A0A060Q608_CAEEL Loading...

Serpentine Receptor, class T

AlphaFold DB , UniProt , Accession A0A060Q608, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 285 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
1M37.4Very low37.4Very low248 Ų248132.3 Ų132.3100%1.22269%0.691SS**  0107.30-81.4165.261.100107.3
2G40.2Very low37.4Very low77 Ų77134.5 Ų134.579%0.79468%0.684SS**  trans-11327.7-168.300000113.9
3E37.1Very low37.3Very low174 Ų174132.4 Ų132.481%0.81367%0.671SS**  trans-130.4105-177-69-178.6150.600108.1
4D42.3Very low37.2Very low113 Ų113126.8 Ų126.860%0.60466%0.655SS**SBendtrans-172.8-18.4166.7-105.1-15.4000111T8D4-T8 PolarHBondContact O-N 3.33Å; D4-T8 PolarHBondContact O-OG1 3Å
5W32.9Very low37.3Very low221 Ų221123.3 Ų123.384%0.83764%0.642SS**Hα-helixtrans-69.5-30.5176.7-70.392.8000113.6T9W5-T9 VanDerWaalsContact O-CB 3.3Å; W5-T9 WeakPolarHBondContact O-CB 3.36Å; W5-T9 PolarHBondContact O-N 3.47Å; W5-T9 PolarHBondContact O-OG1 3.3Å
6T37.9Very low37.6Very low99 Ų99116.3 Ų116.361%0.60761%0.61SS**Hα-helixtrans-72.7-49.1179.732.20000111.7T8 T9 V10T6-T8 PolarHBondContact O-N 2.92Å; T6-T9 PolarHBondContact O-N 3.06Å; T6-V10 WeakPolarHBondContact O-CB 3.5Å; T6-V10 VanDerWaalsContact O-CG2 3.26Å; T6-V10 WeakPolarHBondContact O-CG2 3.17Å; T6-V10 PolarHBondContact O-N 2.98Å
7E32.9Very low37.8Very low144 Ų144113.3 Ų113.367%0.67360%0.6SS**Hα-helixtrans-63.4-45.4179.6-71.5-163.7160.900111.9T9 V10 F11E7-T9 VanDerWaalsContact C-N 3.27Å; E7-T9 PolarHBondContact O-N 3.34Å; E7-V10 PolarHBondContact O-N 3.43Å; E7-F11 WeakPolarHBondContact O-CB 3.32Å; E7-F11 PolarHBondContact O-N 3.19Å
8T39Very low37.9Very low66 Ų66114.4 Ų114.441%0.40560%0.6SS.*Hα-helixtrans-63.9-34.7179.8-44.60000112D4 T6 R12D4-T8 PolarHBondContact O-N 3.33Å; D4-T8 PolarHBondContact O-OG1 3Å; T6-T8 PolarHBondContact O-N 2.92Å; T8-R12 WeakPolarHBondContact O-CB 3.3Å; T8-R12 WeakPolarHBondContact O-CG 3.32Å; T8-R12 PolarHBondContact O-N 3.24Å
9T39.3Very low38.1Very low65 Ų65109.7 Ų109.740%0.39958%0.582SS.*Hα-helixtrans-74.9-42.2178.1-57.10000111.6W5 T6 E7 R12 M13W5-T9 VanDerWaalsContact O-CB 3.3Å; W5-T9 WeakPolarHBondContact O-CB 3.36Å; W5-T9 PolarHBondContact O-N 3.47Å; W5-T9 PolarHBondContact O-OG1 3.3Å; T6-T9 PolarHBondContact O-N 3.06Å; E7-T9 VanDerWaalsContact C-N 3.27Å; E7-T9 PolarHBondContact O-N 3.34Å; T9-R12 PolarHBondContact O-N 3.26Å; T9-M13 HydrophobicContact CG2-CE 4.24Å; T9-M13 HydrophobicContact CG2-SD 4.43Å; T9-M13 WeakPolarHBondContact O-CB 3.45Å; T9-M13 WeakPolarHBondContact O-CG 3.33Å; T9-M13 PolarHBondContact O-N 3.37Å
10V37.1Very low38.4Very low96 Ų96107 Ų10758%0.58257%0.569SS**Hα-helixtrans-65.9-42.1175.5173.40000110.5T6 E7 R12 M13 A14T6-V10 WeakPolarHBondContact O-CB 3.5Å; T6-V10 VanDerWaalsContact O-CG2 3.26Å; T6-V10 WeakPolarHBondContact O-CG2 3.17Å; T6-V10 PolarHBondContact O-N 2.98Å; E7-V10 PolarHBondContact O-N 3.43Å; V10-R12 VanDerWaalsContact C-N 3.35Å; V10-R12 PolarHBondContact O-N 3.34Å; V10-M13 PolarHBondContact O-N 3.41Å; V10-A14 VanDerWaalsContact O-CB 3.27Å; V10-A14 WeakPolarHBondContact O-CB 3.38Å; V10-A14 PolarHBondContact O-N 3.31Å
11F35.7Very low38.2Very low152 Ų152107.1 Ų107.167%0.66757%0.569SS**Hα-helixtrans-67.3-35.5176.1-148-88.9000111.4E7 A14 T15E7-F11 WeakPolarHBondContact O-CB 3.32Å; E7-F11 PolarHBondContact O-N 3.19Å; F11-A14 CarbonylContact O-C 3.37Å; F11-A14 PolarHBondContact O-N 2.76Å; F11-T15 HydrophobicContact CD1-CG2 4.07Å; F11-T15 HydrophobicContact CE1-CG2 4.21Å; F11-T15 VanDerWaalsContact O-CG2 3.32Å; F11-T15 WeakPolarHBondContact O-CG2 3.17Å; F11-T15 PolarHBondContact O-N 2.85Å; F11-T15 PolarHBondContact O-OG1 3.39Å
12R37.3Very low38.4Very low159 Ų15998.4 Ų98.460%0.653%0.53SS*.Hα-helixtrans-74.1-32.1173.5-76.7176.6-178.6-171.33.5113.9T8 T9 V10 T15 G16T8-R12 WeakPolarHBondContact O-CB 3.3Å; T8-R12 WeakPolarHBondContact O-CG 3.32Å; T8-R12 PolarHBondContact O-N 3.24Å; T9-R12 PolarHBondContact O-N 3.26Å; V10-R12 VanDerWaalsContact C-N 3.35Å; V10-R12 PolarHBondContact O-N 3.34Å; R12-T15 WeakPolarHBondContact CA-OG1 3.26Å; R12-T15 PolarHBondContact O-OG1 3.32Å; R12-G16 PolarHBondContact O-N 2.88Å
13M36.4Very low38.7Very low107 Ų10796.6 Ų96.653%0.52750%0.501SS..Hα-helixtrans-66.6-44.2167.9-77.8178.4170.400109.3T9 V10 T15 G16 S17T9-M13 HydrophobicContact CG2-CE 4.24Å; T9-M13 HydrophobicContact CG2-SD 4.43Å; T9-M13 WeakPolarHBondContact O-CB 3.45Å; T9-M13 WeakPolarHBondContact O-CG 3.33Å; T9-M13 PolarHBondContact O-N 3.37Å; V10-M13 PolarHBondContact O-N 3.41Å; M13-T15 PolarHBondContact O-N 3.28Å; M13-G16 PolarHBondContact O-N 3.45Å; M13-S17 WeakPolarHBondContact O-CA 3.44Å; M13-S17 WeakPolarHBondContact O-CB 3.22Å; M13-S17 PolarHBondContact O-N 3.11Å; M13-S17 PolarHBondContact O-OG 3.25Å
14A35.6Very low39.1Very low54 Ų5490.9 Ų90.945%0.44648%0.476SS..Hα-helixtrans-61.4-40.7174.800000111.6V10 F11 S17 F18V10-A14 VanDerWaalsContact O-CB 3.27Å; V10-A14 WeakPolarHBondContact O-CB 3.38Å; V10-A14 PolarHBondContact O-N 3.31Å; F11-A14 CarbonylContact O-C 3.37Å; F11-A14 PolarHBondContact O-N 2.76Å; A14-S17 CarbonylContact O-C 3.5Å; A14-F18 WeakPolarHBondContact O-CA 3.4Å; A14-F18 WeakPolarHBondContact O-CB 3.33Å; A14-F18 PolarHBondContact O-N 3.06Å
15T39.2Very low39.3Very low74 Ų7491.6 Ų91.645%0.45448%0.479SS..Hα-helixtrans-76.2-34177.557.30000114F11 R12 M13 F18 G19F11-T15 HydrophobicContact CD1-CG2 4.07Å; F11-T15 HydrophobicContact CE1-CG2 4.21Å; F11-T15 VanDerWaalsContact O-CG2 3.32Å; F11-T15 WeakPolarHBondContact O-CG2 3.17Å; F11-T15 PolarHBondContact O-N 2.85Å; F11-T15 PolarHBondContact O-OG1 3.39Å; R12-T15 WeakPolarHBondContact CA-OG1 3.26Å; R12-T15 PolarHBondContact O-OG1 3.32Å; M13-T15 PolarHBondContact O-N 3.28Å; T15-F18 CarbonylContact O-C 3.57Å; T15-F18 WeakPolarHBondContact O-CB 3.16Å; T15-F18 PolarHBondContact O-N 3.01Å; T15-G19 PolarHBondContact O-N 3.03Å
16G42.3Very low40.6Very low12 Ų1284 Ų8412%0.12446%0.455CS..Hα-helixtrans-66.8-45.917100000111.6R12 M13 F18 G19 V20R12-G16 PolarHBondContact O-N 2.88Å; M13-G16 PolarHBondContact O-N 3.45Å; G16-F18 VanDerWaalsContact C-N 3.28Å; G16-F18 PolarHBondContact O-N 2.85Å; G16-G19 PolarHBondContact O-N 2.65Å; G16-V20 PolarHBondContact O-N 3.18Å; G16-V20 VanDerWaalsContact O-N 3.13Å
17S40.8Very low41.7Very low65 Ų6580.2 Ų80.246%0.45543%0.432SS..Hα-helixtrans-62.7-32.6168.8-630000112M13 A14 V20 L21M13-S17 WeakPolarHBondContact O-CA 3.44Å; M13-S17 WeakPolarHBondContact O-CB 3.22Å; M13-S17 PolarHBondContact O-N 3.11Å; M13-S17 PolarHBondContact O-OG 3.25Å; A14-S17 CarbonylContact O-C 3.5Å; S17-V20 PolarHBondContact O-N 3.35Å; S17-L21 VanDerWaalsContact O-CB 3.26Å; S17-L21 WeakPolarHBondContact O-CB 3.35Å; S17-L21 PolarHBondContact O-N 2.98Å
18F39.4Very low43.1Very low133 Ų13374.2 Ų74.258%0.58341%0.405SS*.Hα-helixtrans-70.3-38.9175.3-170.4-102.5000111.1A14 T15 G16 V20 L21 V22A14-F18 WeakPolarHBondContact O-CA 3.4Å; A14-F18 WeakPolarHBondContact O-CB 3.33Å; A14-F18 PolarHBondContact O-N 3.06Å; T15-F18 CarbonylContact O-C 3.57Å; T15-F18 WeakPolarHBondContact O-CB 3.16Å; T15-F18 PolarHBondContact O-N 3.01Å; G16-F18 VanDerWaalsContact C-N 3.28Å; G16-F18 PolarHBondContact O-N 2.85Å; F18-V20 VanDerWaalsContact C-N 3.35Å; F18-L21 CarbonylContact O-C 3.54Å; F18-L21 PolarHBondContact O-N 2.83Å; F18-V22 HydrophobicContact CD1-CG2 3.65Å; F18-V22 HydrophobicContact CD2-CG2 4.43Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.28Å; F18-V22 HydrophobicContact CG-CG2 4.14Å; F18-V22 HydrophobicContact CZ-CG2 3.81Å; F18-V22 WeakPolarHBondContact O-CB 3.25Å; F18-V22 WeakPolarHBondContact O-CG2 3.27Å; F18-V22 PolarHBondContact O-N 3.39Å
19G42.2Very low44.6Very low25 Ų2573.5 Ų73.526%0.25840%0.396SS..Hα-helixtrans-60.7-44.4172.100000111.9T15 G16 V22 E23T15-G19 PolarHBondContact O-N 3.03Å; G16-G19 PolarHBondContact O-N 2.65Å; G19-V22 PolarHBondContact O-N 3.04Å; G19-E23 WeakPolarHBondContact O-CG 3.37Å; G19-E23 PolarHBondContact O-N 3.32Å
20V43.3Very low46.5Very low56 Ų5673.6 Ų73.634%0.33939%0.391SS..Hα-helixtrans-64.9-42.3172176.90000111.4G16 S17 F18 V22 E23 L24 T255 E259G16-V20 PolarHBondContact O-N 3.18Å; G16-V20 VanDerWaalsContact O-N 3.13Å; S17-V20 PolarHBondContact O-N 3.35Å; F18-V20 VanDerWaalsContact C-N 3.35Å; V20-V22 PolarHBondContact O-N 3.46Å; V20-E23 PolarHBondContact O-N 3.1Å; V20-L24 HydrophobicContact CG1-CD1 4.04Å; V20-L24 HydrophobicContact CG1-CG 4.46Å; V20-L24 WeakPolarHBondContact O-CB 3.35Å; V20-L24 WeakPolarHBondContact O-CG 3.43Å; V20-L24 PolarHBondContact O-N 2.82Å; V20-T255 HydrophobicContact CG2-CG2 4.21Å; V20-E259 HydrophobicContact CG2-CG 4.48Å
21L35Very low48.6Very low109 Ų10969 Ų6957%0.57136%0.363SS*.Hα-helixtrans-63.3-39.9176.4-122.189000112S17 F18 L24 L25S17-L21 VanDerWaalsContact O-CB 3.26Å; S17-L21 WeakPolarHBondContact O-CB 3.35Å; S17-L21 PolarHBondContact O-N 2.98Å; F18-L21 CarbonylContact O-C 3.54Å; F18-L21 PolarHBondContact O-N 2.83Å; L21-L24 CarbonylContact O-C 3.5Å; L21-L24 WeakPolarHBondContact O-CB 3.45Å; L21-L24 PolarHBondContact O-N 2.89Å; L21-L25 PolarHBondContact O-N 3.41Å
22V41.6Very low50.7Low66 Ų6662.8 Ų62.840%0.434%0.336SS..Hα-helixtrans-71.2-37.2179.7167.80000110.2F18 G19 V20 L25F18-V22 HydrophobicContact CD1-CG2 3.65Å; F18-V22 HydrophobicContact CD2-CG2 4.43Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.28Å; F18-V22 HydrophobicContact CG-CG2 4.14Å; F18-V22 HydrophobicContact CZ-CG2 3.81Å; F18-V22 WeakPolarHBondContact O-CB 3.25Å; F18-V22 WeakPolarHBondContact O-CG2 3.27Å; F18-V22 PolarHBondContact O-N 3.39Å; G19-V22 PolarHBondContact O-N 3.04Å; V20-V22 PolarHBondContact O-N 3.46Å; V22-L25 HydrophobicContact CB-CD1 4.46Å; V22-L25 HydrophobicContact CG2-CD1 4.32Å; V22-L25 WeakPolarHBondContact O-CB 3.32Å; V22-L25 PolarHBondContact O-N 3.38Å
23E46.2Very low52.9Low39 Ų3959.4 Ų59.418%0.18233%0.33CS..Hα-helixtrans-64-42.6168.2-78-173-15600111G19 V20 L25 N26 Y29 N253 T255G19-E23 WeakPolarHBondContact O-CG 3.37Å; G19-E23 PolarHBondContact O-N 3.32Å; V20-E23 PolarHBondContact O-N 3.1Å; E23-L25 PolarHBondContact O-N 2.81Å; E23-N26 PolarHBondContact O-N 3.45Å; E23-Y29 HydrophobicContact CB-CD1 3.95Å; E23-Y29 HydrophobicContact CB-CE1 3.62Å; E23-Y29 HydrophobicContact CB-CE2 4.24Å; E23-Y29 HydrophobicContact CB-CG 4.37Å; E23-Y29 HydrophobicContact CG-CE1 4.07Å; E23-Y29 VanDerWaalsContact O-CB 3.29Å; E23-Y29 WeakPolarHBondContact O-CB 3.2Å; E23-Y29 WeakPolarHBondContact O-CD2 3.27Å; E23-Y29 WeakPolarHBondContact OE2-CE1 3.27Å; E23-Y29 PolarHBondContact OE2-OH 3.3Å; E23-Y29 VanDerWaalsContact OE2-OH 3.06Å; E23-N253 PolarHBondContact OE2-ND2 3.2Å; E23-T255 VanDerWaalsContact OE1-CB 3.26Å; E23-T255 WeakPolarHBondContact OE1-CB 3.32Å; E23-T255 PolarHBondContact OE1-OG1 3.26Å
24L44.8Very low55.4Low53 Ų5355.4 Ų55.428%0.27731%0.31SS..Hα-helixtrans-64.1-15.4174.5-71.4169.1000114.6V20 L21 N26 L33V20-L24 HydrophobicContact CG1-CD1 4.04Å; V20-L24 HydrophobicContact CG1-CG 4.46Å; V20-L24 WeakPolarHBondContact O-CB 3.35Å; V20-L24 WeakPolarHBondContact O-CG 3.43Å; V20-L24 PolarHBondContact O-N 2.82Å; L21-L24 CarbonylContact O-C 3.5Å; L21-L24 WeakPolarHBondContact O-CB 3.45Å; L21-L24 PolarHBondContact O-N 2.89Å; L24-N26 PolarHBondContact O-N 2.88Å; L24-L33 HydrophobicContact CD2-CB 4.32Å; L24-L33 HydrophobicContact CD2-CD2 3.98Å
25L47.1Very low58Low129 Ų12952.9 Ų52.968%0.67529%0.289SS*.THydrogen-bonded Turntrans-64.6-32.2170.9-73.3167.5000111.1L21 V22 E23L21-L25 PolarHBondContact O-N 3.41Å; V22-L25 HydrophobicContact CB-CD1 4.46Å; V22-L25 HydrophobicContact CG2-CD1 4.32Å; V22-L25 WeakPolarHBondContact O-CB 3.32Å; V22-L25 PolarHBondContact O-N 3.38Å; E23-L25 PolarHBondContact O-N 2.81Å
26N58.9Low60.3Low62 Ų6250.6 Ų50.633%0.33228%0.278SS..SBendtrans-73.9125.4179.5176.9-31.9000109.5E23 L24 C28 Y29E23-N26 PolarHBondContact O-N 3.45Å; L24-N26 PolarHBondContact O-N 2.88Å; N26-C28 PolarHBondContact O-N 3.32Å; N26-C28 VanDerWaalsContact O-N 3.07Å; N26-C28 WeakPolarHBondContact OD1-CB 3.25Å; N26-C28 PolarHBondContact OD1-N 3.26Å; N26-Y29 HydrophobicContact CB-CD2 3.7Å; N26-Y29 HydrophobicContact CB-CE2 4.17Å; N26-Y29 WeakPolarHBondContact O-CB 3.2Å; N26-Y29 PolarHBondContact O-N 2.94Å
27P61.2Low62.6Low18 Ų1854.8 Ų54.812%0.11730%0.297CS..Hα-helixtrans-52.4-33.5-177.1-24.331.1000114.9Y29 K30 E106 K107 A110P27-Y29 PolarHBondContact O-N 2.93Å; P27-K30 WeakPolarHBondContact O-CB 3.47Å; P27-K30 PolarHBondContact O-N 2.91Å; P27-E106 WeakPolarHBondContact CB-O 3.13Å; P27-K107 HydrophobicContact CB-CB 4.42Å; P27-K107 VanDerWaalsContact CG-CA 3.41Å; P27-K107 HydrophobicContact CG-CB 3.72Å; P27-K107 HydrophobicContact CG-CG 4.08Å; P27-A110 HydrophobicContact CB-CB 3.43Å; P27-A110 VanDerWaalsContact CB-CB 3.43Å; P27-A110 VanDerWaalsContact O-CB 3.27Å; P27-A110 WeakPolarHBondContact O-CB 3.46Å
28C63.6Low65.2Low18 Ų1852.1 Ų52.112%0.12228%0.277CS..Hα-helixtrans-61-34176.3-70.20000112.5N26 K30 I31 I32N26-C28 PolarHBondContact O-N 3.32Å; N26-C28 VanDerWaalsContact O-N 3.07Å; N26-C28 WeakPolarHBondContact OD1-CB 3.25Å; N26-C28 PolarHBondContact OD1-N 3.26Å; C28-K30 VanDerWaalsContact C-N 3.26Å; C28-K30 PolarHBondContact O-N 2.95Å; C28-I31 PolarHBondContact O-N 2.89Å; C28-I32 PolarHBondContact O-N 3.46Å; C28-I32 VanDerWaalsContact O-N 3.1Å
29Y68.7Low67.8Low51 Ų5146.2 Ų46.220%0.225%0.252CS..Hα-helixtrans-69-25.8179.4-78.9-95.9000112.9E23 N26 P27 I32 L33E23-Y29 HydrophobicContact CB-CD1 3.95Å; E23-Y29 HydrophobicContact CB-CE1 3.62Å; E23-Y29 HydrophobicContact CB-CE2 4.24Å; E23-Y29 HydrophobicContact CB-CG 4.37Å; E23-Y29 HydrophobicContact CG-CE1 4.07Å; E23-Y29 VanDerWaalsContact O-CB 3.29Å; E23-Y29 WeakPolarHBondContact O-CB 3.2Å; E23-Y29 WeakPolarHBondContact O-CD2 3.27Å; E23-Y29 WeakPolarHBondContact OE2-CE1 3.27Å; E23-Y29 PolarHBondContact OE2-OH 3.3Å; E23-Y29 VanDerWaalsContact OE2-OH 3.06Å; N26-Y29 HydrophobicContact CB-CD2 3.7Å; N26-Y29 HydrophobicContact CB-CE2 4.17Å; N26-Y29 WeakPolarHBondContact O-CB 3.2Å; N26-Y29 PolarHBondContact O-N 2.94Å; P27-Y29 PolarHBondContact O-N 2.93Å; Y29-I32 PolarHBondContact O-N 2.93Å; Y29-L33 WeakPolarHBondContact O-CB 3.37Å; Y29-L33 PolarHBondContact O-N 2.92Å
30K79.1Confident70.2Confident68 Ų6850.1 Ų50.130%0.29627%0.266SS..Hα-helixtrans-67.5-38.9174.9-63.8178.2173.8166.90111.7P27 C28 L33 L34 Y111 I114P27-K30 WeakPolarHBondContact O-CB 3.47Å; P27-K30 PolarHBondContact O-N 2.91Å; C28-K30 VanDerWaalsContact C-N 3.26Å; C28-K30 PolarHBondContact O-N 2.95Å; K30-L33 PolarHBondContact O-N 2.93Å; K30-L34 PolarHBondContact O-N 3.33Å; K30-Y111 PolarHBondContact NZ-OH 3.49Å; K30-I114 HydrophobicContact CB-CD1 3.68Å
31I81.2Confident72.7Confident0 Ų050.3 Ų50.30%027%0.267CS..Hα-helixtrans-67.8-43.2173.6-51.7173.8000110.1C28 L33 L34 L35 L88 N91 A110 I114C28-I31 PolarHBondContact O-N 2.89Å; I31-L33 VanDerWaalsContact C-N 3.3Å; I31-L33 PolarHBondContact O-N 3.11Å; I31-L34 PolarHBondContact O-N 2.74Å; I31-L35 WeakPolarHBondContact O-CB 3.37Å; I31-L35 PolarHBondContact O-N 3.21Å; I31-L88 HydrophobicContact CB-CD1 4.36Å; I31-L88 HydrophobicContact CG2-CB 4.39Å; I31-L88 HydrophobicContact CG2-CD1 4.32Å; I31-N91 WeakPolarHBondContact CD1-ND2 3.32Å; I31-A110 HydrophobicContact CD1-CB 3.92Å; I31-A110 HydrophobicContact CG1-CB 4Å; I31-I114 HydrophobicContact CG1-CD1 4.47Å; I31-I114 HydrophobicContact CG1-CG1 4.19Å
32I81.7Confident75.6Confident21 Ų2145.1 Ų45.111%0.10824%0.24CC..Hα-helixtrans-58.5-42.5176.4-77.2163.6000111.3C28 Y29 L35 A36 L88 Y249C28-I32 PolarHBondContact O-N 3.46Å; C28-I32 VanDerWaalsContact O-N 3.1Å; Y29-I32 PolarHBondContact O-N 2.93Å; I32-L35 PolarHBondContact O-N 3.46Å; I32-A36 WeakPolarHBondContact O-CB 3.26Å; I32-A36 PolarHBondContact O-N 2.54Å; I32-L88 HydrophobicContact CG1-CD1 4.11Å; I32-L88 HydrophobicContact CG1-CD2 4.33Å; I32-Y249 HydrophobicContact CG2-CE1 3.91Å; I32-Y249 HydrophobicContact CG2-CE2 4.22Å; I32-Y249 WeakPolarHBondContact CG2-OH 3.32Å
33L82.4Confident78.1Confident87 Ų8744 Ų4446%0.45523%0.233SC..Hα-helixtrans-64.6-45.1176.3179.963.6000111.5L24 Y29 K30 I31 L35 A36 L37L24-L33 HydrophobicContact CD2-CB 4.32Å; L24-L33 HydrophobicContact CD2-CD2 3.98Å; Y29-L33 WeakPolarHBondContact O-CB 3.37Å; Y29-L33 PolarHBondContact O-N 2.92Å; K30-L33 PolarHBondContact O-N 2.93Å; I31-L33 VanDerWaalsContact C-N 3.3Å; I31-L33 PolarHBondContact O-N 3.11Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.26Å; L33-A36 PolarHBondContact O-N 2.99Å; L33-L37 WeakPolarHBondContact O-CG 3.48Å; L33-L37 PolarHBondContact O-N 3.22Å
34L89.2Confident80.5Confident24 Ų2444.5 Ų44.513%0.12624%0.241CC..Hα-helixtrans-58.3-46.6174.6176.865.4000111.2K30 I31 A36 L37 I38 I114 V117 L118K30-L34 PolarHBondContact O-N 3.33Å; I31-L34 PolarHBondContact O-N 2.74Å; L34-A36 VanDerWaalsContact C-N 3.33Å; L34-A36 PolarHBondContact O-N 3.27Å; L34-L37 PolarHBondContact O-N 3.33Å; L34-I38 HydrophobicContact CD1-CD1 4.25Å; L34-I38 HydrophobicContact CG-CD1 3.87Å; L34-I38 WeakPolarHBondContact O-CD1 3.41Å; L34-I38 VanDerWaalsContact O-CG1 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.18Å; L34-I38 PolarHBondContact O-N 3.42Å; L34-I114 HydrophobicContact CD2-CB 4.32Å; L34-I114 HydrophobicContact CD2-CG1 4.13Å; L34-I114 HydrophobicContact CD2-CG2 4.16Å; L34-V117 HydrophobicContact CD2-CB 3.95Å; L34-V117 HydrophobicContact CD2-CG1 3.77Å; L34-V117 HydrophobicContact CG-CG1 4.45Å; L34-L118 HydrophobicContact CD1-CD2 3.84Å; L34-L118 HydrophobicContact CD1-CG 4.48Å; L34-L118 HydrophobicContact CD2-CG 4.47Å
35L90.2Very high82.9Confident1 Ų142.1 Ų42.11%0.00523%0.228CC..Hα-helixtrans-59.4-43.8176.4178.458.8000111.2I31 I32 L33 L37 I38 D39 A81 A84I31-L35 WeakPolarHBondContact O-CB 3.37Å; I31-L35 PolarHBondContact O-N 3.21Å; I32-L35 PolarHBondContact O-N 3.46Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.26Å; L35-L37 VanDerWaalsContact C-N 3.32Å; L35-L37 PolarHBondContact O-N 3.47Å; L35-I38 WeakPolarHBondContact O-CB 3.38Å; L35-I38 PolarHBondContact O-N 3.45Å; L35-D39 WeakPolarHBondContact CG-OD2 3.2Å; L35-D39 WeakPolarHBondContact O-CB 3.36Å; L35-D39 VanDerWaalsContact O-CG 3.24Å; L35-D39 PolarHBondContact O-N 2.9Å; L35-A81 HydrophobicContact CD1-CB 4.33Å; L35-A84 HydrophobicContact CB-CB 4.4Å; L35-A84 HydrophobicContact CD1-CB 4.02Å
36A88.1Confident85.2Confident26 Ų2636.2 Ų36.222%0.21520%0.198CC..Hα-helixtrans-60.6-39.6176.700000112.6I32 L33 L34 D39 I40I32-A36 WeakPolarHBondContact O-CB 3.26Å; I32-A36 PolarHBondContact O-N 2.54Å; L33-A36 PolarHBondContact O-N 2.99Å; L34-A36 VanDerWaalsContact C-N 3.33Å; L34-A36 PolarHBondContact O-N 3.27Å; A36-D39 PolarHBondContact O-N 3.5Å; A36-I40 WeakPolarHBondContact O-CD1 3.03Å; A36-I40 VanDerWaalsContact O-CG1 3.22Å; A36-I40 WeakPolarHBondContact O-CG1 3.47Å; A36-I40 PolarHBondContact O-N 2.89Å
37L90.6Very high86.9Confident100 Ų10035.3 Ų35.352%0.52420%0.196SC..Hα-helixtrans-65.2-43.5174.7-67.8174.4000111.7L33 L34 L35 D39 I40 T41L33-L37 WeakPolarHBondContact O-CG 3.48Å; L33-L37 PolarHBondContact O-N 3.22Å; L34-L37 PolarHBondContact O-N 3.33Å; L35-L37 VanDerWaalsContact C-N 3.32Å; L35-L37 PolarHBondContact O-N 3.47Å; L37-D39 VanDerWaalsContact C-N 3.33Å; L37-D39 PolarHBondContact O-N 3.23Å; L37-I40 PolarHBondContact O-N 3.05Å; L37-T41 PolarHBondContact O-N 3.38Å; L37-T41 PolarHBondContact O-OG1 3.49Å
38I94.7Very high88.4Confident8 Ų840.5 Ų40.54%0.04122%0.222CC..Hα-helixtrans-59.4-46.4175.2-66.9158.4000110.4L34 L35 I40 T41 A42 T77 M80 A81 A84 V117L34-I38 HydrophobicContact CD1-CD1 4.25Å; L34-I38 HydrophobicContact CG-CD1 3.87Å; L34-I38 WeakPolarHBondContact O-CD1 3.41Å; L34-I38 VanDerWaalsContact O-CG1 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.18Å; L34-I38 PolarHBondContact O-N 3.42Å; L35-I38 WeakPolarHBondContact O-CB 3.38Å; L35-I38 PolarHBondContact O-N 3.45Å; I38-I40 PolarHBondContact O-N 3.04Å; I38-T41 PolarHBondContact O-N 2.96Å; I38-A42 WeakPolarHBondContact O-CB 3.48Å; I38-A42 PolarHBondContact O-N 3.45Å; I38-T77 HydrophobicContact CG2-CG2 4.5Å; I38-T77 VanDerWaalsContact CG2-O 3.28Å; I38-T77 WeakPolarHBondContact CG2-O 3.41Å; I38-M80 HydrophobicContact CD1-CB 3.81Å; I38-M80 HydrophobicContact CD1-CE 3.94Å; I38-M80 HydrophobicContact CG1-CB 4.18Å; I38-M80 HydrophobicContact CG1-CE 3.88Å; I38-M80 HydrophobicContact CG2-CB 4.08Å; I38-A81 HydrophobicContact CG2-CB 3.9Å; I38-A84 HydrophobicContact CD1-CB 4.4Å; I38-V117 HydrophobicContact CD1-CG1 3.72Å
39D93.6Very high90Very high10 Ų1041.3 Ų41.35%0.05323%0.225CC..Hα-helixtrans-66.7-35.7-178-72.3-33.6000112.5L35 A36 L37 A42 T43 H242 P245L35-D39 WeakPolarHBondContact CG-OD2 3.2Å; L35-D39 WeakPolarHBondContact O-CB 3.36Å; L35-D39 VanDerWaalsContact O-CG 3.24Å; L35-D39 PolarHBondContact O-N 2.9Å; A36-D39 PolarHBondContact O-N 3.5Å; L37-D39 VanDerWaalsContact C-N 3.33Å; L37-D39 PolarHBondContact O-N 3.23Å; D39-A42 PolarHBondContact O-N 2.7Å; D39-T43 WeakPolarHBondContact O-CB 3.11Å; D39-T43 PolarHBondContact O-N 3.06Å; D39-T43 PolarHBondContact O-OG1 3.01Å; D39-H242 HydrophobicContact CB-CB 4.4Å; D39-H242 IonicContact OD1-CE1 3.53Å; D39-H242 IonicContact OD1-CG 3.82Å; D39-H242 IonicContact OD1-ND1 3.1Å; D39-H242 PolarHBondContact OD1-ND1 2.88Å; D39-P245 WeakPolarHBondContact OD2-CG 3.49Å
40I93.1Very high91.3Very high106 Ų10639.2 Ų39.254%0.54422%0.217SC..Hα-helixtrans-60.4-49.6172.2-71.1162.7000109.7A36 L37 I38 T43 C44A36-I40 WeakPolarHBondContact O-CD1 3.03Å; A36-I40 VanDerWaalsContact O-CG1 3.22Å; A36-I40 WeakPolarHBondContact O-CG1 3.47Å; A36-I40 PolarHBondContact O-N 2.89Å; L37-I40 PolarHBondContact O-N 3.05Å; I38-I40 PolarHBondContact O-N 3.04Å; I40-T43 PolarHBondContact O-N 3.17Å; I40-C44 PolarHBondContact O-N 3.3Å; I40-C44 VanDerWaalsContact O-N 3.08Å; I40-C44 PolarHBondContact O-SG 3.33Å; I40-C44 VanDerWaalsContact O-SG 3.35Å
41T95.1Very high92.1Very high61 Ų6137.3 Ų37.337%0.37422%0.217SC..Hα-helixtrans-64-44.5179.4-52.70000111.7L37 I38 T43 C44 C45 I73 T77L37-T41 PolarHBondContact O-N 3.38Å; L37-T41 PolarHBondContact O-OG1 3.49Å; I38-T41 PolarHBondContact O-N 2.96Å; T41-T43 VanDerWaalsContact C-N 3.32Å; T41-T43 PolarHBondContact O-N 3.24Å; T41-C44 WeakPolarHBondContact O-CB 3.01Å; T41-C44 PolarHBondContact O-N 3.1Å; T41-C45 PolarHBondContact O-N 3Å; T41-C45 VanDerWaalsContact O-N 3.13Å; T41-I73 HydrophobicContact CG2-CG2 3.47Å; T41-I73 VanDerWaalsContact CG2-CG2 3.47Å; T41-T77 HydrophobicContact CG2-CG2 3.73Å
42A96.2Very high92.8Very high0 Ų040.1 Ų40.10%024%0.235CC..Hα-helixtrans-64.3-37.2178.900000112.2I38 D39 C44 C45 S46 H242I38-A42 WeakPolarHBondContact O-CB 3.48Å; I38-A42 PolarHBondContact O-N 3.45Å; D39-A42 PolarHBondContact O-N 2.7Å; A42-C44 VanDerWaalsContact C-N 3.35Å; A42-C45 WeakPolarHBondContact O-CB 3.44Å; A42-C45 PolarHBondContact O-N 3.49Å; A42-C45 VanDerWaalsContact O-N 3.17Å; A42-S46 PolarHBondContact O-N 3.38Å; A42-S46 PolarHBondContact O-OG 3.26Å; A42-H242 HydrophobicContact CB-CB 4.12Å; A42-H242 VanDerWaalsContact CB-CG 3.43Å; A42-H242 WeakPolarHBondContact CB-ND1 3.46Å
43T95.3Very high93.5Very high41 Ų4139.3 Ų39.325%0.25223%0.231SC..Hα-helixtrans-65.2-37.9175-610000111.4D39 I40 T41 C45 S46 C47 H242D39-T43 WeakPolarHBondContact O-CB 3.11Å; D39-T43 PolarHBondContact O-N 3.06Å; D39-T43 PolarHBondContact O-OG1 3.01Å; I40-T43 PolarHBondContact O-N 3.17Å; T41-T43 VanDerWaalsContact C-N 3.32Å; T41-T43 PolarHBondContact O-N 3.24Å; T43-C45 VanDerWaalsContact C-N 3.32Å; T43-C45 PolarHBondContact O-N 3.06Å; T43-S46 PolarHBondContact O-N 3.17Å; T43-S46 PolarHBondContact O-OG 2.88Å; T43-C47 VanDerWaalsContact O-CB 3.26Å; T43-C47 WeakPolarHBondContact O-CB 3.38Å; T43-C47 PolarHBondContact O-N 3.29Å; T43-H242 WeakPolarHBondContact OG1-CB 3.29Å
44C94.9Very high94.1Very high50 Ų5038.5 Ų38.534%0.33823%0.227SC..Iπ-helixtrans-59.6-44.2171.4-68.60000111I40 T41 A42 L48 I49I40-C44 PolarHBondContact O-N 3.3Å; I40-C44 VanDerWaalsContact O-N 3.08Å; I40-C44 PolarHBondContact O-SG 3.33Å; I40-C44 VanDerWaalsContact O-SG 3.35Å; T41-C44 WeakPolarHBondContact O-CB 3.01Å; T41-C44 PolarHBondContact O-N 3.1Å; A42-C44 VanDerWaalsContact C-N 3.35Å; C44-L48 CarbonylContact O-C 3.53Å; C44-L48 WeakPolarHBondContact O-CA 3.1Å; C44-L48 WeakPolarHBondContact O-CB 3.43Å; C44-L48 PolarHBondContact O-N 2.85Å; C44-I49 PolarHBondContact O-N 3.4Å
45C95.6Very high94.5Very high3 Ų344.7 Ų44.72%0.0226%0.258CS..Iπ-helixtrans-63.1-51.1176.3-65.90000112.3T41 A42 T43 C47 T50 A74 W238T41-C45 PolarHBondContact O-N 3Å; T41-C45 VanDerWaalsContact O-N 3.13Å; A42-C45 WeakPolarHBondContact O-CB 3.44Å; A42-C45 PolarHBondContact O-N 3.49Å; A42-C45 VanDerWaalsContact O-N 3.17Å; T43-C45 VanDerWaalsContact C-N 3.32Å; T43-C45 PolarHBondContact O-N 3.06Å; C45-C47 VanDerWaalsContact C-N 3.35Å; C45-C47 PolarHBondContact O-N 2.89Å; C45-T50 WeakPolarHBondContact O-CB 3.48Å; C45-T50 PolarHBondContact O-N 2.99Å; C45-T50 VanDerWaalsContact O-N 3.07Å; C45-T50 PolarHBondContact O-OG1 3.49Å; C45-A74 HydrophobicContact CB-CB 3.89Å; C45-W238 HydrophobicContact CB-CH2 4.16Å; C45-W238 HydrophobicContact CB-CZ2 4.25Å
46S95.1Very high94.7Very high6 Ų649.5 Ų49.54%0.04228%0.282CS..Iπ-helixtrans-73-25.1-17470.50000113.7A42 T43 T50A42-S46 PolarHBondContact O-N 3.38Å; A42-S46 PolarHBondContact O-OG 3.26Å; T43-S46 PolarHBondContact O-N 3.17Å; T43-S46 PolarHBondContact O-OG 2.88Å; S46-T50 WeakPolarHBondContact O-CB 3.18Å
47C94.5Very high95.1Very high43 Ų4350.2 Ų50.229%0.29129%0.292SS..Iπ-helixtrans-113.8-62.5-175.9-55.20000112.5T43 C45 I49 G51 T239T43-C47 VanDerWaalsContact O-CB 3.26Å; T43-C47 WeakPolarHBondContact O-CB 3.38Å; T43-C47 PolarHBondContact O-N 3.29Å; C45-C47 VanDerWaalsContact C-N 3.35Å; C45-C47 PolarHBondContact O-N 2.89Å; C47-I49 VanDerWaalsContact C-N 3.31Å; C47-I49 PolarHBondContact O-N 2.88Å; C47-G51 PolarHBondContact O-N 3.07Å; C47-T239 WeakPolarHBondContact SG-CG2 3.46Å
48L94.4Very high95.4Very high127 Ų12745.5 Ų45.567%0.66527%0.267SS*.Iπ-helixtrans-75.1-21.4-169.5-59.3-177.9000113.2C44 P52C44-L48 CarbonylContact O-C 3.53Å; C44-L48 WeakPolarHBondContact O-CA 3.1Å; C44-L48 WeakPolarHBondContact O-CB 3.43Å; C44-L48 PolarHBondContact O-N 2.85Å; L48-P52 WeakPolarHBondContact O-CD 3.18Å; L48-P52 WeakPolarHBondContact O-CG 3.24Å
49I96.3Very high95.4Very high34 Ų3447.4 Ų47.417%0.17428%0.28CS..Iπ-helixtrans-99.1-58.3174.8-61.1178.8000109.9C44 C47 G51 P52 M53 F66 A70 W140C44-I49 PolarHBondContact O-N 3.4Å; C47-I49 VanDerWaalsContact C-N 3.31Å; C47-I49 PolarHBondContact O-N 2.88Å; I49-G51 PolarHBondContact O-N 3.23Å; I49-P52 WeakPolarHBondContact O-CD 3.22Å; I49-M53 HydrophobicContact CG2-CG 4.44Å; I49-M53 HydrophobicContact CG2-SD 3.54Å; I49-M53 VanDerWaalsContact CG2-SD 3.54Å; I49-M53 WeakPolarHBondContact O-CB 3.39Å; I49-M53 VanDerWaalsContact O-CG 3.23Å; I49-M53 WeakPolarHBondContact O-CG 3.41Å; I49-M53 PolarHBondContact O-N 2.9Å; I49-F66 HydrophobicContact CD1-CZ 4.32Å; I49-F66 HydrophobicContact CG1-CZ 4.26Å; I49-F66 HydrophobicContact CG2-CE1 3.83Å; I49-F66 HydrophobicContact CG2-CZ 3.85Å; I49-A70 HydrophobicContact CD1-CB 4.05Å; I49-A70 HydrophobicContact CG2-CB 4.27Å; I49-W140 HydrophobicContact CG2-CH2 4Å; I49-W140 HydrophobicContact CG2-CZ2 3.98Å
50T96.4Very high95.3Very high7 Ų749 Ų494%0.04329%0.286CS..Hα-helixtrans-60-41.1-175.1-59.60000112.8C45 S46 M53 L54 Y133 W140C45-T50 WeakPolarHBondContact O-CB 3.48Å; C45-T50 PolarHBondContact O-N 2.99Å; C45-T50 VanDerWaalsContact O-N 3.07Å; C45-T50 PolarHBondContact O-OG1 3.49Å; S46-T50 WeakPolarHBondContact O-CB 3.18Å; T50-M53 PolarHBondContact O-N 3.39Å; T50-L54 WeakPolarHBondContact O-CB 3.27Å; T50-L54 PolarHBondContact O-N 2.92Å; T50-Y133 HydrophobicContact CG2-CD2 4.26Å; T50-Y133 HydrophobicContact CG2-CE2 3.53Å; T50-W140 PolarHBondContact OG1-NE1 2.82Å
51G95.4Very high95.3Very high28 Ų2848.4 Ų48.429%0.28929%0.29SS..Hα-helixtrans-61.7-56.6-17800000113.5C47 I49 M53 L54 I55C47-G51 PolarHBondContact O-N 3.07Å; I49-G51 PolarHBondContact O-N 3.23Å; G51-M53 VanDerWaalsContact C-N 3.3Å; G51-M53 PolarHBondContact O-N 3.36Å; G51-L54 WeakPolarHBondContact O-CB 3.45Å; G51-L54 PolarHBondContact O-N 3.47Å; G51-I55 WeakPolarHBondContact O-CG1 3.44Å; G51-I55 PolarHBondContact O-N 3.05Å; G51-I55 VanDerWaalsContact O-N 3.11Å
52P96.6Very high95.3Very high59 Ų5950 Ų5038%0.38329%0.294SS..Hα-helixtrans-58.6-39.3174.7-28.737.4000113.5L48 I49 L54 I55 M56L48-P52 WeakPolarHBondContact O-CD 3.18Å; L48-P52 WeakPolarHBondContact O-CG 3.24Å; I49-P52 WeakPolarHBondContact O-CD 3.22Å; P52-L54 VanDerWaalsContact C-N 3.32Å; P52-L54 PolarHBondContact O-N 2.7Å; P52-I55 PolarHBondContact O-N 3.14Å; P52-M56 HydrophobicContact CB-CE 4.27Å; P52-M56 WeakPolarHBondContact O-CB 3.5Å; P52-M56 WeakPolarHBondContact O-CE 3.24Å; P52-M56 WeakPolarHBondContact O-CG 3.36Å; P52-M56 PolarHBondContact O-N 3.12Å
53M96Very high95.2Very high5 Ų555 Ų553%0.02531%0.314CS..Hα-helixtrans-61.3-40.1176.5-75.5-176.38400112.4I49 T50 G51 G57 T58 F66 T67 Y133 S135 W140I49-M53 HydrophobicContact CG2-CG 4.44Å; I49-M53 HydrophobicContact CG2-SD 3.54Å; I49-M53 VanDerWaalsContact CG2-SD 3.54Å; I49-M53 WeakPolarHBondContact O-CB 3.39Å; I49-M53 VanDerWaalsContact O-CG 3.23Å; I49-M53 WeakPolarHBondContact O-CG 3.41Å; I49-M53 PolarHBondContact O-N 2.9Å; T50-M53 PolarHBondContact O-N 3.39Å; G51-M53 VanDerWaalsContact C-N 3.3Å; G51-M53 PolarHBondContact O-N 3.36Å; M53-G57 PolarHBondContact O-N 3.29Å; M53-G57 VanDerWaalsContact O-N 3.13Å; M53-T58 HydrophobicContact CB-CG2 4.34Å; M53-T58 VanDerWaalsContact CB-OG1 3.29Å; M53-T58 WeakPolarHBondContact CB-OG1 3.49Å; M53-T58 WeakPolarHBondContact CE-OG1 3.35Å; M53-T58 HydrophobicContact CG-CG2 4.37Å; M53-T58 PolarHBondContact O-N 3.32Å; M53-T58 PolarHBondContact O-OG1 2.84Å; M53-F66 HydrophobicContact SD-CE1 4.01Å; M53-T67 HydrophobicContact CE-CG2 4Å; M53-T67 VanDerWaalsContact CE-OG1 3.25Å; M53-T67 WeakPolarHBondContact CE-OG1 3.33Å; M53-Y133 HydrophobicContact CB-CD1 3.6Å; M53-Y133 HydrophobicContact CB-CE1 3.71Å; M53-Y133 HydrophobicContact CE-CD1 3.91Å; M53-Y133 HydrophobicContact CE-CG 4.2Å; M53-Y133 HydrophobicContact CG-CD1 4.46Å; M53-Y133 HydrophobicContact SD-CD1 4.2Å; M53-Y133 HydrophobicContact SD-CG 4.4Å; M53-S135 PolarHBondContact O-OG 3.46Å; M53-W140 HydrophobicContact SD-CH2 4.25Å; M53-W140 HydrophobicContact SD-CZ2 4.43Å
54L95.6Very high95.2Very high70 Ų7055.6 Ų55.637%0.36632%0.319SS..Hα-helixtrans-61.9-49.6173.8-177.860.5000111.5T50 G51 P52 M56 G57 Y133 M138T50-L54 WeakPolarHBondContact O-CB 3.27Å; T50-L54 PolarHBondContact O-N 2.92Å; G51-L54 WeakPolarHBondContact O-CB 3.45Å; G51-L54 PolarHBondContact O-N 3.47Å; P52-L54 VanDerWaalsContact C-N 3.32Å; P52-L54 PolarHBondContact O-N 2.7Å; L54-M56 VanDerWaalsContact C-N 3.3Å; L54-M56 PolarHBondContact O-N 3.31Å; L54-G57 PolarHBondContact O-N 3.01Å; L54-Y133 WeakPolarHBondContact CB-OH 3.45Å; L54-M138 HydrophobicContact CD1-CE 4.27Å; L54-M138 HydrophobicContact CD1-CG 4.09Å; L54-M138 HydrophobicContact CD2-CE 4.2Å
55I96.4Very high95.2Very high153 Ų15358.6 Ų58.679%0.78534%0.335SS*.Hα-helixtrans-61.9-39.1-178.8-65.8168.4000111.4G51 P52 G57G51-I55 WeakPolarHBondContact O-CG1 3.44Å; G51-I55 PolarHBondContact O-N 3.05Å; G51-I55 VanDerWaalsContact O-N 3.11Å; P52-I55 PolarHBondContact O-N 3.14Å; I55-G57 VanDerWaalsContact C-N 3.25Å; I55-G57 PolarHBondContact O-N 3.28Å
56M95.7Very high95.3Very high103 Ų10363.5 Ų63.551%0.50736%0.357SS..THydrogen-bonded Turntrans-76.2-9.5177.3-70.5-174-67.500113.6P52 L54 T58P52-M56 HydrophobicContact CB-CE 4.27Å; P52-M56 WeakPolarHBondContact O-CB 3.5Å; P52-M56 WeakPolarHBondContact O-CE 3.24Å; P52-M56 WeakPolarHBondContact O-CG 3.36Å; P52-M56 PolarHBondContact O-N 3.12Å; L54-M56 VanDerWaalsContact C-N 3.3Å; L54-M56 PolarHBondContact O-N 3.31Å; M56-T58 HydrophobicContact CB-CG2 3.77Å; M56-T58 HydrophobicContact CE-CG2 4.06Å
57G96Very high95.3Very high41 Ų4163.2 Ų63.242%0.42336%0.355SS..THydrogen-bonded Turntrans66.833.8-17700000113.5M53 L54 I55M53-G57 PolarHBondContact O-N 3.29Å; M53-G57 VanDerWaalsContact O-N 3.13Å; L54-G57 PolarHBondContact O-N 3.01Å; I55-G57 VanDerWaalsContact C-N 3.25Å; I55-G57 PolarHBondContact O-N 3.28Å
58T95.8Very high95.4Very high0 Ų067.6 Ų67.60%037%0.366CS..  trans-68141.6-171.8620000114.1M53 M56 M62 Y63 S135M53-T58 HydrophobicContact CB-CG2 4.34Å; M53-T58 VanDerWaalsContact CB-OG1 3.29Å; M53-T58 WeakPolarHBondContact CB-OG1 3.49Å; M53-T58 WeakPolarHBondContact CE-OG1 3.35Å; M53-T58 HydrophobicContact CG-CG2 4.37Å; M53-T58 PolarHBondContact O-N 3.32Å; M53-T58 PolarHBondContact O-OG1 2.84Å; M56-T58 HydrophobicContact CB-CG2 3.77Å; M56-T58 HydrophobicContact CE-CG2 4.06Å; T58-M62 HydrophobicContact CG2-SD 4.44Å; T58-Y63 HydrophobicContact CG2-CD2 3.92Å; T58-Y63 HydrophobicContact CG2-CE2 3.75Å; T58-S135 PolarHBondContact N-OG 2.9Å; T58-S135 VanDerWaalsContact N-OG 3.08Å; T58-S135 WeakPolarHBondContact O-CB 3.49Å; T58-S135 PolarHBondContact O-N 3.1Å; T58-S135 PolarHBondContact O-OG 2.74Å; T58-S135 VanDerWaalsContact O-OG 3.12Å
59V94.6Very high95.5Very high49 Ų4964.9 Ų64.930%0.29736%0.355SS..  trans-119.3167.5165.5-62.70000109.9C61 M62V59-C61 VanDerWaalsContact C-N 3.27Å; V59-C61 PolarHBondContact O-N 3.38Å; V59-C61 VanDerWaalsContact O-N 3.16Å; V59-M62 HydrophobicContact CG2-CG 4.07Å; V59-M62 HydrophobicContact CG2-SD 4.37Å; V59-M62 PolarHBondContact O-N 3.35Å
60F92.7Very high95.5Very high44 Ų4463.5 Ų63.519%0.19335%0.348CS..G310 helixtrans-49.1-45.9-176176.3-110.1000113.3M62 Y63 P64 V132 P144F60-M62 PolarHBondContact O-N 3.42Å; F60-M62 VanDerWaalsContact O-N 3.08Å; F60-Y63 CarbonylContact O-C 3.57Å; F60-Y63 PolarHBondContact O-N 2.85Å; F60-P64 HydrophobicContact CD2-CB 4.4Å; F60-P64 HydrophobicContact CE1-CB 4.05Å; F60-P64 HydrophobicContact CE2-CB 3.85Å; F60-P64 HydrophobicContact CZ-CB 3.66Å; F60-P64 VanDerWaalsContact O-CA 3.3Å; F60-P64 WeakPolarHBondContact O-CA 3.46Å; F60-P64 WeakPolarHBondContact O-CD 3.22Å; F60-P64 VanDerWaalsContact O-N 3.16Å; F60-V132 HydrophobicContact CB-CG2 4.41Å; F60-V132 HydrophobicContact CD2-CB 3.91Å; F60-V132 HydrophobicContact CD2-CG1 3.68Å; F60-V132 HydrophobicContact CD2-CG2 4.12Å; F60-V132 HydrophobicContact CE2-CG1 3.86Å; F60-V132 HydrophobicContact CG-CG2 4.48Å; F60-P144 HydrophobicContact CB-CB 4.12Å; F60-P144 HydrophobicContact CD1-CB 3.55Å; F60-P144 HydrophobicContact CD2-CB 4.2Å; F60-P144 HydrophobicContact CE1-CB 3.95Å; F60-P144 HydrophobicContact CG-CB 3.68Å; F60-P144 HydrophobicContact CZ-CB 4.43Å
61C92.6Very high95.6Very high93 Ų9363.1 Ų63.163%0.62835%0.346SS*.G310 helixtrans-62.9-17.3-176.3-58.20000114.9V59V59-C61 VanDerWaalsContact C-N 3.27Å; V59-C61 PolarHBondContact O-N 3.38Å; V59-C61 VanDerWaalsContact O-N 3.16Å
62M95Very high95.6Very high93 Ų9362.1 Ų62.146%0.45834%0.335SS..G310 helixtrans-78.2-37.7179.4-63.8-179.970.300112.4T58 V59 F60T58-M62 HydrophobicContact CG2-SD 4.44Å; V59-M62 HydrophobicContact CG2-CG 4.07Å; V59-M62 HydrophobicContact CG2-SD 4.37Å; V59-M62 PolarHBondContact O-N 3.35Å; F60-M62 PolarHBondContact O-N 3.42Å; F60-M62 VanDerWaalsContact O-N 3.08Å
63Y95.3Very high95.7Very high105 Ų10562.1 Ų62.141%0.41233%0.332SS..SBendtrans-143.657.3-174.9-57-72.7000111.6T58 F60 T65 F66 T67T58-Y63 HydrophobicContact CG2-CD2 3.92Å; T58-Y63 HydrophobicContact CG2-CE2 3.75Å; F60-Y63 CarbonylContact O-C 3.57Å; F60-Y63 PolarHBondContact O-N 2.85Å; Y63-T65 PolarHBondContact O-N 3Å; Y63-F66 PolarHBondContact O-N 3.31Å; Y63-T67 WeakPolarHBondContact O-CB 3.32Å; Y63-T67 PolarHBondContact O-N 3.02Å; Y63-T67 PolarHBondContact O-OG1 3.49Å; Y63-T67 VanDerWaalsContact O-OG1 3.05Å
64P94.6Very high95.8Very high55 Ų5562 Ų6236%0.35733%0.332SS..Hα-helixtrans-58.7-50.2-165.221.5-33.4000112.8F60 F66 Y68F60-P64 HydrophobicContact CD2-CB 4.4Å; F60-P64 HydrophobicContact CE1-CB 4.05Å; F60-P64 HydrophobicContact CE2-CB 3.85Å; F60-P64 HydrophobicContact CZ-CB 3.66Å; F60-P64 VanDerWaalsContact O-CA 3.3Å; F60-P64 WeakPolarHBondContact O-CA 3.46Å; F60-P64 WeakPolarHBondContact O-CD 3.22Å; F60-P64 VanDerWaalsContact O-N 3.16Å; P64-F66 PolarHBondContact O-N 3.2Å; P64-Y68 WeakPolarHBondContact O-CB 3.45Å; P64-Y68 PolarHBondContact O-N 3.38Å
65T95.7Very high95.8Very high112 Ų11259.1 Ų59.169%0.68732%0.316SS*.Hα-helixtrans-63-44.1-180-49.70000112.3Y63 V69Y63-T65 PolarHBondContact O-N 3Å; T65-V69 WeakPolarHBondContact O-CG2 3.44Å; T65-V69 PolarHBondContact O-N 3.22Å; T65-V69 VanDerWaalsContact O-N 3.12Å
66F96.8Very high95.9Very high106 Ų10652.4 Ų52.447%0.46528%0.283SS..Hα-helixtrans-64.7-50.5-179172.2-99.9000110.9I49 M53 Y63 P64 Y68 V69 A70I49-F66 HydrophobicContact CD1-CZ 4.32Å; I49-F66 HydrophobicContact CG1-CZ 4.26Å; I49-F66 HydrophobicContact CG2-CE1 3.83Å; I49-F66 HydrophobicContact CG2-CZ 3.85Å; M53-F66 HydrophobicContact SD-CE1 4.01Å; Y63-F66 PolarHBondContact O-N 3.31Å; P64-F66 PolarHBondContact O-N 3.2Å; F66-Y68 VanDerWaalsContact C-N 3.32Å; F66-Y68 PolarHBondContact O-N 3.28Å; F66-V69 PolarHBondContact O-N 2.87Å; F66-A70 WeakPolarHBondContact O-CB 3.5Å; F66-A70 PolarHBondContact O-N 3.45Å
67T95.5Very high95.9Very high0 Ų047.9 Ų47.90%026%0.261CS..Hα-helixtrans-63.8-39-179.2-570000111.6M53 Y63 G71 V132 W140M53-T67 HydrophobicContact CE-CG2 4Å; M53-T67 VanDerWaalsContact CE-OG1 3.25Å; M53-T67 WeakPolarHBondContact CE-OG1 3.33Å; Y63-T67 WeakPolarHBondContact O-CB 3.32Å; Y63-T67 PolarHBondContact O-N 3.02Å; Y63-T67 PolarHBondContact O-OG1 3.49Å; Y63-T67 VanDerWaalsContact O-OG1 3.05Å; T67-G71 PolarHBondContact O-N 3.03Å; T67-V132 HydrophobicContact CG2-CB 3.65Å; T67-V132 HydrophobicContact CG2-CG1 4.11Å; T67-W140 HydrophobicContact CG2-CZ3 4.07Å
68Y95.4Very high96Very high135 Ų13546.6 Ų46.653%0.52924%0.244SC..Hα-helixtrans-60-50.5176.3-176.2-87.2000112P64 F66 G72 T130P64-Y68 WeakPolarHBondContact O-CB 3.45Å; P64-Y68 PolarHBondContact O-N 3.38Å; F66-Y68 VanDerWaalsContact C-N 3.32Å; F66-Y68 PolarHBondContact O-N 3.28Å; Y68-G72 PolarHBondContact O-N 3.47Å; Y68-G72 VanDerWaalsContact O-N 3.1Å; Y68-T130 HydrophobicContact CD1-CG2 4.42Å; Y68-T130 HydrophobicContact CD2-CG2 3.32Å; Y68-T130 HydrophobicContact CE1-CG2 4.42Å; Y68-T130 HydrophobicContact CE2-CG2 3.33Å; Y68-T130 HydrophobicContact CG-CG2 3.89Å; Y68-T130 PolarHBondContact O-OG1 2.73Å; Y68-T130 VanDerWaalsContact O-OG1 3.11Å
69V96.9Very high96Very high70 Ų7046.6 Ų46.642%0.42424%0.244SC..Hα-helixtrans-68-47.1179.9174.30000111.2T65 F66 G71 G72 I73T65-V69 WeakPolarHBondContact O-CG2 3.44Å; T65-V69 PolarHBondContact O-N 3.22Å; T65-V69 VanDerWaalsContact O-N 3.12Å; F66-V69 PolarHBondContact O-N 2.87Å; V69-G71 VanDerWaalsContact C-N 3.26Å; V69-G71 PolarHBondContact O-N 3.46Å; V69-G72 PolarHBondContact O-N 2.85Å; V69-G72 VanDerWaalsContact O-N 3.12Å; V69-I73 HydrophobicContact CG1-CD1 4.18Å; V69-I73 WeakPolarHBondContact O-CG1 3.36Å; V69-I73 PolarHBondContact O-N 3.05Å; V69-I73 VanDerWaalsContact O-N 3.07Å
70A97.3Very high96.2Very high5 Ų545.3 Ų45.34%0.04124%0.235CC..Hα-helixtrans-60.1-39.3179.300000111.7I49 F66 I73 A74 W140I49-A70 HydrophobicContact CD1-CB 4.05Å; I49-A70 HydrophobicContact CG2-CB 4.27Å; F66-A70 WeakPolarHBondContact O-CB 3.5Å; F66-A70 PolarHBondContact O-N 3.45Å; A70-I73 PolarHBondContact O-N 3.34Å; A70-A74 WeakPolarHBondContact O-CB 3.28Å; A70-A74 PolarHBondContact O-N 2.85Å; A70-W140 HydrophobicContact CB-CH2 3.88Å; A70-W140 HydrophobicContact CB-CZ3 4.31Å
71G97Very high96.3Very high0 Ų043.3 Ų43.30%023%0.226CC..Hα-helixtrans-65.4-37.5175.100000113.7T67 V69 I73 A74 I75 T131T67-G71 PolarHBondContact O-N 3.03Å; V69-G71 VanDerWaalsContact C-N 3.26Å; V69-G71 PolarHBondContact O-N 3.46Å; G71-I73 VanDerWaalsContact C-N 3.31Å; G71-I73 PolarHBondContact O-N 3.49Å; G71-A74 PolarHBondContact O-N 3.41Å; G71-I75 WeakPolarHBondContact O-CG2 3.32Å; G71-I75 PolarHBondContact O-N 2.86Å; G71-T131 WeakPolarHBondContact CA-O 3.45Å
72G97.2Very high96.5Very high6 Ų638.9 Ų38.96%0.06220%0.196CC..Hα-helixtrans-64.9-41.6177.200000110.5Y68 V69 I75 S76 T130Y68-G72 PolarHBondContact O-N 3.47Å; Y68-G72 VanDerWaalsContact O-N 3.1Å; V69-G72 PolarHBondContact O-N 2.85Å; V69-G72 VanDerWaalsContact O-N 3.12Å; G72-I75 WeakPolarHBondContact O-CG2 3.21Å; G72-S76 WeakPolarHBondContact O-CB 3.11Å; G72-S76 PolarHBondContact O-N 3.1Å; G72-T130 WeakPolarHBondContact CA-OG1 3.04Å; G72-T130 PolarHBondContact N-OG1 2.79Å
73I97.6Very high96.5Very high60 Ų6034.8 Ų34.831%0.30818%0.177SC..Hα-helixtrans-64.9-45.3173.6-62.6171.3000110.5T41 V69 A70 G71 I75 S76 T77 F125T41-I73 HydrophobicContact CG2-CG2 3.47Å; T41-I73 VanDerWaalsContact CG2-CG2 3.47Å; V69-I73 HydrophobicContact CG1-CD1 4.18Å; V69-I73 WeakPolarHBondContact O-CG1 3.36Å; V69-I73 PolarHBondContact O-N 3.05Å; V69-I73 VanDerWaalsContact O-N 3.07Å; A70-I73 PolarHBondContact O-N 3.34Å; G71-I73 VanDerWaalsContact C-N 3.31Å; G71-I73 PolarHBondContact O-N 3.49Å; I73-I75 PolarHBondContact O-N 2.9Å; I73-S76 PolarHBondContact O-N 3.29Å; I73-T77 HydrophobicContact CG2-CG2 4.19Å; I73-T77 WeakPolarHBondContact O-CB 3.27Å; I73-T77 VanDerWaalsContact O-CG2 3.28Å; I73-T77 WeakPolarHBondContact O-CG2 3.5Å; I73-T77 PolarHBondContact O-N 3.05Å; I73-T77 PolarHBondContact O-OG1 2.88Å; I73-F125 HydrophobicContact CG1-CE2 3.86Å
74A97.3Very high96.4Very high3 Ų329.8 Ų29.83%0.02516%0.158CC..Hα-helixtrans-59.3-48.1-179.400000111.5C45 A70 G71 T77 W78 W238C45-A74 HydrophobicContact CB-CB 3.89Å; A70-A74 WeakPolarHBondContact O-CB 3.28Å; A70-A74 PolarHBondContact O-N 2.85Å; G71-A74 PolarHBondContact O-N 3.41Å; A74-T77 PolarHBondContact O-OG1 3.19Å; A74-W78 VanDerWaalsContact O-CB 3.31Å; A74-W78 WeakPolarHBondContact O-CB 3.34Å; A74-W78 PolarHBondContact O-N 3.04Å; A74-W238 HydrophobicContact CB-CH2 4.02Å; A74-W238 HydrophobicContact CB-CZ2 4.06Å
75I96.4Very high96.3Very high8 Ų827.2 Ų27.24%0.04114%0.141CC..Hα-helixtrans-71.9-39.2-179.5-163.2127000112.7G71 G72 I73 W78 C79 I124 T131 H160 L163G71-I75 WeakPolarHBondContact O-CG2 3.32Å; G71-I75 PolarHBondContact O-N 2.86Å; G72-I75 WeakPolarHBondContact O-CG2 3.21Å; I73-I75 PolarHBondContact O-N 2.9Å; I75-W78 PolarHBondContact O-N 2.92Å; I75-C79 WeakPolarHBondContact O-CB 3.47Å; I75-C79 PolarHBondContact O-N 3.26Å; I75-C79 PolarHBondContact O-SG 3.39Å; I75-C79 VanDerWaalsContact O-SG 3.42Å; I75-I124 HydrophobicContact CG1-CG2 4.3Å; I75-I124 HydrophobicContact CG2-CG2 3.92Å; I75-T131 HydrophobicContact CD1-CG2 3.64Å; I75-H160 VanDerWaalsContact CD1-NE2 3.31Å; I75-H160 WeakPolarHBondContact CD1-NE2 3.28Å; I75-L163 HydrophobicContact CD1-CB 4.06Å; I75-L163 HydrophobicContact CD1-CD1 3.71Å; I75-L163 HydrophobicContact CD1-CD2 3.6Å; I75-L163 HydrophobicContact CD1-CG 3.96Å; I75-L163 HydrophobicContact CG1-CD1 4.19Å
76S97.7Very high96.2Very high12 Ų1223.6 Ų23.68%0.08412%0.119CC..Hα-helixtrans-59.5-50.2174.4176.90000110.6G72 I73 W78 C79 M80 G121G72-S76 WeakPolarHBondContact O-CB 3.11Å; G72-S76 PolarHBondContact O-N 3.1Å; I73-S76 PolarHBondContact O-N 3.29Å; S76-W78 PolarHBondContact O-N 3.5Å; S76-C79 PolarHBondContact O-N 3.36Å; S76-M80 WeakPolarHBondContact O-CB 3.11Å; S76-M80 WeakPolarHBondContact O-CG 3.23Å; S76-M80 PolarHBondContact O-N 3.3Å; S76-G121 PolarHBondContact OG-O 3.38Å; S76-G121 VanDerWaalsContact OG-O 3.09Å
77T96.9Very high96.1Very high9 Ų919.1 Ų19.16%0.05510%0.101CC..Hα-helixtrans-66.9-35.9-179.254.20000112.5I38 T41 I73 A74 M80 A81I38-T77 HydrophobicContact CG2-CG2 4.5Å; I38-T77 VanDerWaalsContact CG2-O 3.28Å; I38-T77 WeakPolarHBondContact CG2-O 3.41Å; T41-T77 HydrophobicContact CG2-CG2 3.73Å; I73-T77 HydrophobicContact CG2-CG2 4.19Å; I73-T77 WeakPolarHBondContact O-CB 3.27Å; I73-T77 VanDerWaalsContact O-CG2 3.28Å; I73-T77 WeakPolarHBondContact O-CG2 3.5Å; I73-T77 PolarHBondContact O-N 3.05Å; I73-T77 PolarHBondContact O-OG1 2.88Å; A74-T77 PolarHBondContact O-OG1 3.19Å; T77-M80 PolarHBondContact O-N 3.32Å; T77-A81 VanDerWaalsContact O-CB 3.29Å; T77-A81 WeakPolarHBondContact O-CB 3.26Å; T77-A81 PolarHBondContact O-N 2.75Å
78W97.2Very high95.7Very high13 Ų1319.3 Ų19.35%0.04910%0.102CC..Hα-helixtrans-56.9-54.3170.8174.6-103.9000112A74 I75 S76 M80 A81 C82 N167 N211 T214 A215 W238 H242A74-W78 VanDerWaalsContact O-CB 3.31Å; A74-W78 WeakPolarHBondContact O-CB 3.34Å; A74-W78 PolarHBondContact O-N 3.04Å; I75-W78 PolarHBondContact O-N 2.92Å; S76-W78 PolarHBondContact O-N 3.5Å; W78-M80 PolarHBondContact O-N 2.77Å; W78-A81 PolarHBondContact O-N 3.4Å; W78-C82 PolarHBondContact O-N 3.49Å; W78-C82 PolarHBondContact O-SG 3.04Å; W78-N167 PolarHBondContact NE1-OD1 3.47Å; W78-N211 HydrophobicContact CH2-CB 4.19Å; W78-N211 WeakPolarHBondContact CH2-OD1 3.16Å; W78-N211 WeakPolarHBondContact CZ2-OD1 3.2Å; W78-T214 HydrophobicContact CH2-CG2 3.52Å; W78-T214 HydrophobicContact CZ2-CG2 3.98Å; W78-T214 HydrophobicContact CZ3-CG2 3.88Å; W78-A215 HydrophobicContact CZ2-CB 4.36Å; W78-W238 AromaticContact CE3-CD1 3.49Å; W78-W238 VanDerWaalsContact CE3-CD1 3.49Å; W78-W238 AromaticContact CE3-NE1 3.63Å; W78-W238 AromaticContact CZ3-CD1 3.53Å; W78-W238 HydrophobicContact CZ3-CG 4.42Å; W78-H242 AromaticContact CE3-NE2 3.68Å
79C97.2Very high95.5Very high0 Ų012.9 Ų12.90%08%0.076CC..Hα-helixtrans-63-41.5179.4-74.20000112.1I75 S76 C82 A83 Y120 I124I75-C79 WeakPolarHBondContact O-CB 3.47Å; I75-C79 PolarHBondContact O-N 3.26Å; I75-C79 PolarHBondContact O-SG 3.39Å; I75-C79 VanDerWaalsContact O-SG 3.42Å; S76-C79 PolarHBondContact O-N 3.36Å; C79-C82 WeakPolarHBondContact O-CB 3.4Å; C79-C82 PolarHBondContact O-N 2.94Å; C79-A83 WeakPolarHBondContact O-CB 3.35Å; C79-A83 PolarHBondContact O-N 3.34Å; C79-Y120 HydrophobicContact CB-CD1 4.19Å; C79-Y120 HydrophobicContact CB-CE1 3.57Å; C79-Y120 WeakPolarHBondContact O-CE1 3.21Å; C79-I124 HydrophobicContact CB-CD1 4.46Å; C79-I124 HydrophobicContact CB-CG1 3.87Å; C79-I124 HydrophobicContact CB-CG2 4.44Å
80M97.1Very high95.2Very high23 Ų2311 Ų1111%0.1137%0.066CC..Hα-helixtrans-62-42.5175.1-71.7173.47900112I38 S76 T77 W78 A83 A84 V117 L118I38-M80 HydrophobicContact CD1-CB 3.81Å; I38-M80 HydrophobicContact CD1-CE 3.94Å; I38-M80 HydrophobicContact CG1-CB 4.18Å; I38-M80 HydrophobicContact CG1-CE 3.88Å; I38-M80 HydrophobicContact CG2-CB 4.08Å; S76-M80 WeakPolarHBondContact O-CB 3.11Å; S76-M80 WeakPolarHBondContact O-CG 3.23Å; S76-M80 PolarHBondContact O-N 3.3Å; T77-M80 PolarHBondContact O-N 3.32Å; W78-M80 PolarHBondContact O-N 2.77Å; M80-A83 PolarHBondContact O-N 3.21Å; M80-A84 WeakPolarHBondContact O-CB 3.32Å; M80-A84 PolarHBondContact O-N 2.94Å; M80-V117 HydrophobicContact CB-CG1 3.99Å; M80-V117 HydrophobicContact CE-CG1 4.09Å; M80-V117 HydrophobicContact CG-CG1 4.3Å; M80-L118 HydrophobicContact CE-CD2 4.03Å
81A95.6Very high94.8Very high1 Ų111.2 Ų11.21%0.0087%0.067CC..Hα-helixtrans-65.3-39.9178.200000111.8L35 I38 T77 W78 A84 T85L35-A81 HydrophobicContact CD1-CB 4.33Å; I38-A81 HydrophobicContact CG2-CB 3.9Å; T77-A81 VanDerWaalsContact O-CB 3.29Å; T77-A81 WeakPolarHBondContact O-CB 3.26Å; T77-A81 PolarHBondContact O-N 2.75Å; W78-A81 PolarHBondContact O-N 3.4Å; A81-A84 PolarHBondContact O-N 2.73Å; A81-T85 VanDerWaalsContact O-CB 3.26Å; A81-T85 WeakPolarHBondContact O-CB 3.42Å; A81-T85 PolarHBondContact O-N 2.69Å; A81-T85 PolarHBondContact O-OG1 3.33Å
82C95.9Very high94.1Very high1 Ų113 Ų131%0.0077%0.074CC..Hα-helixtrans-57.6-55.1171.8-650000110.4W78 C79 A84 T85 T86 F170 N211W78-C82 PolarHBondContact O-N 3.49Å; W78-C82 PolarHBondContact O-SG 3.04Å; C79-C82 WeakPolarHBondContact O-CB 3.4Å; C79-C82 PolarHBondContact O-N 2.94Å; C82-A84 VanDerWaalsContact C-N 3.34Å; C82-A84 PolarHBondContact O-N 3.46Å; C82-T85 PolarHBondContact O-N 3.43Å; C82-T86 PolarHBondContact O-N 2.95Å; C82-T86 PolarHBondContact O-OG1 2.77Å; C82-T86 VanDerWaalsContact O-OG1 3.08Å; C82-F170 HydrophobicContact CB-CB 4.45Å; C82-F170 HydrophobicContact CB-CD2 3.62Å; C82-F170 HydrophobicContact CB-CE2 4.14Å; C82-F170 HydrophobicContact CB-CG 4.14Å; C82-N211 PolarHBondContact SG-ND2 3.49Å
83A95.9Very high93.7Very high7 Ų713.4 Ų13.46%0.0587%0.074CC..Hα-helixtrans-59.7-41.8-179.700000112.8C79 M80 S87 F116 V117 Y120C79-A83 WeakPolarHBondContact O-CB 3.35Å; C79-A83 PolarHBondContact O-N 3.34Å; M80-A83 PolarHBondContact O-N 3.21Å; A83-S87 WeakPolarHBondContact O-CB 3.42Å; A83-S87 PolarHBondContact O-N 2.79Å; A83-S87 PolarHBondContact O-OG 3.29Å; A83-F116 HydrophobicContact CB-CD1 4.28Å; A83-F116 HydrophobicContact CB-CE1 3.69Å; A83-F116 HydrophobicContact CB-CZ 4.38Å; A83-V117 HydrophobicContact CB-CG2 4.04Å; A83-Y120 HydrophobicContact CB-CD1 3.76Å; A83-Y120 HydrophobicContact CB-CE1 4.3Å
84A93.6Very high93.2Very high0 Ų013.2 Ų13.20%07%0.073CC..Hα-helixtrans-67.2-43179.300000111.3L35 I38 M80 A81 C82 S87 L88 V117L35-A84 HydrophobicContact CB-CB 4.4Å; L35-A84 HydrophobicContact CD1-CB 4.02Å; I38-A84 HydrophobicContact CD1-CB 4.4Å; M80-A84 WeakPolarHBondContact O-CB 3.32Å; M80-A84 PolarHBondContact O-N 2.94Å; A81-A84 PolarHBondContact O-N 2.73Å; C82-A84 VanDerWaalsContact C-N 3.34Å; C82-A84 PolarHBondContact O-N 3.46Å; A84-S87 PolarHBondContact O-N 3.3Å; A84-L88 VanDerWaalsContact O-CB 3.27Å; A84-L88 WeakPolarHBondContact O-CB 3.19Å; A84-L88 PolarHBondContact O-N 3.13Å; A84-V117 HydrophobicContact CB-CG1 4.2Å; A84-V117 HydrophobicContact CB-CG2 3.82Å
85T92.8Very high92.5Very high1 Ų113.6 Ų13.61%0.0068%0.075CC..Hα-helixtrans-64.4-47.6177.9-60.60000111.1A81 C82 S87 L88 F89 F170 I207A81-T85 VanDerWaalsContact O-CB 3.26Å; A81-T85 WeakPolarHBondContact O-CB 3.42Å; A81-T85 PolarHBondContact O-N 2.69Å; A81-T85 PolarHBondContact O-OG1 3.33Å; C82-T85 PolarHBondContact O-N 3.43Å; T85-S87 VanDerWaalsContact C-N 3.33Å; T85-S87 PolarHBondContact O-N 3.4Å; T85-L88 PolarHBondContact O-N 3.24Å; T85-F89 WeakPolarHBondContact O-CB 3.41Å; T85-F89 PolarHBondContact O-N 3.47Å; T85-F170 HydrophobicContact CG2-CE2 4.37Å; T85-F170 HydrophobicContact CG2-CZ 4.45Å; T85-I207 HydrophobicContact CG2-CB 4.48Å; T85-I207 HydrophobicContact CG2-CG2 3.87Å
86T93.8Very high91.7Very high36 Ų3613.7 Ų13.722%0.2218%0.076CC..Hα-helixtrans-61.6-42.5176.4-57.80000111.4C82 F89 S90 F170 M174 L177C82-T86 PolarHBondContact O-N 2.95Å; C82-T86 PolarHBondContact O-OG1 2.77Å; C82-T86 VanDerWaalsContact O-OG1 3.08Å; T86-F89 PolarHBondContact O-N 2.85Å; T86-S90 VanDerWaalsContact O-CB 3.27Å; T86-S90 WeakPolarHBondContact O-CB 3.48Å; T86-S90 PolarHBondContact O-N 3.42Å; T86-S90 PolarHBondContact O-OG 2.9Å; T86-F170 WeakPolarHBondContact OG1-CD2 3.39Å; T86-F170 WeakPolarHBondContact OG1-CE2 3.5Å; T86-M174 HydrophobicContact CG2-SD 4.29Å; T86-L177 HydrophobicContact CG2-CD1 3.8Å
87S92.9Very high91Very high12 Ų1215 Ų158%0.0849%0.091CC..Hα-helixtrans-64.2-45.6177.6-66.10000112.1A83 A84 T85 F89 S90 N91A83-S87 WeakPolarHBondContact O-CB 3.42Å; A83-S87 PolarHBondContact O-N 2.79Å; A83-S87 PolarHBondContact O-OG 3.29Å; A84-S87 PolarHBondContact O-N 3.3Å; T85-S87 VanDerWaalsContact C-N 3.33Å; T85-S87 PolarHBondContact O-N 3.4Å; S87-F89 VanDerWaalsContact C-N 3.32Å; S87-F89 PolarHBondContact O-N 2.92Å; S87-S90 PolarHBondContact O-N 2.84Å; S87-N91 WeakPolarHBondContact O-CB 3.2Å; S87-N91 PolarHBondContact O-N 3.43Å; S87-N91 PolarHBondContact O-OD1 2.91Å
88L88.9Confident90.4Very high3 Ų320.1 Ų20.12%0.01611%0.113CC..Hα-helixtrans-58.9-46177.9-176.869.1000110.9I31 I32 A84 T85 N91 R92 I200I31-L88 HydrophobicContact CB-CD1 4.36Å; I31-L88 HydrophobicContact CG2-CB 4.39Å; I31-L88 HydrophobicContact CG2-CD1 4.32Å; I32-L88 HydrophobicContact CG1-CD1 4.11Å; I32-L88 HydrophobicContact CG1-CD2 4.33Å; A84-L88 VanDerWaalsContact O-CB 3.27Å; A84-L88 WeakPolarHBondContact O-CB 3.19Å; A84-L88 PolarHBondContact O-N 3.13Å; T85-L88 PolarHBondContact O-N 3.24Å; L88-N91 PolarHBondContact O-N 3.02Å; L88-R92 PolarHBondContact O-N 3.23Å; L88-I200 HydrophobicContact CD2-CG2 4.25Å; L88-I200 HydrophobicContact CG-CG2 4.17Å
89F90.2Very high89.4Confident0 Ų025.4 Ų25.40%013%0.133CC..Hα-helixtrans-71.4-37.7-179.2-162-122.9000112.6T85 T86 S87 R92 I93 M174 L177 F178 Y181 F201 C204T85-F89 WeakPolarHBondContact O-CB 3.41Å; T85-F89 PolarHBondContact O-N 3.47Å; T86-F89 PolarHBondContact O-N 2.85Å; S87-F89 VanDerWaalsContact C-N 3.32Å; S87-F89 PolarHBondContact O-N 2.92Å; F89-R92 WeakPolarHBondContact O-CB 3.46Å; F89-R92 PolarHBondContact O-N 3.36Å; F89-I93 HydrophobicContact CD1-CD1 3.98Å; F89-I93 HydrophobicContact CE1-CD1 3.86Å; F89-I93 HydrophobicContact CZ-CD1 4.42Å; F89-I93 WeakPolarHBondContact O-CG1 3.28Å; F89-I93 PolarHBondContact O-N 3.43Å; F89-M174 HydrophobicContact CB-CE 3.94Å; F89-M174 HydrophobicContact CD1-CE 3.6Å; F89-M174 HydrophobicContact CE1-CE 4.36Å; F89-M174 HydrophobicContact CG-CE 3.94Å; F89-L177 HydrophobicContact CD1-CB 3.53Å; F89-L177 HydrophobicContact CD1-CD1 4.18Å; F89-L177 HydrophobicContact CD1-CG 4.45Å; F89-L177 HydrophobicContact CE1-CB 3.72Å; F89-F178 AromaticContact CE1-CD1 3.82Å; F89-F178 HydrophobicContact CE1-CD1 3.82Å; F89-F178 HydrophobicContact CE1-CD2 4.4Å; F89-F178 HydrophobicContact CE1-CE1 4Å; F89-F178 HydrophobicContact CE1-CG 4.01Å; F89-F178 HydrophobicContact CE1-CZ 4.34Å; F89-F178 HydrophobicContact CE2-CE1 4.17Å; F89-F178 AromaticContact CZ-CD1 3.59Å; F89-F178 HydrophobicContact CZ-CD1 3.59Å; F89-F178 AromaticContact CZ-CE1 3.61Å; F89-F178 HydrophobicContact CZ-CE1 3.61Å; F89-F178 HydrophobicContact CZ-CG 4.25Å; F89-F178 HydrophobicContact CZ-CZ 4.28Å; F89-Y181 HydrophobicContact CE2-CD2 4.35Å; F89-Y181 HydrophobicContact CE2-CG 4.45Å; F89-Y181 HydrophobicContact CZ-CD1 4.44Å; F89-Y181 HydrophobicContact CZ-CD2 4.2Å; F89-Y181 AromaticContact CZ-CG 3.91Å; F89-Y181 HydrophobicContact CZ-CG 3.91Å; F89-F201 AromaticContact CE2-CD2 4Å; F89-F201 HydrophobicContact CE2-CD2 4Å; F89-F201 HydrophobicContact CZ-CD2 4.27Å; F89-F201 HydrophobicContact CZ-CE2 4.49Å; F89-C204 HydrophobicContact CD2-CB 3.9Å; F89-C204 HydrophobicContact CE2-CB 4.46Å; F89-C204 HydrophobicContact CG-CB 4.33Å
90S91.1Very high88.4Confident30 Ų3033.7 Ų33.721%0.2117%0.169CC..Hα-helixtrans-61.7-47.4173-60.50000111.3T86 S87 R92 I93 I94 L177T86-S90 VanDerWaalsContact O-CB 3.27Å; T86-S90 WeakPolarHBondContact O-CB 3.48Å; T86-S90 PolarHBondContact O-N 3.42Å; T86-S90 PolarHBondContact O-OG 2.9Å; S87-S90 PolarHBondContact O-N 2.84Å; S90-R92 PolarHBondContact O-N 3.36Å; S90-I93 PolarHBondContact O-N 2.67Å; S90-I93 VanDerWaalsContact O-N 3.11Å; S90-I94 VanDerWaalsContact O-CG1 3.32Å; S90-I94 WeakPolarHBondContact O-CG1 3.5Å; S90-I94 PolarHBondContact O-N 3.08Å; S90-L177 WeakPolarHBondContact OG-CD1 3.44Å
91N88Confident87.4Confident10 Ų1039 Ų395%0.05319%0.189CC..Hα-helixtrans-59.1-36.9176.4-69.9-5000111.1I31 S87 L88 I94 S95 S113I31-N91 WeakPolarHBondContact CD1-ND2 3.32Å; S87-N91 WeakPolarHBondContact O-CB 3.2Å; S87-N91 PolarHBondContact O-N 3.43Å; S87-N91 PolarHBondContact O-OD1 2.91Å; L88-N91 PolarHBondContact O-N 3.02Å; N91-I94 PolarHBondContact O-N 2.86Å; N91-S95 VanDerWaalsContact O-CB 3.25Å; N91-S95 WeakPolarHBondContact O-CB 3.33Å; N91-S95 PolarHBondContact O-N 3.06Å; N91-S113 PolarHBondContact ND2-OG 3.38Å
92R83.6Confident86.4Confident39 Ų3939.7 Ų39.715%0.14720%0.195CC..Hα-helixtrans-64-46.4175.1-177.667.2-156.8143.43.7112.4L88 F89 S90 S95 I96 S197 I200L88-R92 PolarHBondContact O-N 3.23Å; F89-R92 WeakPolarHBondContact O-CB 3.46Å; F89-R92 PolarHBondContact O-N 3.36Å; S90-R92 PolarHBondContact O-N 3.36Å; R92-S95 PolarHBondContact O-N 3.5Å; R92-I96 HydrophobicContact CG-CD1 4.16Å; R92-I96 WeakPolarHBondContact O-CG1 3.28Å; R92-I96 PolarHBondContact O-N 2.93Å; R92-S197 PolarHBondContact NE-OG 2.95Å; R92-S197 PolarHBondContact NH2-OG 3.24Å; R92-I200 HydrophobicContact CB-CG2 4.43Å; R92-I200 HydrophobicContact CG-CG2 4.41Å
93I87.3Confident85.3Confident14 Ų1446.1 Ų46.17%0.07223%0.229CC..Hα-helixtrans-60.9-46.8177.6-73.1167.1000110.2F89 S90 I96 G97 L177 V180 Y181 M184F89-I93 HydrophobicContact CD1-CD1 3.98Å; F89-I93 HydrophobicContact CE1-CD1 3.86Å; F89-I93 HydrophobicContact CZ-CD1 4.42Å; F89-I93 WeakPolarHBondContact O-CG1 3.28Å; F89-I93 PolarHBondContact O-N 3.43Å; S90-I93 PolarHBondContact O-N 2.67Å; S90-I93 VanDerWaalsContact O-N 3.11Å; I93-I96 PolarHBondContact O-N 3.44Å; I93-G97 PolarHBondContact O-N 2.96Å; I93-L177 HydrophobicContact CD1-CB 3.75Å; I93-L177 HydrophobicContact CD1-CD2 3.75Å; I93-L177 HydrophobicContact CD1-CG 4.33Å; I93-L177 VanDerWaalsContact CD1-O 3.22Å; I93-L177 WeakPolarHBondContact CD1-O 3.28Å; I93-V180 HydrophobicContact CG2-CG1 3.88Å; I93-Y181 HydrophobicContact CG1-CD2 4.11Å; I93-M184 HydrophobicContact CG2-SD 3.63Å; I93-M184 WeakPolarHBondContact O-CE 3.38Å
94I88.2Confident84.5Confident56 Ų5650.2 Ų50.229%0.28725%0.253SS..Hα-helixtrans-63.7-44.6179.6-62.4164.7000110.9S90 N91 I96 G97 F98 I105 L109S90-I94 VanDerWaalsContact O-CG1 3.32Å; S90-I94 WeakPolarHBondContact O-CG1 3.5Å; S90-I94 PolarHBondContact O-N 3.08Å; N91-I94 PolarHBondContact O-N 2.86Å; I94-I96 VanDerWaalsContact C-N 3.3Å; I94-I96 PolarHBondContact O-N 3.15Å; I94-G97 PolarHBondContact O-N 3.49Å; I94-G97 VanDerWaalsContact O-N 3.11Å; I94-F98 HydrophobicContact CG2-CD2 3.76Å; I94-F98 HydrophobicContact CG2-CE2 4.27Å; I94-F98 WeakPolarHBondContact O-CD2 3.29Å; I94-F98 PolarHBondContact O-N 3.49Å; I94-I105 HydrophobicContact CG2-CG2 3.87Å; I94-L109 HydrophobicContact CB-CD1 3.95Å; I94-L109 HydrophobicContact CD1-CD1 3.88Å; I94-L109 HydrophobicContact CD1-CD2 4.34Å; I94-L109 HydrophobicContact CG2-CD1 3.71Å
95S81.9Confident84Confident10 Ų1052.4 Ų52.47%0.0726%0.264CS..Hα-helixtrans-56-42.7174.7163.70000112.4N91 R92 R99 E106N91-S95 VanDerWaalsContact O-CB 3.25Å; N91-S95 WeakPolarHBondContact O-CB 3.33Å; N91-S95 PolarHBondContact O-N 3.06Å; R92-S95 PolarHBondContact O-N 3.5Å; S95-R99 PolarHBondContact O-N 3.44Å; S95-E106 WeakPolarHBondContact CB-OE1 3.4Å; S95-E106 PolarHBondContact OG-OE1 2.91Å
96I80Confident83.4Confident10 Ų1053.6 Ų53.65%0.05127%0.27CS..Hα-helixtrans-68.3-37.4177.3-67.8166.4000111.5R92 I93 I94 R99 Y181 M184 L188R92-I96 HydrophobicContact CG-CD1 4.16Å; R92-I96 WeakPolarHBondContact O-CG1 3.28Å; R92-I96 PolarHBondContact O-N 2.93Å; I93-I96 PolarHBondContact O-N 3.44Å; I94-I96 VanDerWaalsContact C-N 3.3Å; I94-I96 PolarHBondContact O-N 3.15Å; I96-R99 WeakPolarHBondContact O-CG 3.2Å; I96-Y181 HydrophobicContact CD1-CD2 4.14Å; I96-Y181 HydrophobicContact CD1-CE2 3.53Å; I96-M184 HydrophobicContact CB-CE 4.28Å; I96-M184 HydrophobicContact CG2-CE 4.05Å; I96-L188 HydrophobicContact CG2-CD1 3.67Å
97G83.3Confident82.9Confident40 Ų4057.5 Ų57.541%0.41228%0.284SS..Hα-helixtrans-72-39.5-179.200000113.1I93 I94I93-G97 PolarHBondContact O-N 2.96Å; I94-G97 PolarHBondContact O-N 3.49Å; I94-G97 VanDerWaalsContact O-N 3.11Å
98F83.8Confident82.6Confident117 Ų11764 Ų6451%0.51331%0.31SS..THydrogen-bonded Turntrans-111.647.2-174-63.6-84.3000112.6I94 K100 Y101 A102 I105I94-F98 HydrophobicContact CG2-CD2 3.76Å; I94-F98 HydrophobicContact CG2-CE2 4.27Å; I94-F98 WeakPolarHBondContact O-CD2 3.29Å; I94-F98 PolarHBondContact O-N 3.49Å; F98-K100 PolarHBondContact O-N 2.84Å; F98-Y101 CarbonylContact O-C 3.57Å; F98-Y101 PolarHBondContact O-N 3.38Å; F98-A102 PolarHBondContact O-N 2.68Å; F98-I105 HydrophobicContact CB-CD1 3.83Å; F98-I105 HydrophobicContact CG-CD1 4.29Å
99R76.5Confident82.6Confident123 Ų12365.8 Ų65.846%0.46432%0.32SS..G310 helixtrans-49.8-35.2-176.1-64.6-173.1-178.1-169.8-2.6114.6S95 I96 Y101 A102 K190S95-R99 PolarHBondContact O-N 3.44Å; I96-R99 WeakPolarHBondContact O-CG 3.2Å; R99-Y101 PolarHBondContact O-N 2.87Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.91Å; R99-K190 PolarHBondContact NH2-O 2.9Å
100K77Confident82.5Confident174 Ų17465.8 Ų65.876%0.75732%0.32SS*.G310 helixtrans-64.1-27.5-179.5-173.2177.8178-174.30113.1F98F98-K100 PolarHBondContact O-N 2.84Å
101Y76.1Confident82.5Confident134 Ų13469.4 Ų69.453%0.52533%0.33SS..G310 helixtrans-118.817.3-176.6-55.9-67.9000112F98 R99 D103 V104 I105F98-Y101 CarbonylContact O-C 3.57Å; F98-Y101 PolarHBondContact O-N 3.38Å; R99-Y101 PolarHBondContact O-N 2.87Å; Y101-D103 PolarHBondContact O-N 2.8Å; Y101-V104 PolarHBondContact O-N 3.49Å; Y101-I105 WeakPolarHBondContact O-CB 3.32Å; Y101-I105 WeakPolarHBondContact O-CG1 3.23Å; Y101-I105 PolarHBondContact O-N 2.9Å
102A73.7Confident82.7Confident16 Ų1673.5 Ų73.513%0.13236%0.355CS..Hα-helixtrans-53.9-49.7-171.500000111.7F98 R99 V104 I105 E106F98-A102 PolarHBondContact O-N 2.68Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.91Å; A102-V104 PolarHBondContact O-N 3.37Å; A102-I105 PolarHBondContact O-N 3.34Å; A102-E106 WeakPolarHBondContact O-CB 3.48Å; A102-E106 WeakPolarHBondContact O-CG 3.32Å; A102-E106 PolarHBondContact O-N 2.97Å
103D73.3Confident83.2Confident137 Ų13772 Ų7273%0.73335%0.351SS*.Hα-helixtrans-61.3-40.7-174.2-58-34.9000113.6Y101Y101-D103 PolarHBondContact O-N 2.8Å
104V79Confident83.4Confident93 Ų9372.9 Ų72.956%0.56436%0.355SS*.Hα-helixtrans-75.5-41.5-179.8-178.60000110.9Y101 A102 K108Y101-V104 PolarHBondContact O-N 3.49Å; A102-V104 PolarHBondContact O-N 3.37Å; V104-K108 PolarHBondContact O-N 3.36Å
105I81.9Confident83.8Confident46 Ų4673 Ų7324%0.23636%0.361CS..Hα-helixtrans-70.4-46.7-178.2-69.6177.2000110.4I94 F98 Y101 A102 K107 K108 L109I94-I105 HydrophobicContact CG2-CG2 3.87Å; F98-I105 HydrophobicContact CB-CD1 3.83Å; F98-I105 HydrophobicContact CG-CD1 4.29Å; Y101-I105 WeakPolarHBondContact O-CB 3.32Å; Y101-I105 WeakPolarHBondContact O-CG1 3.23Å; Y101-I105 PolarHBondContact O-N 2.9Å; A102-I105 PolarHBondContact O-N 3.34Å; I105-K107 VanDerWaalsContact C-N 3.28Å; I105-K107 PolarHBondContact O-N 3.28Å; I105-K108 PolarHBondContact O-N 3.41Å; I105-L109 HydrophobicContact CG2-CD1 3.4Å; I105-L109 HydrophobicContact CG2-CG 3.83Å; I105-L109 VanDerWaalsContact O-CB 3.3Å; I105-L109 WeakPolarHBondContact O-CB 3.37Å; I105-L109 VanDerWaalsContact O-CG 3.26Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.08Å
106E80.8Confident84.4Confident25 Ų2577.7 Ų77.712%0.11738%0.381CS..Hα-helixtrans-57.9-41.3-179.3-76.7-179179.700111.6P27 S95 A102 A110P27-E106 WeakPolarHBondContact CB-O 3.13Å; S95-E106 WeakPolarHBondContact CB-OE1 3.4Å; S95-E106 PolarHBondContact OG-OE1 2.91Å; A102-E106 WeakPolarHBondContact O-CB 3.48Å; A102-E106 WeakPolarHBondContact O-CG 3.32Å; A102-E106 PolarHBondContact O-N 2.97Å; E106-A110 VanDerWaalsContact O-CB 3.27Å; E106-A110 WeakPolarHBondContact O-CB 3.26Å; E106-A110 PolarHBondContact O-N 3.38Å
107K83.3Confident85.3Confident119 Ų11977.2 Ų77.252%0.51738%0.378SS..Hα-helixtrans-62.4-53.4177-170175.6179-179.90111.7P27 I105 A110 Y111P27-K107 HydrophobicContact CB-CB 4.42Å; P27-K107 VanDerWaalsContact CG-CA 3.41Å; P27-K107 HydrophobicContact CG-CB 3.72Å; P27-K107 HydrophobicContact CG-CG 4.08Å; I105-K107 VanDerWaalsContact C-N 3.28Å; I105-K107 PolarHBondContact O-N 3.28Å; K107-A110 PolarHBondContact O-N 3.39Å; K107-Y111 HydrophobicContact CD-CE2 4.49Å; K107-Y111 HydrophobicContact CG-CD2 4.03Å; K107-Y111 HydrophobicContact CG-CE2 3.77Å; K107-Y111 WeakPolarHBondContact O-CD2 3.3Å; K107-Y111 PolarHBondContact O-N 2.91Å
108K87.6Confident85.9Confident148 Ų14879.3 Ų79.364%0.64338%0.379SS*.Hα-helixtrans-61.7-46.7-179.3-71-175.7178.3-175.30111.3V104 I105 A110 Y111 T112V104-K108 PolarHBondContact O-N 3.36Å; I105-K108 PolarHBondContact O-N 3.41Å; K108-A110 VanDerWaalsContact C-N 3.33Å; K108-A110 PolarHBondContact O-N 3.04Å; K108-Y111 PolarHBondContact O-N 3.07Å; K108-T112 PolarHBondContact O-N 2.72Å; K108-T112 PolarHBondContact O-OG1 3.37Å; K108-T112 VanDerWaalsContact O-OG1 3.06Å
109L88.6Confident86.6Confident40 Ų4080.9 Ų80.921%0.20939%0.386CS..Hα-helixtrans-59.3-43.4178.5-73.7-179.1000112.1I94 I105 Y111 T112 S113I94-L109 HydrophobicContact CB-CD1 3.95Å; I94-L109 HydrophobicContact CD1-CD1 3.88Å; I94-L109 HydrophobicContact CD1-CD2 4.34Å; I94-L109 HydrophobicContact CG2-CD1 3.71Å; I105-L109 HydrophobicContact CG2-CD1 3.4Å; I105-L109 HydrophobicContact CG2-CG 3.83Å; I105-L109 VanDerWaalsContact O-CB 3.3Å; I105-L109 WeakPolarHBondContact O-CB 3.37Å; I105-L109 VanDerWaalsContact O-CG 3.26Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.08Å; L109-Y111 PolarHBondContact O-N 2.93Å; L109-T112 PolarHBondContact O-N 2.72Å; L109-S113 WeakPolarHBondContact O-CB 3.46Å; L109-S113 PolarHBondContact O-N 2.86Å; L109-S113 PolarHBondContact O-OG 2.95Å
110A88.1Confident87.6Confident1 Ų177.2 Ų77.21%0.00837%0.373CS..Hα-helixtrans-62.7-43.518000000113P27 I31 E106 K107 K108 S113 I114P27-A110 HydrophobicContact CB-CB 3.43Å; P27-A110 VanDerWaalsContact CB-CB 3.43Å; P27-A110 VanDerWaalsContact O-CB 3.27Å; P27-A110 WeakPolarHBondContact O-CB 3.46Å; I31-A110 HydrophobicContact CD1-CB 3.92Å; I31-A110 HydrophobicContact CG1-CB 4Å; E106-A110 VanDerWaalsContact O-CB 3.27Å; E106-A110 WeakPolarHBondContact O-CB 3.26Å; E106-A110 PolarHBondContact O-N 3.38Å; K107-A110 PolarHBondContact O-N 3.39Å; K108-A110 VanDerWaalsContact C-N 3.33Å; K108-A110 PolarHBondContact O-N 3.04Å; A110-S113 PolarHBondContact O-N 3.46Å; A110-I114 WeakPolarHBondContact O-CD1 3.14Å; A110-I114 VanDerWaalsContact O-CG1 3.25Å; A110-I114 WeakPolarHBondContact O-CG1 3.44Å; A110-I114 PolarHBondContact O-N 3.49Å
111Y89.8Confident88.6Confident106 Ų10669 Ų6942%0.41634%0.337SS..Hα-helixtrans-65.8-43.4176.1-76.2-71.1000111.8K30 K107 K108 L109 S113 I114 S115K30-Y111 PolarHBondContact NZ-OH 3.49Å; K107-Y111 HydrophobicContact CD-CE2 4.49Å; K107-Y111 HydrophobicContact CG-CD2 4.03Å; K107-Y111 HydrophobicContact CG-CE2 3.77Å; K107-Y111 WeakPolarHBondContact O-CD2 3.3Å; K107-Y111 PolarHBondContact O-N 2.91Å; K108-Y111 PolarHBondContact O-N 3.07Å; L109-Y111 PolarHBondContact O-N 2.93Å; Y111-S113 VanDerWaalsContact C-N 3.31Å; Y111-S113 PolarHBondContact O-N 3.29Å; Y111-I114 PolarHBondContact O-N 3.02Å; Y111-S115 PolarHBondContact O-N 3.45Å; Y111-S115 PolarHBondContact O-OG 2.83Å
112T92.2Very high89.6Confident95 Ų9568 Ų6858%0.58334%0.336SS*.Hα-helixtrans-60.1-41.5175-580000111.7K108 L109 S115 F116K108-T112 PolarHBondContact O-N 2.72Å; K108-T112 PolarHBondContact O-OG1 3.37Å; K108-T112 VanDerWaalsContact O-OG1 3.06Å; L109-T112 PolarHBondContact O-N 2.72Å; T112-S115 PolarHBondContact O-N 3Å; T112-F116 WeakPolarHBondContact O-CB 3.33Å; T112-F116 PolarHBondContact O-N 3.42Å
113S93.8Very high90.7Very high9 Ų972.4 Ų72.46%0.06335%0.35CS..Hα-helixtrans-63.8-44.2175.8-63.60000112.4N91 L109 A110 Y111 F116 V117N91-S113 PolarHBondContact ND2-OG 3.38Å; L109-S113 WeakPolarHBondContact O-CB 3.46Å; L109-S113 PolarHBondContact O-N 2.86Å; L109-S113 PolarHBondContact O-OG 2.95Å; A110-S113 PolarHBondContact O-N 3.46Å; Y111-S113 VanDerWaalsContact C-N 3.31Å; Y111-S113 PolarHBondContact O-N 3.29Å; S113-F116 PolarHBondContact O-N 3.42Å; S113-V117 VanDerWaalsContact O-CG2 3.24Å; S113-V117 WeakPolarHBondContact O-CG2 3.4Å; S113-V117 PolarHBondContact O-N 3.49Å
114I92.9Very high91.9Very high31 Ų3166 Ų6616%0.15932%0.315CS..Hα-helixtrans-60.4-48.4176.7-72.1163.6000110.1K30 I31 L34 A110 Y111 F116 V117 L118K30-I114 HydrophobicContact CB-CD1 3.68Å; I31-I114 HydrophobicContact CG1-CD1 4.47Å; I31-I114 HydrophobicContact CG1-CG1 4.19Å; L34-I114 HydrophobicContact CD2-CB 4.32Å; L34-I114 HydrophobicContact CD2-CG1 4.13Å; L34-I114 HydrophobicContact CD2-CG2 4.16Å; A110-I114 WeakPolarHBondContact O-CD1 3.14Å; A110-I114 VanDerWaalsContact O-CG1 3.25Å; A110-I114 WeakPolarHBondContact O-CG1 3.44Å; A110-I114 PolarHBondContact O-N 3.49Å; Y111-I114 PolarHBondContact O-N 3.02Å; I114-F116 PolarHBondContact O-N 2.86Å; I114-V117 PolarHBondContact O-N 2.8Å; I114-L118 HydrophobicContact CG2-CD1 3.89Å; I114-L118 HydrophobicContact CG2-CG 4.46Å; I114-L118 WeakPolarHBondContact O-CG 3.49Å; I114-L118 PolarHBondContact O-N 3.35Å
115S95.3Very high92.7Very high58 Ų5864.9 Ų64.941%0.40630%0.303SS..Hα-helixtrans-57.5-49.7176-64.10000110.9Y111 T112 V117 L118 F119Y111-S115 PolarHBondContact O-N 3.45Å; Y111-S115 PolarHBondContact O-OG 2.83Å; T112-S115 PolarHBondContact O-N 3Å; S115-V117 PolarHBondContact O-N 3.26Å; S115-L118 PolarHBondContact O-N 3.49Å; S115-F119 WeakPolarHBondContact O-CB 3.45Å; S115-F119 WeakPolarHBondContact O-CD2 3.44Å; S115-F119 PolarHBondContact O-N 3.41Å
116F96.2Very high93.4Very high110 Ų11070.7 Ų70.748%0.48232%0.322SS..Hα-helixtrans-55.5-48.2178.5171.4-115000112.6A83 T112 S113 I114 Y120A83-F116 HydrophobicContact CB-CD1 4.28Å; A83-F116 HydrophobicContact CB-CE1 3.69Å; A83-F116 HydrophobicContact CB-CZ 4.38Å; T112-F116 WeakPolarHBondContact O-CB 3.33Å; T112-F116 PolarHBondContact O-N 3.42Å; S113-F116 PolarHBondContact O-N 3.42Å; I114-F116 PolarHBondContact O-N 2.86Å; F116-Y120 VanDerWaalsContact O-CB 3.22Å; F116-Y120 WeakPolarHBondContact O-CB 3.2Å; F116-Y120 PolarHBondContact O-N 2.97Å
117V97.2Very high94Very high0 Ų075.8 Ų75.80%034%0.344CS..Hα-helixtrans-62.2-45.8179.8171.70000111.5L34 I38 M80 A83 A84 S113 I114 S115 Y120 G121L34-V117 HydrophobicContact CD2-CB 3.95Å; L34-V117 HydrophobicContact CD2-CG1 3.77Å; L34-V117 HydrophobicContact CG-CG1 4.45Å; I38-V117 HydrophobicContact CD1-CG1 3.72Å; M80-V117 HydrophobicContact CB-CG1 3.99Å; M80-V117 HydrophobicContact CE-CG1 4.09Å; M80-V117 HydrophobicContact CG-CG1 4.3Å; A83-V117 HydrophobicContact CB-CG2 4.04Å; A84-V117 HydrophobicContact CB-CG1 4.2Å; A84-V117 HydrophobicContact CB-CG2 3.82Å; S113-V117 VanDerWaalsContact O-CG2 3.24Å; S113-V117 WeakPolarHBondContact O-CG2 3.4Å; S113-V117 PolarHBondContact O-N 3.49Å; I114-V117 PolarHBondContact O-N 2.8Å; S115-V117 PolarHBondContact O-N 3.26Å; V117-Y120 PolarHBondContact O-N 3.36Å; V117-G121 PolarHBondContact O-N 3.26Å
118L96.8Very high94.6Very high84 Ų8470.8 Ų70.844%0.4432%0.324SS..Hα-helixtrans-67-44.9-179.3-69.5176.1000112.1L34 M80 I114 S115 Y120 G121 F122L34-L118 HydrophobicContact CD1-CD2 3.84Å; L34-L118 HydrophobicContact CD1-CG 4.48Å; L34-L118 HydrophobicContact CD2-CG 4.47Å; M80-L118 HydrophobicContact CE-CD2 4.03Å; I114-L118 HydrophobicContact CG2-CD1 3.89Å; I114-L118 HydrophobicContact CG2-CG 4.46Å; I114-L118 WeakPolarHBondContact O-CG 3.49Å; I114-L118 PolarHBondContact O-N 3.35Å; S115-L118 PolarHBondContact O-N 3.49Å; L118-Y120 VanDerWaalsContact C-N 3.32Å; L118-Y120 PolarHBondContact O-N 3.07Å; L118-G121 PolarHBondContact O-N 3.49Å; L118-F122 WeakPolarHBondContact O-CB 3.45Å; L118-F122 PolarHBondContact O-N 2.88Å
119F97.9Very high94.9Very high150 Ų15065.9 Ų65.966%0.65831%0.307SS*.Hα-helixtrans-63.2-40.5176.2-81.6-66.8000111.6S115 F122 Y123S115-F119 WeakPolarHBondContact O-CB 3.45Å; S115-F119 WeakPolarHBondContact O-CD2 3.44Å; S115-F119 PolarHBondContact O-N 3.41Å; F119-F122 PolarHBondContact O-N 2.78Å; F119-Y123 WeakPolarHBondContact O-CB 3.22Å; F119-Y123 PolarHBondContact O-N 2.89Å
120Y97.8Very high95.2Very high45 Ų4564.7 Ų64.718%0.17630%0.301CS..Hα-helixtrans-65.2-46.3178-175-134000111.7C79 A83 F116 V117 L118 F122 Y123 I124 N166C79-Y120 HydrophobicContact CB-CD1 4.19Å; C79-Y120 HydrophobicContact CB-CE1 3.57Å; C79-Y120 WeakPolarHBondContact O-CE1 3.21Å; A83-Y120 HydrophobicContact CB-CD1 3.76Å; A83-Y120 HydrophobicContact CB-CE1 4.3Å; F116-Y120 VanDerWaalsContact O-CB 3.22Å; F116-Y120 WeakPolarHBondContact O-CB 3.2Å; F116-Y120 PolarHBondContact O-N 2.97Å; V117-Y120 PolarHBondContact O-N 3.36Å; L118-Y120 VanDerWaalsContact C-N 3.32Å; L118-Y120 PolarHBondContact O-N 3.07Å; Y120-F122 PolarHBondContact O-N 3.39Å; Y120-Y123 PolarHBondContact O-N 3.46Å; Y120-I124 HydrophobicContact CD2-CD1 4.44Å; Y120-I124 HydrophobicContact CD2-CG1 4.09Å; Y120-I124 HydrophobicContact CE2-CD1 3.75Å; Y120-I124 HydrophobicContact CE2-CG1 3.82Å; Y120-I124 VanDerWaalsContact O-CG1 3.28Å; Y120-I124 WeakPolarHBondContact O-CG1 3.48Å; Y120-I124 PolarHBondContact O-N 2.9Å; Y120-N166 WeakPolarHBondContact CE1-OD1 3.38Å; Y120-N166 WeakPolarHBondContact OH-CB 3.16Å; Y120-N166 PolarHBondContact OH-OD1 3.3Å
121G97.6Very high95.5Very high1 Ų164.9 Ų64.91%0.0130%0.302CS..Hα-helixtrans-59-47.6174.400000113.2S76 V117 L118 Y123 I124 F125S76-G121 PolarHBondContact OG-O 3.38Å; S76-G121 VanDerWaalsContact OG-O 3.09Å; V117-G121 PolarHBondContact O-N 3.26Å; L118-G121 PolarHBondContact O-N 3.49Å; G121-Y123 VanDerWaalsContact C-N 3.29Å; G121-Y123 PolarHBondContact O-N 2.91Å; G121-I124 PolarHBondContact O-N 2.71Å; G121-F125 WeakPolarHBondContact O-CB 3.13Å; G121-F125 PolarHBondContact O-N 2.97Å
122F97.6Very high95.8Very high113 Ų11360.1 Ų60.150%0.49628%0.284SS..Hα-helixtrans-56.7-44.4175.4177.4-95.3000111.9L118 F119 Y120 F125 W126 F127L118-F122 WeakPolarHBondContact O-CB 3.45Å; L118-F122 PolarHBondContact O-N 2.88Å; F119-F122 PolarHBondContact O-N 2.78Å; Y120-F122 PolarHBondContact O-N 3.39Å; F122-F125 PolarHBondContact O-N 3.14Å; F122-W126 AromaticContact CD2-CD1 3.48Å; F122-W126 VanDerWaalsContact CD2-CD1 3.48Å; F122-W126 AromaticContact CD2-NE1 3.8Å; F122-W126 AromaticContact CE2-CD1 3.26Å; F122-W126 HydrophobicContact CE2-CG 4.3Å; F122-W126 AromaticContact CE2-NE1 3.44Å; F122-W126 AromaticContact CZ-CD1 3.72Å; F122-W126 HydrophobicContact CZ-CG 4.42Å; F122-W126 PolarHBondContact O-N 2.73Å; F122-W126 VanDerWaalsContact O-N 3.15Å; F122-F127 HydrophobicContact CD1-CE2 4.37Å; F122-F127 AromaticContact CE1-CE2 3.78Å; F122-F127 HydrophobicContact CE1-CE2 3.78Å; F122-F127 HydrophobicContact CZ-CE2 4.48Å
123Y97.9Very high96Very high110 Ų11055.6 Ų55.643%0.43126%0.257SS..Hα-helixtrans-62.2-48177.7176.1-100.3000111.9F119 Y120 G121 F125 F127 T128 I162F119-Y123 WeakPolarHBondContact O-CB 3.22Å; F119-Y123 PolarHBondContact O-N 2.89Å; Y120-Y123 PolarHBondContact O-N 3.46Å; G121-Y123 VanDerWaalsContact C-N 3.29Å; G121-Y123 PolarHBondContact O-N 2.91Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; Y123-F125 PolarHBondContact O-N 3.37Å; Y123-F127 HydrophobicContact CD2-CB 3.88Å; Y123-F127 AromaticContact CD2-CD2 3.9Å; Y123-F127 HydrophobicContact CD2-CD2 3.9Å; Y123-F127 HydrophobicContact CD2-CG 4.13Å; Y123-F127 HydrophobicContact CE2-CB 3.74Å; Y123-F127 HydrophobicContact CE2-CD2 4.48Å; Y123-F127 HydrophobicContact CE2-CG 4.26Å; Y123-F127 WeakPolarHBondContact O-CB 3.35Å; Y123-F127 PolarHBondContact O-N 2.99Å; Y123-T128 HydrophobicContact CD1-CG2 4.28Å; Y123-T128 HydrophobicContact CE1-CG2 3.91Å; Y123-I162 HydrophobicContact CE1-CD1 3.88Å
124I97.2Very high96Very high1 Ų155.7 Ų55.71%0.00526%0.256CS..Hα-helixtrans-58.8-46.9177.5-66.6-63.6000110.7I75 C79 Y120 G121 W126 T128 I162I75-I124 HydrophobicContact CG1-CG2 4.3Å; I75-I124 HydrophobicContact CG2-CG2 3.92Å; C79-I124 HydrophobicContact CB-CD1 4.46Å; C79-I124 HydrophobicContact CB-CG1 3.87Å; C79-I124 HydrophobicContact CB-CG2 4.44Å; Y120-I124 HydrophobicContact CD2-CD1 4.44Å; Y120-I124 HydrophobicContact CD2-CG1 4.09Å; Y120-I124 HydrophobicContact CE2-CD1 3.75Å; Y120-I124 HydrophobicContact CE2-CG1 3.82Å; Y120-I124 VanDerWaalsContact O-CG1 3.28Å; Y120-I124 WeakPolarHBondContact O-CG1 3.48Å; Y120-I124 PolarHBondContact O-N 2.9Å; G121-I124 PolarHBondContact O-N 2.71Å; I124-W126 PolarHBondContact O-N 3.22Å; I124-T128 HydrophobicContact CD1-CG2 4.02Å; I124-T128 PolarHBondContact O-N 3.43Å; I124-T128 PolarHBondContact O-OG1 3.4Å; I124-I162 HydrophobicContact CD1-CG2 3.51Å
125F96.5Very high96.2Very high70 Ų7055 Ų5531%0.30725%0.254SS..Hα-helixtrans-64.5-41.6-175.9-173.3-95.8000113.6I73 G121 F122 Y123I73-F125 HydrophobicContact CG1-CE2 3.86Å; G121-F125 WeakPolarHBondContact O-CB 3.13Å; G121-F125 PolarHBondContact O-N 2.97Å; F122-F125 PolarHBondContact O-N 3.14Å; Y123-F125 VanDerWaalsContact C-N 3.34Å; Y123-F125 PolarHBondContact O-N 3.37Å
126W95.6Very high96Very high168 Ų16857.5 Ų57.564%0.63627%0.267SS*.Hα-helixtrans-98.3-28.4-171.8-73.6108.6000115F122 I124F122-W126 AromaticContact CD2-CD1 3.48Å; F122-W126 VanDerWaalsContact CD2-CD1 3.48Å; F122-W126 AromaticContact CD2-NE1 3.8Å; F122-W126 AromaticContact CE2-CD1 3.26Å; F122-W126 HydrophobicContact CE2-CG 4.3Å; F122-W126 AromaticContact CE2-NE1 3.44Å; F122-W126 AromaticContact CZ-CD1 3.72Å; F122-W126 HydrophobicContact CZ-CG 4.42Å; F122-W126 PolarHBondContact O-N 2.73Å; F122-W126 VanDerWaalsContact O-N 3.15Å; I124-W126 PolarHBondContact O-N 3.22Å
127F95.1Very high95.8Very high133 Ų13354.5 Ų54.558%0.58325%0.254SS*.Hα-helixtrans-117.66.2-168.8-59.7-83.7000113.6F122 Y123F122-F127 HydrophobicContact CD1-CE2 4.37Å; F122-F127 AromaticContact CE1-CE2 3.78Å; F122-F127 HydrophobicContact CE1-CE2 3.78Å; F122-F127 HydrophobicContact CZ-CE2 4.48Å; Y123-F127 HydrophobicContact CD2-CB 3.88Å; Y123-F127 AromaticContact CD2-CD2 3.9Å; Y123-F127 HydrophobicContact CD2-CD2 3.9Å; Y123-F127 HydrophobicContact CD2-CG 4.13Å; Y123-F127 HydrophobicContact CE2-CB 3.74Å; Y123-F127 HydrophobicContact CE2-CD2 4.48Å; Y123-F127 HydrophobicContact CE2-CG 4.26Å; Y123-F127 WeakPolarHBondContact O-CB 3.35Å; Y123-F127 PolarHBondContact O-N 2.99Å
128T94.9Very high95.7Very high14 Ų1456.3 Ų56.39%0.08626%0.263CS..SBendtrans-124.5147.5176.6770000110.9Y123 I124 T130 I162Y123-T128 HydrophobicContact CD1-CG2 4.28Å; Y123-T128 HydrophobicContact CE1-CG2 3.91Å; I124-T128 HydrophobicContact CD1-CG2 4.02Å; I124-T128 PolarHBondContact O-N 3.43Å; I124-T128 PolarHBondContact O-OG1 3.4Å; T128-T130 PolarHBondContact O-N 3.37Å; T128-I162 HydrophobicContact CG2-CD1 3.33Å
129P94Very high95.6Very high45 Ų4552.4 Ų52.429%0.29224%0.242SC..  trans-55.2139.4174.2-24.134000110.3H160P129-H160 PolarHBondContact O-CD2 3.2Å; P129-H160 PolarHBondContact O-NE2 3.13Å; P129-H160 VanDerWaalsContact O-NE2 3.11Å
130T95Very high95.5Very high15 Ų1545.4 Ų45.49%0.09221%0.211CC..  trans-76.8172.5174.8-168.90000111.1Y68 G72 T128 V132Y68-T130 HydrophobicContact CD1-CG2 4.42Å; Y68-T130 HydrophobicContact CD2-CG2 3.32Å; Y68-T130 HydrophobicContact CE1-CG2 4.42Å; Y68-T130 HydrophobicContact CE2-CG2 3.33Å; Y68-T130 HydrophobicContact CG-CG2 3.89Å; Y68-T130 PolarHBondContact O-OG1 2.73Å; Y68-T130 VanDerWaalsContact O-OG1 3.11Å; G72-T130 WeakPolarHBondContact CA-OG1 3.04Å; G72-T130 PolarHBondContact N-OG1 2.79Å; T128-T130 PolarHBondContact O-N 3.37Å; T130-V132 HydrophobicContact CG2-CG1 4.32Å
131T95.1Very high95.3Very high4 Ų443.9 Ų43.93%0.02521%0.206CC..  trans-107150.1164.350.60000109.6G71 I75 I141 P142G71-T131 WeakPolarHBondContact CA-O 3.45Å; I75-T131 HydrophobicContact CD1-CG2 3.64Å; T131-I141 CarbonylContact C-O 3.58Å; T131-I141 WeakPolarHBondContact CA-O 3.16Å; T131-P142 HydrophobicContact CG2-CG 4.14Å
132V95.5Very high95.1Very high6 Ų645.9 Ų45.94%0.03622%0.219CC..EExtended strand (participates in β ladder)trans-123.1141.5175.9-65.30000110.2F60 T67 T130 W140 I141 P144F60-V132 HydrophobicContact CB-CG2 4.41Å; F60-V132 HydrophobicContact CD2-CB 3.91Å; F60-V132 HydrophobicContact CD2-CG1 3.68Å; F60-V132 HydrophobicContact CD2-CG2 4.12Å; F60-V132 HydrophobicContact CE2-CG1 3.86Å; F60-V132 HydrophobicContact CG-CG2 4.48Å; T67-V132 HydrophobicContact CG2-CB 3.65Å; T67-V132 HydrophobicContact CG2-CG1 4.11Å; T130-V132 HydrophobicContact CG2-CG1 4.32Å; V132-W140 CarbonylContact O-C 3.6Å; V132-W140 WeakPolarHBondContact O-CA 3.28Å; V132-I141 PolarHBondContact N-O 2.9Å; V132-I141 PolarHBondContact O-N 3.38Å; V132-P144 HydrophobicContact CG2-CB 3.96Å
133Y95.9Very high94.8Very high1 Ų142.5 Ų42.50%0.00421%0.206CC..EExtended strand (participates in β ladder)trans-74.9135.7-178.8-167.6-107.6000111.6T50 M53 L54 S135 A139 W140T50-Y133 HydrophobicContact CG2-CD2 4.26Å; T50-Y133 HydrophobicContact CG2-CE2 3.53Å; M53-Y133 HydrophobicContact CB-CD1 3.6Å; M53-Y133 HydrophobicContact CB-CE1 3.71Å; M53-Y133 HydrophobicContact CE-CD1 3.91Å; M53-Y133 HydrophobicContact CE-CG 4.2Å; M53-Y133 HydrophobicContact CG-CD1 4.46Å; M53-Y133 HydrophobicContact SD-CD1 4.2Å; M53-Y133 HydrophobicContact SD-CG 4.4Å; L54-Y133 WeakPolarHBondContact CB-OH 3.45Å; Y133-S135 WeakPolarHBondContact CE1-OG 3.42Å; Y133-A139 WeakPolarHBondContact CD2-O 3.31Å; Y133-W140 AromaticContact CD2-CD1 3.6Å; Y133-W140 AromaticContact CD2-CD2 3.9Å; Y133-W140 HydrophobicContact CD2-CD2 3.9Å; Y133-W140 AromaticContact CD2-CE2 3.63Å; Y133-W140 AromaticContact CD2-CG 3.89Å; Y133-W140 HydrophobicContact CD2-CG 3.89Å; Y133-W140 HydrophobicContact CD2-CZ2 4.25Å; Y133-W140 AromaticContact CD2-NE1 3.4Å; Y133-W140 AromaticContact CE2-NE1 3.99Å; Y133-W140 HydrophobicContact CG-CD2 4.31Å; Y133-W140 HydrophobicContact CG-CZ2 4.26Å
134N95.1Very high94.5Very high11 Ų1137.6 Ų37.66%0.05919%0.188CC..EExtended strand (participates in β ladder)trans-134.4118.6173.1-170.6-48000109.6V136 F137 M138 A139 I141N134-V136 VanDerWaalsContact C-N 3.27Å; N134-V136 PolarHBondContact O-N 3.45Å; N134-V136 WeakPolarHBondContact OD1-CB 3.42Å; N134-V136 WeakPolarHBondContact OD1-CG2 3.32Å; N134-V136 PolarHBondContact OD1-N 3.25Å; N134-F137 HydrophobicContact CB-CD2 4.34Å; N134-F137 CarbonylContact O-C 3.5Å; N134-F137 PolarHBondContact O-N 3.3Å; N134-M138 PolarHBondContact O-N 2.93Å; N134-A139 PolarHBondContact N-O 3.46Å; N134-A139 PolarHBondContact O-N 3.17Å; N134-I141 HydrophobicContact CB-CD1 3.89Å; N134-I141 HydrophobicContact CB-CG1 4.15Å
135S95.5Very high94.2Very high17 Ų1741 Ų4112%0.11921%0.205CC..THydrogen-bonded Turntrans-68.5-22.8-178.4-63.40000113.7M53 T58 Y133 F137 M138M53-S135 PolarHBondContact O-OG 3.46Å; T58-S135 PolarHBondContact N-OG 2.9Å; T58-S135 VanDerWaalsContact N-OG 3.08Å; T58-S135 WeakPolarHBondContact O-CB 3.49Å; T58-S135 PolarHBondContact O-N 3.1Å; T58-S135 PolarHBondContact O-OG 2.74Å; T58-S135 VanDerWaalsContact O-OG 3.12Å; Y133-S135 WeakPolarHBondContact CE1-OG 3.42Å; S135-F137 VanDerWaalsContact C-N 3.31Å; S135-M138 WeakPolarHBondContact O-CG 3.47Å; S135-M138 PolarHBondContact O-N 3.09Å
136V91.9Very high93.5Very high109 Ų10940.5 Ų40.566%0.66121%0.211SC*.THydrogen-bonded Turntrans-66-37.9174.1-177.20000110.6N134N134-V136 VanDerWaalsContact C-N 3.27Å; N134-V136 PolarHBondContact O-N 3.45Å; N134-V136 WeakPolarHBondContact OD1-CB 3.42Å; N134-V136 WeakPolarHBondContact OD1-CG2 3.32Å; N134-V136 PolarHBondContact OD1-N 3.25Å
137F92Very high93Very high48 Ų4836.5 Ų36.521%0.21120%0.199CC..THydrogen-bonded Turntrans-91.3-4.2175.7-70.4-96.7000112.7N134 S135 A139 I141 L145 L221 T225 L231N134-F137 HydrophobicContact CB-CD2 4.34Å; N134-F137 CarbonylContact O-C 3.5Å; N134-F137 PolarHBondContact O-N 3.3Å; S135-F137 VanDerWaalsContact C-N 3.31Å; F137-A139 HydrophobicContact CB-CB 4.32Å; F137-A139 VanDerWaalsContact O-CB 3.29Å; F137-A139 WeakPolarHBondContact O-CB 3.3Å; F137-A139 PolarHBondContact O-N 3Å; F137-I141 HydrophobicContact CB-CG2 4.35Å; F137-I141 HydrophobicContact CD2-CD1 4.07Å; F137-I141 HydrophobicContact CE2-CD1 4.48Å; F137-I141 HydrophobicContact CG-CD1 4.35Å; F137-L145 HydrophobicContact CD2-CD1 3.9Å; F137-L145 HydrophobicContact CE2-CD1 3.23Å; F137-L145 HydrophobicContact CZ-CD1 3.89Å; F137-L221 HydrophobicContact CD1-CD1 4.12Å; F137-T225 HydrophobicContact CD1-CG2 3.84Å; F137-T225 HydrophobicContact CE1-CG2 3.84Å; F137-L231 WeakPolarHBondContact O-CD1 3.4Å
138M94.3Very high92.3Very high38 Ų3839.8 Ų39.819%0.18722%0.216CC..THydrogen-bonded Turntrans4734.1-172-55.4177.566.200112.5L54 N134 S135 E228 L231 A232 Q235L54-M138 HydrophobicContact CD1-CE 4.27Å; L54-M138 HydrophobicContact CD1-CG 4.09Å; L54-M138 HydrophobicContact CD2-CE 4.2Å; N134-M138 PolarHBondContact O-N 2.93Å; S135-M138 WeakPolarHBondContact O-CG 3.47Å; S135-M138 PolarHBondContact O-N 3.09Å; M138-E228 HydrophobicContact SD-CB 4.28Å; M138-L231 HydrophobicContact CB-CB 4.38Å; M138-A232 HydrophobicContact CE-CB 4.03Å; M138-Q235 WeakPolarHBondContact O-CG 3.01Å; M138-Q235 PolarHBondContact O-NE2 2.94Å
139A95.4Very high91.7Very high1 Ų145 Ų451%0.00825%0.248CC..EExtended strand (participates in β ladder)trans-151.1159.5-16700000113.8Y133 N134 F137 I141 L221 L231Y133-A139 WeakPolarHBondContact CD2-O 3.31Å; N134-A139 PolarHBondContact N-O 3.46Å; N134-A139 PolarHBondContact O-N 3.17Å; F137-A139 HydrophobicContact CB-CB 4.32Å; F137-A139 VanDerWaalsContact O-CB 3.29Å; F137-A139 WeakPolarHBondContact O-CB 3.3Å; F137-A139 PolarHBondContact O-N 3Å; A139-I141 HydrophobicContact CB-CG2 4.25Å; A139-L221 HydrophobicContact CB-CD2 3.65Å; A139-L231 HydrophobicContact CB-CD2 4.45Å
140W95.5Very high91.1Very high4 Ų445.6 Ų45.62%0.01525%0.251CS..EExtended strand (participates in β ladder)trans-88.4100.1171-67.686.9000109I49 T50 M53 T67 A70 V132 Y133 Y218 W238I49-W140 HydrophobicContact CG2-CH2 4Å; I49-W140 HydrophobicContact CG2-CZ2 3.98Å; T50-W140 PolarHBondContact OG1-NE1 2.82Å; M53-W140 HydrophobicContact SD-CH2 4.25Å; M53-W140 HydrophobicContact SD-CZ2 4.43Å; T67-W140 HydrophobicContact CG2-CZ3 4.07Å; A70-W140 HydrophobicContact CB-CH2 3.88Å; A70-W140 HydrophobicContact CB-CZ3 4.31Å; V132-W140 CarbonylContact O-C 3.6Å; V132-W140 WeakPolarHBondContact O-CA 3.28Å; Y133-W140 AromaticContact CD2-CD1 3.6Å; Y133-W140 AromaticContact CD2-CD2 3.9Å; Y133-W140 HydrophobicContact CD2-CD2 3.9Å; Y133-W140 AromaticContact CD2-CE2 3.63Å; Y133-W140 AromaticContact CD2-CG 3.89Å; Y133-W140 HydrophobicContact CD2-CG 3.89Å; Y133-W140 HydrophobicContact CD2-CZ2 4.25Å; Y133-W140 AromaticContact CD2-NE1 3.4Å; Y133-W140 AromaticContact CE2-NE1 3.99Å; Y133-W140 HydrophobicContact CG-CD2 4.31Å; Y133-W140 HydrophobicContact CG-CZ2 4.26Å; W140-Y218 HydrophobicContact CB-CE1 4.34Å; W140-Y218 VanDerWaalsContact O-CE1 3.31Å; W140-Y218 WeakPolarHBondContact O-CE1 3.33Å; W140-W238 AromaticContact CD1-CH2 3.83Å; W140-W238 AromaticContact CD1-CZ3 3.49Å; W140-W238 VanDerWaalsContact CD1-CZ3 3.49Å; W140-W238 AromaticContact NE1-CH2 3.69Å; W140-W238 AromaticContact NE1-CZ3 3.45Å
141I94.2Very high90.7Very high13 Ų1347.2 Ų47.27%0.06726%0.263CS..EExtended strand (participates in β ladder)trans-104.6145.7-17453.4170.5000111.1T131 V132 N134 F137 A139 D143 L145 L221T131-I141 CarbonylContact C-O 3.58Å; T131-I141 WeakPolarHBondContact CA-O 3.16Å; V132-I141 PolarHBondContact N-O 2.9Å; V132-I141 PolarHBondContact O-N 3.38Å; N134-I141 HydrophobicContact CB-CD1 3.89Å; N134-I141 HydrophobicContact CB-CG1 4.15Å; F137-I141 HydrophobicContact CB-CG2 4.35Å; F137-I141 HydrophobicContact CD2-CD1 4.07Å; F137-I141 HydrophobicContact CE2-CD1 4.48Å; F137-I141 HydrophobicContact CG-CD1 4.35Å; A139-I141 HydrophobicContact CB-CG2 4.25Å; I141-D143 VanDerWaalsContact C-N 3.33Å; I141-D143 WeakPolarHBondContact CD1-O 3.42Å; I141-D143 VanDerWaalsContact CG1-O 3.3Å; I141-D143 WeakPolarHBondContact CG1-O 3.45Å; I141-D143 PolarHBondContact O-N 2.8Å; I141-L145 HydrophobicContact CD1-CD1 3.6Å; I141-L145 HydrophobicContact CD1-CG 3.93Å; I141-L221 HydrophobicContact CG2-CD2 3.73Å; I141-L221 HydrophobicContact CG2-CG 4.38Å
142P93.1Very high90.3Very high42 Ų4255.5 Ų55.527%0.27330%0.302SS..SBendtrans-64.3-37.2177.5-2334000113.5T131 Y158 H160T131-P142 HydrophobicContact CG2-CG 4.14Å; P142-Y158 WeakPolarHBondContact CB-O 3.18Å; P142-H160 HydrophobicContact CB-CB 3.88Å; P142-H160 HydrophobicContact CG-CB 3.76Å
143D91.7Very high89.9Confident42 Ų4263 Ų6323%0.22534%0.337CS..  trans-80.3121.9-180-168.1-25.7000110.5I141 L145I141-D143 VanDerWaalsContact C-N 3.33Å; I141-D143 WeakPolarHBondContact CD1-O 3.42Å; I141-D143 VanDerWaalsContact CG1-O 3.3Å; I141-D143 WeakPolarHBondContact CG1-O 3.45Å; I141-D143 PolarHBondContact O-N 2.8Å; D143-L145 HydrophobicContact CB-CD2 4.21Å; D143-L145 PolarHBondContact O-N 2.84Å; D143-L145 WeakPolarHBondContact OD1-CA 3.26Å; D143-L145 PolarHBondContact OD1-N 3.48Å
144P91.6Very high89.5Confident8 Ų863.3 Ų63.35%0.05234%0.34CS..  trans-69.6-11.217629.6-34.9000114.6F60 V132 S146 Y158F60-P144 HydrophobicContact CB-CB 4.12Å; F60-P144 HydrophobicContact CD1-CB 3.55Å; F60-P144 HydrophobicContact CD2-CB 4.2Å; F60-P144 HydrophobicContact CE1-CB 3.95Å; F60-P144 HydrophobicContact CG-CB 3.68Å; F60-P144 HydrophobicContact CZ-CB 4.43Å; V132-P144 HydrophobicContact CG2-CB 3.96Å; P144-S146 PolarHBondContact O-N 3.4Å; P144-Y158 HydrophobicContact CG-CD1 4.23Å; P144-Y158 HydrophobicContact CG-CD2 4.16Å; P144-Y158 HydrophobicContact CG-CE1 3.83Å; P144-Y158 HydrophobicContact CG-CE2 3.74Å; P144-Y158 HydrophobicContact CG-CG 4.4Å
145L89.7Confident89.1Confident71 Ų7165.1 Ų65.137%0.37236%0.356SS..  trans53.942.3-176.1-55.5176.3000111.5F137 I141 D143F137-L145 HydrophobicContact CD2-CD1 3.9Å; F137-L145 HydrophobicContact CE2-CD1 3.23Å; F137-L145 HydrophobicContact CZ-CD1 3.89Å; I141-L145 HydrophobicContact CD1-CD1 3.6Å; I141-L145 HydrophobicContact CD1-CG 3.93Å; D143-L145 HydrophobicContact CB-CD2 4.21Å; D143-L145 PolarHBondContact O-N 2.84Å; D143-L145 WeakPolarHBondContact OD1-CA 3.26Å; D143-L145 PolarHBondContact OD1-N 3.48Å
146S83.5Confident88.8Confident60 Ų6067.6 Ų67.642%0.4238%0.377SS..  trans-80.7-19.4178.855.10000113.4P144P144-S146 PolarHBondContact O-N 3.4Å
147E83.3Confident88.6Confident84 Ų8468.6 Ų68.639%0.39338%0.376SS..SBendtrans-113.5138.5177.9-65.6173.8-165.900109.1V149 S151E147-V149 VanDerWaalsContact C-N 3.32Å; E147-S151 PolarHBondContact OE2-N 3.45Å; E147-S151 PolarHBondContact OE2-OG 3.24Å
148E80.2Confident88.5Confident203 Ų20369.7 Ų69.795%0.94938%0.38SS*.SBendtrans-64.4-38175.9-71-175.3170.900112.1
149V83.2Confident88.3Confident124 Ų12474.6 Ų74.675%0.75240%0.4SS*.SBendtrans-124.1106.2171.4-178.20000107E147 S151E147-V149 VanDerWaalsContact C-N 3.32Å; V149-S151 PolarHBondContact O-N 3.05Å
150P80.6Confident88.1Confident56 Ų5675 Ų7536%0.36440%0.402SS..  trans-59.7127.5179.3-24.433.5000111
151S87.1Confident87.8Confident49 Ų4978.2 Ų78.234%0.34342%0.422SS..  trans-60.4153.5165.662.20000111E147 V149 E153 A154 A155E147-S151 PolarHBondContact OE2-N 3.45Å; E147-S151 PolarHBondContact OE2-OG 3.24Å; V149-S151 PolarHBondContact O-N 3.05Å; S151-E153 PolarHBondContact O-N 2.82Å; S151-A154 PolarHBondContact O-N 3.37Å; S151-A154 VanDerWaalsContact O-N 3.15Å; S151-A154 WeakPolarHBondContact OG-CB 3.29Å; S151-A154 PolarHBondContact OG-N 3.35Å; S151-A155 WeakPolarHBondContact O-CB 3.49Å; S151-A155 PolarHBondContact O-N 3.1Å
152E87.2Confident87.8Confident179 Ų17979.7 Ų79.784%0.83643%0.429SS*.Hα-helixtrans-58.3-36.1176.9-172.3177.4177.500111.5A156E152-A156 WeakPolarHBondContact O-CB 3.39Å; E152-A156 PolarHBondContact O-N 2.64Å
153E87.2Confident87.8Confident163 Ų16378.3 Ų78.376%0.76242%0.419SS*.Hα-helixtrans-64.4-46.1175.6-63.6-176.5176.100112.1S151 A156 M157S151-E153 PolarHBondContact O-N 2.82Å; E153-A156 PolarHBondContact O-N 3.07Å; E153-M157 WeakPolarHBondContact O-CB 3.43Å; E153-M157 PolarHBondContact O-N 3.46Å
154A87.1Confident87.9Confident8 Ų878 Ų787%0.06642%0.42CS..Hα-helixtrans-63.4-46.2176.500000111.5S151 A156 M157 Y158S151-A154 PolarHBondContact O-N 3.37Å; S151-A154 VanDerWaalsContact O-N 3.15Å; S151-A154 WeakPolarHBondContact OG-CB 3.29Å; S151-A154 PolarHBondContact OG-N 3.35Å; A154-A156 VanDerWaalsContact C-N 3.27Å; A154-A156 PolarHBondContact O-N 3.11Å; A154-M157 PolarHBondContact O-N 2.85Å; A154-M157 VanDerWaalsContact O-N 3.1Å; A154-Y158 HydrophobicContact CB-CD2 4.33Å; A154-Y158 HydrophobicContact CB-CE2 4.01Å; A154-Y158 WeakPolarHBondContact O-CD2 3.34Å; A154-Y158 PolarHBondContact O-N 2.67Å
155A87Confident88.1Confident48 Ų4885.6 Ų85.640%0.39745%0.447SS..Hα-helixtrans-59.3-38.9177.300000111.8S151 K159S151-A155 WeakPolarHBondContact O-CB 3.49Å; S151-A155 PolarHBondContact O-N 3.1Å; A155-K159 WeakPolarHBondContact O-CB 3.22Å; A155-K159 PolarHBondContact O-N 3.47Å
156A88Confident88.4Confident69 Ų6982.8 Ų82.857%0.5743%0.433SS*.Hα-helixtrans-68.5-39.3174.900000112.5E152 E153 A154 K159E152-A156 WeakPolarHBondContact O-CB 3.39Å; E152-A156 PolarHBondContact O-N 2.64Å; E153-A156 PolarHBondContact O-N 3.07Å; A154-A156 VanDerWaalsContact C-N 3.27Å; A154-A156 PolarHBondContact O-N 3.11Å; A156-K159 PolarHBondContact O-N 3.46Å
157M89Confident89Confident130 Ų13080 Ų8064%0.6441%0.413SS*.Hα-helixtrans-66.8-42.1-179-171.1-179.5-59.800112.7E153 A154 K159E153-M157 WeakPolarHBondContact O-CB 3.43Å; E153-M157 PolarHBondContact O-N 3.46Å; A154-M157 PolarHBondContact O-N 2.85Å; A154-M157 VanDerWaalsContact O-N 3.1Å; M157-K159 VanDerWaalsContact C-N 3.32Å
158Y90.1Very high89.6Confident72 Ų7282.6 Ų82.628%0.28242%0.419SS..Hα-helixtrans-84.6-5.7-178.8-58.6-52.7000113.5P142 P144 A154 H160P142-Y158 WeakPolarHBondContact CB-O 3.18Å; P144-Y158 HydrophobicContact CG-CD1 4.23Å; P144-Y158 HydrophobicContact CG-CD2 4.16Å; P144-Y158 HydrophobicContact CG-CE1 3.83Å; P144-Y158 HydrophobicContact CG-CE2 3.74Å; P144-Y158 HydrophobicContact CG-CG 4.4Å; A154-Y158 HydrophobicContact CB-CD2 4.33Å; A154-Y158 HydrophobicContact CB-CE2 4.01Å; A154-Y158 WeakPolarHBondContact O-CD2 3.34Å; A154-Y158 PolarHBondContact O-N 2.67Å; Y158-H160 PolarHBondContact O-N 3.33Å
159K89.8Confident90.3Very high141 Ų14178.5 Ų78.561%0.61340%0.403SS*.  trans-66.1103.6-178.1-170.5178.7-176.3173.60111.8A155 A156 M157 T161A155-K159 WeakPolarHBondContact O-CB 3.22Å; A155-K159 PolarHBondContact O-N 3.47Å; A156-K159 PolarHBondContact O-N 3.46Å; M157-K159 VanDerWaalsContact C-N 3.32Å; K159-T161 HydrophobicContact CD-CG2 4.01Å; K159-T161 HydrophobicContact CG-CG2 3.92Å; K159-T161 PolarHBondContact O-N 3.36Å; K159-T161 VanDerWaalsContact O-N 3.11Å
160H90Very high90.9Very high10 Ų1072.8 Ų72.85%0.04637%0.368CS..  trans-84.885175.5-163.6-23000111.8I75 P129 P142 Y158 L163 P164I75-H160 VanDerWaalsContact CD1-NE2 3.31Å; I75-H160 WeakPolarHBondContact CD1-NE2 3.28Å; P129-H160 PolarHBondContact O-CD2 3.2Å; P129-H160 PolarHBondContact O-NE2 3.13Å; P129-H160 VanDerWaalsContact O-NE2 3.11Å; P142-H160 HydrophobicContact CB-CB 3.88Å; P142-H160 HydrophobicContact CG-CB 3.76Å; Y158-H160 PolarHBondContact O-N 3.33Å; H160-L163 PolarHBondContact CE1-N 3.02Å; H160-L163 PolarHBondContact ND1-N 3.47Å; H160-P164 WeakPolarHBondContact O-CD 3.25Å
161T90.7Very high91.5Very high71 Ų7171.7 Ų71.744%0.43636%0.36SS..  trans-70.3-34.2-177.954.60000113.9K159 L163 P164K159-T161 HydrophobicContact CD-CG2 4.01Å; K159-T161 HydrophobicContact CG-CG2 3.92Å; K159-T161 PolarHBondContact O-N 3.36Å; K159-T161 VanDerWaalsContact O-N 3.11Å; T161-L163 PolarHBondContact O-N 2.77Å; T161-P164 WeakPolarHBondContact O-CD 3.23Å
162I93.4Very high91.9Very high43 Ų4371.8 Ų71.822%0.22136%0.364CS..Hα-helixtrans-70.3-33.3-173.5-69.1159.2000112.5Y123 I124 T128 W165 N166Y123-I162 HydrophobicContact CE1-CD1 3.88Å; I124-I162 HydrophobicContact CD1-CG2 3.51Å; T128-I162 HydrophobicContact CG2-CD1 3.33Å; I162-W165 PolarHBondContact O-N 3.19Å; I162-N166 WeakPolarHBondContact O-CB 3.2Å; I162-N166 PolarHBondContact O-N 2.99Å
163L93.2Very high92.3Very high14 Ų1464.2 Ų64.27%0.07333%0.334CS..Hα-helixtrans-62.9-51.4-178171.869.9000112.6I75 H160 T161 W165 N166 N167I75-L163 HydrophobicContact CD1-CB 4.06Å; I75-L163 HydrophobicContact CD1-CD1 3.71Å; I75-L163 HydrophobicContact CD1-CD2 3.6Å; I75-L163 HydrophobicContact CD1-CG 3.96Å; I75-L163 HydrophobicContact CG1-CD1 4.19Å; H160-L163 PolarHBondContact CE1-N 3.02Å; H160-L163 PolarHBondContact ND1-N 3.47Å; T161-L163 PolarHBondContact O-N 2.77Å; L163-W165 VanDerWaalsContact C-N 3.28Å; L163-W165 PolarHBondContact O-N 3.5Å; L163-N166 WeakPolarHBondContact O-CB 3.41Å; L163-N166 PolarHBondContact O-N 3.26Å; L163-N167 PolarHBondContact O-N 2.87Å
164P94.1Very high92.7Very high35 Ų3556.6 Ų56.623%0.22730%0.298CS..Hα-helixtrans-57.9-39.4174.7-27.434.6000113.5H160 T161 N167 W168 N219H160-P164 WeakPolarHBondContact O-CD 3.25Å; T161-P164 WeakPolarHBondContact O-CD 3.23Å; P164-N167 PolarHBondContact O-N 3.21Å; P164-W168 PolarHBondContact O-N 2.88Å; P164-N219 WeakPolarHBondContact CA-OD1 3.28Å
165W95.3Very high93Very high168 Ų16863.3 Ų63.364%0.63633%0.326SS*.Hα-helixtrans-65.6-43.4176.1-77119.3000112.3I162 L163 N167 W168 I169I162-W165 PolarHBondContact O-N 3.19Å; L163-W165 VanDerWaalsContact C-N 3.28Å; L163-W165 PolarHBondContact O-N 3.5Å; W165-N167 VanDerWaalsContact C-N 3.27Å; W165-N167 PolarHBondContact O-N 3.29Å; W165-W168 PolarHBondContact O-N 3.5Å; W165-I169 VanDerWaalsContact O-CB 3.32Å; W165-I169 WeakPolarHBondContact O-CB 3.32Å; W165-I169 WeakPolarHBondContact O-CD1 3.26Å; W165-I169 WeakPolarHBondContact O-CG1 3.26Å; W165-I169 PolarHBondContact O-N 3.25Å
166N96.4Very high93.4Very high12 Ų1265.8 Ų65.86%0.06433%0.332CS..Hα-helixtrans-53.3-48.7172.8173.683.5000110.7Y120 I162 L163 I169 F170Y120-N166 WeakPolarHBondContact CE1-OD1 3.38Å; Y120-N166 WeakPolarHBondContact OH-CB 3.16Å; Y120-N166 PolarHBondContact OH-OD1 3.3Å; I162-N166 WeakPolarHBondContact O-CB 3.2Å; I162-N166 PolarHBondContact O-N 2.99Å; L163-N166 WeakPolarHBondContact O-CB 3.41Å; L163-N166 PolarHBondContact O-N 3.26Å; N166-I169 PolarHBondContact O-N 3.06Å; N166-F170 VanDerWaalsContact O-CB 3.24Å; N166-F170 WeakPolarHBondContact O-CB 3.43Å; N166-F170 PolarHBondContact O-N 3.3Å
167N96.1Very high93.7Very high1 Ų163.9 Ų63.91%0.00531%0.312CS..Hα-helixtrans-62.2-47-179.7-72.8-4.6000111.8W78 L163 P164 W165 F170 V171 A215 N219W78-N167 PolarHBondContact NE1-OD1 3.47Å; L163-N167 PolarHBondContact O-N 2.87Å; P164-N167 PolarHBondContact O-N 3.21Å; W165-N167 VanDerWaalsContact C-N 3.27Å; W165-N167 PolarHBondContact O-N 3.29Å; N167-F170 PolarHBondContact O-N 2.98Å; N167-V171 VanDerWaalsContact O-CG2 3.32Å; N167-V171 WeakPolarHBondContact O-CG2 3.46Å; N167-V171 PolarHBondContact O-N 2.83Å; N167-A215 HydrophobicContact CB-CB 3.86Å; N167-A215 PolarHBondContact ND2-O 3.08Å; N167-N219 WeakPolarHBondContact CB-OD1 3.42Å; N167-N219 PolarHBondContact ND2-OD1 3.12Å
168W95.2Very high93.9Very high138 Ų13859.3 Ų59.352%0.52329%0.288SS..Hα-helixtrans-63.6-45.7177.4-80.2120.7000112.9P164 W165 F170 V171 A172 N219P164-W168 PolarHBondContact O-N 2.88Å; W165-W168 PolarHBondContact O-N 3.5Å; W168-F170 VanDerWaalsContact C-N 3.33Å; W168-F170 PolarHBondContact O-N 3.33Å; W168-V171 PolarHBondContact O-N 2.96Å; W168-A172 VanDerWaalsContact O-CB 3.29Å; W168-A172 WeakPolarHBondContact O-CB 3.24Å; W168-A172 PolarHBondContact O-N 3.43Å; W168-N219 PolarHBondContact NE1-ND2 3Å
169I95.6Very high94.1Very high117 Ų11758 Ų5860%0.629%0.29SS*.Hα-helixtrans-62.4-43.1178.2-69.9166.7000110.2W165 N166 G173W165-I169 VanDerWaalsContact O-CB 3.32Å; W165-I169 WeakPolarHBondContact O-CB 3.32Å; W165-I169 WeakPolarHBondContact O-CD1 3.26Å; W165-I169 WeakPolarHBondContact O-CG1 3.26Å; W165-I169 PolarHBondContact O-N 3.25Å; N166-I169 PolarHBondContact O-N 3.06Å; I169-G173 WeakPolarHBondContact O-CA 3.43Å; I169-G173 PolarHBondContact O-N 3.25Å
170F94.7Very high94.2Very high5 Ų554 Ų542%0.02228%0.277CS..Hα-helixtrans-62.2-52.6177.9177.6-94.3000111.4C82 T85 T86 N166 N167 W168 A172 G173 M174 N211C82-F170 HydrophobicContact CB-CB 4.45Å; C82-F170 HydrophobicContact CB-CD2 3.62Å; C82-F170 HydrophobicContact CB-CE2 4.14Å; C82-F170 HydrophobicContact CB-CG 4.14Å; T85-F170 HydrophobicContact CG2-CE2 4.37Å; T85-F170 HydrophobicContact CG2-CZ 4.45Å; T86-F170 WeakPolarHBondContact OG1-CD2 3.39Å; T86-F170 WeakPolarHBondContact OG1-CE2 3.5Å; N166-F170 VanDerWaalsContact O-CB 3.24Å; N166-F170 WeakPolarHBondContact O-CB 3.43Å; N166-F170 PolarHBondContact O-N 3.3Å; N167-F170 PolarHBondContact O-N 2.98Å; W168-F170 VanDerWaalsContact C-N 3.33Å; W168-F170 PolarHBondContact O-N 3.33Å; F170-A172 PolarHBondContact O-N 3.32Å; F170-G173 PolarHBondContact O-N 3.02Å; F170-M174 HydrophobicContact CD1-CG 4.34Å; F170-M174 HydrophobicContact CD2-CG 4.02Å; F170-M174 HydrophobicContact CE1-CG 3.93Å; F170-M174 HydrophobicContact CE2-CG 3.61Å; F170-M174 HydrophobicContact CE2-SD 4.18Å; F170-M174 HydrophobicContact CG-CG 4.37Å; F170-M174 HydrophobicContact CZ-CG 3.57Å; F170-M174 HydrophobicContact CZ-SD 4.49Å; F170-M174 WeakPolarHBondContact O-CB 3.26Å; F170-M174 WeakPolarHBondContact O-CG 3.42Å; F170-M174 PolarHBondContact O-N 3.21Å; F170-N211 HydrophobicContact CE1-CB 3.71Å; F170-N211 VanDerWaalsContact CE1-ND2 3.25Å; F170-N211 WeakPolarHBondContact CE1-ND2 3.35Å; F170-N211 HydrophobicContact CZ-CB 4.13Å; F170-N211 VanDerWaalsContact CZ-ND2 3.28Å; F170-N211 WeakPolarHBondContact CZ-ND2 3.36Å
171V95Very high94.2Very high32 Ų3253.7 Ų53.719%0.19428%0.276CS..Hα-helixtrans-60.7-49.5-178171.30000110.9N167 W168 F175 T212 A215N167-V171 VanDerWaalsContact O-CG2 3.32Å; N167-V171 WeakPolarHBondContact O-CG2 3.46Å; N167-V171 PolarHBondContact O-N 2.83Å; W168-V171 PolarHBondContact O-N 2.96Å; V171-F175 WeakPolarHBondContact O-CB 3.37Å; V171-F175 PolarHBondContact O-N 3.35Å; V171-F175 VanDerWaalsContact O-N 3.07Å; V171-T212 HydrophobicContact CG1-CG2 4.33Å; V171-T212 HydrophobicContact CG2-CG2 4.14Å; V171-A215 HydrophobicContact CG2-CB 4.2Å
172A95.5Very high94.1Very high51 Ų5155.3 Ų55.342%0.42128%0.276SS..Hα-helixtrans-64.5-44.3178.600000111.8W168 F170 F175 I176W168-A172 VanDerWaalsContact O-CB 3.29Å; W168-A172 WeakPolarHBondContact O-CB 3.24Å; W168-A172 PolarHBondContact O-N 3.43Å; F170-A172 PolarHBondContact O-N 3.32Å; A172-F175 PolarHBondContact O-N 2.98Å; A172-I176 WeakPolarHBondContact O-CG1 3.38Å; A172-I176 PolarHBondContact O-N 2.88Å
173G95.3Very high93.9Very high20 Ų2057.4 Ų57.421%0.20629%0.287CS..Hα-helixtrans-61.7-47179.300000112.1I169 F170 F175 I176 L177I169-G173 WeakPolarHBondContact O-CA 3.43Å; I169-G173 PolarHBondContact O-N 3.25Å; F170-G173 PolarHBondContact O-N 3.02Å; G173-F175 PolarHBondContact O-N 3.46Å; G173-I176 PolarHBondContact O-N 2.68Å; G173-L177 WeakPolarHBondContact O-CB 3.22Å; G173-L177 VanDerWaalsContact O-CG 3.24Å; G173-L177 WeakPolarHBondContact O-CG 3.37Å; G173-L177 PolarHBondContact O-N 2.92Å
174M94.3Very high93.6Very high4 Ų458.5 Ų58.52%0.0229%0.293CS..Hα-helixtrans-64.7-40.7177.6-70.3-49-63.600111.8T86 F89 F170 I176 L177 F178 C208T86-M174 HydrophobicContact CG2-SD 4.29Å; F89-M174 HydrophobicContact CB-CE 3.94Å; F89-M174 HydrophobicContact CD1-CE 3.6Å; F89-M174 HydrophobicContact CE1-CE 4.36Å; F89-M174 HydrophobicContact CG-CE 3.94Å; F170-M174 HydrophobicContact CD1-CG 4.34Å; F170-M174 HydrophobicContact CD2-CG 4.02Å; F170-M174 HydrophobicContact CE1-CG 3.93Å; F170-M174 HydrophobicContact CE2-CG 3.61Å; F170-M174 HydrophobicContact CE2-SD 4.18Å; F170-M174 HydrophobicContact CG-CG 4.37Å; F170-M174 HydrophobicContact CZ-CG 3.57Å; F170-M174 HydrophobicContact CZ-SD 4.49Å; F170-M174 WeakPolarHBondContact O-CB 3.26Å; F170-M174 WeakPolarHBondContact O-CG 3.42Å; F170-M174 PolarHBondContact O-N 3.21Å; M174-I176 VanDerWaalsContact C-N 3.33Å; M174-I176 PolarHBondContact O-N 3.11Å; M174-L177 PolarHBondContact O-N 3.21Å; M174-L177 HydrophobicContact SD-CD1 3.92Å; M174-F178 HydrophobicContact CB-CD2 4.42Å; M174-F178 HydrophobicContact CB-CE2 4.43Å; M174-F178 HydrophobicContact CE-CD2 4.42Å; M174-F178 HydrophobicContact CE-CE2 3.79Å; M174-F178 HydrophobicContact CE-CZ 4.28Å; M174-F178 WeakPolarHBondContact O-CB 3.38Å; M174-F178 WeakPolarHBondContact O-CD2 3.24Å; M174-F178 PolarHBondContact O-N 2.93Å; M174-C208 WeakPolarHBondContact CE-SG 3.13Å
175F94.4Very high93Very high148 Ų14858.8 Ų58.865%0.64929%0.293SS*.Hα-helixtrans-58-44.7174.6-179.2-96.4000112.4V171 A172 G173 S179V171-F175 WeakPolarHBondContact O-CB 3.37Å; V171-F175 PolarHBondContact O-N 3.35Å; V171-F175 VanDerWaalsContact O-N 3.07Å; A172-F175 PolarHBondContact O-N 2.98Å; G173-F175 PolarHBondContact O-N 3.46Å; F175-S179 WeakPolarHBondContact O-CB 3.31Å; F175-S179 PolarHBondContact O-N 2.73Å; F175-S179 PolarHBondContact O-OG 3.22Å
176I95.7Very high92.3Very high101 Ų10159.3 Ų59.352%0.51830%0.3SS..Hα-helixtrans-62.6-49.1175.9-68.9164.6000110.3A172 G173 M174 F178 S179 V180A172-I176 WeakPolarHBondContact O-CG1 3.38Å; A172-I176 PolarHBondContact O-N 2.88Å; G173-I176 PolarHBondContact O-N 2.68Å; M174-I176 VanDerWaalsContact C-N 3.33Å; M174-I176 PolarHBondContact O-N 3.11Å; I176-F178 VanDerWaalsContact C-N 3.34Å; I176-F178 PolarHBondContact O-N 2.82Å; I176-S179 WeakPolarHBondContact O-CB 3.1Å; I176-S179 PolarHBondContact O-N 3.41Å; I176-V180 HydrophobicContact CG2-CG2 4.35Å; I176-V180 WeakPolarHBondContact O-CG2 3.34Å; I176-V180 PolarHBondContact O-N 3.47Å
177L94.6Very high91.6Very high29 Ų2968.8 Ų68.815%0.15234%0.335CS..Hα-helixtrans-61.9-41.7-178.6-68.3171000111.5T86 F89 S90 I93 G173 M174 S179 V180 Y181T86-L177 HydrophobicContact CG2-CD1 3.8Å; F89-L177 HydrophobicContact CD1-CB 3.53Å; F89-L177 HydrophobicContact CD1-CD1 4.18Å; F89-L177 HydrophobicContact CD1-CG 4.45Å; F89-L177 HydrophobicContact CE1-CB 3.72Å; S90-L177 WeakPolarHBondContact OG-CD1 3.44Å; I93-L177 HydrophobicContact CD1-CB 3.75Å; I93-L177 HydrophobicContact CD1-CD2 3.75Å; I93-L177 HydrophobicContact CD1-CG 4.33Å; I93-L177 VanDerWaalsContact CD1-O 3.22Å; I93-L177 WeakPolarHBondContact CD1-O 3.28Å; G173-L177 WeakPolarHBondContact O-CB 3.22Å; G173-L177 VanDerWaalsContact O-CG 3.24Å; G173-L177 WeakPolarHBondContact O-CG 3.37Å; G173-L177 PolarHBondContact O-N 2.92Å; M174-L177 PolarHBondContact O-N 3.21Å; M174-L177 HydrophobicContact SD-CD1 3.92Å; L177-S179 VanDerWaalsContact C-N 3.34Å; L177-S179 PolarHBondContact O-N 2.97Å; L177-V180 PolarHBondContact O-N 3.35Å; L177-Y181 VanDerWaalsContact O-CB 3.32Å; L177-Y181 WeakPolarHBondContact O-CB 3.19Å; L177-Y181 PolarHBondContact O-N 3.48Å
178F93Very high90.5Very high33 Ų3371.9 Ų71.915%0.14535%0.351CS..Hα-helixtrans-62.7-43.8176-84.9-65.6000111F89 M174 I176 Y181 F182 F201 C204 S205 C208F89-F178 AromaticContact CE1-CD1 3.82Å; F89-F178 HydrophobicContact CE1-CD1 3.82Å; F89-F178 HydrophobicContact CE1-CD2 4.4Å; F89-F178 HydrophobicContact CE1-CE1 4Å; F89-F178 HydrophobicContact CE1-CG 4.01Å; F89-F178 HydrophobicContact CE1-CZ 4.34Å; F89-F178 HydrophobicContact CE2-CE1 4.17Å; F89-F178 AromaticContact CZ-CD1 3.59Å; F89-F178 HydrophobicContact CZ-CD1 3.59Å; F89-F178 AromaticContact CZ-CE1 3.61Å; F89-F178 HydrophobicContact CZ-CE1 3.61Å; F89-F178 HydrophobicContact CZ-CG 4.25Å; F89-F178 HydrophobicContact CZ-CZ 4.28Å; M174-F178 HydrophobicContact CB-CD2 4.42Å; M174-F178 HydrophobicContact CB-CE2 4.43Å; M174-F178 HydrophobicContact CE-CD2 4.42Å; M174-F178 HydrophobicContact CE-CE2 3.79Å; M174-F178 HydrophobicContact CE-CZ 4.28Å; M174-F178 WeakPolarHBondContact O-CB 3.38Å; M174-F178 WeakPolarHBondContact O-CD2 3.24Å; M174-F178 PolarHBondContact O-N 2.93Å; I176-F178 VanDerWaalsContact C-N 3.34Å; I176-F178 PolarHBondContact O-N 2.82Å; F178-Y181 WeakPolarHBondContact O-CB 3.39Å; F178-Y181 PolarHBondContact O-N 3.49Å; F178-F182 HydrophobicContact CB-CE2 4.41Å; F178-F182 HydrophobicContact CD1-CE2 4.45Å; F178-F182 WeakPolarHBondContact O-CD2 3.37Å; F178-F182 PolarHBondContact O-N 2.84Å; F178-F201 AromaticContact CD1-CE2 3.93Å; F178-F201 HydrophobicContact CD1-CE2 3.93Å; F178-F201 HydrophobicContact CE1-CD2 4.3Å; F178-F201 AromaticContact CE1-CE2 3.76Å; F178-F201 HydrophobicContact CE1-CE2 3.76Å; F178-F201 HydrophobicContact CE1-CZ 4.39Å; F178-C204 HydrophobicContact CZ-CB 4.41Å; F178-S205 WeakPolarHBondContact CE1-OG 3.47Å; F178-C208 HydrophobicContact CE2-CB 3.94Å; F178-C208 HydrophobicContact CZ-CB 4.45Å
179S93.7Very high88.5Confident45 Ų4570.1 Ų70.132%0.31537%0.366SS..Hα-helixtrans-59.9-47.4176.8-62.90000111.8F175 I176 L177 Y181 F182 I183F175-S179 WeakPolarHBondContact O-CB 3.31Å; F175-S179 PolarHBondContact O-N 2.73Å; F175-S179 PolarHBondContact O-OG 3.22Å; I176-S179 WeakPolarHBondContact O-CB 3.1Å; I176-S179 PolarHBondContact O-N 3.41Å; L177-S179 VanDerWaalsContact C-N 3.34Å; L177-S179 PolarHBondContact O-N 2.97Å; S179-Y181 PolarHBondContact O-N 3.07Å; S179-F182 PolarHBondContact O-N 3.21Å; S179-I183 WeakPolarHBondContact O-CD1 3.21Å; S179-I183 VanDerWaalsContact O-CG1 3.28Å; S179-I183 WeakPolarHBondContact O-CG1 3.19Å; S179-I183 PolarHBondContact O-N 2.98Å
180V92.9Very high86.8Confident56 Ų5672.6 Ų72.634%0.33937%0.372SS..Hα-helixtrans-59.6-45.7175.2171.30000110.9I93 I176 L177 F182 I183 M184I93-V180 HydrophobicContact CG2-CG1 3.88Å; I176-V180 HydrophobicContact CG2-CG2 4.35Å; I176-V180 WeakPolarHBondContact O-CG2 3.34Å; I176-V180 PolarHBondContact O-N 3.47Å; L177-V180 PolarHBondContact O-N 3.35Å; V180-F182 PolarHBondContact O-N 3.18Å; V180-I183 PolarHBondContact O-N 3.23Å; V180-M184 HydrophobicContact CG1-CG 4.33Å; V180-M184 HydrophobicContact CG1-SD 3.87Å; V180-M184 WeakPolarHBondContact O-CB 3.33Å; V180-M184 VanDerWaalsContact O-CG 3.32Å; V180-M184 WeakPolarHBondContact O-CG 3.39Å; V180-M184 PolarHBondContact O-N 3.41Å
181Y89.3Confident84.8Confident5 Ų573.4 Ų73.42%0.0238%0.383CS..Hα-helixtrans-57.9-48.5178179.7-94.9000111.9F89 I93 I96 L177 F178 S179 I183 M184 V185 Q192 F201F89-Y181 HydrophobicContact CE2-CD2 4.35Å; F89-Y181 HydrophobicContact CE2-CG 4.45Å; F89-Y181 HydrophobicContact CZ-CD1 4.44Å; F89-Y181 HydrophobicContact CZ-CD2 4.2Å; F89-Y181 AromaticContact CZ-CG 3.91Å; F89-Y181 HydrophobicContact CZ-CG 3.91Å; I93-Y181 HydrophobicContact CG1-CD2 4.11Å; I96-Y181 HydrophobicContact CD1-CD2 4.14Å; I96-Y181 HydrophobicContact CD1-CE2 3.53Å; L177-Y181 VanDerWaalsContact O-CB 3.32Å; L177-Y181 WeakPolarHBondContact O-CB 3.19Å; L177-Y181 PolarHBondContact O-N 3.48Å; F178-Y181 WeakPolarHBondContact O-CB 3.39Å; F178-Y181 PolarHBondContact O-N 3.49Å; S179-Y181 PolarHBondContact O-N 3.07Å; Y181-I183 PolarHBondContact O-N 2.77Å; Y181-M184 PolarHBondContact O-N 2.86Å; Y181-V185 HydrophobicContact CD1-CG2 4.12Å; Y181-V185 HydrophobicContact CD2-CG2 4.49Å; Y181-V185 HydrophobicContact CE1-CG2 3.68Å; Y181-V185 HydrophobicContact CE2-CG2 4.1Å; Y181-V185 HydrophobicContact CG-CG2 4.49Å; Y181-V185 WeakPolarHBondContact O-CG2 3.19Å; Y181-V185 PolarHBondContact O-N 3.47Å; Y181-Q192 PolarHBondContact OH-NE2 3.38Å; Y181-Q192 PolarHBondContact OH-OE1 3.48Å; Y181-Q192 VanDerWaalsContact OH-OE1 3.05Å; Y181-F201 AromaticContact CD1-CD2 3.76Å; Y181-F201 HydrophobicContact CD1-CD2 3.76Å; Y181-F201 AromaticContact CD1-CE2 3.57Å; Y181-F201 HydrophobicContact CD1-CE2 3.57Å; Y181-F201 AromaticContact CE1-CD2 3.28Å; Y181-F201 HydrophobicContact CE1-CD2 3.28Å; Y181-F201 AromaticContact CE1-CE2 3.4Å; Y181-F201 HydrophobicContact CE1-CE2 3.4Å; Y181-F201 HydrophobicContact CE1-CG 4.09Å; Y181-F201 HydrophobicContact CE1-CZ 4.27Å; Y181-F201 HydrophobicContact CE2-CD2 4.43Å; Y181-F201 HydrophobicContact CG-CD2 4.5Å; Y181-F201 AromaticContact CZ-CD2 3.68Å
182F88.6Confident82.9Confident104 Ų10475 Ų7546%0.45639%0.388SS..Hα-helixtrans-62.9-40.2178.3-76.2-61.9000112.5F178 S179 V180 V185 K186 F201F178-F182 HydrophobicContact CB-CE2 4.41Å; F178-F182 HydrophobicContact CD1-CE2 4.45Å; F178-F182 WeakPolarHBondContact O-CD2 3.37Å; F178-F182 PolarHBondContact O-N 2.84Å; S179-F182 PolarHBondContact O-N 3.21Å; V180-F182 PolarHBondContact O-N 3.18Å; F182-V185 PolarHBondContact O-N 2.83Å; F182-K186 WeakPolarHBondContact O-CG 3.31Å; F182-K186 PolarHBondContact O-N 3.39Å; F182-F201 HydrophobicContact CE1-CZ 4.19Å; F182-F201 HydrophobicContact CZ-CE2 4.31Å; F182-F201 AromaticContact CZ-CZ 3.86Å; F182-F201 HydrophobicContact CZ-CZ 3.86Å
183I89.5Confident81Confident87 Ų8782.3 Ų82.345%0.44641%0.41SS..Hα-helixtrans-61.7-45.2175-68.3164.7000110.4S179 V180 Y181 K186 R187S179-I183 WeakPolarHBondContact O-CD1 3.21Å; S179-I183 VanDerWaalsContact O-CG1 3.28Å; S179-I183 WeakPolarHBondContact O-CG1 3.19Å; S179-I183 PolarHBondContact O-N 2.98Å; V180-I183 PolarHBondContact O-N 3.23Å; Y181-I183 PolarHBondContact O-N 2.77Å; I183-K186 PolarHBondContact O-N 3.04Å; I183-R187 WeakPolarHBondContact O-CG 3.23Å; I183-R187 PolarHBondContact O-N 2.87Å
184M85.6Confident79.7Confident38 Ų3884.1 Ų84.119%0.18742%0.42CS..Hα-helixtrans-64.9-43.9179.5-73.9-179.67200112.4I93 I96 V180 Y181 K186 R187 L188I93-M184 HydrophobicContact CG2-SD 3.63Å; I93-M184 WeakPolarHBondContact O-CE 3.38Å; I96-M184 HydrophobicContact CB-CE 4.28Å; I96-M184 HydrophobicContact CG2-CE 4.05Å; V180-M184 HydrophobicContact CG1-CG 4.33Å; V180-M184 HydrophobicContact CG1-SD 3.87Å; V180-M184 WeakPolarHBondContact O-CB 3.33Å; V180-M184 VanDerWaalsContact O-CG 3.32Å; V180-M184 WeakPolarHBondContact O-CG 3.39Å; V180-M184 PolarHBondContact O-N 3.41Å; Y181-M184 PolarHBondContact O-N 2.86Å; M184-K186 VanDerWaalsContact C-N 3.33Å; M184-K186 PolarHBondContact O-N 3.22Å; M184-R187 PolarHBondContact O-N 3.44Å; M184-L188 HydrophobicContact CB-CD1 4.37Å; M184-L188 HydrophobicContact CE-CD1 4.28Å; M184-L188 VanDerWaalsContact O-CB 3.22Å; M184-L188 WeakPolarHBondContact O-CB 3.42Å; M184-L188 WeakPolarHBondContact O-CG 3.31Å; M184-L188 PolarHBondContact O-N 3.5Å
185V81.4Confident78.5Confident40 Ų4092.1 Ų92.124%0.24245%0.454CS..Hα-helixtrans-63.2-39.7177.9169.80000111.3Y181 F182 L188Y181-V185 HydrophobicContact CD1-CG2 4.12Å; Y181-V185 HydrophobicContact CD2-CG2 4.49Å; Y181-V185 HydrophobicContact CE1-CG2 3.68Å; Y181-V185 HydrophobicContact CE2-CG2 4.1Å; Y181-V185 HydrophobicContact CG-CG2 4.49Å; Y181-V185 WeakPolarHBondContact O-CG2 3.19Å; Y181-V185 PolarHBondContact O-N 3.47Å; F182-V185 PolarHBondContact O-N 2.83Å; V185-L188 CarbonylContact O-C 3.58Å; V185-L188 VanDerWaalsContact O-O 3.05Å
186K81.5Confident77.4Confident179 Ų17987.5 Ų87.578%0.77844%0.444SS*.Hα-helixtrans-64.7-43.3175.4-74.7-178.2179.9-176.20112.6F182 I183 M184F182-K186 WeakPolarHBondContact O-CG 3.31Å; F182-K186 PolarHBondContact O-N 3.39Å; I183-K186 PolarHBondContact O-N 3.04Å; M184-K186 VanDerWaalsContact C-N 3.33Å; M184-K186 PolarHBondContact O-N 3.22Å
187R81.5Confident76.3Confident212 Ų21282.8 Ų82.880%0.842%0.42SS*.Hα-helixtrans-74-41.1-178.5-72.1-177.4177.5-173.70.4112.7I183 M184 A189I183-R187 WeakPolarHBondContact O-CG 3.23Å; I183-R187 PolarHBondContact O-N 2.87Å; M184-R187 PolarHBondContact O-N 3.44Å; R187-A189 PolarHBondContact O-N 2.85Å
188L72.8Confident75.5Confident66 Ų6689.3 Ų89.335%0.34644%0.442SS..SBendtrans-8780.3175.2-60.8162.8000106.8I96 M184 V185 K190 G191I96-L188 HydrophobicContact CG2-CD1 3.67Å; M184-L188 HydrophobicContact CB-CD1 4.37Å; M184-L188 HydrophobicContact CE-CD1 4.28Å; M184-L188 VanDerWaalsContact O-CB 3.22Å; M184-L188 WeakPolarHBondContact O-CB 3.42Å; M184-L188 WeakPolarHBondContact O-CG 3.31Å; M184-L188 PolarHBondContact O-N 3.5Å; V185-L188 CarbonylContact O-C 3.58Å; V185-L188 VanDerWaalsContact O-O 3.05Å; L188-K190 CarbonylContact O-C 3.56Å; L188-K190 PolarHBondContact O-N 3.48Å; L188-G191 WeakPolarHBondContact O-CA 3.41Å; L188-G191 PolarHBondContact O-N 2.68Å
189A54.8Low74.9Confident101 Ų10188.8 Ų88.884%0.83544%0.443SS*.THydrogen-bonded Turntrans-54.66.517800000115.6R187R187-A189 PolarHBondContact O-N 2.85Å
190K57.8Low74.3Confident168 Ų16887.5 Ų87.573%0.7343%0.432SS*.THydrogen-bonded Turntrans-112.827.6170.5-63.6-178.6177.1178.40112R99 L188 Q192R99-K190 PolarHBondContact NH2-O 2.9Å; L188-K190 CarbonylContact O-C 3.56Å; L188-K190 PolarHBondContact O-N 3.48Å; K190-Q192 PolarHBondContact O-N 3.35Å
191G53.6Low73.9Confident23 Ų2386.6 Ų86.624%0.23742%0.424CS..  trans-85.783.7-16800000114.4L188L188-G191 WeakPolarHBondContact O-CA 3.41Å; L188-G191 PolarHBondContact O-N 2.68Å
192Q54.3Low73.7Confident66 Ų6688.8 Ų88.831%0.30844%0.435SS..  trans109.985.2171.2-65.8-164.3-76.200114.9Y181 K190 S197Y181-Q192 PolarHBondContact OH-NE2 3.38Å; Y181-Q192 PolarHBondContact OH-OE1 3.48Å; Y181-Q192 VanDerWaalsContact OH-OE1 3.05Å; K190-Q192 PolarHBondContact O-N 3.35Å; Q192-S197 PolarHBondContact NE2-O 2.86Å; Q192-S197 PolarHBondContact NE2-OG 3.42Å
193K56.5Low73.6Confident203 Ų20383.9 Ų83.988%0.88341%0.414SS*.  trans-98.1-20.9159.8-71.9-166.8176.3-171.50113.7
194S68.2Low73.5Confident59 Ų5979.8 Ų79.841%0.41339%0.393SS..  trans-84.2127.2-176.264.70000112.1A196 S197 R198S194-A196 VanDerWaalsContact C-N 3.26Å; S194-A196 PolarHBondContact O-N 2.72Å; S194-S197 WeakPolarHBondContact O-CB 3.26Å; S194-S197 PolarHBondContact O-N 3.46Å; S194-S197 WeakPolarHBondContact OG-CB 3.18Å; S194-R198 PolarHBondContact O-N 3.46Å
195K69.8Low73.8Confident171 Ų17179.7 Ų79.774%0.74340%0.396SS*.Hα-helixtrans-52.3-41.8173.8-66.1177179.91730112.8S197 R198 S199K195-S197 PolarHBondContact O-N 3.11Å; K195-R198 PolarHBondContact O-N 3.03Å; K195-R198 VanDerWaalsContact O-N 3.07Å; K195-S199 PolarHBondContact O-N 2.91Å
196A69.6Low74.2Confident51 Ų5180.8 Ų80.842%0.42140%0.4SS..Hα-helixtrans-56-47179.100000112.7S194 R198 S199 I200S194-A196 VanDerWaalsContact C-N 3.26Å; S194-A196 PolarHBondContact O-N 2.72Å; A196-R198 VanDerWaalsContact C-N 3.29Å; A196-R198 PolarHBondContact O-N 2.94Å; A196-S199 WeakPolarHBondContact O-CB 3.34Å; A196-S199 PolarHBondContact O-N 3.2Å; A196-I200 WeakPolarHBondContact O-CG1 3.06Å; A196-I200 PolarHBondContact O-N 3.48Å
197S73.3Confident74.7Confident2 Ų272.4 Ų72.41%0.01436%0.364CS..Hα-helixtrans-59.4-38.6176.41790000113.5R92 Q192 S194 K195 S199 F201R92-S197 PolarHBondContact NE-OG 2.95Å; R92-S197 PolarHBondContact NH2-OG 3.24Å; Q192-S197 PolarHBondContact NE2-O 2.86Å; Q192-S197 PolarHBondContact NE2-OG 3.42Å; S194-S197 WeakPolarHBondContact O-CB 3.26Å; S194-S197 PolarHBondContact O-N 3.46Å; S194-S197 WeakPolarHBondContact OG-CB 3.18Å; K195-S197 PolarHBondContact O-N 3.11Å; S197-S199 VanDerWaalsContact C-N 3.33Å; S197-F201 PolarHBondContact O-N 3.41Å; S197-F201 VanDerWaalsContact O-N 3.1Å
198R78.2Confident75.2Confident166 Ų16662.7 Ų62.763%0.62633%0.328SS*.Hα-helixtrans-68.6-40.2-179.4-177.8178.7171.7-172.9-2.4110S194 K195 A196 F201 I202S194-R198 PolarHBondContact O-N 3.46Å; K195-R198 PolarHBondContact O-N 3.03Å; K195-R198 VanDerWaalsContact O-N 3.07Å; A196-R198 VanDerWaalsContact C-N 3.29Å; A196-R198 PolarHBondContact O-N 2.94Å; R198-F201 PolarHBondContact O-N 3.32Å; R198-I202 HydrophobicContact CG-CD1 3.84Å; R198-I202 HydrophobicContact CG-CG1 4.49Å; R198-I202 VanDerWaalsContact O-CG1 3.29Å; R198-I202 WeakPolarHBondContact O-CG1 3.36Å; R198-I202 PolarHBondContact O-N 3.45Å
199S80.4Confident76.1Confident23 Ų2366.3 Ų66.316%0.16134%0.341CS..Hα-helixtrans-58.7-49.8173.4-164.40000112K195 A196 S197 F201 I202 Q203K195-S199 PolarHBondContact O-N 2.91Å; A196-S199 WeakPolarHBondContact O-CB 3.34Å; A196-S199 PolarHBondContact O-N 3.2Å; S197-S199 VanDerWaalsContact C-N 3.33Å; S199-F201 VanDerWaalsContact C-N 3.35Å; S199-F201 PolarHBondContact O-N 3.19Å; S199-I202 PolarHBondContact O-N 3.32Å; S199-Q203 VanDerWaalsContact O-CB 3.28Å; S199-Q203 WeakPolarHBondContact O-CB 3.43Å; S199-Q203 PolarHBondContact O-N 3.31Å
200I80.6Confident78Confident17 Ų1763.8 Ų63.89%0.08731%0.311CS..Hα-helixtrans-59.7-44.7179.2-65.9167.3000111.2L88 R92 A196 Q203 C204L88-I200 HydrophobicContact CD2-CG2 4.25Å; L88-I200 HydrophobicContact CG-CG2 4.17Å; R92-I200 HydrophobicContact CB-CG2 4.43Å; R92-I200 HydrophobicContact CG-CG2 4.41Å; A196-I200 WeakPolarHBondContact O-CG1 3.06Å; A196-I200 PolarHBondContact O-N 3.48Å; I200-Q203 PolarHBondContact O-N 2.83Å; I200-C204 PolarHBondContact O-N 2.92Å; I200-C204 PolarHBondContact O-SG 3.1Å; I200-C204 VanDerWaalsContact O-SG 3.38Å
201F83.7Confident79.7Confident37 Ų3755.9 Ų55.916%0.16228%0.277CS..Hα-helixtrans-62.7-47.6179.3174.5-96.5000112.4F89 F178 Y181 F182 S197 R198 S199 Q203 C204 S205F89-F201 AromaticContact CE2-CD2 4Å; F89-F201 HydrophobicContact CE2-CD2 4Å; F89-F201 HydrophobicContact CZ-CD2 4.27Å; F89-F201 HydrophobicContact CZ-CE2 4.49Å; F178-F201 AromaticContact CD1-CE2 3.93Å; F178-F201 HydrophobicContact CD1-CE2 3.93Å; F178-F201 HydrophobicContact CE1-CD2 4.3Å; F178-F201 AromaticContact CE1-CE2 3.76Å; F178-F201 HydrophobicContact CE1-CE2 3.76Å; F178-F201 HydrophobicContact CE1-CZ 4.39Å; Y181-F201 AromaticContact CD1-CD2 3.76Å; Y181-F201 HydrophobicContact CD1-CD2 3.76Å; Y181-F201 AromaticContact CD1-CE2 3.57Å; Y181-F201 HydrophobicContact CD1-CE2 3.57Å; Y181-F201 AromaticContact CE1-CD2 3.28Å; Y181-F201 HydrophobicContact CE1-CD2 3.28Å; Y181-F201 AromaticContact CE1-CE2 3.4Å; Y181-F201 HydrophobicContact CE1-CE2 3.4Å; Y181-F201 HydrophobicContact CE1-CG 4.09Å; Y181-F201 HydrophobicContact CE1-CZ 4.27Å; Y181-F201 HydrophobicContact CE2-CD2 4.43Å; Y181-F201 HydrophobicContact CG-CD2 4.5Å; Y181-F201 AromaticContact CZ-CD2 3.68Å; F182-F201 HydrophobicContact CE1-CZ 4.19Å; F182-F201 HydrophobicContact CZ-CE2 4.31Å; F182-F201 AromaticContact CZ-CZ 3.86Å; F182-F201 HydrophobicContact CZ-CZ 3.86Å; S197-F201 PolarHBondContact O-N 3.41Å; S197-F201 VanDerWaalsContact O-N 3.1Å; R198-F201 PolarHBondContact O-N 3.32Å; S199-F201 VanDerWaalsContact C-N 3.35Å; S199-F201 PolarHBondContact O-N 3.19Å; F201-Q203 VanDerWaalsContact C-N 3.29Å; F201-Q203 PolarHBondContact O-N 3.41Å; F201-C204 PolarHBondContact O-N 3.48Å; F201-S205 WeakPolarHBondContact O-CB 3.34Å; F201-S205 PolarHBondContact O-N 3.46Å; F201-S205 PolarHBondContact O-OG 2.95Å
202I85.7Confident81.6Confident52 Ų5256.7 Ų56.727%0.26728%0.278SS..Hα-helixtrans-60.4-43.9177.6-69.6169.4000110R198 S199 S205 I206 L252R198-I202 HydrophobicContact CG-CD1 3.84Å; R198-I202 HydrophobicContact CG-CG1 4.49Å; R198-I202 VanDerWaalsContact O-CG1 3.29Å; R198-I202 WeakPolarHBondContact O-CG1 3.36Å; R198-I202 PolarHBondContact O-N 3.45Å; S199-I202 PolarHBondContact O-N 3.32Å; I202-S205 PolarHBondContact O-N 2.95Å; I202-I206 HydrophobicContact CG2-CD1 3.79Å; I202-I206 WeakPolarHBondContact O-CG1 3.22Å; I202-I206 PolarHBondContact O-N 3.47Å; I202-L252 HydrophobicContact CB-CD1 4.48Å; I202-L252 HydrophobicContact CD1-CD1 4.34Å; I202-L252 HydrophobicContact CG2-CD1 4.22Å
203Q86.6Confident83.5Confident1 Ų154.3 Ų54.31%0.00527%0.27CS..Hα-helixtrans-59.2-55.6178.2177.7-176.6-6.500112.3S199 I200 F201 S205 I206 I207 I248 Y249S199-Q203 VanDerWaalsContact O-CB 3.28Å; S199-Q203 WeakPolarHBondContact O-CB 3.43Å; S199-Q203 PolarHBondContact O-N 3.31Å; I200-Q203 PolarHBondContact O-N 2.83Å; F201-Q203 VanDerWaalsContact C-N 3.29Å; F201-Q203 PolarHBondContact O-N 3.41Å; Q203-S205 PolarHBondContact O-N 3.11Å; Q203-I206 PolarHBondContact O-N 3.32Å; Q203-I207 HydrophobicContact CG-CD1 3.62Å; Q203-I207 HydrophobicContact CG-CG1 4.41Å; Q203-I207 VanDerWaalsContact O-CG1 3.28Å; Q203-I207 WeakPolarHBondContact O-CG1 3.43Å; Q203-I207 PolarHBondContact O-N 3.07Å; Q203-I248 HydrophobicContact CB-CD1 4.18Å; Q203-I248 HydrophobicContact CB-CG2 4.16Å; Q203-I248 HydrophobicContact CG-CD1 4.14Å; Q203-Y249 PolarHBondContact NE2-OH 2.68Å
204C88.5Confident85.4Confident1 Ų144.7 Ų44.71%0.00723%0.229CC..Hα-helixtrans-59-36.7179-680000111.4F89 F178 I200 F201 C208F89-C204 HydrophobicContact CD2-CB 3.9Å; F89-C204 HydrophobicContact CE2-CB 4.46Å; F89-C204 HydrophobicContact CG-CB 4.33Å; F178-C204 HydrophobicContact CZ-CB 4.41Å; I200-C204 PolarHBondContact O-N 2.92Å; I200-C204 PolarHBondContact O-SG 3.1Å; I200-C204 VanDerWaalsContact O-SG 3.38Å; F201-C204 PolarHBondContact O-N 3.48Å; C204-C208 WeakPolarHBondContact O-CB 3.24Å; C204-C208 PolarHBondContact O-N 3.28Å; C204-C208 PolarHBondContact O-SG 2.88Å
205S90.2Very high86.7Confident36 Ų3642 Ų4225%0.25221%0.21SC..Hα-helixtrans-63.8-46.1179.1-56.50000112.4F178 F201 I202 Q203 F209F178-S205 WeakPolarHBondContact CE1-OG 3.47Å; F201-S205 WeakPolarHBondContact O-CB 3.34Å; F201-S205 PolarHBondContact O-N 3.46Å; F201-S205 PolarHBondContact O-OG 2.95Å; I202-S205 PolarHBondContact O-N 2.95Å; Q203-S205 PolarHBondContact O-N 3.11Å; S205-F209 PolarHBondContact O-N 3.34Å; S205-F209 VanDerWaalsContact O-N 3.11Å
206I91.7Very high87.8Confident62 Ų6237.9 Ų37.932%0.31820%0.195SC..Hα-helixtrans-66.9-47.7179.4-67.5168.4000110.7I202 Q203 C208 F209 F210 I248I202-I206 HydrophobicContact CG2-CD1 3.79Å; I202-I206 WeakPolarHBondContact O-CG1 3.22Å; I202-I206 PolarHBondContact O-N 3.47Å; Q203-I206 PolarHBondContact O-N 3.32Å; I206-C208 VanDerWaalsContact C-N 3.33Å; I206-C208 PolarHBondContact O-N 3.26Å; I206-F209 PolarHBondContact O-N 2.95Å; I206-F210 HydrophobicContact CG2-CD2 3.92Å; I206-F210 HydrophobicContact CG2-CE2 3.72Å; I206-F210 WeakPolarHBondContact O-CD2 3.41Å; I206-F210 PolarHBondContact O-N 3.03Å; I206-I248 HydrophobicContact CB-CD1 4.3Å; I206-I248 HydrophobicContact CD1-CD1 4.01Å; I206-I248 HydrophobicContact CD1-CG1 4.29Å; I206-I248 HydrophobicContact CG2-CD1 4.4Å
207I90.9Very high89Confident4 Ų436.2 Ų36.22%0.02118%0.179CC..Hα-helixtrans-57.5-47.7176.8-66.9172.3000109.9T85 Q203 F209 F210 N211 N241 P245T85-I207 HydrophobicContact CG2-CB 4.48Å; T85-I207 HydrophobicContact CG2-CG2 3.87Å; Q203-I207 HydrophobicContact CG-CD1 3.62Å; Q203-I207 HydrophobicContact CG-CG1 4.41Å; Q203-I207 VanDerWaalsContact O-CG1 3.28Å; Q203-I207 WeakPolarHBondContact O-CG1 3.43Å; Q203-I207 PolarHBondContact O-N 3.07Å; I207-F209 VanDerWaalsContact C-N 3.31Å; I207-F209 PolarHBondContact O-N 2.83Å; I207-F210 PolarHBondContact O-N 3.33Å; I207-N211 WeakPolarHBondContact O-CB 3.36Å; I207-N211 PolarHBondContact O-N 3.34Å; I207-N241 VanDerWaalsContact CG2-OD1 3.23Å; I207-N241 WeakPolarHBondContact CG2-OD1 3.49Å; I207-N241 PolarHBondContact O-OD1 3.38Å; I207-N241 VanDerWaalsContact O-OD1 3.07Å; I207-P245 HydrophobicContact CD1-CG 3.76Å; I207-P245 HydrophobicContact CG1-CG 4.1Å
208C92.7Very high90Very high7 Ų737.7 Ų37.75%0.04719%0.185CC..Hα-helixtrans-64-35.6-178.1-70.50000113.2M174 F178 C204 I206 T212M174-C208 WeakPolarHBondContact CE-SG 3.13Å; F178-C208 HydrophobicContact CE2-CB 3.94Å; F178-C208 HydrophobicContact CZ-CB 4.45Å; C204-C208 WeakPolarHBondContact O-CB 3.24Å; C204-C208 PolarHBondContact O-N 3.28Å; C204-C208 PolarHBondContact O-SG 2.88Å; I206-C208 VanDerWaalsContact C-N 3.33Å; I206-C208 PolarHBondContact O-N 3.26Å; C208-T212 VanDerWaalsContact O-CB 3.26Å; C208-T212 WeakPolarHBondContact O-CB 3.2Å; C208-T212 PolarHBondContact O-N 2.97Å; C208-T212 PolarHBondContact O-OG1 3.21Å
209F92Very high90.7Very high142 Ų14230.4 Ų30.462%0.62316%0.158SC*.Hα-helixtrans-60.9-53.2175.8173.8-100000111.2S205 I206 I207 T212 G213S205-F209 PolarHBondContact O-N 3.34Å; S205-F209 VanDerWaalsContact O-N 3.11Å; I206-F209 PolarHBondContact O-N 2.95Å; I207-F209 VanDerWaalsContact C-N 3.31Å; I207-F209 PolarHBondContact O-N 2.83Å; F209-T212 PolarHBondContact O-N 3.45Å; F209-G213 PolarHBondContact O-N 3.31Å
210F94.3Very high91.4Very high49 Ų4931.1 Ų31.122%0.21517%0.165CC..Hα-helixtrans-66.3-42.7179.7-71.9-58.8000112.3I206 I207 T212 G213 T214 C240 N241I206-F210 HydrophobicContact CG2-CD2 3.92Å; I206-F210 HydrophobicContact CG2-CE2 3.72Å; I206-F210 WeakPolarHBondContact O-CD2 3.41Å; I206-F210 PolarHBondContact O-N 3.03Å; I207-F210 PolarHBondContact O-N 3.33Å; F210-T212 VanDerWaalsContact C-N 3.35Å; F210-T212 PolarHBondContact O-N 2.79Å; F210-G213 PolarHBondContact O-N 3.19Å; F210-T214 PolarHBondContact O-N 2.98Å; F210-T214 VanDerWaalsContact O-N 3.12Å; F210-T214 PolarHBondContact O-OG1 3.39Å; F210-C240 HydrophobicContact CD1-CB 3.68Å; F210-C240 HydrophobicContact CD2-CB 3.97Å; F210-C240 HydrophobicContact CE1-CB 3.64Å; F210-C240 HydrophobicContact CE2-CB 3.92Å; F210-C240 HydrophobicContact CG-CB 3.86Å; F210-C240 HydrophobicContact CZ-CB 3.76Å; F210-N241 HydrophobicContact CB-CB 3.84Å
211N93.5Very high91.9Very high1 Ų131.5 Ų31.51%0.00517%0.168CC..Hα-helixtrans-59.6-45.9177.6-173.7-30.9000111.3W78 C82 F170 I207 G213 T214 A215W78-N211 HydrophobicContact CH2-CB 4.19Å; W78-N211 WeakPolarHBondContact CH2-OD1 3.16Å; W78-N211 WeakPolarHBondContact CZ2-OD1 3.2Å; C82-N211 PolarHBondContact SG-ND2 3.49Å; F170-N211 HydrophobicContact CE1-CB 3.71Å; F170-N211 VanDerWaalsContact CE1-ND2 3.25Å; F170-N211 WeakPolarHBondContact CE1-ND2 3.35Å; F170-N211 HydrophobicContact CZ-CB 4.13Å; F170-N211 VanDerWaalsContact CZ-ND2 3.28Å; F170-N211 WeakPolarHBondContact CZ-ND2 3.36Å; I207-N211 WeakPolarHBondContact O-CB 3.36Å; I207-N211 PolarHBondContact O-N 3.34Å; N211-G213 VanDerWaalsContact C-N 3.28Å; N211-G213 PolarHBondContact O-N 3.01Å; N211-T214 PolarHBondContact O-N 3.44Å; N211-A215 WeakPolarHBondContact O-CB 3.38Å; N211-A215 PolarHBondContact O-N 3.06Å
212T93.7Very high92.1Very high41 Ų4133.3 Ų33.325%0.25219%0.189SC..Hα-helixtrans-57.9-42.3177.2-58.50000111.4V171 C208 F209 F210 A215 L216V171-T212 HydrophobicContact CG1-CG2 4.33Å; V171-T212 HydrophobicContact CG2-CG2 4.14Å; C208-T212 VanDerWaalsContact O-CB 3.26Å; C208-T212 WeakPolarHBondContact O-CB 3.2Å; C208-T212 PolarHBondContact O-N 2.97Å; C208-T212 PolarHBondContact O-OG1 3.21Å; F209-T212 PolarHBondContact O-N 3.45Å; F210-T212 VanDerWaalsContact C-N 3.35Å; F210-T212 PolarHBondContact O-N 2.79Å; T212-A215 PolarHBondContact O-N 3Å; T212-L216 HydrophobicContact CG2-CD1 3.86Å; T212-L216 HydrophobicContact CG2-CG 4.22Å; T212-L216 WeakPolarHBondContact O-CB 3.38Å; T212-L216 VanDerWaalsContact O-CG 3.24Å; T212-L216 WeakPolarHBondContact O-CG 3.4Å; T212-L216 PolarHBondContact O-N 2.99Å
213G93.3Very high92.2Very high15 Ų1538.1 Ų38.116%0.15521%0.214CC..Hα-helixtrans-56.9-53.5175.500000112.3F209 F210 N211 L216 I217F209-G213 PolarHBondContact O-N 3.31Å; F210-G213 PolarHBondContact O-N 3.19Å; N211-G213 VanDerWaalsContact C-N 3.28Å; N211-G213 PolarHBondContact O-N 3.01Å; G213-L216 PolarHBondContact O-N 3.23Å; G213-I217 VanDerWaalsContact O-CD1 3.28Å; G213-I217 WeakPolarHBondContact O-CD1 3.35Å; G213-I217 VanDerWaalsContact O-CG1 3.28Å; G213-I217 WeakPolarHBondContact O-CG1 3.26Å; G213-I217 PolarHBondContact O-N 3.44Å
214T96Very high92.4Very high2 Ų242.5 Ų42.51%0.01224%0.241CC..Hα-helixtrans-61.9-46.6177.8-59.20000112.1W78 F210 N211 L216 I217 Y218 G234 C237 W238W78-T214 HydrophobicContact CH2-CG2 3.52Å; W78-T214 HydrophobicContact CZ2-CG2 3.98Å; W78-T214 HydrophobicContact CZ3-CG2 3.88Å; F210-T214 PolarHBondContact O-N 2.98Å; F210-T214 VanDerWaalsContact O-N 3.12Å; F210-T214 PolarHBondContact O-OG1 3.39Å; N211-T214 PolarHBondContact O-N 3.44Å; T214-L216 VanDerWaalsContact C-N 3.34Å; T214-L216 PolarHBondContact O-N 3.44Å; T214-I217 PolarHBondContact O-N 3.12Å; T214-Y218 HydrophobicContact CG2-CD2 3.69Å; T214-Y218 HydrophobicContact CG2-CE2 3.81Å; T214-Y218 WeakPolarHBondContact O-CD2 3.07Å; T214-Y218 PolarHBondContact O-N 3.11Å; T214-G234 PolarHBondContact OG1-O 3.15Å; T214-C237 VanDerWaalsContact OG1-C 3.31Å; T214-C237 WeakPolarHBondContact OG1-CB 3.49Å; T214-W238 HydrophobicContact CG2-CB 3.84Å; T214-W238 HydrophobicContact CG2-CG 4.31Å; T214-W238 WeakPolarHBondContact OG1-CA 3.17Å; T214-W238 PolarHBondContact OG1-N 3.26Å
215A95.4Very high92.4Very high1 Ų146.4 Ų46.41%0.00827%0.265CS..Hα-helixtrans-57.5-45.1-179.200000112.2W78 N167 V171 N211 T212 N219W78-A215 HydrophobicContact CZ2-CB 4.36Å; N167-A215 HydrophobicContact CB-CB 3.86Å; N167-A215 PolarHBondContact ND2-O 3.08Å; V171-A215 HydrophobicContact CG2-CB 4.2Å; N211-A215 WeakPolarHBondContact O-CB 3.38Å; N211-A215 PolarHBondContact O-N 3.06Å; T212-A215 PolarHBondContact O-N 3Å; A215-N219 WeakPolarHBondContact O-CB 3.34Å; A215-N219 VanDerWaalsContact O-CG 3.25Å; A215-N219 PolarHBondContact O-N 3.36Å; A215-N219 PolarHBondContact O-OD1 2.81Å
216L93.6Very high92.5Very high85 Ų8545.6 Ų45.645%0.44526%0.258SS..Hα-helixtrans-66.2-39.7178.1-69.6176000112T212 G213 T214 N219 A220T212-L216 HydrophobicContact CG2-CD1 3.86Å; T212-L216 HydrophobicContact CG2-CG 4.22Å; T212-L216 WeakPolarHBondContact O-CB 3.38Å; T212-L216 VanDerWaalsContact O-CG 3.24Å; T212-L216 WeakPolarHBondContact O-CG 3.4Å; T212-L216 PolarHBondContact O-N 2.99Å; G213-L216 PolarHBondContact O-N 3.23Å; T214-L216 VanDerWaalsContact C-N 3.34Å; T214-L216 PolarHBondContact O-N 3.44Å; L216-N219 PolarHBondContact O-N 3.11Å; L216-A220 WeakPolarHBondContact O-CB 3.07Å; L216-A220 PolarHBondContact O-N 3.35Å
217I94.7Very high92.6Very high16 Ų1644.9 Ų44.98%0.08226%0.262CS..Hα-helixtrans-69-43.6-179.4-68161000111.2G213 T214 N219 A220 L221 I230 L231 F233G213-I217 VanDerWaalsContact O-CD1 3.28Å; G213-I217 WeakPolarHBondContact O-CD1 3.35Å; G213-I217 VanDerWaalsContact O-CG1 3.28Å; G213-I217 WeakPolarHBondContact O-CG1 3.26Å; G213-I217 PolarHBondContact O-N 3.44Å; T214-I217 PolarHBondContact O-N 3.12Å; I217-N219 VanDerWaalsContact C-N 3.34Å; I217-A220 PolarHBondContact O-N 2.89Å; I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 PolarHBondContact O-N 2.85Å; I217-I230 HydrophobicContact CD1-CG2 4.29Å; I217-I230 HydrophobicContact CG1-CG2 3.99Å; I217-I230 HydrophobicContact CG2-CG2 4.35Å; I217-L231 HydrophobicContact CG2-CD2 4.43Å; I217-F233 HydrophobicContact CD1-CD1 3.67Å; I217-F233 HydrophobicContact CD1-CE1 4.27Å
218Y94.2Very high92.7Very high33 Ų3351.5 Ų51.513%0.12929%0.292CS..Hα-helixtrans-66.8-35.6175.7-88.3-97.2000112.3W140 T214 L221 A222 Q235W140-Y218 HydrophobicContact CB-CE1 4.34Å; W140-Y218 VanDerWaalsContact O-CE1 3.31Å; W140-Y218 WeakPolarHBondContact O-CE1 3.33Å; T214-Y218 HydrophobicContact CG2-CD2 3.69Å; T214-Y218 HydrophobicContact CG2-CE2 3.81Å; T214-Y218 WeakPolarHBondContact O-CD2 3.07Å; T214-Y218 PolarHBondContact O-N 3.11Å; Y218-L221 PolarHBondContact O-N 3.35Å; Y218-A222 PolarHBondContact O-N 3.08Å; Y218-Q235 PolarHBondContact OH-NE2 3.39Å
219N93.8Very high92.7Very high14 Ų1459.9 Ų59.98%0.07532%0.323CS..Hα-helixtrans-68.6-36.6173.1-75.913000111.9P164 N167 W168 A215 L216 I217 A222P164-N219 WeakPolarHBondContact CA-OD1 3.28Å; N167-N219 WeakPolarHBondContact CB-OD1 3.42Å; N167-N219 PolarHBondContact ND2-OD1 3.12Å; W168-N219 PolarHBondContact NE1-ND2 3Å; A215-N219 WeakPolarHBondContact O-CB 3.34Å; A215-N219 VanDerWaalsContact O-CG 3.25Å; A215-N219 PolarHBondContact O-N 3.36Å; A215-N219 PolarHBondContact O-OD1 2.81Å; L216-N219 PolarHBondContact O-N 3.11Å; I217-N219 VanDerWaalsContact C-N 3.34Å; N219-A222 WeakPolarHBondContact O-CB 3.21Å; N219-A222 PolarHBondContact O-N 3.1Å
220A93.3Very high92.9Very high37 Ų3755.5 Ų55.531%0.30631%0.306SS..Hα-helixtrans-64.5-43.9173.100000111L216 I217 A222 I223 V224 P226L216-A220 WeakPolarHBondContact O-CB 3.07Å; L216-A220 PolarHBondContact O-N 3.35Å; I217-A220 PolarHBondContact O-N 2.89Å; A220-A222 PolarHBondContact O-N 3.48Å; A220-I223 PolarHBondContact O-N 2.84Å; A220-V224 CarbonylContact C-O 3.54Å; A220-V224 PolarHBondContact O-N 3.17Å; A220-P226 HydrophobicContact CB-CG 4.4Å
221L91.8Very high92.9Very high26 Ų2653.5 Ų53.514%0.13630%0.297CS..Hα-helixtrans-56.8-30.6176.4-177.459.8000113F137 A139 I141 I217 Y218 I223 V224 L231F137-L221 HydrophobicContact CD1-CD1 4.12Å; A139-L221 HydrophobicContact CB-CD2 3.65Å; I141-L221 HydrophobicContact CG2-CD2 3.73Å; I141-L221 HydrophobicContact CG2-CG 4.38Å; I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 PolarHBondContact O-N 2.85Å; Y218-L221 PolarHBondContact O-N 3.35Å; L221-I223 PolarHBondContact O-N 3.47Å; L221-V224 VanDerWaalsContact CA-O 3.29Å; L221-V224 WeakPolarHBondContact CA-O 3.31Å; L221-L231 HydrophobicContact CD1-CD2 4.27Å; L221-L231 HydrophobicContact CD2-CD2 4.26Å
222A87.3Confident92.9Very high74 Ų7454.8 Ų54.861%0.61231%0.308SS*.THydrogen-bonded Turntrans-70.6-13.617500000114.2Y218 N219 A220Y218-A222 PolarHBondContact O-N 3.08Å; N219-A222 WeakPolarHBondContact O-CB 3.21Å; N219-A222 PolarHBondContact O-N 3.1Å; A220-A222 PolarHBondContact O-N 3.48Å
223I88.5Confident92.9Very high153 Ų15357.6 Ų57.679%0.78532%0.317SS*.THydrogen-bonded Turntrans-113.4-39.9-177.9-56168.8000110.7A220 L221A220-I223 PolarHBondContact O-N 2.84Å; L221-I223 PolarHBondContact O-N 3.47Å
224V90.7Very high93Very high94 Ų9456.9 Ų56.957%0.5731%0.31SS*.SBendtrans-153.3145.1-176.663.50000109.7A220 L221 P226A220-V224 CarbonylContact C-O 3.54Å; A220-V224 PolarHBondContact O-N 3.17Å; L221-V224 VanDerWaalsContact CA-O 3.29Å; L221-V224 WeakPolarHBondContact CA-O 3.31Å; V224-P226 WeakPolarHBondContact O-CD 3.18Å
225T89.4Confident93Very high83 Ų8357.9 Ų57.951%0.50931%0.314SS..  trans-71.3112172.6-500000110.2F137F137-T225 HydrophobicContact CD1-CG2 3.84Å; F137-T225 HydrophobicContact CE1-CG2 3.84Å
226P91.1Very high92.9Very high19 Ų1962.6 Ų62.612%0.12334%0.339CS..  trans-69.3164.9176.2-14.632000111.2A220 V224 I230 L231A220-P226 HydrophobicContact CB-CG 4.4Å; V224-P226 WeakPolarHBondContact O-CD 3.18Å; P226-I230 HydrophobicContact CB-CB 3.99Å; P226-I230 HydrophobicContact CB-CD1 4.31Å; P226-I230 HydrophobicContact CB-CG2 3.91Å; P226-L231 HydrophobicContact CB-CG 4.32Å; P226-L231 HydrophobicContact CG-CD2 4.21Å; P226-L231 HydrophobicContact CG-CG 4.48Å; P226-L231 WeakPolarHBondContact O-CD1 3.28Å
227A94.3Very high93Very high47 Ų4758.6 Ų58.639%0.38832%0.318SS..  trans-61150.7172.400000111.7W229 I230 L231A227-W229 VanDerWaalsContact C-N 3.28Å; A227-W229 PolarHBondContact O-N 3.2Å; A227-I230 HydrophobicContact CB-CD1 4.21Å; A227-I230 HydrophobicContact CB-CG1 4.33Å; A227-I230 WeakPolarHBondContact O-CA 3.36Å; A227-I230 WeakPolarHBondContact O-CB 3.36Å; A227-I230 PolarHBondContact O-N 2.93Å; A227-L231 PolarHBondContact O-N 3.43Å; A227-L231 VanDerWaalsContact O-N 3.11Å
228E92.7Very high93.1Very high142 Ų14258.2 Ų58.266%0.66432%0.315SS*.Hα-helixtrans-53.9-40.6-176.4-65.1177-179.100113.4M138 I230 L231 A232M138-E228 HydrophobicContact SD-CB 4.28Å; E228-I230 VanDerWaalsContact C-N 3.27Å; E228-I230 PolarHBondContact O-N 3.13Å; E228-L231 WeakPolarHBondContact O-CB 3.39Å; E228-L231 PolarHBondContact O-N 3.34Å; E228-A232 WeakPolarHBondContact O-CB 3.28Å; E228-A232 PolarHBondContact O-N 3.35Å
229W94.2Very high93.2Very high184 Ų18458.4 Ų58.470%0.69732%0.32SS*.Hα-helixtrans-66-29.6178.569.5-95.1000112.8A227 F233A227-W229 VanDerWaalsContact C-N 3.28Å; A227-W229 PolarHBondContact O-N 3.2Å; W229-F233 WeakPolarHBondContact O-CB 3.4Å; W229-F233 PolarHBondContact O-N 2.95Å
230I94.6Very high93.2Very high49 Ų4959.7 Ų59.725%0.25133%0.33SS..Hα-helixtrans-72-43174.6-58.7176.1000109.3I217 P226 A227 E228 F233 G234I217-I230 HydrophobicContact CD1-CG2 4.29Å; I217-I230 HydrophobicContact CG1-CG2 3.99Å; I217-I230 HydrophobicContact CG2-CG2 4.35Å; P226-I230 HydrophobicContact CB-CB 3.99Å; P226-I230 HydrophobicContact CB-CD1 4.31Å; P226-I230 HydrophobicContact CB-CG2 3.91Å; A227-I230 HydrophobicContact CB-CD1 4.21Å; A227-I230 HydrophobicContact CB-CG1 4.33Å; A227-I230 WeakPolarHBondContact O-CA 3.36Å; A227-I230 WeakPolarHBondContact O-CB 3.36Å; A227-I230 PolarHBondContact O-N 2.93Å; E228-I230 VanDerWaalsContact C-N 3.27Å; E228-I230 PolarHBondContact O-N 3.13Å; I230-F233 WeakPolarHBondContact O-CB 3.49Å; I230-F233 PolarHBondContact O-N 3.44Å; I230-G234 PolarHBondContact O-N 3.38Å
231L94.3Very high93.2Very high7 Ų758 Ų584%0.03732%0.315CS..Hα-helixtrans-62.2-45.8176.6-70162.5000111.2F137 M138 A139 I217 L221 P226 A227 E228 F233 G234 Q235F137-L231 WeakPolarHBondContact O-CD1 3.4Å; M138-L231 HydrophobicContact CB-CB 4.38Å; A139-L231 HydrophobicContact CB-CD2 4.45Å; I217-L231 HydrophobicContact CG2-CD2 4.43Å; L221-L231 HydrophobicContact CD1-CD2 4.27Å; L221-L231 HydrophobicContact CD2-CD2 4.26Å; P226-L231 HydrophobicContact CB-CG 4.32Å; P226-L231 HydrophobicContact CG-CD2 4.21Å; P226-L231 HydrophobicContact CG-CG 4.48Å; P226-L231 WeakPolarHBondContact O-CD1 3.28Å; A227-L231 PolarHBondContact O-N 3.43Å; A227-L231 VanDerWaalsContact O-N 3.11Å; E228-L231 WeakPolarHBondContact O-CB 3.39Å; E228-L231 PolarHBondContact O-N 3.34Å; L231-F233 VanDerWaalsContact C-N 3.32Å; L231-F233 PolarHBondContact O-N 2.74Å; L231-G234 WeakPolarHBondContact O-CA 3.44Å; L231-G234 PolarHBondContact O-N 3.32Å; L231-Q235 PolarHBondContact O-N 3.49Å
232A94.1Very high93.3Very high29 Ų2956.9 Ų56.924%0.2431%0.31CS..Hα-helixtrans-58.5-43.617400000111.8M138 E228 G234 Q235 I236M138-A232 HydrophobicContact CE-CB 4.03Å; E228-A232 WeakPolarHBondContact O-CB 3.28Å; E228-A232 PolarHBondContact O-N 3.35Å; A232-G234 VanDerWaalsContact C-N 3.3Å; A232-G234 PolarHBondContact O-N 3Å; A232-Q235 PolarHBondContact O-N 3.2Å; A232-I236 VanDerWaalsContact O-CG1 3.32Å; A232-I236 WeakPolarHBondContact O-CG1 3.36Å; A232-I236 PolarHBondContact O-N 3.47Å
233F94.2Very high93.5Very high99 Ų9955 Ų5543%0.43429%0.294SS..Hα-helixtrans-60.2-40173.9177.9-108.6000111.9I217 W229 I230 L231 Q235 I236 C237I217-F233 HydrophobicContact CD1-CD1 3.67Å; I217-F233 HydrophobicContact CD1-CE1 4.27Å; W229-F233 WeakPolarHBondContact O-CB 3.4Å; W229-F233 PolarHBondContact O-N 2.95Å; I230-F233 WeakPolarHBondContact O-CB 3.49Å; I230-F233 PolarHBondContact O-N 3.44Å; L231-F233 VanDerWaalsContact C-N 3.32Å; L231-F233 PolarHBondContact O-N 2.74Å; F233-Q235 PolarHBondContact O-N 3.15Å; F233-I236 PolarHBondContact O-N 3.46Å; F233-C237 VanDerWaalsContact CE1-SG 3.59Å; F233-C237 WeakPolarHBondContact CZ-SG 3.3Å; F233-C237 WeakPolarHBondContact O-CB 3.46Å; F233-C237 PolarHBondContact O-N 2.84Å; F233-C237 PolarHBondContact O-SG 3.39Å; F233-C237 VanDerWaalsContact O-SG 3.38Å
234G94.8Very high93.5Very high1 Ų148.1 Ų48.11%0.0126%0.259CS..Hα-helixtrans-61.5-40.4175.100000113.8T214 I230 L231 A232 C237 W238T214-G234 PolarHBondContact OG1-O 3.15Å; I230-G234 PolarHBondContact O-N 3.38Å; L231-G234 WeakPolarHBondContact O-CA 3.44Å; L231-G234 PolarHBondContact O-N 3.32Å; A232-G234 VanDerWaalsContact C-N 3.3Å; A232-G234 PolarHBondContact O-N 3Å; G234-C237 PolarHBondContact O-N 3.18Å; G234-W238 WeakPolarHBondContact O-CB 3.41Å; G234-W238 PolarHBondContact O-N 3.34Å
235Q95.2Very high93.2Very high22 Ų2243.7 Ų43.710%0.10323%0.233CC..Hα-helixtrans-66.7-40.8174.6-64-58.3-24.300112.2M138 Y218 L231 A232 F233 W238 T239M138-Q235 WeakPolarHBondContact O-CG 3.01Å; M138-Q235 PolarHBondContact O-NE2 2.94Å; Y218-Q235 PolarHBondContact OH-NE2 3.39Å; L231-Q235 PolarHBondContact O-N 3.49Å; A232-Q235 PolarHBondContact O-N 3.2Å; F233-Q235 PolarHBondContact O-N 3.15Å; Q235-W238 PolarHBondContact O-N 2.82Å; Q235-W238 VanDerWaalsContact OE1-CE3 3.26Å; Q235-T239 WeakPolarHBondContact O-CB 3.41Å; Q235-T239 PolarHBondContact O-N 2.94Å; Q235-T239 PolarHBondContact O-OG1 3.26Å; Q235-T239 VanDerWaalsContact O-OG1 3.1Å
236I95Very high93Very high101 Ų10142.7 Ų42.752%0.51823%0.233SC..Hα-helixtrans-64.1-46.3175.4-67.5165.1000109.9A232 F233 W238 T239 C240A232-I236 VanDerWaalsContact O-CG1 3.32Å; A232-I236 WeakPolarHBondContact O-CG1 3.36Å; A232-I236 PolarHBondContact O-N 3.47Å; F233-I236 PolarHBondContact O-N 3.46Å; I236-W238 VanDerWaalsContact C-N 3.3Å; I236-W238 PolarHBondContact O-N 3.49Å; I236-T239 PolarHBondContact O-N 3.39Å; I236-C240 WeakPolarHBondContact O-CB 3.29Å; I236-C240 PolarHBondContact O-N 2.92Å; I236-C240 PolarHBondContact O-SG 2.95Å; I236-C240 VanDerWaalsContact O-SG 3.32Å
237C96Very high92.8Very high1 Ų147 Ų471%0.00725%0.254CS..Hα-helixtrans-57.2-43.7174.4-76.30000111.6T214 F233 G234 T239 C240 N241T214-C237 VanDerWaalsContact OG1-C 3.31Å; T214-C237 WeakPolarHBondContact OG1-CB 3.49Å; F233-C237 VanDerWaalsContact CE1-SG 3.59Å; F233-C237 WeakPolarHBondContact CZ-SG 3.3Å; F233-C237 WeakPolarHBondContact O-CB 3.46Å; F233-C237 PolarHBondContact O-N 2.84Å; F233-C237 PolarHBondContact O-SG 3.39Å; F233-C237 VanDerWaalsContact O-SG 3.38Å; G234-C237 PolarHBondContact O-N 3.18Å; C237-T239 PolarHBondContact O-N 3.31Å; C237-C240 PolarHBondContact O-N 3.2Å; C237-N241 VanDerWaalsContact O-CB 3.26Å; C237-N241 WeakPolarHBondContact O-CB 3.42Å; C237-N241 PolarHBondContact O-N 2.94Å
238W96.2Very high92.3Very high8 Ų845.2 Ų45.23%0.0324%0.237CC..Hα-helixtrans-64.3-43.9180-179.830.4000111.3C45 A74 W78 W140 T214 G234 Q235 I236 N241 H242C45-W238 HydrophobicContact CB-CH2 4.16Å; C45-W238 HydrophobicContact CB-CZ2 4.25Å; A74-W238 HydrophobicContact CB-CH2 4.02Å; A74-W238 HydrophobicContact CB-CZ2 4.06Å; W78-W238 AromaticContact CE3-CD1 3.49Å; W78-W238 VanDerWaalsContact CE3-CD1 3.49Å; W78-W238 AromaticContact CE3-NE1 3.63Å; W78-W238 AromaticContact CZ3-CD1 3.53Å; W78-W238 HydrophobicContact CZ3-CG 4.42Å; W140-W238 AromaticContact CD1-CH2 3.83Å; W140-W238 AromaticContact CD1-CZ3 3.49Å; W140-W238 VanDerWaalsContact CD1-CZ3 3.49Å; W140-W238 AromaticContact NE1-CH2 3.69Å; W140-W238 AromaticContact NE1-CZ3 3.45Å; T214-W238 HydrophobicContact CG2-CB 3.84Å; T214-W238 HydrophobicContact CG2-CG 4.31Å; T214-W238 WeakPolarHBondContact OG1-CA 3.17Å; T214-W238 PolarHBondContact OG1-N 3.26Å; G234-W238 WeakPolarHBondContact O-CB 3.41Å; G234-W238 PolarHBondContact O-N 3.34Å; Q235-W238 PolarHBondContact O-N 2.82Å; Q235-W238 VanDerWaalsContact OE1-CE3 3.26Å; I236-W238 VanDerWaalsContact C-N 3.3Å; I236-W238 PolarHBondContact O-N 3.49Å; W238-N241 WeakPolarHBondContact O-CB 3.25Å; W238-N241 PolarHBondContact O-N 3.28Å; W238-H242 AromaticContact CD1-CD2 3.39Å; W238-H242 AromaticContact CD1-NE2 3.43Å; W238-H242 AromaticContact NE1-CD2 3.32Å; W238-H242 PolarHBondContact NE1-CD2 3.34Å; W238-H242 VanDerWaalsContact NE1-CD2 3.32Å; W238-H242 AromaticContact NE1-NE2 3.19Å; W238-H242 PolarHBondContact NE1-NE2 3.2Å; W238-H242 VanDerWaalsContact NE1-NE2 3.19Å; W238-H242 PolarHBondContact O-CD2 2.86Å; W238-H242 VanDerWaalsContact O-CD2 3.31Å; W238-H242 PolarHBondContact O-N 3.19Å
239T95.4Very high91.6Very high37 Ų3739.5 Ų39.523%0.22721%0.21CC..Hα-helixtrans-62.1-49.9175.3-66.60000111.7C47 Q235 I236 C237 N241 H242 A243C47-T239 WeakPolarHBondContact SG-CG2 3.46Å; Q235-T239 WeakPolarHBondContact O-CB 3.41Å; Q235-T239 PolarHBondContact O-N 2.94Å; Q235-T239 PolarHBondContact O-OG1 3.26Å; Q235-T239 VanDerWaalsContact O-OG1 3.1Å; I236-T239 PolarHBondContact O-N 3.39Å; C237-T239 PolarHBondContact O-N 3.31Å; T239-N241 VanDerWaalsContact C-N 3.27Å; T239-N241 PolarHBondContact O-N 2.83Å; T239-H242 PolarHBondContact O-N 3.5Å; T239-A243 WeakPolarHBondContact O-CB 3.39Å; T239-A243 PolarHBondContact O-N 3.32Å
240C93.8Very high90.9Very high41 Ų4132.6 Ų32.628%0.27719%0.188SC..Hα-helixtrans-62.4-35.3179-720000112.1F210 I236 C237 H242 A243 S244F210-C240 HydrophobicContact CD1-CB 3.68Å; F210-C240 HydrophobicContact CD2-CB 3.97Å; F210-C240 HydrophobicContact CE1-CB 3.64Å; F210-C240 HydrophobicContact CE2-CB 3.92Å; F210-C240 HydrophobicContact CG-CB 3.86Å; F210-C240 HydrophobicContact CZ-CB 3.76Å; I236-C240 WeakPolarHBondContact O-CB 3.29Å; I236-C240 PolarHBondContact O-N 2.92Å; I236-C240 PolarHBondContact O-SG 2.95Å; I236-C240 VanDerWaalsContact O-SG 3.32Å; C237-C240 PolarHBondContact O-N 3.2Å; C240-H242 PolarHBondContact O-N 3.38Å; C240-A243 PolarHBondContact O-N 3.42Å; C240-S244 WeakPolarHBondContact O-CB 3.35Å; C240-S244 PolarHBondContact O-N 2.85Å; C240-S244 PolarHBondContact O-OG 3.25Å
241N93.9Very high90.3Very high1 Ų133.8 Ų33.81%0.00520%0.197CC..Hα-helixtrans-54.3-52.4176.4179.859.6000111.1I207 F210 C237 W238 T239 S244 P245I207-N241 VanDerWaalsContact CG2-OD1 3.23Å; I207-N241 WeakPolarHBondContact CG2-OD1 3.49Å; I207-N241 PolarHBondContact O-OD1 3.38Å; I207-N241 VanDerWaalsContact O-OD1 3.07Å; F210-N241 HydrophobicContact CB-CB 3.84Å; C237-N241 VanDerWaalsContact O-CB 3.26Å; C237-N241 WeakPolarHBondContact O-CB 3.42Å; C237-N241 PolarHBondContact O-N 2.94Å; W238-N241 WeakPolarHBondContact O-CB 3.25Å; W238-N241 PolarHBondContact O-N 3.28Å; T239-N241 VanDerWaalsContact C-N 3.27Å; T239-N241 PolarHBondContact O-N 2.83Å; N241-S244 PolarHBondContact O-OG 3.19Å; N241-P245 WeakPolarHBondContact O-CD 3.45Å
242H93.2Very high89.5Confident3 Ų337.4 Ų37.41%0.01422%0.216CC..Hα-helixtrans-83.8-22.5-177-63.9-65.2000114.3D39 A42 T43 W78 W238 T239 C240 P245D39-H242 HydrophobicContact CB-CB 4.4Å; D39-H242 IonicContact OD1-CE1 3.53Å; D39-H242 IonicContact OD1-CG 3.82Å; D39-H242 IonicContact OD1-ND1 3.1Å; D39-H242 PolarHBondContact OD1-ND1 2.88Å; A42-H242 HydrophobicContact CB-CB 4.12Å; A42-H242 VanDerWaalsContact CB-CG 3.43Å; A42-H242 WeakPolarHBondContact CB-ND1 3.46Å; T43-H242 WeakPolarHBondContact OG1-CB 3.29Å; W78-H242 AromaticContact CE3-NE2 3.68Å; W238-H242 AromaticContact CD1-CD2 3.39Å; W238-H242 AromaticContact CD1-NE2 3.43Å; W238-H242 AromaticContact NE1-CD2 3.32Å; W238-H242 PolarHBondContact NE1-CD2 3.34Å; W238-H242 VanDerWaalsContact NE1-CD2 3.32Å; W238-H242 AromaticContact NE1-NE2 3.19Å; W238-H242 PolarHBondContact NE1-NE2 3.2Å; W238-H242 VanDerWaalsContact NE1-NE2 3.19Å; W238-H242 PolarHBondContact O-CD2 2.86Å; W238-H242 VanDerWaalsContact O-CD2 3.31Å; W238-H242 PolarHBondContact O-N 3.19Å; T239-H242 PolarHBondContact O-N 3.5Å; C240-H242 PolarHBondContact O-N 3.38Å; H242-P245 WeakPolarHBondContact O-CD 3.44Å
243A91.6Very high88.6Confident34 Ų3437 Ų3728%0.28121%0.21SC..Hα-helixtrans-78.3-30.7173.400000112.8T239 C240 P245 A246 I247T239-A243 WeakPolarHBondContact O-CB 3.39Å; T239-A243 PolarHBondContact O-N 3.32Å; C240-A243 PolarHBondContact O-N 3.42Å; A243-P245 VanDerWaalsContact C-CD 3.43Å; A243-A246 PolarHBondContact O-N 3.23Å; A243-I247 PolarHBondContact O-N 2.93Å
244S88.7Confident87.8Confident9 Ų934.4 Ų34.46%0.06320%0.201CC..Hα-helixtrans-56.2-40.4-174.270.30000114.7C240 N241 A246 I247 I248C240-S244 WeakPolarHBondContact O-CB 3.35Å; C240-S244 PolarHBondContact O-N 2.85Å; C240-S244 PolarHBondContact O-OG 3.25Å; N241-S244 PolarHBondContact O-OG 3.19Å; S244-A246 VanDerWaalsContact C-N 3.35Å; S244-A246 PolarHBondContact O-N 3.12Å; S244-I247 PolarHBondContact O-N 3.43Å; S244-I248 WeakPolarHBondContact O-CB 3.19Å; S244-I248 WeakPolarHBondContact O-CD1 3.35Å; S244-I248 VanDerWaalsContact O-CG1 3.23Å; S244-I248 WeakPolarHBondContact O-CG1 3.29Å; S244-I248 PolarHBondContact O-N 2.91Å
245P85.2Confident86.8Confident1 Ų136.2 Ų36.21%0.00621%0.212CC..Hα-helixtrans-65.2-38.9-175.7-25.341.3000111.8D39 I207 N241 H242 A243 I247 I248 Y249D39-P245 WeakPolarHBondContact OD2-CG 3.49Å; I207-P245 HydrophobicContact CD1-CG 3.76Å; I207-P245 HydrophobicContact CG1-CG 4.1Å; N241-P245 WeakPolarHBondContact O-CD 3.45Å; H242-P245 WeakPolarHBondContact O-CD 3.44Å; A243-P245 VanDerWaalsContact C-CD 3.43Å; P245-I247 PolarHBondContact O-N 2.86Å; P245-I248 PolarHBondContact O-N 3.47Å; P245-Y249 HydrophobicContact CB-CD2 4.44Å; P245-Y249 HydrophobicContact CB-CE2 3.9Å; P245-Y249 WeakPolarHBondContact O-CB 3.32Å; P245-Y249 WeakPolarHBondContact O-CD2 3.49Å; P245-Y249 PolarHBondContact O-N 2.98Å
246A84.6Confident85.8Confident62 Ų6237.7 Ų37.751%0.51222%0.22SC..Hα-helixtrans-59.1-46.3175.100000111.7A243 S244 Y249 V250A243-A246 PolarHBondContact O-N 3.23Å; S244-A246 VanDerWaalsContact C-N 3.35Å; S244-A246 PolarHBondContact O-N 3.12Å; A246-Y249 PolarHBondContact O-N 2.98Å; A246-V250 WeakPolarHBondContact O-CG2 3.46Å; A246-V250 PolarHBondContact O-N 2.83Å
247I86.3Confident85.2Confident109 Ų10936.1 Ų36.156%0.55921%0.207SC*.Hα-helixtrans-63.3-44.5177.2-60.9173.3000110.3A243 S244 P245 Y249 V250 T251A243-I247 PolarHBondContact O-N 2.93Å; S244-I247 PolarHBondContact O-N 3.43Å; P245-I247 PolarHBondContact O-N 2.86Å; I247-Y249 PolarHBondContact O-N 3.06Å; I247-V250 PolarHBondContact O-N 2.89Å; I247-T251 HydrophobicContact CG2-CG2 4.25Å; I247-T251 WeakPolarHBondContact O-CB 3.35Å; I247-T251 WeakPolarHBondContact O-CG2 3.46Å; I247-T251 PolarHBondContact O-N 3.35Å; I247-T251 PolarHBondContact O-OG1 3.05Å
248I83.9Confident84.4Confident9 Ų938.5 Ų38.55%0.04622%0.216CC..Hα-helixtrans-62.5-43.5179.3-69.4157.6000111Q203 I206 S244 P245 T251 L252Q203-I248 HydrophobicContact CB-CD1 4.18Å; Q203-I248 HydrophobicContact CB-CG2 4.16Å; Q203-I248 HydrophobicContact CG-CD1 4.14Å; I206-I248 HydrophobicContact CB-CD1 4.3Å; I206-I248 HydrophobicContact CD1-CD1 4.01Å; I206-I248 HydrophobicContact CD1-CG1 4.29Å; I206-I248 HydrophobicContact CG2-CD1 4.4Å; S244-I248 WeakPolarHBondContact O-CB 3.19Å; S244-I248 WeakPolarHBondContact O-CD1 3.35Å; S244-I248 VanDerWaalsContact O-CG1 3.23Å; S244-I248 WeakPolarHBondContact O-CG1 3.29Å; S244-I248 PolarHBondContact O-N 2.91Å; P245-I248 PolarHBondContact O-N 3.47Å; I248-T251 WeakPolarHBondContact CA-OG1 3.49Å; I248-T251 PolarHBondContact O-N 3.07Å; I248-T251 PolarHBondContact O-OG1 3.41Å; I248-T251 VanDerWaalsContact O-OG1 3.11Å; I248-L252 HydrophobicContact CG2-CD1 3.86Å; I248-L252 HydrophobicContact CG2-CG 4.29Å; I248-L252 WeakPolarHBondContact O-CB 3.3Å; I248-L252 PolarHBondContact O-N 3Å
249Y78.2Confident83.6Confident23 Ų2340.6 Ų40.69%0.0923%0.226CC..Hα-helixtrans-66.7-44.7179.4-64.9-40.2000112I32 Q203 P245 A246 I247 T251 N253 I256I32-Y249 HydrophobicContact CG2-CE1 3.91Å; I32-Y249 HydrophobicContact CG2-CE2 4.22Å; I32-Y249 WeakPolarHBondContact CG2-OH 3.32Å; Q203-Y249 PolarHBondContact NE2-OH 2.68Å; P245-Y249 HydrophobicContact CB-CD2 4.44Å; P245-Y249 HydrophobicContact CB-CE2 3.9Å; P245-Y249 WeakPolarHBondContact O-CB 3.32Å; P245-Y249 WeakPolarHBondContact O-CD2 3.49Å; P245-Y249 PolarHBondContact O-N 2.98Å; A246-Y249 PolarHBondContact O-N 2.98Å; I247-Y249 PolarHBondContact O-N 3.06Å; Y249-T251 VanDerWaalsContact C-N 3.26Å; Y249-T251 PolarHBondContact O-N 3.44Å; Y249-N253 VanDerWaalsContact O-CB 3.3Å; Y249-N253 WeakPolarHBondContact O-CB 3.4Å; Y249-N253 PolarHBondContact O-N 3.49Å; Y249-I256 HydrophobicContact CD1-CD1 4.45Å; Y249-I256 HydrophobicContact CG-CD1 4.21Å
250V80.2Confident82.8Confident38 Ų3842.7 Ų42.723%0.2323%0.232CC..Hα-helixtrans-66.2-29.6177.1174.10000111.6A246 I247 I256 R257 F260A246-V250 WeakPolarHBondContact O-CG2 3.46Å; A246-V250 PolarHBondContact O-N 2.83Å; I247-V250 PolarHBondContact O-N 2.89Å; V250-I256 HydrophobicContact CG2-CG2 4.45Å; V250-R257 HydrophobicContact CG1-CG 4.48Å; V250-R257 WeakPolarHBondContact O-CB 3.23Å; V250-R257 WeakPolarHBondContact O-CD 3.46Å; V250-R257 WeakPolarHBondContact O-CG 3.43Å; V250-F260 HydrophobicContact CG1-CD1 3.67Å; V250-F260 HydrophobicContact CG1-CE1 4.04Å; V250-F260 HydrophobicContact CG1-CG 4.28Å; V250-F260 HydrophobicContact CG2-CB 4.27Å; V250-F260 HydrophobicContact CG2-CD1 4.06Å; V250-F260 HydrophobicContact CG2-CD2 4.16Å; V250-F260 HydrophobicContact CG2-CE1 4.45Å; V250-F260 HydrophobicContact CG2-CG 3.89Å
251T81.7Confident82.3Confident74 Ų7442.6 Ų42.645%0.45423%0.229SC..Hα-helixtrans-86.8-45.5-17953.40000113.3I247 I248 Y249 R257I247-T251 HydrophobicContact CG2-CG2 4.25Å; I247-T251 WeakPolarHBondContact O-CB 3.35Å; I247-T251 WeakPolarHBondContact O-CG2 3.46Å; I247-T251 PolarHBondContact O-N 3.35Å; I247-T251 PolarHBondContact O-OG1 3.05Å; I248-T251 WeakPolarHBondContact CA-OG1 3.49Å; I248-T251 PolarHBondContact O-N 3.07Å; I248-T251 PolarHBondContact O-OG1 3.41Å; I248-T251 VanDerWaalsContact O-OG1 3.11Å; Y249-T251 VanDerWaalsContact C-N 3.26Å; Y249-T251 PolarHBondContact O-N 3.44Å; T251-R257 PolarHBondContact O-NH1 3.1Å
252L78.2Confident81.9Confident83 Ų8345.3 Ų45.344%0.43524%0.241SC..Hα-helixtrans-96.8-23.7-170.6-59.9-171.8000114.6I202 I248I202-L252 HydrophobicContact CB-CD1 4.48Å; I202-L252 HydrophobicContact CD1-CD1 4.34Å; I202-L252 HydrophobicContact CG2-CD1 4.22Å; I248-L252 HydrophobicContact CG2-CD1 3.86Å; I248-L252 HydrophobicContact CG2-CG 4.29Å; I248-L252 WeakPolarHBondContact O-CB 3.3Å; I248-L252 PolarHBondContact O-N 3Å
253N75Confident81.3Confident22 Ų2250.2 Ų50.212%0.11827%0.271CS..  trans-96.7108.6177-174.6-36.1000109.9E23 Y249 T255 I256 R257E23-N253 PolarHBondContact OE2-ND2 3.2Å; Y249-N253 VanDerWaalsContact O-CB 3.3Å; Y249-N253 WeakPolarHBondContact O-CB 3.4Å; Y249-N253 PolarHBondContact O-N 3.49Å; N253-T255 VanDerWaalsContact C-N 3.25Å; N253-T255 PolarHBondContact O-N 3.03Å; N253-T255 WeakPolarHBondContact OD1-CA 3.11Å; N253-T255 VanDerWaalsContact OD1-CB 3.23Å; N253-T255 WeakPolarHBondContact OD1-CB 3.46Å; N253-T255 PolarHBondContact OD1-N 2.8Å; N253-I256 HydrophobicContact CB-CB 4.05Å; N253-I256 HydrophobicContact CB-CD1 3.93Å; N253-I256 HydrophobicContact CB-CG1 4.07Å; N253-I256 WeakPolarHBondContact ND2-CD1 3.36Å; N253-I256 PolarHBondContact O-N 3.03Å; N253-I256 PolarHBondContact OD1-N 3.28Å; N253-I256 VanDerWaalsContact OD1-N 3.08Å; N253-R257 VanDerWaalsContact O-CB 3.31Å; N253-R257 WeakPolarHBondContact O-CB 3.4Å; N253-R257 PolarHBondContact O-N 3.46Å
254D75.7Confident80.9Confident43 Ų4352.5 Ų52.523%0.2328%0.281CS..Hα-helixtrans-58.2-36.7-179.6-74-42.9000112.4R257 R258 K272D254-R257 IonicContact OD1-CZ 2.68Å; D254-R257 IonicContact OD1-NH1 2.67Å; D254-R257 IonicContact OD1-NH2 3.43Å; D254-R257 PolarHBondContact OD1-NH2 3.27Å; D254-R258 WeakPolarHBondContact O-CB 3.49Å; D254-R258 WeakPolarHBondContact O-CD 3.5Å; D254-R258 WeakPolarHBondContact O-CG 3.39Å; D254-R258 PolarHBondContact O-N 2.98Å; D254-R258 VanDerWaalsContact O-N 3.13Å; D254-K272 IonicContact OD1-NZ 3.77Å; D254-K272 PolarHBondContact OD1-NZ 2.95Å; D254-K272 VanDerWaalsContact OD1-NZ 3.1Å; D254-K272 IonicContact OD2-NZ 2.83Å; D254-K272 PolarHBondContact OD2-NZ 2.79Å
255T75.4Confident80.9Confident39 Ų3958.2 Ų58.224%0.23931%0.305CS..Hα-helixtrans-66.8-54.5179.3-50.10000110.2V20 E23 N253 R257 R258 E259V20-T255 HydrophobicContact CG2-CG2 4.21Å; E23-T255 VanDerWaalsContact OE1-CB 3.26Å; E23-T255 WeakPolarHBondContact OE1-CB 3.32Å; E23-T255 PolarHBondContact OE1-OG1 3.26Å; N253-T255 VanDerWaalsContact C-N 3.25Å; N253-T255 PolarHBondContact O-N 3.03Å; N253-T255 WeakPolarHBondContact OD1-CA 3.11Å; N253-T255 VanDerWaalsContact OD1-CB 3.23Å; N253-T255 WeakPolarHBondContact OD1-CB 3.46Å; N253-T255 PolarHBondContact OD1-N 2.8Å; T255-R257 VanDerWaalsContact C-N 3.3Å; T255-R257 PolarHBondContact O-N 3.25Å; T255-R258 PolarHBondContact O-N 3.29Å; T255-E259 PolarHBondContact O-N 2.93Å; T255-E259 VanDerWaalsContact O-N 3.14Å
256I74.3Confident80.9Confident53 Ų5368.8 Ų68.827%0.27235%0.345SS..Hα-helixtrans-61.1-42.2179.5-63.1174.6000110.3Y249 V250 N253 R258 E259 F260Y249-I256 HydrophobicContact CD1-CD1 4.45Å; Y249-I256 HydrophobicContact CG-CD1 4.21Å; V250-I256 HydrophobicContact CG2-CG2 4.45Å; N253-I256 HydrophobicContact CB-CB 4.05Å; N253-I256 HydrophobicContact CB-CD1 3.93Å; N253-I256 HydrophobicContact CB-CG1 4.07Å; N253-I256 WeakPolarHBondContact ND2-CD1 3.36Å; N253-I256 PolarHBondContact O-N 3.03Å; N253-I256 PolarHBondContact OD1-N 3.28Å; N253-I256 VanDerWaalsContact OD1-N 3.08Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.06Å; I256-E259 PolarHBondContact O-N 3.41Å; I256-F260 WeakPolarHBondContact O-CB 3.49Å; I256-F260 PolarHBondContact O-N 3.42Å
257R81.4Confident80.9Confident69 Ų6969 Ų6926%0.2634%0.34SS..Hα-helixtrans-57.9-45.5177.4-168.7170.866.5-130.8-6.6112.3V250 T251 N253 D254 T255 L261V250-R257 HydrophobicContact CG1-CG 4.48Å; V250-R257 WeakPolarHBondContact O-CB 3.23Å; V250-R257 WeakPolarHBondContact O-CD 3.46Å; V250-R257 WeakPolarHBondContact O-CG 3.43Å; T251-R257 PolarHBondContact O-NH1 3.1Å; N253-R257 VanDerWaalsContact O-CB 3.31Å; N253-R257 WeakPolarHBondContact O-CB 3.4Å; N253-R257 PolarHBondContact O-N 3.46Å; D254-R257 IonicContact OD1-CZ 2.68Å; D254-R257 IonicContact OD1-NH1 2.67Å; D254-R257 IonicContact OD1-NH2 3.43Å; D254-R257 PolarHBondContact OD1-NH2 3.27Å; T255-R257 VanDerWaalsContact C-N 3.3Å; T255-R257 PolarHBondContact O-N 3.25Å; R257-L261 HydrophobicContact CG-CD1 3.92Å; R257-L261 HydrophobicContact CG-CG 4.33Å; R257-L261 WeakPolarHBondContact O-CB 3.48Å; R257-L261 VanDerWaalsContact O-CG 3.24Å; R257-L261 WeakPolarHBondContact O-CG 3.29Å; R257-L261 PolarHBondContact O-N 3.11Å
258R80.3Confident80.7Confident51 Ų5169 Ų6919%0.19235%0.345CS..Hα-helixtrans-63.1-48.2-179.5-75.6168.2-180-73.8-1.1111.3D254 T255 I256 L261 K262 L269 A270 K272D254-R258 WeakPolarHBondContact O-CB 3.49Å; D254-R258 WeakPolarHBondContact O-CD 3.5Å; D254-R258 WeakPolarHBondContact O-CG 3.39Å; D254-R258 PolarHBondContact O-N 2.98Å; D254-R258 VanDerWaalsContact O-N 3.13Å; T255-R258 PolarHBondContact O-N 3.29Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.06Å; R258-L261 PolarHBondContact O-N 3.27Å; R258-K262 VanDerWaalsContact O-CB 3.26Å; R258-K262 WeakPolarHBondContact O-CB 3.22Å; R258-K262 PolarHBondContact O-N 3.26Å; R258-L269 HydrophobicContact CG-CB 4.24Å; R258-L269 HydrophobicContact CG-CD1 3.99Å; R258-L269 VanDerWaalsContact NH1-CB 3.26Å; R258-L269 PolarHBondContact NH1-O 2.99Å; R258-A270 VanDerWaalsContact CZ-O 3.26Å; R258-A270 PolarHBondContact NH1-O 3.08Å; R258-A270 PolarHBondContact NH2-O 2.92Å; R258-K272 VanDerWaalsContact NH2-N 3.14Å
259E79.3Confident80.3Confident52 Ų5271.5 Ų71.524%0.24336%0.358CS..Hα-helixtrans-67.3-39179.5-67.6-52.5130.300111.9V20 T255 I256 K262 T263V20-E259 HydrophobicContact CG2-CG 4.48Å; T255-E259 PolarHBondContact O-N 2.93Å; T255-E259 VanDerWaalsContact O-N 3.14Å; I256-E259 PolarHBondContact O-N 3.41Å; E259-K262 PolarHBondContact O-N 3.08Å; E259-T263 VanDerWaalsContact O-CB 3.26Å; E259-T263 WeakPolarHBondContact O-CB 3.35Å; E259-T263 PolarHBondContact O-N 3.39Å; E259-T263 PolarHBondContact O-OG1 3.16Å
260F78.1Confident80.2Confident80 Ų8074.3 Ų74.335%0.35139%0.386SS..Hα-helixtrans-61.7-50.2174.5178.6-99.9000111.9V250 I256 K262 T263 V264 F265V250-F260 HydrophobicContact CG1-CD1 3.67Å; V250-F260 HydrophobicContact CG1-CE1 4.04Å; V250-F260 HydrophobicContact CG1-CG 4.28Å; V250-F260 HydrophobicContact CG2-CB 4.27Å; V250-F260 HydrophobicContact CG2-CD1 4.06Å; V250-F260 HydrophobicContact CG2-CD2 4.16Å; V250-F260 HydrophobicContact CG2-CE1 4.45Å; V250-F260 HydrophobicContact CG2-CG 3.89Å; I256-F260 WeakPolarHBondContact O-CB 3.49Å; I256-F260 PolarHBondContact O-N 3.42Å; F260-K262 VanDerWaalsContact C-N 3.32Å; F260-K262 PolarHBondContact O-N 3.06Å; F260-T263 PolarHBondContact O-N 3.34Å; F260-V264 HydrophobicContact CD2-CG2 3.78Å; F260-V264 HydrophobicContact CE1-CG2 4.49Å; F260-V264 HydrophobicContact CE2-CB 4.39Å; F260-V264 HydrophobicContact CE2-CG2 3.52Å; F260-V264 HydrophobicContact CG-CG2 4.39Å; F260-V264 HydrophobicContact CZ-CB 4.32Å; F260-V264 HydrophobicContact CZ-CG1 4.41Å; F260-V264 HydrophobicContact CZ-CG2 3.9Å; F260-V264 WeakPolarHBondContact O-CB 3.45Å; F260-V264 WeakPolarHBondContact O-CG2 3.43Å; F260-V264 PolarHBondContact O-N 3.2Å; F260-F265 HydrophobicContact CE1-CD2 4.5Å; F260-F265 AromaticContact CE1-CE2 3.93Å; F260-F265 HydrophobicContact CE1-CE2 3.93Å
261L83.6Confident79.6Confident39 Ų3977.6 Ų77.620%0.20441%0.408CS..Hα-helixtrans-64.4-36.9179.5-71.7175.6000112.5R257 R258 F265 R266 V267 L269R257-L261 HydrophobicContact CG-CD1 3.92Å; R257-L261 HydrophobicContact CG-CG 4.33Å; R257-L261 WeakPolarHBondContact O-CB 3.48Å; R257-L261 VanDerWaalsContact O-CG 3.24Å; R257-L261 WeakPolarHBondContact O-CG 3.29Å; R257-L261 PolarHBondContact O-N 3.11Å; R258-L261 PolarHBondContact O-N 3.27Å; L261-F265 HydrophobicContact CD2-CD2 3.68Å; L261-F265 HydrophobicContact CD2-CE2 4.2Å; L261-F265 CarbonylContact O-C 3.47Å; L261-F265 WeakPolarHBondContact O-CA 3.38Å; L261-F265 WeakPolarHBondContact O-CB 3.43Å; L261-F265 PolarHBondContact O-N 3.2Å; L261-R266 PolarHBondContact O-N 2.99Å; L261-V267 CarbonylContact C-O 3.47Å; L261-V267 HydrophobicContact CB-CB 4.44Å; L261-V267 PolarHBondContact O-N 3.03Å; L261-V267 VanDerWaalsContact O-N 3.08Å; L261-L269 HydrophobicContact CD1-CD1 3.63Å; L261-L269 HydrophobicContact CD1-CG 4.12Å
262K85.3Confident78.5Confident59 Ų5979.6 Ų79.626%0.25741%0.41SS..Hα-helixtrans-66.6-41.1174.5-176.8-175.7173.8-166.30111.7R258 E259 F260 R266 V267R258-K262 VanDerWaalsContact O-CB 3.26Å; R258-K262 WeakPolarHBondContact O-CB 3.22Å; R258-K262 PolarHBondContact O-N 3.26Å; E259-K262 PolarHBondContact O-N 3.08Å; F260-K262 VanDerWaalsContact C-N 3.32Å; F260-K262 PolarHBondContact O-N 3.06Å; K262-R266 WeakPolarHBondContact O-CA 3.47Å; K262-R266 PolarHBondContact O-N 3.41Å; K262-V267 WeakPolarHBondContact CA-O 3.5Å; K262-V267 PolarHBondContact N-O 3.18Å
263T81.3Confident77.5Confident105 Ų10582 Ų8264%0.64442%0.422SS*.Hα-helixtrans-75.3-48.6-177.4-56.60000111.8E259 F260E259-T263 VanDerWaalsContact O-CB 3.26Å; E259-T263 WeakPolarHBondContact O-CB 3.35Å; E259-T263 PolarHBondContact O-N 3.39Å; E259-T263 PolarHBondContact O-OG1 3.16Å; F260-T263 PolarHBondContact O-N 3.34Å
264V82.6Confident76.3Confident82 Ų8286 Ų8650%0.49744%0.443SS..Hα-helixtrans-85.4-44.1-172.5178.60000111.9F260F260-V264 HydrophobicContact CD2-CG2 3.78Å; F260-V264 HydrophobicContact CE1-CG2 4.49Å; F260-V264 HydrophobicContact CE2-CB 4.39Å; F260-V264 HydrophobicContact CE2-CG2 3.52Å; F260-V264 HydrophobicContact CG-CG2 4.39Å; F260-V264 HydrophobicContact CZ-CB 4.32Å; F260-V264 HydrophobicContact CZ-CG1 4.41Å; F260-V264 HydrophobicContact CZ-CG2 3.9Å; F260-V264 WeakPolarHBondContact O-CB 3.45Å; F260-V264 WeakPolarHBondContact O-CG2 3.43Å; F260-V264 PolarHBondContact O-N 3.2Å
265F88.1Confident75.1Confident129 Ų12987.1 Ų87.157%0.56646%0.459SS*.SBendtrans-107.2-1.8-174-62.9-78000113.7F260 L261 V267F260-F265 HydrophobicContact CE1-CD2 4.5Å; F260-F265 AromaticContact CE1-CE2 3.93Å; F260-F265 HydrophobicContact CE1-CE2 3.93Å; L261-F265 HydrophobicContact CD2-CD2 3.68Å; L261-F265 HydrophobicContact CD2-CE2 4.2Å; L261-F265 CarbonylContact O-C 3.47Å; L261-F265 WeakPolarHBondContact O-CA 3.38Å; L261-F265 WeakPolarHBondContact O-CB 3.43Å; L261-F265 PolarHBondContact O-N 3.2Å; F265-V267 HydrophobicContact CB-CB 4.47Å; F265-V267 HydrophobicContact CB-CG2 3.89Å; F265-V267 PolarHBondContact O-N 3.12Å; F265-V267 VanDerWaalsContact O-N 3.11Å
266R85.3Confident73.9Confident224 Ų22490.5 Ų90.585%0.84548%0.48SS*.  trans55.223.5-173.1-57.6-177.3179.8176.5-0.1113.5L261 K262L261-R266 PolarHBondContact O-N 2.99Å; K262-R266 WeakPolarHBondContact O-CA 3.47Å; K262-R266 PolarHBondContact O-N 3.41Å
267V84.1Confident72.5Confident67 Ų6791.8 Ų91.841%0.40649%0.49SS..  trans-90.2116178.51760000109.1L261 K262 F265 L269L261-V267 CarbonylContact C-O 3.47Å; L261-V267 HydrophobicContact CB-CB 4.44Å; L261-V267 PolarHBondContact O-N 3.03Å; L261-V267 VanDerWaalsContact O-N 3.08Å; K262-V267 WeakPolarHBondContact CA-O 3.5Å; K262-V267 PolarHBondContact N-O 3.18Å; F265-V267 HydrophobicContact CB-CB 4.47Å; F265-V267 HydrophobicContact CB-CG2 3.89Å; F265-V267 PolarHBondContact O-N 3.12Å; F265-V267 VanDerWaalsContact O-N 3.11Å; V267-L269 HydrophobicContact CG1-CD2 4.31Å
268T82.4Confident70.7Confident107 Ų10791 Ų9166%0.65650%0.496SS*.  trans-92107.6173.1-59.20000109.5
269L75.9Confident69Low63 Ų6393.3 Ų93.333%0.3352%0.515SS..PPolyproline II helixtrans-74.8132.2173.1-67.9178.9000110.3R258 L261 V267R258-L269 HydrophobicContact CG-CB 4.24Å; R258-L269 HydrophobicContact CG-CD1 3.99Å; R258-L269 VanDerWaalsContact NH1-CB 3.26Å; R258-L269 PolarHBondContact NH1-O 2.99Å; L261-L269 HydrophobicContact CD1-CD1 3.63Å; L261-L269 HydrophobicContact CD1-CG 4.12Å; V267-L269 HydrophobicContact CG1-CD2 4.31Å
270A75.5Confident67.2Low81 Ų8193.3 Ų93.367%0.66952%0.524SS*.PPolyproline II helixtrans-54.4139172.500000110.7R258 K272R258-A270 VanDerWaalsContact CZ-O 3.26Å; R258-A270 PolarHBondContact NH1-O 3.08Å; R258-A270 PolarHBondContact NH2-O 2.92Å; A270-K272 PolarHBondContact O-N 3.22Å
271P67.8Low65.4Low108 Ų10896.6 Ų96.670%0.70154%0.542SS*.PPolyproline II helixtrans-50.1141.6175-22.631.1000110.1I273P271-I273 PolarHBondContact O-N 3.11Å
272K60.2Low63.4Low115 Ų115103.3 Ų103.350%0.557%0.57SS.*  trans-64.5109.9166.1-90.6-179.9-178175.80105D254 R258 A270 D274D254-K272 IonicContact OD1-NZ 3.77Å; D254-K272 PolarHBondContact OD1-NZ 2.95Å; D254-K272 VanDerWaalsContact OD1-NZ 3.1Å; D254-K272 IonicContact OD2-NZ 2.83Å; D254-K272 PolarHBondContact OD2-NZ 2.79Å; R258-K272 VanDerWaalsContact NH2-N 3.14Å; A270-K272 PolarHBondContact O-N 3.22Å; K272-D274 VanDerWaalsContact C-N 3.31Å; K272-D274 PolarHBondContact O-N 3.35Å
273I56.2Low61.6Low134 Ų134104.9 Ų104.969%0.68759%0.588SS**  trans-63.8103.9163.9-57.7172.8000103.6P271 A275P271-I273 PolarHBondContact O-N 3.11Å; I273-A275 PolarHBondContact O-N 2.89Å
274D50.4Low59.9Low105 Ų105105.5 Ų105.556%0.56159%0.591SS**  trans-56.4130171.7-74.7-35.4000106.9K272 T276 T277K272-D274 VanDerWaalsContact C-N 3.31Å; K272-D274 PolarHBondContact O-N 3.35Å; D274-T276 WeakPolarHBondContact CB-OG1 3.44Å; D274-T276 PolarHBondContact O-N 3.36Å; D274-T277 PolarHBondContact O-N 3.22Å; D274-T277 PolarHBondContact O-OG1 3.34Å; D274-T277 VanDerWaalsContact O-OG1 3.1Å
275A49.6Very low58.3Low68 Ų68111.8 Ų111.856%0.56262%0.62SS**Hα-helixtrans-56-17.2-178.300000112.3I273 T277 S278 V279I273-A275 PolarHBondContact O-N 2.89Å; A275-T277 VanDerWaalsContact C-N 3.3Å; A275-T277 PolarHBondContact O-N 2.97Å; A275-S278 WeakPolarHBondContact CA-OG 3.41Å; A275-S278 PolarHBondContact O-N 2.91Å; A275-S278 VanDerWaalsContact O-N 3.14Å; A275-S278 PolarHBondContact O-OG 3.18Å; A275-V279 WeakPolarHBondContact O-CG2 3.36Å; A275-V279 PolarHBondContact O-N 2.96Å
276T49.5Very low56.8Low109 Ų109110.9 Ų110.967%0.66962%0.623SS**Hα-helixtrans-55.7-37.3168.57.50000113.5D274 A280D274-T276 WeakPolarHBondContact CB-OG1 3.44Å; D274-T276 PolarHBondContact O-N 3.36Å; T276-A280 PolarHBondContact O-N 3.45Å
277T45.1Very low55.3Low81 Ų81104.9 Ų104.950%0.49761%0.611SS.*Hα-helixtrans-76.9-28.6175.5-110000112.1D274 A275 V279 A280 M281D274-T277 PolarHBondContact O-N 3.22Å; D274-T277 PolarHBondContact O-OG1 3.34Å; D274-T277 VanDerWaalsContact O-OG1 3.1Å; A275-T277 VanDerWaalsContact C-N 3.3Å; A275-T277 PolarHBondContact O-N 2.97Å; T277-V279 VanDerWaalsContact C-N 3.34Å; T277-A280 PolarHBondContact O-N 3.24Å; T277-M281 PolarHBondContact O-N 2.84Å
278S44.8Very low53.7Low53 Ų53107.1 Ų107.137%0.37162%0.622SS.*Hα-helixtrans-71.7-28.3174.773.50000113.1A275 K282A275-S278 WeakPolarHBondContact CA-OG 3.41Å; A275-S278 PolarHBondContact O-N 2.91Å; A275-S278 VanDerWaalsContact O-N 3.14Å; A275-S278 PolarHBondContact O-OG 3.18Å; S278-K282 PolarHBondContact O-N 3.13Å; S278-K282 VanDerWaalsContact O-N 3.12Å
279V44Very low52Low99 Ų99107.1 Ų107.160%0.662%0.62SS**Hα-helixtrans-71.7-38.6171177.90000110.5A275 T277 M281 K282 S283A275-V279 WeakPolarHBondContact O-CG2 3.36Å; A275-V279 PolarHBondContact O-N 2.96Å; T277-V279 VanDerWaalsContact C-N 3.34Å; V279-M281 PolarHBondContact O-N 3.04Å; V279-K282 PolarHBondContact O-N 3.29Å; V279-S283 PolarHBondContact O-N 3.43Å; V279-S283 VanDerWaalsContact O-N 3.1Å
280A41.8Very low50.5Low51 Ų51109.8 Ų109.842%0.42164%0.639SS.*Hα-helixtrans-65.9-35.3174.600000113T276 T277 S283 T284T276-A280 PolarHBondContact O-N 3.45Å; T277-A280 PolarHBondContact O-N 3.24Å; A280-S283 PolarHBondContact O-OG 3.02Å; A280-T284 PolarHBondContact O-OG1 3.38Å
281M40Very low48.9Very low150 Ų150111.7 Ų111.774%0.73964%0.637SS**Hα-helixtrans-71.6-33.5173.5-92.7-178.4-169.900113.3T277 V279T277-M281 PolarHBondContact O-N 2.84Å; V279-M281 PolarHBondContact O-N 3.04Å
282K42.2Very low47.5Very low180 Ų180112 Ų11278%0.78363%0.632SS**Hα-helixtrans-78.6-17.5178-78.8-171.9176.5-174.50114.3S278 V279 T284S278-K282 PolarHBondContact O-N 3.13Å; S278-K282 VanDerWaalsContact O-N 3.12Å; V279-K282 PolarHBondContact O-N 3.29Å; K282-T284 VanDerWaalsContact C-N 3.34Å
283S47.7Very low46.5Very low91 Ų91111.8 Ų111.864%0.63664%0.642SS**THydrogen-bonded Turntrans-89.84.6175.474.40000114.1V279 A280V279-S283 PolarHBondContact O-N 3.43Å; V279-S283 VanDerWaalsContact O-N 3.1Å; A280-S283 PolarHBondContact O-OG 3.02Å
284T45.6Very low45.7Very low118 Ų118109.9 Ų109.972%0.72464%0.638SS**  trans-119.320.8-177.4-32.70000112.9A280 K282A280-T284 PolarHBondContact O-OG1 3.38Å; K282-T284 VanDerWaalsContact C-N 3.34Å
285I48Very low45.3Very low214 Ų214110.4 Ų110.4100%1.09765%0.645SS**  trans-117.20162.7-55.1177.3000106.6

Retrieved 285 of 285 residues in 190.4 ms (Link to these results)

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