-L213 VanDerWaalsContact O-N 3.09Å
210K61.3Low59.5Low84 Ų8495.3 Ų95.337%0.36541%0.411SS..Hα-helixtrans-65.5-34.3179.8-177.5178.4-179.3-177.50112.1Y206 Q208 F212 Y214Y206-K210 HydrophobicContact CD1-CD 4.42Å; Y206-K210 HydrophobicContact CE1-CD 3.69Å; Y206-K210 WeakPolarHBondContact O-CA 3.05Å; Y206-K210 WeakPolarHBondContact O-CB 3.11Å; Y206-K210 PolarHBondContact O-N 3.26Å; Q208-K210 PolarHBondContact O-N 3.45Å; K210-F212 PolarHBondContact O-N 3.08Å; K210-Y214 HydrophobicContact CG-CD2 4.43Å; K210-Y214 HydrophobicContact CG-CE2 4.42Å
211R51.7Low58.6Low199 Ų19998.3 Ų98.375%0.75142%0.424SS*.Hα-helixtrans-63.5-17.5172.3-172177.1-179.8-165.3-0.3112.4Q207 Q208 V209Q207-R211 VanDerWaalsContact O-CB 3.27Å; Q207-R211 WeakPolarHBondContact O-CB 3.37Å; Q207-R211 PolarHBondContact O-N 3.32Å; Q208-R211 WeakPolarHBondContact O-CB 3.44Å; Q208-R211 PolarHBondContact O-N 3.19Å; V209-R211 VanDerWaalsContact C-N 3.33Å; V209-R211 PolarHBondContact O-N 2.93Å
212F49.8Very low57.9Low71 Ų71101.3 Ų101.331%0.31144%0.439SS..Hα-helixtrans-115.3-2.8-174.6-56.2-57.2000114.6S123 R127 Q208 V209 K210S123-F212 WeakPolarHBondContact OG-CE2 3.34Å; R127-F212 VanDerWaalsContact NH2-CE1 3.27Å; Q208-F212 HydrophobicContact CB-CE2 4.33Å; Q208-F212 WeakPolarHBondContact O-CD2 3.37Å; Q208-F212 WeakPolarHBondContact O-CE2 3.35Å; V209-F212 CarbonylContact O-C 3.16Å; V209-F212 PolarHBondContact O-N 3.38Å; K210-F212 PolarHBondContact O-N 3.08Å
213L47.7Very low57.2Low129 Ų12998.8 Ų98.868%0.67544%0.435SS*.  trans-97.4-0173.6-70.8178.1000113.5V209V209-L213 HydrophobicContact CG1-CD1 3.67Å; V209-L213 HydrophobicContact CG1-CG 4.09Å; V209-L213 WeakPolarHBondContact O-CG 3.4Å; V209-L213 PolarHBondContact O-N 2.92Å; V209-L213 VanDerWaalsContact O-N 3.09Å
214Y44.7Very low56.2Low251 Ų251100.6 Ų100.698%0.98444%0.436SS*.  trans-131.70172.1-65.4-79.4000109.1K210K210-Y214 HydrophobicContact CG-CD2 4.43Å; K210-Y214 HydrophobicContact CG-CE2 4.42Å

Retrieved 214 of 214 residues in 329.7 ms (Link to these results)

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