A0A087XQV8_POEFO Loading...

Prolactin releasing hormone receptor

AlphaFold DB , UniProt , Accession A0A087XQV8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 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
1F38Very low44.5Very low12 Ų1227.4 Ų27.45%0.05315%0.145CC..  0-68.70-159.4-106.7000109.4F3 L5 M53 Y120 N317F1-F3 PolarHBondContact O-N 3.42Å; F1-L5 HydrophobicContact CD1-CD1 3.44Å; F1-L5 VanDerWaalsContact CD1-CD1 3.44Å; F1-L5 HydrophobicContact CD2-CD1 4.04Å; F1-L5 HydrophobicContact CE1-CD1 3.16Å; F1-L5 HydrophobicContact CE2-CD1 3.81Å; F1-L5 HydrophobicContact CG-CD1 3.88Å; F1-L5 HydrophobicContact CZ-CD1 3.37Å; F1-L5 WeakPolarHBondContact O-CB 3.39Å; F1-L5 PolarHBondContact O-N 3.04Å; F1-L5 VanDerWaalsContact O-N 3.16Å; F1-M53 HydrophobicContact CD2-CE 4.39Å; F1-M53 HydrophobicContact CD2-SD 3.77Å; F1-M53 HydrophobicContact CE2-CE 3.54Å; F1-M53 HydrophobicContact CE2-SD 3.51Å; F1-M53 VanDerWaalsContact CE2-SD 3.51Å; F1-M53 HydrophobicContact CZ-CE 4.37Å; F1-Y120 AromaticContact CD1-CD1 3.98Å; F1-Y120 HydrophobicContact CD1-CD1 3.98Å; F1-Y120 AromaticContact CD1-CE1 3.54Å; F1-Y120 HydrophobicContact CD1-CE1 3.54Å; F1-Y120 HydrophobicContact CD1-CE2 4.22Å; F1-Y120 HydrophobicContact CD1-CG 4.5Å; F1-Y120 AromaticContact CD1-CZ 3.67Å; F1-Y120 HydrophobicContact CE1-CD1 4.07Å; F1-Y120 AromaticContact CE1-CD2 3.88Å; F1-Y120 HydrophobicContact CE1-CD2 3.88Å; F1-Y120 AromaticContact CE1-CE1 3.71Å; F1-Y120 HydrophobicContact CE1-CE1 3.71Å; F1-Y120 AromaticContact CE1-CE2 3.5Å; F1-Y120 HydrophobicContact CE1-CE2 3.5Å; F1-Y120 HydrophobicContact CE1-CG 4.16Å; F1-Y120 AromaticContact CE1-CZ 3.41Å; F1-Y120 VanDerWaalsContact CE1-CZ 3.41Å; F1-Y120 WeakPolarHBondContact CE1-O 3.33Å; F1-Y120 HydrophobicContact CZ-CE2 4.49Å; F1-Y120 WeakPolarHBondContact CZ-O 3.38Å; F1-N317 VanDerWaalsContact CA-OD1 3.29Å; F1-N317 WeakPolarHBondContact CA-OD1 3.39Å; F1-N317 PolarHBondContact N-OD1 3.32Å
2A40.3Very low44.7Very low16 Ų1630 Ų3013%0.13216%0.157CC..Hα-helixtrans-44.9-49.5178.200000117.7R6 E214A2-R6 WeakPolarHBondContact O-CB 3.45Å; A2-R6 PolarHBondContact O-N 2.92Å; A2-E214 WeakPolarHBondContact CA-OE1 3.34Å; A2-E214 WeakPolarHBondContact CA-OE2 3.15Å; A2-E214 HydrophobicContact CB-CG 4.39Å; A2-E214 WeakPolarHBondContact CB-OE1 3.46Å; A2-E214 WeakPolarHBondContact CB-OE2 3.24Å
3F40.9Very low44.9Very low23 Ų2333.6 Ų33.610%0.10118%0.176CC..Hα-helixtrans-81.5-34.7-168-161.6-85.3000112.9F1 S7 L302 F308F1-F3 PolarHBondContact O-N 3.42Å; F3-S7 PolarHBondContact O-N 3.02Å; F3-L302 HydrophobicContact CB-CD1 4.28Å; F3-L302 HydrophobicContact CD1-CD2 4.16Å; F3-L302 HydrophobicContact CD2-CB 4.16Å; F3-L302 HydrophobicContact CE1-CD2 4.45Å; F3-L302 HydrophobicContact CE2-CB 4.15Å; F3-L302 WeakPolarHBondContact CE2-O 3.24Å; F3-L302 HydrophobicContact CG-CB 4.41Å; F3-L302 HydrophobicContact CG-CD1 4.44Å; F3-L302 HydrophobicContact CG-CD2 4.45Å; F3-L302 HydrophobicContact CZ-CB 4.45Å; F3-L302 WeakPolarHBondContact CZ-O 3.5Å; F3-F308 AromaticContact CD1-CE1 3.79Å; F3-F308 HydrophobicContact CD1-CE1 3.79Å; F3-F308 HydrophobicContact CD1-CE2 4.38Å; F3-F308 AromaticContact CD1-CZ 3.44Å; F3-F308 HydrophobicContact CD1-CZ 3.44Å; F3-F308 VanDerWaalsContact CD1-CZ 3.44Å; F3-F308 HydrophobicContact CE1-CE1 4.07Å; F3-F308 HydrophobicContact CE1-CE2 4.2Å; F3-F308 AromaticContact CE1-CZ 3.64Å; F3-F308 HydrophobicContact CE1-CZ 3.64Å
4L39.3Very low45.4Very low9 Ų937.8 Ų37.85%0.04720%0.197CC..Hα-helixtrans-71.1-44.8173.2-77.7174.3000111.5R6 S7 T8 F308 K313 I316L4-R6 VanDerWaalsContact C-N 3.28Å; L4-R6 PolarHBondContact O-N 3.08Å; L4-S7 WeakPolarHBondContact O-CB 3.25Å; L4-S7 PolarHBondContact O-N 3.42Å; L4-S7 VanDerWaalsContact O-N 3.13Å; L4-T8 PolarHBondContact O-N 3.34Å; L4-T8 PolarHBondContact O-OG1 3.44Å; L4-F308 HydrophobicContact CD2-CE1 3.92Å; L4-F308 HydrophobicContact CD2-CE2 4.18Å; L4-F308 HydrophobicContact CD2-CZ 3.56Å; L4-F308 HydrophobicContact CG-CE1 4.43Å; L4-F308 HydrophobicContact CG-CZ 4.28Å; L4-K313 HydrophobicContact CD2-CB 4.1Å; L4-K313 HydrophobicContact CD2-CD 4.4Å; L4-K313 HydrophobicContact CD2-CG 4.07Å; L4-I316 HydrophobicContact CD1-CG2 3.23Å; L4-I316 HydrophobicContact CD2-CG2 4.4Å; L4-I316 HydrophobicContact CG-CG2 3.72Å
5L47.1Very low44.9Very low19 Ų1943.4 Ų43.410%0.09922%0.22CC..Hα-helixtrans-59.3-41.1173.5-83.2162.7000111.5F1 T8 C9 L210 V212F1-L5 HydrophobicContact CD1-CD1 3.44Å; F1-L5 VanDerWaalsContact CD1-CD1 3.44Å; F1-L5 HydrophobicContact CD2-CD1 4.04Å; F1-L5 HydrophobicContact CE1-CD1 3.16Å; F1-L5 HydrophobicContact CE2-CD1 3.81Å; F1-L5 HydrophobicContact CG-CD1 3.88Å; F1-L5 HydrophobicContact CZ-CD1 3.37Å; F1-L5 WeakPolarHBondContact O-CB 3.39Å; F1-L5 PolarHBondContact O-N 3.04Å; F1-L5 VanDerWaalsContact O-N 3.16Å; L5-T8 WeakPolarHBondContact CA-OG1 3.38Å; L5-T8 PolarHBondContact O-N 3.4Å; L5-T8 PolarHBondContact O-OG1 3.01Å; L5-C9 VanDerWaalsContact O-CB 3.24Å; L5-C9 WeakPolarHBondContact O-CB 3.16Å; L5-C9 PolarHBondContact O-N 3.09Å; L5-L210 HydrophobicContact CD2-CD2 3.75Å; L5-V212 HydrophobicContact CD2-CG2 4.35Å
6R50.8Low44.6Very low23 Ų2346.8 Ų46.89%0.08724%0.236CC..Hα-helixtrans-61.6-43172.5-173.3-169.7-57.3-154.81112.6A2 L4 C9 K10 E215 F216A2-R6 WeakPolarHBondContact O-CB 3.45Å; A2-R6 PolarHBondContact O-N 2.92Å; L4-R6 VanDerWaalsContact C-N 3.28Å; L4-R6 PolarHBondContact O-N 3.08Å; R6-C9 PolarHBondContact O-N 2.99Å; R6-K10 WeakPolarHBondContact O-CB 3.3Å; R6-K10 PolarHBondContact O-N 3.25Å; R6-E215 PolarHBondContact NE-O 3.37Å; R6-E215 PolarHBondContact NH1-O 3.45Å; R6-E215 PolarHBondContact NH2-O 2.82Å; R6-E215 IonicContact NH2-OE2 3.07Å; R6-F216 HydrophobicContact CG-CD1 4.3Å; R6-F216 HydrophobicContact CG-CE1 4.06Å
7S42.7Very low44.6Very low33 Ų3351.6 Ų51.623%0.23126%0.263CS..Hα-helixtrans-58.6-49.8175.4-167.80000110.6F3 L4 C9 K10 D11F3-S7 PolarHBondContact O-N 3.02Å; L4-S7 WeakPolarHBondContact O-CB 3.25Å; L4-S7 PolarHBondContact O-N 3.42Å; L4-S7 VanDerWaalsContact O-N 3.13Å; S7-C9 PolarHBondContact O-N 3.17Å; S7-K10 PolarHBondContact O-N 3.15Å; S7-D11 WeakPolarHBondContact O-CB 3.46Å; S7-D11 PolarHBondContact O-N 3.48Å; S7-D11 VanDerWaalsContact O-OD2 3.1Å
8T45.3Very low44.5Very low36 Ų3656.4 Ų56.422%0.22128%0.282CS..Hα-helixtrans-66.8-35.7176.224.80000114.1L4 L5 K10 D11 M12 M49L4-T8 PolarHBondContact O-N 3.34Å; L4-T8 PolarHBondContact O-OG1 3.44Å; L5-T8 WeakPolarHBondContact CA-OG1 3.38Å; L5-T8 PolarHBondContact O-N 3.4Å; L5-T8 PolarHBondContact O-OG1 3.01Å; T8-K10 VanDerWaalsContact C-N 3.31Å; T8-D11 PolarHBondContact O-N 2.72Å; T8-M12 VanDerWaalsContact O-CB 3.29Å; T8-M12 WeakPolarHBondContact O-CB 3.35Å; T8-M12 VanDerWaalsContact O-CG 3.29Å; T8-M12 WeakPolarHBondContact O-CG 3.03Å; T8-M12 PolarHBondContact O-N 2.88Å; T8-M49 HydrophobicContact CG2-CE 3.58Å; T8-M49 HydrophobicContact CG2-SD 3.34Å; T8-M49 WeakPolarHBondContact CG2-SD 3.33Å; T8-M49 PolarHBondContact OG1-SD 3.18Å; T8-M49 VanDerWaalsContact OG1-SD 3.39Å
9C47.7Very low44.3Very low2 Ų257.7 Ų57.71%0.01429%0.289CS..Hα-helixtrans-69.8-35.7177.9-154.50000110.6L5 R6 S7 M12 D13 L201 F216L5-C9 VanDerWaalsContact O-CB 3.24Å; L5-C9 WeakPolarHBondContact O-CB 3.16Å; L5-C9 PolarHBondContact O-N 3.09Å; R6-C9 PolarHBondContact O-N 2.99Å; S7-C9 PolarHBondContact O-N 3.17Å; C9-M12 PolarHBondContact O-N 2.86Å; C9-D13 VanDerWaalsContact O-CB 3.28Å; C9-D13 WeakPolarHBondContact O-CB 3.33Å; C9-D13 PolarHBondContact O-N 3.46Å; C9-L201 WeakPolarHBondContact SG-CD1 3.31Å; C9-F216 HydrophobicContact CB-CE1 4.17Å; C9-F216 HydrophobicContact CB-CZ 4.06Å
10K49.7Very low44.1Very low78 Ų7862.6 Ų62.634%0.33931%0.309SS..Hα-helixtrans-67.1-42.2171.5-172177.1174.4177.80111.4R6 S7 T8 D13 I14 D219R6-K10 WeakPolarHBondContact O-CB 3.3Å; R6-K10 PolarHBondContact O-N 3.25Å; S7-K10 PolarHBondContact O-N 3.15Å; T8-K10 VanDerWaalsContact C-N 3.31Å; K10-D13 PolarHBondContact O-N 2.76Å; K10-I14 HydrophobicContact CG-CD1 4.19Å; K10-I14 WeakPolarHBondContact O-CB 3.33Å; K10-I14 WeakPolarHBondContact O-CD1 3.45Å; K10-I14 WeakPolarHBondContact O-CG1 3.32Å; K10-I14 PolarHBondContact O-N 3.29Å; K10-D219 WeakPolarHBondContact CE-OD2 3.24Å; K10-D219 IonicContact NZ-OD1 3.91Å; K10-D219 PolarHBondContact NZ-OD1 3.32Å; K10-D219 IonicContact NZ-OD2 2.82Å; K10-D219 PolarHBondContact NZ-OD2 2.81Å
11D47.5Very low43.6Very low50 Ų5062.2 Ų62.227%0.26732%0.321SS..Hα-helixtrans-64.8-39.7174.4-68.9-35.6000111.5S7 T8 I14 F15S7-D11 WeakPolarHBondContact O-CB 3.46Å; S7-D11 PolarHBondContact O-N 3.48Å; S7-D11 VanDerWaalsContact O-OD2 3.1Å; T8-D11 PolarHBondContact O-N 2.72Å; D11-I14 PolarHBondContact O-N 2.95Å; D11-F15 VanDerWaalsContact O-CB 3.28Å; D11-F15 WeakPolarHBondContact O-CB 3.49Å; D11-F15 PolarHBondContact O-N 3.44Å
12M47.1Very low43.7Very low59 Ų5967.9 Ų67.929%0.29135%0.352SS..Hα-helixtrans-70.4-39174.6-77.5-169.7-58.700112.8T8 C9 I14 F15 M16 L203 I208T8-M12 VanDerWaalsContact O-CB 3.29Å; T8-M12 WeakPolarHBondContact O-CB 3.35Å; T8-M12 VanDerWaalsContact O-CG 3.29Å; T8-M12 WeakPolarHBondContact O-CG 3.03Å; T8-M12 PolarHBondContact O-N 2.88Å; C9-M12 PolarHBondContact O-N 2.86Å; M12-I14 VanDerWaalsContact C-N 3.35Å; M12-F15 PolarHBondContact O-N 2.99Å; M12-M16 VanDerWaalsContact O-CB 3.31Å; M12-M16 WeakPolarHBondContact O-CB 3.48Å; M12-M16 VanDerWaalsContact O-CG 3.24Å; M12-M16 WeakPolarHBondContact O-CG 3.32Å; M12-M16 PolarHBondContact O-N 3.34Å; M12-L203 HydrophobicContact CE-CD1 3.64Å; M12-I208 HydrophobicContact SD-CD1 3.62Å
13D47.4Very low43.5Very low77 Ų7772.8 Ų72.841%0.41238%0.38SS..Hα-helixtrans-64.2-42.2173.2-85.1-23.2000110.2C9 K10 F15 N17C9-D13 VanDerWaalsContact O-CB 3.28Å; C9-D13 WeakPolarHBondContact O-CB 3.33Å; C9-D13 PolarHBondContact O-N 3.46Å; K10-D13 PolarHBondContact O-N 2.76Å; D13-F15 VanDerWaalsContact C-N 3.34Å; D13-N17 WeakPolarHBondContact O-CB 3.38Å; D13-N17 PolarHBondContact O-N 3.24Å
14I52Low43.3Very low92 Ų9274.2 Ų74.247%0.47240%0.401SS..Hα-helixtrans-61.1-44.8172.3-70.2164.4000110.1K10 D11 M12 N17 K18K10-I14 HydrophobicContact CG-CD1 4.19Å; K10-I14 WeakPolarHBondContact O-CB 3.33Å; K10-I14 WeakPolarHBondContact O-CD1 3.45Å; K10-I14 WeakPolarHBondContact O-CG1 3.32Å; K10-I14 PolarHBondContact O-N 3.29Å; D11-I14 PolarHBondContact O-N 2.95Å; M12-I14 VanDerWaalsContact C-N 3.35Å; I14-N17 PolarHBondContact O-N 3.09Å; I14-K18 WeakPolarHBondContact O-CB 3.49Å; I14-K18 PolarHBondContact O-N 3.28Å
15F38.1Very low43.1Very low122 Ų12281 Ų8154%0.53544%0.437SS..Hα-helixtrans-63.9-48.5179.7-166.1-91.2000112.1D11 M12 D13 N17 K18 D19D11-F15 VanDerWaalsContact O-CB 3.28Å; D11-F15 WeakPolarHBondContact O-CB 3.49Å; D11-F15 PolarHBondContact O-N 3.44Å; M12-F15 PolarHBondContact O-N 2.99Å; D13-F15 VanDerWaalsContact C-N 3.34Å; F15-N17 VanDerWaalsContact C-N 3.34Å; F15-N17 PolarHBondContact O-N 3.17Å; F15-K18 CarbonylContact O-C 3.52Å; F15-K18 WeakPolarHBondContact O-CB 3.28Å; F15-K18 PolarHBondContact O-N 3.19Å; F15-K18 VanDerWaalsContact O-N 3.12Å; F15-D19 WeakPolarHBondContact CD1-OD2 3.3Å; F15-D19 WeakPolarHBondContact CE1-OD2 3.36Å; F15-D19 PolarHBondContact O-N 3.45Å
16M40Very low42.5Very low97 Ų9785 Ų8548%0.47847%0.474SS..Hα-helixtrans-61.6-40.2175.8-74.8-107.1-66.200112.2M12 K18 F20M12-M16 VanDerWaalsContact O-CB 3.31Å; M12-M16 WeakPolarHBondContact O-CB 3.48Å; M12-M16 VanDerWaalsContact O-CG 3.24Å; M12-M16 WeakPolarHBondContact O-CG 3.32Å; M12-M16 PolarHBondContact O-N 3.34Å; M16-K18 VanDerWaalsContact C-N 3.3Å; M16-F20 WeakPolarHBondContact O-CB 3.46Å; M16-F20 PolarHBondContact O-N 3.5Å
17N44.7Very low41.6Very low129 Ų12990.5 Ų90.569%0.6951%0.51SS*.Hα-helixtrans-71.7-27.8177.5-153.38.4000111.5D13 I14 F15 G21D13-N17 WeakPolarHBondContact O-CB 3.38Å; D13-N17 PolarHBondContact O-N 3.24Å; I14-N17 PolarHBondContact O-N 3.09Å; F15-N17 VanDerWaalsContact C-N 3.34Å; F15-N17 PolarHBondContact O-N 3.17Å; N17-G21 PolarHBondContact O-N 3.2Å
18K42.7Very low41.1Very low139 Ų13997.6 Ų97.660%0.60454%0.539SS*.Hα-helixtrans-77.8-37.6174.6-157.1174.2-171.5177.20112.4I14 F15 M16 G21 L22I14-K18 WeakPolarHBondContact O-CB 3.49Å; I14-K18 PolarHBondContact O-N 3.28Å; F15-K18 CarbonylContact O-C 3.52Å; F15-K18 WeakPolarHBondContact O-CB 3.28Å; F15-K18 PolarHBondContact O-N 3.19Å; F15-K18 VanDerWaalsContact O-N 3.12Å; M16-K18 VanDerWaalsContact C-N 3.3Å; K18-G21 PolarHBondContact O-N 2.85Å; K18-L22 WeakPolarHBondContact O-CB 3.4Å; K18-L22 WeakPolarHBondContact O-CG 3.42Å; K18-L22 PolarHBondContact O-N 3.09Å
19D39.9Very low40.4Very low80 Ų80103.5 Ų103.543%0.42857%0.569SS.*Hα-helixtrans-68.3-40.3173.5-81.4-17.6000111.8F15 G21 L22 T23F15-D19 WeakPolarHBondContact CD1-OD2 3.3Å; F15-D19 WeakPolarHBondContact CE1-OD2 3.36Å; F15-D19 PolarHBondContact O-N 3.45Å; D19-G21 VanDerWaalsContact C-N 3.33Å; D19-G21 PolarHBondContact O-N 2.97Å; D19-L22 PolarHBondContact O-N 3.49Å; D19-T23 PolarHBondContact O-N 3.04Å; D19-T23 PolarHBondContact O-OG1 3.1Å
20F39.8Very low39.7Very low156 Ų156109.9 Ų109.968%0.68461%0.608SS**Hα-helixtrans-68-31.6170.9-97.9-87.3000112.8M16 T23M16-F20 WeakPolarHBondContact O-CB 3.46Å; M16-F20 PolarHBondContact O-N 3.5Å; F20-T23 PolarHBondContact O-OG1 3.29Å
21G34.5Very low38.6Very low55 Ų55110 Ų11057%0.56763%0.632SS**Hα-helixtrans-70.2-27172.800000114.1N17 K18 D19N17-G21 PolarHBondContact O-N 3.2Å; K18-G21 PolarHBondContact O-N 2.85Å; D19-G21 VanDerWaalsContact C-N 3.33Å; D19-G21 PolarHBondContact O-N 2.97Å
22L41.2Very low37.5Very low131 Ų131111.4 Ų111.469%0.68666%0.658SS**Hα-helixtrans-85.6-15.5178.1-79.6162.7000113.7K18 D19 G24K18-L22 WeakPolarHBondContact O-CB 3.4Å; K18-L22 WeakPolarHBondContact O-CG 3.42Å; K18-L22 PolarHBondContact O-N 3.09Å; D19-L22 PolarHBondContact O-N 3.49Å; L22-G24 PolarHBondContact O-N 2.95Å
23T35.1Very low37.6Very low118 Ų118114.3 Ų114.372%0.72468%0.682SS**THydrogen-bonded Turntrans-80.71.9168.544.50000114.3D19 F20D19-T23 PolarHBondContact O-N 3.04Å; D19-T23 PolarHBondContact O-OG1 3.1Å; F20-T23 PolarHBondContact O-OG1 3.29Å
24G37.7Very low36.9Very low53 Ų53120.2 Ų120.255%0.54671%0.707SS.*THydrogen-bonded Turntrans-100.7-1.6-17300000117.5L22L22-G24 PolarHBondContact O-N 2.95Å
25N34.8Very low35.7Very low152 Ų152119.6 Ų119.681%0.81372%0.723SS**  trans-155.492.1177.4-92.2-25.2000111.7
26A32.8Very low35.4Very low104 Ų104121.2 Ų121.286%0.8674%0.737SS**  trans-107.396164.200000109.4
27T31.8Very low34.9Very low138 Ų138126.2 Ų126.285%0.84776%0.756SS**  trans-138.4134.8154.536.20000109.9
28Q34.2Very low34.4Very low181 Ų181123.5 Ų123.585%0.84676%0.759SS**  trans-42.1144.9-175.7-70.5160-35.100116.4
29D29.2Very low33.7Very low160 Ų160125.8 Ų125.886%0.85677%0.772SS**  -167.4154.1114.1-101.6-22.6000113.9
30T32.8Very low33.4Very low136 Ų136125.6 Ų125.683%0.83479%0.789SS**  trans-87.7152.3-164.3460000116.4
31G27.9Very low33.1Very low80 Ų80125.9 Ų125.983%0.82580%0.797SS**  trans123.5118.5149.200000117.5
32G24.8Very low33.3Very low80 Ų80131 Ų13183%0.82581%0.811SS**  trans-89.2-160.717300000114.3
33P47.8Very low33.4Very low121 Ų121131.3 Ų131.379%0.78681%0.809SS**  cis-131.5169.5-8.639.3-21.1000116
34E34.1Very low34.1Very low200 Ų200127.9 Ų127.994%0.93579%0.789SS**  trans49128.7155.6-67.6-171.6156.600123
35G25.7Very low34.7Very low80 Ų80131 Ų13183%0.82579%0.793SS**  trans168.275.7165.500000116.8
36N32.4Very low35.7Very low155 Ų155128.3 Ų128.383%0.82979%0.785SS**  trans-19.1129162.7-16114.6000117.9
37K28.7Very low36.8Very low202 Ų202129.5 Ų129.588%0.87878%0.776SS**  -176.5135.5128.8-103.9168.6-173.6178.20112.4
38G33.6Very low38.1Very low72 Ų72127.2 Ų127.274%0.74276%0.758SS**  trans-69.3155.1-169.800000115.4
39Q29.5Very low39.1Very low187 Ų187121.2 Ų121.287%0.87473%0.731SS**  trans-144.9109.3139.7-108.9172.1-100105.9L41Q39-L41 PolarHBondContact O-N 3.39Å
40G33.5Very low40.7Very low76 Ų76120.5 Ų120.578%0.78472%0.721SS**  trans-60.5104.9173.700000108.8N42G40-N42 PolarHBondContact O-N 3.34Å
41L33.2Very low42.3Very low163 Ų163115.8 Ų115.885%0.85369%0.691SS**  trans-66.9108.7158.6-85.2145.4000105.8Q39 H43Q39-L41 PolarHBondContact O-N 3.39Å; L41-H43 PolarHBondContact O-N 3.38Å
42N38.4Very low44.3Very low161 Ų161112 Ų11286%0.86165%0.652SS**  trans-62.877.1165.7-79.5-15.2000108G40G40-N42 PolarHBondContact O-N 3.34Å
43H43.7Very low46.3Very low139 Ų139110.2 Ų110.264%0.64462%0.623SS**  trans-80.2126.7169.3-146.617.8000106.5L41 D45L41-H43 PolarHBondContact O-N 3.38Å; H43-D45 PolarHBondContact O-N 3.47Å
44S49.8Very low47.6Very low45 Ų45109.8 Ų109.832%0.31561%0.61SS.*  trans-49.6106.9173.7-60.20000110.1P46 K313S44-P46 VanDerWaalsContact O-CD 3.32Å; S44-P46 WeakPolarHBondContact O-CD 3.47Å; S44-K313 PolarHBondContact OG-NZ 2.94Å
45D50.1Low49.8Very low118 Ų118101.5 Ų101.563%0.63157%0.573SS**  trans-59.1122.1177.1-91.8-36.1000109.4H43 L47 D48H43-D45 PolarHBondContact O-N 3.47Å; D45-L47 PolarHBondContact O-N 2.86Å; D45-D48 PolarHBondContact O-N 3.11Å; D45-D48 VanDerWaalsContact O-N 3.13Å
46P54.8Low52.4Low97 Ų9797.8 Ų97.863%0.6353%0.534SS*.Hα-helixtrans-54.9-23.6179.4-25.832.9000113.4S44 M49 F50S44-P46 VanDerWaalsContact O-CD 3.32Å; S44-P46 WeakPolarHBondContact O-CD 3.47Å; P46-M49 PolarHBondContact O-N 3.41Å; P46-F50 PolarHBondContact O-N 3.17Å
47L57.7Low54.7Low129 Ų12994.4 Ų94.468%0.67551%0.513SS*.Hα-helixtrans-62.2-42.3179.4-157.879.1000112.6D45 M49 F50 V51D45-L47 PolarHBondContact O-N 2.86Å; L47-M49 VanDerWaalsContact C-N 3.32Å; L47-M49 PolarHBondContact O-N 3.39Å; L47-F50 PolarHBondContact O-N 2.99Å; L47-V51 VanDerWaalsContact O-CG2 3.3Å; L47-V51 WeakPolarHBondContact O-CG2 3.48Å; L47-V51 PolarHBondContact O-N 3.22Å; L47-V51 VanDerWaalsContact O-N 3.14Å
48D57.5Low57.5Low90 Ų9094.4 Ų94.448%0.48151%0.507SS..Hα-helixtrans-70.7-29.6-176.8-84.9-16.6000112.7D45 G52D45-D48 PolarHBondContact O-N 3.11Å; D45-D48 VanDerWaalsContact O-N 3.13Å; D48-G52 PolarHBondContact O-N 3Å
49M56.3Low60Low55 Ų5594.8 Ų94.827%0.27149%0.489SS..Hα-helixtrans-71.1-42.5174.3-174.9-172.763.200111.5T8 P46 L47 V51 G52 M53T8-M49 HydrophobicContact CG2-CE 3.58Å; T8-M49 HydrophobicContact CG2-SD 3.34Å; T8-M49 WeakPolarHBondContact CG2-SD 3.33Å; T8-M49 PolarHBondContact OG1-SD 3.18Å; T8-M49 VanDerWaalsContact OG1-SD 3.39Å; P46-M49 PolarHBondContact O-N 3.41Å; L47-M49 VanDerWaalsContact C-N 3.32Å; L47-M49 PolarHBondContact O-N 3.39Å; M49-V51 VanDerWaalsContact C-N 3.28Å; M49-V51 PolarHBondContact O-N 2.78Å; M49-G52 PolarHBondContact O-N 2.83Å; M49-M53 PolarHBondContact O-N 3.05Å; M49-M53 VanDerWaalsContact O-N 3.15Å
50F61.3Low62.8Low145 Ų14590 Ų9064%0.63647%0.465SS*.Hα-helixtrans-59.3-42.2176.7-167.6-97.4000111P46 L47 G52 M53 E54P46-F50 PolarHBondContact O-N 3.17Å; L47-F50 PolarHBondContact O-N 2.99Å; F50-G52 PolarHBondContact O-N 3.45Å; F50-M53 PolarHBondContact O-N 3.1Å; F50-E54 WeakPolarHBondContact O-CB 3.2Å; F50-E54 PolarHBondContact O-N 3.13Å
51V67.2Low65.6Low36 Ų3691.2 Ų91.222%0.21846%0.459CS..Hα-helixtrans-64.1-37.5177.4175.80000112.4L47 M49 L55 R314L47-V51 VanDerWaalsContact O-CG2 3.3Å; L47-V51 WeakPolarHBondContact O-CG2 3.48Å; L47-V51 PolarHBondContact O-N 3.22Å; L47-V51 VanDerWaalsContact O-N 3.14Å; M49-V51 VanDerWaalsContact C-N 3.28Å; M49-V51 PolarHBondContact O-N 2.78Å; V51-L55 WeakPolarHBondContact O-CB 3.24Å; V51-L55 PolarHBondContact O-N 2.92Å; V51-R314 HydrophobicContact CG1-CG 4.01Å
52G69.4Low68.4Low0 Ų087.8 Ų87.80%044%0.441CS..Hα-helixtrans-68.9-34.7177.100000113.7D48 M49 F50 L56 R314D48-G52 PolarHBondContact O-N 3Å; M49-G52 PolarHBondContact O-N 2.83Å; F50-G52 PolarHBondContact O-N 3.45Å; G52-L56 PolarHBondContact O-N 2.94Å; G52-R314 WeakPolarHBondContact CA-O 3.04Å
53M67.6Low70.9Confident43 Ų4380.7 Ų80.721%0.21240%0.403CS..Hα-helixtrans-70.7-45.2174.1-83.3-67-7300112F1 M49 F50 L55 L56 Q57F1-M53 HydrophobicContact CD2-CE 4.39Å; F1-M53 HydrophobicContact CD2-SD 3.77Å; F1-M53 HydrophobicContact CE2-CE 3.54Å; F1-M53 HydrophobicContact CE2-SD 3.51Å; F1-M53 VanDerWaalsContact CE2-SD 3.51Å; F1-M53 HydrophobicContact CZ-CE 4.37Å; M49-M53 PolarHBondContact O-N 3.05Å; M49-M53 VanDerWaalsContact O-N 3.15Å; F50-M53 PolarHBondContact O-N 3.1Å; M53-L55 VanDerWaalsContact C-N 3.31Å; M53-L55 PolarHBondContact O-N 2.77Å; M53-L56 PolarHBondContact O-N 2.88Å; M53-Q57 WeakPolarHBondContact O-CG 3.42Å; M53-Q57 PolarHBondContact O-N 3.4Å
54E75.4Confident73.2Confident112 Ų11277.5 Ų77.552%0.52339%0.39SS..Hα-helixtrans-61.1-40.6176.1-166.6-173.217000111.5F50 L56 Q57 R58F50-E54 WeakPolarHBondContact O-CB 3.2Å; F50-E54 PolarHBondContact O-N 3.13Å; E54-L56 PolarHBondContact O-N 2.95Å; E54-Q57 PolarHBondContact O-N 2.75Å; E54-R58 PolarHBondContact O-N 3.32Å
55L79.9Confident75.4Confident27 Ų2778.9 Ų78.914%0.14140%0.398CS..Hα-helixtrans-61.6-44175.3-171.868.7000111.9V51 M53 R58 F59 R314 Y315 V318V51-L55 WeakPolarHBondContact O-CB 3.24Å; V51-L55 PolarHBondContact O-N 2.92Å; M53-L55 VanDerWaalsContact C-N 3.31Å; M53-L55 PolarHBondContact O-N 2.77Å; L55-R58 WeakPolarHBondContact O-CB 3.27Å; L55-R58 PolarHBondContact O-N 3.27Å; L55-F59 HydrophobicContact CD1-CD2 4.43Å; L55-F59 HydrophobicContact CD1-CE2 3.8Å; L55-F59 HydrophobicContact CG-CD2 4.27Å; L55-F59 HydrophobicContact CG-CE2 3.95Å; L55-F59 WeakPolarHBondContact O-CD2 3.43Å; L55-F59 PolarHBondContact O-N 3.32Å; L55-R314 HydrophobicContact CD2-CG 4.15Å; L55-Y315 HydrophobicContact CD2-CD1 3.85Å; L55-Y315 HydrophobicContact CD2-CE1 3.96Å; L55-V318 HydrophobicContact CD2-CG2 4.04Å; L55-V318 HydrophobicContact CG-CG2 4.12Å
56L79.7Confident77.6Confident2 Ų276.4 Ų76.41%0.0138%0.384CS..Hα-helixtrans-62.4-44.4176.6178.866.1000111.3G52 M53 E54 R58 F59 K60 F122 N317 V318 V321G52-L56 PolarHBondContact O-N 2.94Å; M53-L56 PolarHBondContact O-N 2.88Å; E54-L56 PolarHBondContact O-N 2.95Å; L56-R58 VanDerWaalsContact C-N 3.28Å; L56-R58 PolarHBondContact O-N 3.03Å; L56-F59 CarbonylContact O-C 3.6Å; L56-F59 PolarHBondContact O-N 3.37Å; L56-F59 VanDerWaalsContact O-N 3.09Å; L56-K60 PolarHBondContact O-N 3.47Å; L56-K60 VanDerWaalsContact O-N 3.16Å; L56-F122 HydrophobicContact CD1-CE1 3.99Å; L56-F122 HydrophobicContact CD1-CZ 4.37Å; L56-F122 HydrophobicContact CG-CD1 4.48Å; L56-F122 HydrophobicContact CG-CE1 3.99Å; L56-N317 HydrophobicContact CB-CB 4.31Å; L56-N317 HydrophobicContact CD2-CB 4.24Å; L56-V318 HydrophobicContact CD1-CG2 4.45Å; L56-V321 HydrophobicContact CD1-CB 4.09Å; L56-V321 HydrophobicContact CD1-CG1 4.41Å; L56-V321 HydrophobicContact CD1-CG2 3.76Å; L56-V321 HydrophobicContact CD2-CG2 4.28Å
57Q81.6Confident79.4Confident83 Ų8372.1 Ų72.139%0.38836%0.356SS..Hα-helixtrans-61.9-35.8176.7-72.5-173-12.500112.1M53 E54 F59 K60M53-Q57 WeakPolarHBondContact O-CG 3.42Å; M53-Q57 PolarHBondContact O-N 3.4Å; E54-Q57 PolarHBondContact O-N 2.75Å; Q57-F59 VanDerWaalsContact C-N 3.25Å; Q57-F59 PolarHBondContact O-N 3.38Å; Q57-K60 WeakPolarHBondContact O-CB 3.47Å; Q57-K60 PolarHBondContact O-N 3.31Å; Q57-K60 VanDerWaalsContact O-N 3.08Å
58R86.4Confident81.2Confident203 Ų20369.3 Ų69.377%0.76635%0.346SS*.Hα-helixtrans-61.5-32174-169.9173.8-177.81711.1113.1E54 L55 L56 P61E54-R58 PolarHBondContact O-N 3.32Å; L55-R58 WeakPolarHBondContact O-CB 3.27Å; L55-R58 PolarHBondContact O-N 3.27Å; L56-R58 VanDerWaalsContact C-N 3.28Å; L56-R58 PolarHBondContact O-N 3.03Å; R58-P61 WeakPolarHBondContact O-CD 3.16Å
59F87.7Confident83Confident80 Ų8069.9 Ų69.935%0.35135%0.349SS..THydrogen-bonded Turntrans-90-0.6175.5-69.7-69.6000114.2L55 L56 Q57 P61 L62 F63 V318L55-F59 HydrophobicContact CD1-CD2 4.43Å; L55-F59 HydrophobicContact CD1-CE2 3.8Å; L55-F59 HydrophobicContact CG-CD2 4.27Å; L55-F59 HydrophobicContact CG-CE2 3.95Å; L55-F59 WeakPolarHBondContact O-CD2 3.43Å; L55-F59 PolarHBondContact O-N 3.32Å; L56-F59 CarbonylContact O-C 3.6Å; L56-F59 PolarHBondContact O-N 3.37Å; L56-F59 VanDerWaalsContact O-N 3.09Å; Q57-F59 VanDerWaalsContact C-N 3.25Å; Q57-F59 PolarHBondContact O-N 3.38Å; F59-P61 VanDerWaalsContact C-CD 3.44Å; F59-L62 HydrophobicContact CD1-CD2 4.21Å; F59-L62 WeakPolarHBondContact O-CA 3.35Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 3.36Å; F59-F63 HydrophobicContact CB-CD2 3.64Å; F59-F63 HydrophobicContact CB-CE2 3.48Å; F59-F63 VanDerWaalsContact CB-CE2 3.48Å; F59-F63 HydrophobicContact CG-CE2 4.24Å; F59-F63 WeakPolarHBondContact O-CD2 3.44Å; F59-F63 PolarHBondContact O-N 2.97Å; F59-V318 HydrophobicContact CD2-CG1 4.49Å; F59-V318 HydrophobicContact CD2-CG2 4.18Å
60K87.7Confident84.8Confident85 Ų8568 Ų6837%0.3734%0.34SS..Hα-helixtrans-46.8-47.4173.1-174.3172.1-179.2165.20114.2L56 Q57 L62 F63 L64 F122L56-K60 PolarHBondContact O-N 3.47Å; L56-K60 VanDerWaalsContact O-N 3.16Å; Q57-K60 WeakPolarHBondContact O-CB 3.47Å; Q57-K60 PolarHBondContact O-N 3.31Å; Q57-K60 VanDerWaalsContact O-N 3.08Å; K60-L62 PolarHBondContact O-N 3.05Å; K60-L62 VanDerWaalsContact O-N 3.16Å; K60-F63 PolarHBondContact O-N 3.02Å; K60-L64 VanDerWaalsContact O-CB 3.27Å; K60-L64 WeakPolarHBondContact O-CB 2.94Å; K60-L64 PolarHBondContact O-N 3.04Å; K60-F122 HydrophobicContact CB-CD1 3.83Å; K60-F122 HydrophobicContact CB-CE1 3.95Å; K60-F122 HydrophobicContact CD-CB 4.11Å; K60-F122 HydrophobicContact CD-CD1 4.08Å; K60-F122 HydrophobicContact CD-CG 4.31Å; K60-F122 HydrophobicContact CG-CB 4.41Å; K60-F122 HydrophobicContact CG-CD1 3.74Å; K60-F122 HydrophobicContact CG-CE1 4.21Å; K60-F122 HydrophobicContact CG-CG 4.09Å; K60-F122 PolarHBondContact NZ-O 2.75Å
61P91.6Very high86.5Confident102 Ų10262.5 Ų62.566%0.66232%0.318SS*.Hα-helixtrans-66.7-14.6179.427.4-36.4000114.1R58 F59 P65R58-P61 WeakPolarHBondContact O-CD 3.16Å; F59-P61 VanDerWaalsContact C-CD 3.44Å; P61-P65 WeakPolarHBondContact O-CD 3.43Å; P61-P65 VanDerWaalsContact O-CG 3.22Å; P61-P65 WeakPolarHBondContact O-CG 3.29Å
62L92.4Very high87.8Confident92 Ų9265 Ų6548%0.48233%0.334SS..Hα-helixtrans-89.7-48.5173.6177.267.4000111.6F59 K60 P65 L66F59-L62 HydrophobicContact CD1-CD2 4.21Å; F59-L62 WeakPolarHBondContact O-CA 3.35Å; F59-L62 WeakPolarHBondContact O-CB 3.34Å; F59-L62 PolarHBondContact O-N 3.36Å; K60-L62 PolarHBondContact O-N 3.05Å; K60-L62 VanDerWaalsContact O-N 3.16Å; L62-P65 WeakPolarHBondContact O-CD 3.47Å; L62-P65 WeakPolarHBondContact O-CG 3.32Å; L62-L66 HydrophobicContact CD1-CD1 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.33Å; L62-L66 WeakPolarHBondContact O-CD1 3.19Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å
63F91.6Very high89.1Confident11 Ų1167.2 Ų67.25%0.04835%0.347CS..Hα-helixtrans-73.9-39-174.8-74.2-63.6000113.3F59 K60 L66 Y67 F122 V318 V321 C322 L325F59-F63 HydrophobicContact CB-CD2 3.64Å; F59-F63 HydrophobicContact CB-CE2 3.48Å; F59-F63 VanDerWaalsContact CB-CE2 3.48Å; F59-F63 HydrophobicContact CG-CE2 4.24Å; F59-F63 WeakPolarHBondContact O-CD2 3.44Å; F59-F63 PolarHBondContact O-N 2.97Å; K60-F63 PolarHBondContact O-N 3.02Å; F63-L66 WeakPolarHBondContact O-CB 3.42Å; F63-L66 PolarHBondContact O-N 3.29Å; F63-L66 VanDerWaalsContact O-N 3.14Å; F63-Y67 HydrophobicContact CB-CD2 4.38Å; F63-Y67 HydrophobicContact CB-CE2 4.42Å; F63-Y67 VanDerWaalsContact O-CD2 3.28Å; F63-Y67 WeakPolarHBondContact O-CD2 3.29Å; F63-Y67 PolarHBondContact O-N 2.98Å; F63-F122 HydrophobicContact CB-CE1 4.5Å; F63-F122 HydrophobicContact CB-CE2 4.13Å; F63-F122 HydrophobicContact CB-CZ 3.55Å; F63-F122 HydrophobicContact CD2-CZ 4.16Å; F63-F122 HydrophobicContact CG-CZ 4.18Å; F63-V318 HydrophobicContact CE2-CG1 4.24Å; F63-V318 HydrophobicContact CZ-CG1 4.12Å; F63-V321 HydrophobicContact CB-CG1 4.36Å; F63-V321 HydrophobicContact CD1-CG1 3.8Å; F63-V321 HydrophobicContact CD2-CG1 4.1Å; F63-V321 HydrophobicContact CE1-CG1 4.06Å; F63-V321 HydrophobicContact CE2-CG1 4.34Å; F63-V321 HydrophobicContact CG-CG1 3.83Å; F63-V321 HydrophobicContact CZ-CG1 4.33Å; F63-C322 WeakPolarHBondContact CZ-SG 3.4Å; F63-L325 HydrophobicContact CD1-CD2 4.33Å
64L92.4Very high90.3Very high73 Ų7365.1 Ų65.138%0.38234%0.337SS..Hα-helixtrans-56.5-51.7-178.4-170.866.4000112.9K60 L66 Y67 C68 V118K60-L64 VanDerWaalsContact O-CB 3.27Å; K60-L64 WeakPolarHBondContact O-CB 2.94Å; K60-L64 PolarHBondContact O-N 3.04Å; L64-L66 VanDerWaalsContact C-N 3.28Å; L64-L66 PolarHBondContact O-N 3.34Å; L64-Y67 PolarHBondContact O-N 3.41Å; L64-C68 PolarHBondContact O-N 3.01Å; L64-C68 PolarHBondContact O-SG 3.39Å; L64-V118 HydrophobicContact CD1-CG1 3.96Å
65P95.1Very high91.3Very high74 Ų7460.2 Ų60.248%0.48132%0.316SS..Hα-helixtrans-64.5-30.4177.125.2-34.4000113P61 L62 C68 L69P61-P65 WeakPolarHBondContact O-CD 3.43Å; P61-P65 VanDerWaalsContact O-CG 3.22Å; P61-P65 WeakPolarHBondContact O-CG 3.29Å; L62-P65 WeakPolarHBondContact O-CD 3.47Å; L62-P65 WeakPolarHBondContact O-CG 3.32Å; P65-C68 PolarHBondContact O-N 2.9Å; P65-L69 WeakPolarHBondContact O-CB 3.49Å; P65-L69 PolarHBondContact O-N 3.49Å
66L95.2Very high92Very high65 Ų6563.6 Ų63.634%0.3434%0.337SS..Hα-helixtrans-67.2-42.9175.2-69.1170.6000111.8L62 F63 L64 L69 V70 L325L62-L66 HydrophobicContact CD1-CD1 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.33Å; L62-L66 WeakPolarHBondContact O-CD1 3.19Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å; F63-L66 WeakPolarHBondContact O-CB 3.42Å; F63-L66 PolarHBondContact O-N 3.29Å; F63-L66 VanDerWaalsContact O-N 3.14Å; L64-L66 VanDerWaalsContact C-N 3.28Å; L64-L66 PolarHBondContact O-N 3.34Å; L66-L69 WeakPolarHBondContact O-CB 3.29Å; L66-L69 PolarHBondContact O-N 2.88Å; L66-V70 WeakPolarHBondContact O-CG2 3.15Å; L66-V70 PolarHBondContact O-N 2.94Å; L66-L325 HydrophobicContact CB-CD1 4.19Å; L66-L325 HydrophobicContact CB-CD2 3.86Å; L66-L325 HydrophobicContact CD1-CD2 3.87Å; L66-L325 HydrophobicContact CG-CD2 4.45Å
67Y93.9Very high92.6Very high8 Ų864.2 Ų64.23%0.03134%0.344CS..Hα-helixtrans-63.8-42.8172.9-83.3-72.6000111.7F63 L64 L69 V70 V71 V114 V118 V321 H324 L325 M328F63-Y67 HydrophobicContact CB-CD2 4.38Å; F63-Y67 HydrophobicContact CB-CE2 4.42Å; F63-Y67 VanDerWaalsContact O-CD2 3.28Å; F63-Y67 WeakPolarHBondContact O-CD2 3.29Å; F63-Y67 PolarHBondContact O-N 2.98Å; L64-Y67 PolarHBondContact O-N 3.41Å; Y67-L69 VanDerWaalsContact C-N 3.29Å; Y67-L69 PolarHBondContact O-N 3.13Å; Y67-V70 PolarHBondContact O-N 3.47Å; Y67-V71 WeakPolarHBondContact O-CG2 3.25Å; Y67-V71 PolarHBondContact O-N 3.48Å; Y67-V114 HydrophobicContact CD1-CG1 3.77Å; Y67-V114 HydrophobicContact CE1-CG1 4.39Å; Y67-V118 HydrophobicContact CD1-CG2 3.43Å; Y67-V118 VanDerWaalsContact CD1-CG2 3.43Å; Y67-V118 HydrophobicContact CD2-CG1 4.41Å; Y67-V118 HydrophobicContact CD2-CG2 3.72Å; Y67-V118 HydrophobicContact CE1-CG2 3.76Å; Y67-V118 HydrophobicContact CE2-CG2 4.05Å; Y67-V118 HydrophobicContact CG-CG1 4.49Å; Y67-V118 HydrophobicContact CG-CG2 3.41Å; Y67-V118 VanDerWaalsContact CG-CG2 3.41Å; Y67-V321 HydrophobicContact CE2-CG1 3.86Å; Y67-V321 PolarHBondContact OH-O 3.43Å; Y67-H324 AromaticContact CE1-ND1 3.55Å; Y67-H324 AromaticContact CZ-ND1 3.62Å; Y67-H324 PolarHBondContact OH-ND1 2.67Å; Y67-L325 HydrophobicContact CD1-CD1 3.76Å; Y67-L325 HydrophobicContact CD2-CD1 4.1Å; Y67-L325 HydrophobicContact CE1-CB 4.27Å; Y67-L325 HydrophobicContact CE1-CD1 3.77Å; Y67-L325 HydrophobicContact CE2-CB 4.33Å; Y67-L325 HydrophobicContact CE2-CD1 4.08Å; Y67-L325 HydrophobicContact CG-CD1 3.93Å; Y67-L325 PolarHBondContact OH-N 3.01Å; Y67-M328 HydrophobicContact CE1-CG 4.41Å
68C95.3Very high93.2Very high69 Ų6960.3 Ų60.347%0.46633%0.326SS..Hα-helixtrans-58.1-42.8173.5-66.30000111.6L64 P65 V71 V72L64-C68 PolarHBondContact O-N 3.01Å; L64-C68 PolarHBondContact O-SG 3.39Å; P65-C68 PolarHBondContact O-N 2.9Å; C68-V71 PolarHBondContact O-N 3.13Å; C68-V72 WeakPolarHBondContact O-CB 3.26Å; C68-V72 VanDerWaalsContact O-CG2 3.31Å; C68-V72 WeakPolarHBondContact O-CG2 2.98Å; C68-V72 PolarHBondContact O-N 2.87Å
69L95.5Very high93.6Very high103 Ų10353.3 Ų53.354%0.53931%0.308SS..Hα-helixtrans-60.8-45.4176.1-179.965.9000111.4P65 L66 Y67 V71 V72 V73P65-L69 WeakPolarHBondContact O-CB 3.49Å; P65-L69 PolarHBondContact O-N 3.49Å; L66-L69 WeakPolarHBondContact O-CB 3.29Å; L66-L69 PolarHBondContact O-N 2.88Å; Y67-L69 VanDerWaalsContact C-N 3.29Å; Y67-L69 PolarHBondContact O-N 3.13Å; L69-V71 PolarHBondContact O-N 2.86Å; L69-V72 PolarHBondContact O-N 3.41Å; L69-V73 HydrophobicContact CD1-CG2 3.83Å; L69-V73 HydrophobicContact CG-CG2 4.24Å; L69-V73 WeakPolarHBondContact O-CB 3.39Å; L69-V73 VanDerWaalsContact O-CG2 3.25Å; L69-V73 WeakPolarHBondContact O-CG2 3.28Å; L69-V73 PolarHBondContact O-N 3.26Å
70V94.5Very high93.7Very high14 Ų1452.8 Ų52.89%0.08531%0.306CS..Hα-helixtrans-59.3-47.6175.9169.30000110.8L66 Y67 V72 V73 A74 L325 M328L66-V70 WeakPolarHBondContact O-CG2 3.15Å; L66-V70 PolarHBondContact O-N 2.94Å; Y67-V70 PolarHBondContact O-N 3.47Å; V70-V72 PolarHBondContact O-N 2.69Å; V70-V73 PolarHBondContact O-N 2.58Å; V70-A74 WeakPolarHBondContact O-CB 3.47Å; V70-A74 PolarHBondContact O-N 3.28Å; V70-L325 HydrophobicContact CG2-CD1 4Å; V70-M328 HydrophobicContact CG1-CB 4.11Å
71V95.8Very high93.8Very high31 Ų3149 Ų4919%0.18829%0.29CS..Hα-helixtrans-62-43.1179.1173.80000111.4Y67 C68 L69 G75 C110 L111 V114Y67-V71 WeakPolarHBondContact O-CG2 3.25Å; Y67-V71 PolarHBondContact O-N 3.48Å; C68-V71 PolarHBondContact O-N 3.13Å; L69-V71 PolarHBondContact O-N 2.86Å; V71-G75 VanDerWaalsContact O-CA 3.28Å; V71-G75 WeakPolarHBondContact O-CA 3.47Å; V71-G75 PolarHBondContact O-N 2.99Å; V71-C110 WeakPolarHBondContact CG2-O 3.35Å; V71-L111 HydrophobicContact CG1-CD2 4.28Å; V71-V114 HydrophobicContact CG2-CB 4.24Å; V71-V114 HydrophobicContact CG2-CG1 3.76Å
72V95.9Very high93.8Very high89 Ų8946.3 Ų46.354%0.53927%0.269SS..Hα-helixtrans-66.9-48.7178.6169.90000111.1C68 L69 V70 V76C68-V72 WeakPolarHBondContact O-CB 3.26Å; C68-V72 VanDerWaalsContact O-CG2 3.31Å; C68-V72 WeakPolarHBondContact O-CG2 2.98Å; C68-V72 PolarHBondContact O-N 2.87Å; L69-V72 PolarHBondContact O-N 3.41Å; V70-V72 PolarHBondContact O-N 2.69Å; V72-V76 HydrophobicContact CG1-CG2 4.36Å; V72-V76 VanDerWaalsContact O-CB 3.27Å; V72-V76 WeakPolarHBondContact O-CB 3.28Å; V72-V76 VanDerWaalsContact O-CG2 3.24Å; V72-V76 WeakPolarHBondContact O-CG2 3.14Å; V72-V76 PolarHBondContact O-N 3.1Å
73V94.9Very high93.7Very high45 Ų4544.4 Ų44.427%0.27327%0.267SS..Hα-helixtrans-66.7-48.7-177.3173.10000110.9L69 V70 G77 C332 F336L69-V73 HydrophobicContact CD1-CG2 3.83Å; L69-V73 HydrophobicContact CG-CG2 4.24Å; L69-V73 WeakPolarHBondContact O-CB 3.39Å; L69-V73 VanDerWaalsContact O-CG2 3.25Å; L69-V73 WeakPolarHBondContact O-CG2 3.28Å; L69-V73 PolarHBondContact O-N 3.26Å; V70-V73 PolarHBondContact O-N 2.58Å; V73-G77 WeakPolarHBondContact O-CA 3.49Å; V73-G77 PolarHBondContact O-N 3.08Å; V73-C332 HydrophobicContact CG1-CB 3.9Å; V73-F336 HydrophobicContact CG1-CE2 3.79Å; V73-F336 HydrophobicContact CG1-CZ 4.02Å
74A94.7Very high93.5Very high0 Ų045 Ų450%027%0.273CS..Hα-helixtrans-65.3-44.2177.100000111.2V70 N78 C110 A331V70-A74 WeakPolarHBondContact O-CB 3.47Å; V70-A74 PolarHBondContact O-N 3.28Å; A74-N78 VanDerWaalsContact O-CB 3.22Å; A74-N78 WeakPolarHBondContact O-CB 3.48Å; A74-N78 PolarHBondContact O-N 3.29Å; A74-N78 PolarHBondContact O-ND2 3.14Å; A74-C110 HydrophobicContact CB-CB 4.14Å; A74-A331 HydrophobicContact CB-CB 3.94Å
75G95.6Very high93.3Very high8 Ų842.2 Ų42.28%0.08226%0.258CS..Hα-helixtrans-61-54.318000000112.2V71 S79 L107V71-G75 VanDerWaalsContact O-CA 3.28Å; V71-G75 WeakPolarHBondContact O-CA 3.47Å; V71-G75 PolarHBondContact O-N 2.99Å; G75-S79 WeakPolarHBondContact O-CB 3.29Å; G75-S79 PolarHBondContact O-N 3.26Å; G75-S79 PolarHBondContact O-OG 3.02Å; G75-L107 WeakPolarHBondContact O-CD2 3.31Å
76V94.3Very high92.9Very high99 Ų9944.3 Ų44.360%0.626%0.264SS*.Hα-helixtrans-65.6-45.4179.6174.70000110.7V72 F80V72-V76 HydrophobicContact CG1-CG2 4.36Å; V72-V76 VanDerWaalsContact O-CB 3.27Å; V72-V76 WeakPolarHBondContact O-CB 3.28Å; V72-V76 VanDerWaalsContact O-CG2 3.24Å; V72-V76 WeakPolarHBondContact O-CG2 3.14Å; V72-V76 PolarHBondContact O-N 3.1Å; V76-F80 VanDerWaalsContact O-CB 3.28Å; V76-F80 WeakPolarHBondContact O-CB 3.28Å; V76-F80 PolarHBondContact O-N 3.24Å
77G92.3Very high92.5Very high15 Ų1545.3 Ų45.316%0.15528%0.282CS..Hα-helixtrans-63-50.2-177.600000112.8V73 F80 L81V73-G77 WeakPolarHBondContact O-CA 3.49Å; V73-G77 PolarHBondContact O-N 3.08Å; G77-F80 PolarHBondContact O-N 2.99Å; G77-L81 WeakPolarHBondContact O-CB 3.34Å; G77-L81 PolarHBondContact O-N 3.25Å
78N94.4Very high91.9Very high0 Ų046.6 Ų46.60%029%0.289CS..Hα-helixtrans-70.6-36-179.6-72.2-66.5000111.9A74 F80 L81 L82 A103 L107 A331 P335A74-N78 VanDerWaalsContact O-CB 3.22Å; A74-N78 WeakPolarHBondContact O-CB 3.48Å; A74-N78 PolarHBondContact O-N 3.29Å; A74-N78 PolarHBondContact O-ND2 3.14Å; N78-F80 PolarHBondContact O-N 3.09Å; N78-L81 PolarHBondContact O-N 3.27Å; N78-L82 VanDerWaalsContact O-CB 3.29Å; N78-L82 WeakPolarHBondContact O-CB 3.41Å; N78-L82 PolarHBondContact O-N 3.33Å; N78-A103 HydrophobicContact CB-CB 4.14Å; N78-L107 HydrophobicContact CB-CD1 4.3Å; N78-L107 HydrophobicContact CB-CD2 3.91Å; N78-L107 HydrophobicContact CB-CG 3.75Å; N78-A331 PolarHBondContact ND2-O 3.2Å; N78-P335 HydrophobicContact CB-CG 4.27Å; N78-P335 VanDerWaalsContact CG-CG 3.47Å; N78-P335 WeakPolarHBondContact OD1-CD 3.44Å; N78-P335 VanDerWaalsContact OD1-CG 3.29Å; N78-P335 WeakPolarHBondContact OD1-CG 3.29Å
79S93.9Very high91.2Very high56 Ų5651.8 Ų51.839%0.39230%0.304SS..Hα-helixtrans-61.1-45.3172.5-600000111.6G75 L82 A83 L107G75-S79 WeakPolarHBondContact O-CB 3.29Å; G75-S79 PolarHBondContact O-N 3.26Å; G75-S79 PolarHBondContact O-OG 3.02Å; S79-L82 PolarHBondContact O-N 3.46Å; S79-A83 VanDerWaalsContact O-CB 3.3Å; S79-A83 WeakPolarHBondContact O-CB 3.49Å; S79-A83 PolarHBondContact O-N 3.14Å; S79-L107 WeakPolarHBondContact OG-CD2 3.04Å
80F90.8Very high90.4Very high69 Ų6955.1 Ų55.130%0.30331%0.314SS..Hα-helixtrans-64.7-43178.3175.1-97.8000112.1V76 G77 N78 A83 C84 V345 L349V76-F80 VanDerWaalsContact O-CB 3.28Å; V76-F80 WeakPolarHBondContact O-CB 3.28Å; V76-F80 PolarHBondContact O-N 3.24Å; G77-F80 PolarHBondContact O-N 2.99Å; N78-F80 PolarHBondContact O-N 3.09Å; F80-A83 PolarHBondContact O-N 2.89Å; F80-C84 WeakPolarHBondContact CZ-SG 3.31Å; F80-C84 PolarHBondContact O-N 3.46Å; F80-C84 PolarHBondContact O-SG 3.33Å; F80-V345 HydrophobicContact CE1-CG1 3.77Å; F80-V345 HydrophobicContact CZ-CG1 4.38Å; F80-L349 HydrophobicContact CD1-CD1 4.48Å; F80-L349 HydrophobicContact CE1-CD1 3.87Å; F80-L349 HydrophobicContact CZ-CD1 4.26Å
81L89.8Confident89.7Confident7 Ų755.5 Ų55.54%0.03732%0.315CS..Hα-helixtrans-59.7-47.3175.7177.161000111G77 N78 C84 I85 I99 A103 Y338G77-L81 WeakPolarHBondContact O-CB 3.34Å; G77-L81 PolarHBondContact O-N 3.25Å; N78-L81 PolarHBondContact O-N 3.27Å; L81-C84 PolarHBondContact O-N 2.8Å; L81-I85 HydrophobicContact CD1-CD1 4.12Å; L81-I85 HydrophobicContact CG-CD1 4.11Å; L81-I85 WeakPolarHBondContact O-CG1 3.27Å; L81-I85 PolarHBondContact O-N 2.94Å; L81-I85 VanDerWaalsContact O-N 3.11Å; L81-I99 HydrophobicContact CD1-CG2 4.37Å; L81-I99 HydrophobicContact CD2-CG2 3.82Å; L81-I99 HydrophobicContact CG-CG2 4.33Å; L81-A103 HydrophobicContact CD2-CB 4.22Å; L81-Y338 HydrophobicContact CD2-CD2 4.16Å
82L92.1Very high89.1Confident44 Ų4459.7 Ų59.723%0.2333%0.333CS..Hα-helixtrans-62.9-45.6178.5-172.361.9000111.4N78 S79 C84 I85 L86 A103 L107N78-L82 VanDerWaalsContact O-CB 3.29Å; N78-L82 WeakPolarHBondContact O-CB 3.41Å; N78-L82 PolarHBondContact O-N 3.33Å; S79-L82 PolarHBondContact O-N 3.46Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 2.85Å; L82-I85 PolarHBondContact O-N 3.36Å; L82-L86 HydrophobicContact CG-CD1 4.13Å; L82-L86 WeakPolarHBondContact O-CG 3.39Å; L82-L86 PolarHBondContact O-N 3.41Å; L82-A103 HydrophobicContact CB-CB 4.45Å; L82-L107 HydrophobicContact CD2-CD1 4.19Å
83A89.9Confident88.6Confident53 Ų5357.6 Ų57.644%0.43832%0.319SS..Hα-helixtrans-59.2-42.1176.300000112.3S79 F80 I85 L86 A87S79-A83 VanDerWaalsContact O-CB 3.3Å; S79-A83 WeakPolarHBondContact O-CB 3.49Å; S79-A83 PolarHBondContact O-N 3.14Å; F80-A83 PolarHBondContact O-N 2.89Å; A83-I85 VanDerWaalsContact C-N 3.35Å; A83-I85 PolarHBondContact O-N 3.08Å; A83-L86 PolarHBondContact O-N 2.69Å; A83-A87 VanDerWaalsContact O-CB 3.25Å; A83-A87 WeakPolarHBondContact O-CB 3.5Å; A83-A87 PolarHBondContact O-N 2.89Å
84C86.5Confident88.3Confident24 Ų2456 Ų5616%0.16231%0.31CS..Hα-helixtrans-61.1-43.2175.9-73.20000112.2F80 L81 L82 D88F80-C84 WeakPolarHBondContact CZ-SG 3.31Å; F80-C84 PolarHBondContact O-N 3.46Å; F80-C84 PolarHBondContact O-SG 3.33Å; L81-C84 PolarHBondContact O-N 2.8Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 2.85Å; C84-D88 PolarHBondContact O-N 3.45Å; C84-D88 VanDerWaalsContact O-N 3.17Å
85I87.9Confident88Confident13 Ų1356.2 Ų56.27%0.06731%0.311CS..Hα-helixtrans-64.7-42.9179.7-68.2164.1000110.5L81 L82 A83 H92 I99L81-I85 HydrophobicContact CD1-CD1 4.12Å; L81-I85 HydrophobicContact CG-CD1 4.11Å; L81-I85 WeakPolarHBondContact O-CG1 3.27Å; L81-I85 PolarHBondContact O-N 2.94Å; L81-I85 VanDerWaalsContact O-N 3.11Å; L82-I85 PolarHBondContact O-N 3.36Å; A83-I85 VanDerWaalsContact C-N 3.35Å; A83-I85 PolarHBondContact O-N 3.08Å; I85-H92 PolarHBondContact O-CD2 3.1Å; I85-H92 PolarHBondContact O-NE2 3.01Å; I85-H92 VanDerWaalsContact O-NE2 3.1Å; I85-I99 HydrophobicContact CD1-CB 4.41Å; I85-I99 HydrophobicContact CD1-CG2 3.98Å
86L88.4Confident87.7Confident119 Ų11956 Ų5662%0.62331%0.308SS*.Hα-helixtrans-70.8-34-179.9-66.4174.3000113.1L82 A83L82-L86 HydrophobicContact CG-CD1 4.13Å; L82-L86 WeakPolarHBondContact O-CG 3.39Å; L82-L86 PolarHBondContact O-N 3.41Å; A83-L86 PolarHBondContact O-N 2.69Å
87A85.3Confident87.5Confident85 Ų8555.5 Ų55.570%0.70230%0.298SS*.Hα-helixtrans-79.8-39.2-176.400000113.5A83A83-A87 VanDerWaalsContact O-CB 3.25Å; A83-A87 WeakPolarHBondContact O-CB 3.5Å; A83-A87 PolarHBondContact O-N 2.89Å
88D81.4Confident87.6Confident36 Ų3654.9 Ų54.919%0.19329%0.291CS..  trans-95.9102.5-176.4-169.9-11.4000111.2C84 K90 L91 K344C84-D88 PolarHBondContact O-N 3.45Å; C84-D88 VanDerWaalsContact O-N 3.17Å; D88-K90 PolarHBondContact O-N 2.97Å; D88-K90 WeakPolarHBondContact OD1-CB 3.47Å; D88-K90 WeakPolarHBondContact OD1-CG 3.47Å; D88-K90 PolarHBondContact OD1-N 3.36Å; D88-L91 HydrophobicContact CB-CB 4.48Å; D88-L91 HydrophobicContact CB-CD1 3.98Å; D88-L91 HydrophobicContact CB-CG 3.89Å; D88-L91 WeakPolarHBondContact O-CA 3.02Å; D88-L91 VanDerWaalsContact O-CB 3.3Å; D88-L91 WeakPolarHBondContact O-CB 3.36Å; D88-L91 PolarHBondContact O-N 2.99Å; D88-K344 IonicContact OD2-NZ 2.72Å; D88-K344 PolarHBondContact OD2-NZ 3.12Å
89K81.9Confident87.5Confident177 Ų17755 Ų5577%0.7729%0.292SS*.G310 helixtrans-53.1-25.6174.5-65.4-176.1-179.6-179.20113.5L91 H92K89-L91 PolarHBondContact O-N 3.39Å; K89-H92 WeakPolarHBondContact O-CB 3.32Å; K89-H92 PolarHBondContact O-N 3.4Å
90K77.8Confident87.4Confident173 Ų17352.8 Ų52.875%0.75228%0.277SS*.G310 helixtrans-69.3-18.2176.3-58.1177.5178-179.30112.3D88D88-K90 PolarHBondContact O-N 2.97Å; D88-K90 WeakPolarHBondContact OD1-CB 3.47Å; D88-K90 WeakPolarHBondContact OD1-CG 3.47Å; D88-K90 PolarHBondContact OD1-N 3.36Å
91L79.2Confident87.6Confident23 Ų2350.3 Ų50.312%0.1227%0.267CS..G310 helixtrans-88.1-7.1174.9-59.3-176.2000112.7D88 K89 N93 N96 H342D88-L91 HydrophobicContact CB-CB 4.48Å; D88-L91 HydrophobicContact CB-CD1 3.98Å; D88-L91 HydrophobicContact CB-CG 3.89Å; D88-L91 WeakPolarHBondContact O-CA 3.02Å; D88-L91 VanDerWaalsContact O-CB 3.3Å; D88-L91 WeakPolarHBondContact O-CB 3.36Å; D88-L91 PolarHBondContact O-N 2.99Å; K89-L91 PolarHBondContact O-N 3.39Å; L91-N93 VanDerWaalsContact C-N 3.31Å; L91-N93 PolarHBondContact O-N 3.25Å; L91-N93 PolarHBondContact O-ND2 2.92Å; L91-N96 WeakPolarHBondContact CA-ND2 3.25Å; L91-N96 WeakPolarHBondContact O-CB 3.22Å; L91-N96 PolarHBondContact O-ND2 2.88Å; L91-H342 VanDerWaalsContact CD2-CE1 3.4Å; L91-H342 WeakPolarHBondContact CD2-CE1 3.48Å; L91-H342 WeakPolarHBondContact CD2-ND1 3.41Å
92H84.4Confident87.8Confident118 Ų11850.1 Ų50.155%0.54627%0.266SS..  trans-74.182.5179.1-65.8-178.3000111.7I85 K89I85-H92 PolarHBondContact O-CD2 3.1Å; I85-H92 PolarHBondContact O-NE2 3.01Å; I85-H92 VanDerWaalsContact O-NE2 3.1Å; K89-H92 WeakPolarHBondContact O-CB 3.32Å; K89-H92 PolarHBondContact O-N 3.4Å
93N86.1Confident87.9Confident46 Ų4648.1 Ų48.125%0.24626%0.256CS..SBendtrans-134.4163.7170.662.564.5000109.7L91 T95 N96 F97L91-N93 VanDerWaalsContact C-N 3.31Å; L91-N93 PolarHBondContact O-N 3.25Å; L91-N93 PolarHBondContact O-ND2 2.92Å; N93-T95 VanDerWaalsContact C-N 3.3Å; N93-T95 PolarHBondContact O-N 3Å; N93-T95 WeakPolarHBondContact OD1-CB 3.49Å; N93-T95 PolarHBondContact OD1-N 2.84Å; N93-N96 PolarHBondContact ND2-ND2 3.07Å; N93-N96 PolarHBondContact O-N 3.04Å; N93-N96 VanDerWaalsContact O-N 3.13Å; N93-N96 PolarHBondContact OD1-N 2.75Å; N93-F97 PolarHBondContact O-N 3.47Å
94A87.9Confident88.2Confident11 Ų1147.4 Ų47.49%0.09125%0.25CC..Hα-helixtrans-53.2-43.7-175.300000113.4N96 F97 F98 D158 I171 C176A94-N96 PolarHBondContact O-N 2.93Å; A94-F97 VanDerWaalsContact O-CB 3.32Å; A94-F97 WeakPolarHBondContact O-CB 3.5Å; A94-F97 PolarHBondContact O-N 3.27Å; A94-F98 WeakPolarHBondContact O-CD2 3.31Å; A94-F98 PolarHBondContact O-N 3.14Å; A94-F98 VanDerWaalsContact O-N 3.1Å; A94-D158 WeakPolarHBondContact CB-OD1 3.22Å; A94-I171 HydrophobicContact CB-CB 4.37Å; A94-C176 VanDerWaalsContact CB-SG 3.54Å
95T87.7Confident88.7Confident4 Ų446.4 Ų46.43%0.02524%0.244CC..Hα-helixtrans-60.9-48.6178.1-37.40000112.7N93 F97 F98 I99 I155 D158 R159N93-T95 VanDerWaalsContact C-N 3.3Å; N93-T95 PolarHBondContact O-N 3Å; N93-T95 WeakPolarHBondContact OD1-CB 3.49Å; N93-T95 PolarHBondContact OD1-N 2.84Å; T95-F97 PolarHBondContact O-N 2.93Å; T95-F98 PolarHBondContact O-N 3.39Å; T95-I99 HydrophobicContact CG2-CD1 4.05Å; T95-I99 WeakPolarHBondContact O-CG1 3.46Å; T95-I99 PolarHBondContact O-N 3.26Å; T95-I155 HydrophobicContact CG2-CG2 3.56Å; T95-D158 PolarHBondContact OG1-OD2 2.93Å; T95-R159 PolarHBondContact OG1-NH1 2.93Å; T95-R159 PolarHBondContact OG1-NH2 3.46Å
96N88.9Confident89Confident4 Ų445.9 Ų45.92%0.02124%0.241CC..Hα-helixtrans-69.7-26.9-178.7-71.9-14.2000111.2L91 N93 A94 I99 G100L91-N96 WeakPolarHBondContact CA-ND2 3.25Å; L91-N96 WeakPolarHBondContact O-CB 3.22Å; L91-N96 PolarHBondContact O-ND2 2.88Å; N93-N96 PolarHBondContact ND2-ND2 3.07Å; N93-N96 PolarHBondContact O-N 3.04Å; N93-N96 VanDerWaalsContact O-N 3.13Å; N93-N96 PolarHBondContact OD1-N 2.75Å; A94-N96 PolarHBondContact O-N 2.93Å; N96-I99 PolarHBondContact O-N 3.31Å; N96-G100 PolarHBondContact O-N 2.95Å
97F91.6Very high89.4Confident88 Ų8841.2 Ų41.239%0.38622%0.217SC..Hα-helixtrans-61.3-48.6169.1-169.4-82.7000111.1N93 A94 T95 I99 G100 N101 C176 T180N93-F97 PolarHBondContact O-N 3.47Å; A94-F97 VanDerWaalsContact O-CB 3.32Å; A94-F97 WeakPolarHBondContact O-CB 3.5Å; A94-F97 PolarHBondContact O-N 3.27Å; T95-F97 PolarHBondContact O-N 2.93Å; F97-I99 PolarHBondContact O-N 3.38Å; F97-G100 CarbonylContact O-C 3Å; F97-G100 WeakPolarHBondContact O-CA 3.49Å; F97-G100 PolarHBondContact O-N 3.16Å; F97-G100 VanDerWaalsContact O-N 3.13Å; F97-N101 PolarHBondContact O-N 2.98Å; F97-C176 HydrophobicContact CB-CB 4.32Å; F97-C176 HydrophobicContact CD1-CB 3.65Å; F97-C176 HydrophobicContact CD2-CB 4.33Å; F97-C176 HydrophobicContact CE1-CB 4Å; F97-C176 HydrophobicContact CG-CB 3.83Å; F97-C176 HydrophobicContact CZ-CB 4.47Å; F97-T180 HydrophobicContact CE1-CG2 4.47Å; F97-T180 VanDerWaalsContact CE1-OG1 3.29Å; F97-T180 WeakPolarHBondContact CE1-OG1 3.46Å
98F92.7Very high89.8Confident3 Ų339.9 Ų39.91%0.01320%0.197CC..Hα-helixtrans-68.1-33176.6-63.1-51.5000113.3A94 T95 G100 N101 L102 A154 I155 V179A94-F98 WeakPolarHBondContact O-CD2 3.31Å; A94-F98 PolarHBondContact O-N 3.14Å; A94-F98 VanDerWaalsContact O-N 3.1Å; T95-F98 PolarHBondContact O-N 3.39Å; F98-G100 VanDerWaalsContact C-N 3.3Å; F98-N101 WeakPolarHBondContact O-CB 3.46Å; F98-N101 PolarHBondContact O-N 3.29Å; F98-L102 PolarHBondContact O-N 3.41Å; F98-A154 HydrophobicContact CD1-CB 4.21Å; F98-A154 HydrophobicContact CD2-CB 4.18Å; F98-A154 HydrophobicContact CE1-CB 4.15Å; F98-A154 HydrophobicContact CE2-CB 4.1Å; F98-A154 HydrophobicContact CG-CB 4.24Å; F98-A154 HydrophobicContact CZ-CB 4.1Å; F98-I155 HydrophobicContact CB-CD1 4.01Å; F98-I155 HydrophobicContact CB-CG1 3.43Å; F98-I155 VanDerWaalsContact CB-CG1 3.43Å; F98-I155 HydrophobicContact CD2-CG1 4.35Å; F98-I155 HydrophobicContact CG-CG1 4.28Å; F98-V179 HydrophobicContact CE1-CB 3.97Å; F98-V179 HydrophobicContact CE1-CG1 3.59Å; F98-V179 HydrophobicContact CZ-CB 4.01Å; F98-V179 HydrophobicContact CZ-CG1 3.7Å
99I92.3Very high90.4Very high3 Ų338.3 Ų38.32%0.01519%0.189CC..Hα-helixtrans-63.5-39.5169.8-67.4166.8000110.4L81 I85 T95 N96 F97 L102 A103 I155 Y338L81-I99 HydrophobicContact CD1-CG2 4.37Å; L81-I99 HydrophobicContact CD2-CG2 3.82Å; L81-I99 HydrophobicContact CG-CG2 4.33Å; I85-I99 HydrophobicContact CD1-CB 4.41Å; I85-I99 HydrophobicContact CD1-CG2 3.98Å; T95-I99 HydrophobicContact CG2-CD1 4.05Å; T95-I99 WeakPolarHBondContact O-CG1 3.46Å; T95-I99 PolarHBondContact O-N 3.26Å; N96-I99 PolarHBondContact O-N 3.31Å; F97-I99 PolarHBondContact O-N 3.38Å; I99-L102 WeakPolarHBondContact O-CB 3.33Å; I99-L102 PolarHBondContact O-N 3.49Å; I99-A103 PolarHBondContact O-N 3.16Å; I99-I155 HydrophobicContact CG1-CD1 3.96Å; I99-Y338 HydrophobicContact CD1-CD1 3.72Å; I99-Y338 HydrophobicContact CD1-CE1 3.94Å; I99-Y338 HydrophobicContact CD1-CG 4.22Å; I99-Y338 HydrophobicContact CG1-CD1 4.13Å; I99-Y338 HydrophobicContact CG1-CE1 4.03Å; I99-Y338 HydrophobicContact CG1-CE2 4.42Å; I99-Y338 HydrophobicContact CG1-CG 4.41Å; I99-Y338 HydrophobicContact CG2-CD1 4.43Å; I99-Y338 HydrophobicContact CG2-CD2 3.76Å; I99-Y338 HydrophobicContact CG2-CE2 4.22Å; I99-Y338 HydrophobicContact CG2-CG 3.89Å
100G93Very high90.9Very high8 Ų830.1 Ų30.18%0.08215%0.154CC..Hα-helixtrans-63-40.3172.300000112.5N96 F97 F98 A103 A104N96-G100 PolarHBondContact O-N 2.95Å; F97-G100 CarbonylContact O-C 3Å; F97-G100 WeakPolarHBondContact O-CA 3.49Å; F97-G100 PolarHBondContact O-N 3.16Å; F97-G100 VanDerWaalsContact O-N 3.13Å; F98-G100 VanDerWaalsContact C-N 3.3Å; G100-A103 PolarHBondContact O-N 2.93Å; G100-A104 WeakPolarHBondContact O-CB 3.09Å; G100-A104 PolarHBondContact O-N 3.34Å
101N95.1Very high91.7Very high18 Ų1826.5 Ų26.510%0.09614%0.142CC..Hα-helixtrans-62.4-42.6173.9-173.962.8000112.2F97 F98 A104 G105 S151 T180 W184F97-N101 PolarHBondContact O-N 2.98Å; F98-N101 WeakPolarHBondContact O-CB 3.46Å; F98-N101 PolarHBondContact O-N 3.29Å; N101-A104 PolarHBondContact O-N 3.36Å; N101-G105 PolarHBondContact O-N 3.32Å; N101-S151 PolarHBondContact ND2-OG 3.5Å; N101-T180 HydrophobicContact CB-CG2 4.21Å; N101-T180 WeakPolarHBondContact OD1-CG2 3.24Å; N101-W184 PolarHBondContact OD1-NE1 3.31Å
102L93.6Very high92.2Very high3 Ų327.7 Ų27.72%0.01615%0.153CC..Hα-helixtrans-58-50.6172.5-80.7165.8000111.3F98 I99 A104 G105 D106 L152 I155 Y338F98-L102 PolarHBondContact O-N 3.41Å; I99-L102 WeakPolarHBondContact O-CB 3.33Å; I99-L102 PolarHBondContact O-N 3.49Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 2.91Å; L102-G105 PolarHBondContact O-N 2.97Å; L102-G105 VanDerWaalsContact O-N 3.16Å; L102-D106 WeakPolarHBondContact O-CB 3.29Å; L102-D106 PolarHBondContact O-N 2.99Å; L102-L152 HydrophobicContact CD1-CD2 3.93Å; L102-L152 HydrophobicContact CD1-CG 4.23Å; L102-L152 HydrophobicContact CD2-CG 4.31Å; L102-I155 HydrophobicContact CD1-CD1 3.44Å; L102-I155 VanDerWaalsContact CD1-CD1 3.44Å; L102-Y338 HydrophobicContact CD1-CE2 4.49Å
103A95Very high92.6Very high1 Ų122.1 Ų22.11%0.00813%0.127CC..Hα-helixtrans-59.7-40.1178.900000112.2N78 L81 L82 I99 G100 L107N78-A103 HydrophobicContact CB-CB 4.14Å; L81-A103 HydrophobicContact CD2-CB 4.22Å; L82-A103 HydrophobicContact CB-CB 4.45Å; I99-A103 PolarHBondContact O-N 3.16Å; G100-A103 PolarHBondContact O-N 2.93Å; A103-L107 WeakPolarHBondContact O-CB 3.45Å; A103-L107 WeakPolarHBondContact O-CG 3.29Å; A103-L107 PolarHBondContact O-N 2.94Å
104A95.8Very high92.7Very high38 Ų3820 Ų2031%0.31412%0.116SC..Hα-helixtrans-66.3-41175.800000112.5G100 N101 L102 L107 L108G100-A104 WeakPolarHBondContact O-CB 3.09Å; G100-A104 PolarHBondContact O-N 3.34Å; N101-A104 PolarHBondContact O-N 3.36Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 2.91Å; A104-L107 PolarHBondContact O-N 3.26Å; A104-L108 PolarHBondContact O-N 3.5Å
105G96Very high92.9Very high3 Ų322.2 Ų22.23%0.03113%0.129CC..Hα-helixtrans-64.6-42.9174.900000112.8N101 L102 L107 L108 M109N101-G105 PolarHBondContact O-N 3.32Å; L102-G105 PolarHBondContact O-N 2.97Å; L102-G105 VanDerWaalsContact O-N 3.16Å; G105-L107 VanDerWaalsContact C-N 3.34Å; G105-L107 PolarHBondContact O-N 2.89Å; G105-L108 WeakPolarHBondContact O-CB 3.15Å; G105-L108 PolarHBondContact O-N 3.19Å; G105-M109 PolarHBondContact O-N 3.28Å
106D95.1Very high93.1Very high3 Ų323.6 Ų23.62%0.01614%0.136CC..Hα-helixtrans-62.3-41175.1-75-24.6000111.3L102 M109 C110 A331 N334L102-D106 WeakPolarHBondContact O-CB 3.29Å; L102-D106 PolarHBondContact O-N 2.99Å; D106-M109 PolarHBondContact O-N 2.86Å; D106-C110 VanDerWaalsContact O-CB 3.32Å; D106-C110 WeakPolarHBondContact O-CB 3.36Å; D106-C110 PolarHBondContact O-N 3.26Å; D106-C110 PolarHBondContact O-SG 2.99Å; D106-A331 HydrophobicContact CB-CB 3.99Å; D106-N334 PolarHBondContact OD2-ND2 3.36Å
107L95.9Very high93.1Very high21 Ų2124.7 Ų24.711%0.1114%0.143CC..Hα-helixtrans-63.5-43.8174.6-74.3169.9000112.2G75 N78 S79 L82 A103 A104 G105 M109 C110 L111G75-L107 WeakPolarHBondContact O-CD2 3.31Å; N78-L107 HydrophobicContact CB-CD1 4.3Å; N78-L107 HydrophobicContact CB-CD2 3.91Å; N78-L107 HydrophobicContact CB-CG 3.75Å; S79-L107 WeakPolarHBondContact OG-CD2 3.04Å; L82-L107 HydrophobicContact CD2-CD1 4.19Å; A103-L107 WeakPolarHBondContact O-CB 3.45Å; A103-L107 WeakPolarHBondContact O-CG 3.29Å; A103-L107 PolarHBondContact O-N 2.94Å; A104-L107 PolarHBondContact O-N 3.26Å; G105-L107 VanDerWaalsContact C-N 3.34Å; G105-L107 PolarHBondContact O-N 2.89Å; L107-M109 VanDerWaalsContact C-N 3.34Å; L107-M109 PolarHBondContact O-N 2.9Å; L107-C110 PolarHBondContact O-N 3.32Å; L107-L111 HydrophobicContact CB-CD1 4.49Å; L107-L111 HydrophobicContact CD2-CD1 4.2Å; L107-L111 VanDerWaalsContact O-CB 3.25Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 VanDerWaalsContact O-CG 3.32Å; L107-L111 WeakPolarHBondContact O-CG 3.33Å; L107-L111 PolarHBondContact O-N 2.8Å
108L95.4Very high93Very high56 Ų5621.1 Ų21.129%0.29313%0.128SC..Hα-helixtrans-58.7-48.6175.9177.962.4000110.6A104 G105 S112 L140 T144 W184A104-L108 PolarHBondContact O-N 3.5Å; G105-L108 WeakPolarHBondContact O-CB 3.15Å; G105-L108 PolarHBondContact O-N 3.19Å; L108-S112 WeakPolarHBondContact O-CB 3.45Å; L108-S112 PolarHBondContact O-N 3.03Å; L108-S112 VanDerWaalsContact O-N 3.16Å; L108-S112 PolarHBondContact O-OG 3.22Å; L108-L140 HydrophobicContact CD2-CD2 4.37Å; L108-T144 HydrophobicContact CD2-CG2 3.98Å; L108-T144 HydrophobicContact CG-CG2 4.35Å; L108-W184 HydrophobicContact CD2-CH2 3.93Å; L108-W184 HydrophobicContact CD2-CZ3 4.22Å
109M92.3Very high92.9Very high4 Ų423.2 Ų23.22%0.0214%0.143CC..Iπ-helixtrans-62.8-49178.5-172.9-169.2-76.200111.6G105 D106 L107 C113 V114 T144 V145 W292 M328G105-M109 PolarHBondContact O-N 3.28Å; D106-M109 PolarHBondContact O-N 2.86Å; L107-M109 VanDerWaalsContact C-N 3.34Å; L107-M109 PolarHBondContact O-N 2.9Å; M109-C113 HydrophobicContact CG-CB 4.44Å; M109-C113 WeakPolarHBondContact O-CA 3.37Å; M109-C113 WeakPolarHBondContact O-CB 3.43Å; M109-C113 PolarHBondContact O-N 2.93Å; M109-V114 PolarHBondContact O-N 2.85Å; M109-T144 HydrophobicContact CB-CG2 4.4Å; M109-T144 WeakPolarHBondContact CE-OG1 3.42Å; M109-V145 HydrophobicContact CE-CG2 3.9Å; M109-W292 HydrophobicContact CE-CH2 3.95Å; M109-W292 HydrophobicContact CE-CZ2 3.77Å; M109-W292 HydrophobicContact SD-CH2 4.35Å; M109-W292 HydrophobicContact SD-CZ2 4.05Å; M109-M328 HydrophobicContact CG-SD 4.3Å; M109-M328 HydrophobicContact SD-CE 4.18Å; M109-M328 HydrophobicContact SD-SD 3.82Å
110C94Very high92.6Very high4 Ų423.9 Ų23.93%0.02715%0.146CC..Iπ-helixtrans-77.5-32.2-171.579.70000113.9V71 A74 D106 L107 P115V71-C110 WeakPolarHBondContact CG2-O 3.35Å; A74-C110 HydrophobicContact CB-CB 4.14Å; D106-C110 VanDerWaalsContact O-CB 3.32Å; D106-C110 WeakPolarHBondContact O-CB 3.36Å; D106-C110 PolarHBondContact O-N 3.26Å; D106-C110 PolarHBondContact O-SG 2.99Å; L107-C110 PolarHBondContact O-N 3.32Å; C110-P115 WeakPolarHBondContact O-CD 3.43Å
111L93.1Very high92.2Very high98 Ų9824.1 Ų24.151%0.51315%0.147SC..Iπ-helixtrans-86.7-25.2-179.6-61.3179000112.7V71 L107V71-L111 HydrophobicContact CG1-CD2 4.28Å; L107-L111 HydrophobicContact CB-CD1 4.49Å; L107-L111 HydrophobicContact CD2-CD1 4.2Å; L107-L111 VanDerWaalsContact O-CB 3.25Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 VanDerWaalsContact O-CG 3.32Å; L107-L111 WeakPolarHBondContact O-CG 3.33Å; L107-L111 PolarHBondContact O-N 2.8Å
112S91.4Very high91.7Very high48 Ų4823.7 Ų23.734%0.33614%0.144SC..Iπ-helixtrans-110.7-60.1-175.3-41.90000111.8L108 L116L108-S112 WeakPolarHBondContact O-CB 3.45Å; L108-S112 PolarHBondContact O-N 3.03Å; L108-S112 VanDerWaalsContact O-N 3.16Å; L108-S112 PolarHBondContact O-OG 3.22Å; S112-L116 VanDerWaalsContact O-CD1 3.31Å; S112-L116 WeakPolarHBondContact O-CD1 3.23Å; S112-L116 WeakPolarHBondContact O-CG 3.49Å
113C90.9Very high91.3Very high0 Ų025.6 Ų25.60%015%0.154CC..Iπ-helixtrans-70.8-47.2-172.1-54.50000111.9M109 L116 T117 V137 Q141M109-C113 HydrophobicContact CG-CB 4.44Å; M109-C113 WeakPolarHBondContact O-CA 3.37Å; M109-C113 WeakPolarHBondContact O-CB 3.43Å; M109-C113 PolarHBondContact O-N 2.93Å; C113-L116 PolarHBondContact O-N 2.99Å; C113-T117 WeakPolarHBondContact O-CB 3.15Å; C113-T117 PolarHBondContact O-N 3.29Å; C113-T117 PolarHBondContact O-OG1 2.87Å; C113-V137 HydrophobicContact CB-CG1 4.36Å; C113-Q141 HydrophobicContact CB-CB 4.5Å
114V90.1Very high90.5Very high3 Ų328.8 Ų28.82%0.01818%0.176CC..Hα-helixtrans-58.5-50.8-175.2174.70000113Y67 V71 M109 L116 T117 V118 M328Y67-V114 HydrophobicContact CD1-CG1 3.77Å; Y67-V114 HydrophobicContact CE1-CG1 4.39Å; V71-V114 HydrophobicContact CG2-CB 4.24Å; V71-V114 HydrophobicContact CG2-CG1 3.76Å; M109-V114 PolarHBondContact O-N 2.85Å; V114-L116 VanDerWaalsContact C-N 3.32Å; V114-L116 PolarHBondContact O-N 3.35Å; V114-T117 PolarHBondContact O-N 3.17Å; V114-V118 HydrophobicContact CG1-CG2 4.14Å; V114-V118 WeakPolarHBondContact O-CB 3.39Å; V114-V118 WeakPolarHBondContact O-CG2 3.29Å; V114-V118 PolarHBondContact O-N 2.86Å; V114-M328 HydrophobicContact CG2-CB 4.32Å; V114-M328 HydrophobicContact CG2-CG 3.79Å; V114-M328 HydrophobicContact CG2-SD 3.43Å; V114-M328 WeakPolarHBondContact CG2-SD 3.38Å
115P91.7Very high89.8Confident57 Ų5731.2 Ų31.237%0.3718%0.181SC..Hα-helixtrans-62.2-38.8179.9-24.236.1000112.8C110 V118 S119C110-P115 WeakPolarHBondContact O-CD 3.43Å; P115-V118 PolarHBondContact O-N 3.41Å; P115-S119 WeakPolarHBondContact O-CB 3.34Å; P115-S119 PolarHBondContact O-N 3.24Å
116L91.4Very high89.3Confident32 Ų3231.2 Ų31.217%0.16818%0.181CC..Hα-helixtrans-67.3-45.1179.2-64.6174.2000111.4S112 C113 V114 S119 Y120 F129 V137S112-L116 VanDerWaalsContact O-CD1 3.31Å; S112-L116 WeakPolarHBondContact O-CD1 3.23Å; S112-L116 WeakPolarHBondContact O-CG 3.49Å; C113-L116 PolarHBondContact O-N 2.99Å; V114-L116 VanDerWaalsContact C-N 3.32Å; V114-L116 PolarHBondContact O-N 3.35Å; L116-S119 PolarHBondContact O-N 3.46Å; L116-Y120 WeakPolarHBondContact O-CB 3.36Å; L116-Y120 PolarHBondContact O-N 2.98Å; L116-F129 HydrophobicContact CB-CE2 4.38Å; L116-F129 HydrophobicContact CD2-CD1 3.61Å; L116-F129 HydrophobicContact CD2-CD2 3.84Å; L116-F129 HydrophobicContact CD2-CE1 3.48Å; L116-F129 VanDerWaalsContact CD2-CE1 3.48Å; L116-F129 HydrophobicContact CD2-CE2 3.72Å; L116-F129 HydrophobicContact CD2-CG 3.78Å; L116-F129 HydrophobicContact CD2-CZ 3.54Å; L116-V137 HydrophobicContact CB-CG2 4.21Å; L116-V137 HydrophobicContact CD1-CG2 3.43Å; L116-V137 VanDerWaalsContact CD1-CG2 3.43Å; L116-V137 HydrophobicContact CG-CG2 4.46Å
117T88.7Confident88.9Confident28 Ų2831.5 Ų31.517%0.17218%0.182CC..Hα-helixtrans-64.6-40.3176.3-55.50000111.9C113 V114 Y120 A121C113-T117 WeakPolarHBondContact O-CB 3.15Å; C113-T117 PolarHBondContact O-N 3.29Å; C113-T117 PolarHBondContact O-OG1 2.87Å; V114-T117 PolarHBondContact O-N 3.17Å; T117-Y120 PolarHBondContact O-N 2.95Å; T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.26Å
118V89.4Confident88.6Confident12 Ų1233.9 Ų33.97%0.07320%0.204CC..Hα-helixtrans-66.9-42.2177.2171.10000110.9L64 Y67 V114 P115 A121 F122L64-V118 HydrophobicContact CD1-CG1 3.96Å; Y67-V118 HydrophobicContact CD1-CG2 3.43Å; Y67-V118 VanDerWaalsContact CD1-CG2 3.43Å; Y67-V118 HydrophobicContact CD2-CG1 4.41Å; Y67-V118 HydrophobicContact CD2-CG2 3.72Å; Y67-V118 HydrophobicContact CE1-CG2 3.76Å; Y67-V118 HydrophobicContact CE2-CG2 4.05Å; Y67-V118 HydrophobicContact CG-CG1 4.49Å; Y67-V118 HydrophobicContact CG-CG2 3.41Å; Y67-V118 VanDerWaalsContact CG-CG2 3.41Å; V114-V118 HydrophobicContact CG1-CG2 4.14Å; V114-V118 WeakPolarHBondContact O-CB 3.39Å; V114-V118 WeakPolarHBondContact O-CG2 3.29Å; V114-V118 PolarHBondContact O-N 2.86Å; P115-V118 PolarHBondContact O-N 3.41Å; V118-A121 PolarHBondContact O-N 2.82Å; V118-F122 HydrophobicContact CG1-CD2 3.79Å; V118-F122 HydrophobicContact CG1-CE2 4.07Å; V118-F122 VanDerWaalsContact O-CD2 3.31Å; V118-F122 WeakPolarHBondContact O-CD2 3.46Å; V118-F122 PolarHBondContact O-N 2.97Å; V118-F122 VanDerWaalsContact O-N 3.15Å
119S89.9Confident88.3Confident47 Ų4734.4 Ų34.433%0.32921%0.205SC..Hα-helixtrans-59.7-48.3175-169.80000110.6P115 L116 A121 F122 D123 F129P115-S119 WeakPolarHBondContact O-CB 3.34Å; P115-S119 PolarHBondContact O-N 3.24Å; L116-S119 PolarHBondContact O-N 3.46Å; S119-A121 VanDerWaalsContact C-N 3.31Å; S119-A121 PolarHBondContact O-N 3.33Å; S119-F122 PolarHBondContact O-N 2.97Å; S119-D123 VanDerWaalsContact O-CB 3.23Å; S119-D123 WeakPolarHBondContact O-CB 3.43Å; S119-D123 PolarHBondContact O-N 3.5Å; S119-F129 WeakPolarHBondContact OG-CZ 3.47Å
120Y86.4Confident88.2Confident18 Ų1835.4 Ų35.47%0.07122%0.216CC..Hα-helixtrans-58.7-40.5176.1176.3-128.4000112.8F1 L116 T117 F122 W127 C213 E214F1-Y120 AromaticContact CD1-CD1 3.98Å; F1-Y120 HydrophobicContact CD1-CD1 3.98Å; F1-Y120 AromaticContact CD1-CE1 3.54Å; F1-Y120 HydrophobicContact CD1-CE1 3.54Å; F1-Y120 HydrophobicContact CD1-CE2 4.22Å; F1-Y120 HydrophobicContact CD1-CG 4.5Å; F1-Y120 AromaticContact CD1-CZ 3.67Å; F1-Y120 HydrophobicContact CE1-CD1 4.07Å; F1-Y120 AromaticContact CE1-CD2 3.88Å; F1-Y120 HydrophobicContact CE1-CD2 3.88Å; F1-Y120 AromaticContact CE1-CE1 3.71Å; F1-Y120 HydrophobicContact CE1-CE1 3.71Å; F1-Y120 AromaticContact CE1-CE2 3.5Å; F1-Y120 HydrophobicContact CE1-CE2 3.5Å; F1-Y120 HydrophobicContact CE1-CG 4.16Å; F1-Y120 AromaticContact CE1-CZ 3.41Å; F1-Y120 VanDerWaalsContact CE1-CZ 3.41Å; F1-Y120 WeakPolarHBondContact CE1-O 3.33Å; F1-Y120 HydrophobicContact CZ-CE2 4.49Å; F1-Y120 WeakPolarHBondContact CZ-O 3.38Å; L116-Y120 WeakPolarHBondContact O-CB 3.36Å; L116-Y120 PolarHBondContact O-N 2.98Å; T117-Y120 PolarHBondContact O-N 2.95Å; Y120-F122 PolarHBondContact O-N 3.2Å; Y120-W127 HydrophobicContact CD1-CE3 4.24Å; Y120-W127 HydrophobicContact CD2-CB 3.79Å; Y120-W127 AromaticContact CD2-CE3 3.8Å; Y120-W127 HydrophobicContact CD2-CE3 3.8Å; Y120-W127 HydrophobicContact CE2-CB 3.73Å; Y120-W127 HydrophobicContact CE2-CE3 4.38Å; Y120-W127 AromaticContact CG-CE3 3.71Å; Y120-W127 HydrophobicContact CG-CE3 3.71Å; Y120-W127 HydrophobicContact CG-CZ3 4.3Å; Y120-C213 PolarHBondContact OH-N 3.35Å; Y120-C213 PolarHBondContact OH-O 2.96Å; Y120-E214 WeakPolarHBondContact CE1-OE1 3.32Å; Y120-E214 PolarHBondContact OH-OE1 3.27Å
121A84.3Confident88Confident13 Ų1340.5 Ų40.511%0.10724%0.239CC..Hα-helixtrans-71.1-25.2-17800000114.5T117 V118 S119T117-A121 WeakPolarHBondContact O-CB 3.49Å; T117-A121 PolarHBondContact O-N 3.26Å; V118-A121 PolarHBondContact O-N 2.82Å; S119-A121 VanDerWaalsContact C-N 3.31Å; S119-A121 PolarHBondContact O-N 3.33Å
122F85.4Confident88Confident9 Ų940.8 Ų40.84%0.03925%0.247CC..Hα-helixtrans-115.33.1-175.2-69.9-66.7000114.5L56 K60 F63 V118 S119 Y120 V321L56-F122 HydrophobicContact CD1-CE1 3.99Å; L56-F122 HydrophobicContact CD1-CZ 4.37Å; L56-F122 HydrophobicContact CG-CD1 4.48Å; L56-F122 HydrophobicContact CG-CE1 3.99Å; K60-F122 HydrophobicContact CB-CD1 3.83Å; K60-F122 HydrophobicContact CB-CE1 3.95Å; K60-F122 HydrophobicContact CD-CB 4.11Å; K60-F122 HydrophobicContact CD-CD1 4.08Å; K60-F122 HydrophobicContact CD-CG 4.31Å; K60-F122 HydrophobicContact CG-CB 4.41Å; K60-F122 HydrophobicContact CG-CD1 3.74Å; K60-F122 HydrophobicContact CG-CE1 4.21Å; K60-F122 HydrophobicContact CG-CG 4.09Å; K60-F122 PolarHBondContact NZ-O 2.75Å; F63-F122 HydrophobicContact CB-CE1 4.5Å; F63-F122 HydrophobicContact CB-CE2 4.13Å; F63-F122 HydrophobicContact CB-CZ 3.55Å; F63-F122 HydrophobicContact CD2-CZ 4.16Å; F63-F122 HydrophobicContact CG-CZ 4.18Å; V118-F122 HydrophobicContact CG1-CD2 3.79Å; V118-F122 HydrophobicContact CG1-CE2 4.07Å; V118-F122 VanDerWaalsContact O-CD2 3.31Å; V118-F122 WeakPolarHBondContact O-CD2 3.46Å; V118-F122 PolarHBondContact O-N 2.97Å; V118-F122 VanDerWaalsContact O-N 3.15Å; S119-F122 PolarHBondContact O-N 2.97Å; Y120-F122 PolarHBondContact O-N 3.2Å; F122-V321 HydrophobicContact CZ-CG1 4.24Å
123D85.1Confident87.9Confident43 Ų4341.4 Ų41.423%0.2325%0.246CC..  trans-88.8130170.9-163.8-23.7000109.6S119 H125 G126S119-D123 VanDerWaalsContact O-CB 3.23Å; S119-D123 WeakPolarHBondContact O-CB 3.43Å; S119-D123 PolarHBondContact O-N 3.5Å; D123-H125 VanDerWaalsContact C-N 3.27Å; D123-H125 IonicContact OD1-CD2 3.43Å; D123-H125 PolarHBondContact OD1-CD2 3.28Å; D123-H125 IonicContact OD1-CG 3.85Å; D123-H125 PolarHBondContact OD1-N 3.36Å; D123-G126 PolarHBondContact O-N 3.43Å
124S78.6Confident87.9Confident67 Ų6741.4 Ų41.447%0.46925%0.246SC..THydrogen-bonded Turntrans-69.6-26.417642.40000112.6G126S124-G126 VanDerWaalsContact C-N 3.32Å
125H81.5Confident87.9Confident90 Ų9043.9 Ų43.942%0.41726%0.257SS..THydrogen-bonded Turntrans-88.3-1.8-179.7-54.3-73.5000112.6D123 D209 L210 V211D123-H125 VanDerWaalsContact C-N 3.27Å; D123-H125 IonicContact OD1-CD2 3.43Å; D123-H125 PolarHBondContact OD1-CD2 3.28Å; D123-H125 IonicContact OD1-CG 3.85Å; D123-H125 PolarHBondContact OD1-N 3.36Å; H125-D209 IonicContact CE1-OD2 3.03Å; H125-D209 PolarHBondContact CE1-OD2 3.39Å; H125-D209 IonicContact ND1-OD1 3.91Å; H125-D209 IonicContact ND1-OD2 2.81Å; H125-D209 PolarHBondContact ND1-OD2 2.86Å; H125-L210 WeakPolarHBondContact O-CA 3.45Å; H125-V211 PolarHBondContact O-N 2.86Å
126G83.8Confident87.9Confident2 Ų244.8 Ų44.82%0.02126%0.259CS..BIsolated β-bridgetrans77.8-131.1178.300000113.3D123 S124 A128 V211D123-G126 PolarHBondContact O-N 3.43Å; S124-G126 VanDerWaalsContact C-N 3.32Å; G126-A128 PolarHBondContact O-N 2.92Å; G126-V211 WeakPolarHBondContact CA-O 2.92Å
127W88.1Confident87.8Confident9 Ų943.5 Ų43.53%0.03425%0.252CS..  trans-82105.8-168.8-176.2-92.8000113.1Y120 F129 G130 L133 C134 V137 Y200 V211 C213Y120-W127 HydrophobicContact CD1-CE3 4.24Å; Y120-W127 HydrophobicContact CD2-CB 3.79Å; Y120-W127 AromaticContact CD2-CE3 3.8Å; Y120-W127 HydrophobicContact CD2-CE3 3.8Å; Y120-W127 HydrophobicContact CE2-CB 3.73Å; Y120-W127 HydrophobicContact CE2-CE3 4.38Å; Y120-W127 AromaticContact CG-CE3 3.71Å; Y120-W127 HydrophobicContact CG-CE3 3.71Å; Y120-W127 HydrophobicContact CG-CZ3 4.3Å; W127-F129 HydrophobicContact CD2-CD2 4.26Å; W127-F129 HydrophobicContact CE3-CD2 4.28Å; W127-F129 HydrophobicContact CH2-CB 4.47Å; W127-F129 AromaticContact CH2-CD2 3.96Å; W127-F129 HydrophobicContact CH2-CD2 3.96Å; W127-F129 HydrophobicContact CZ2-CB 3.69Å; W127-F129 AromaticContact CZ2-CD2 3.93Å; W127-F129 HydrophobicContact CZ2-CD2 3.93Å; W127-F129 HydrophobicContact CZ2-CG 4.28Å; W127-F129 HydrophobicContact CZ3-CD2 4.13Å; W127-G130 PolarHBondContact NE1-O 3.24Å; W127-L133 HydrophobicContact CZ2-CB 3.69Å; W127-L133 WeakPolarHBondContact CZ2-O 3.46Å; W127-C134 HydrophobicContact CZ2-CB 4.31Å; W127-C134 VanDerWaalsContact CZ2-N 3.35Å; W127-V137 HydrophobicContact CH2-CB 4.12Å; W127-V137 HydrophobicContact CH2-CG2 3.98Å; W127-Y200 AromaticContact CD1-CE2 3.93Å; W127-V211 HydrophobicContact CB-CB 4.42Å; W127-V211 HydrophobicContact CB-CG1 4.07Å; W127-V211 PolarHBondContact N-O 3.32Å; W127-V211 WeakPolarHBondContact O-CB 3.13Å; W127-V211 WeakPolarHBondContact O-CG1 3.4Å; W127-C213 HydrophobicContact CB-CB 3.78Å; W127-C213 HydrophobicContact CD2-CB 3.81Å; W127-C213 HydrophobicContact CE3-CB 4.09Å; W127-C213 HydrophobicContact CG-CB 3.65Å
128A89.1Confident87.7Confident71 Ų7143.9 Ų43.959%0.58726%0.255SS*.  trans-90-10.3-176.300000115.6G126 G130G126-A128 PolarHBondContact O-N 2.92Å; A128-G130 PolarHBondContact O-N 3.23Å
129F90Very high87.8Confident68 Ų6845 Ų4530%0.29826%0.261SS..SBendtrans-95.49.8-165.4-52.8-75.5000115L116 S119 W127 L133L116-F129 HydrophobicContact CB-CE2 4.38Å; L116-F129 HydrophobicContact CD2-CD1 3.61Å; L116-F129 HydrophobicContact CD2-CD2 3.84Å; L116-F129 HydrophobicContact CD2-CE1 3.48Å; L116-F129 VanDerWaalsContact CD2-CE1 3.48Å; L116-F129 HydrophobicContact CD2-CE2 3.72Å; L116-F129 HydrophobicContact CD2-CG 3.78Å; L116-F129 HydrophobicContact CD2-CZ 3.54Å; S119-F129 WeakPolarHBondContact OG-CZ 3.47Å; W127-F129 HydrophobicContact CD2-CD2 4.26Å; W127-F129 HydrophobicContact CE3-CD2 4.28Å; W127-F129 HydrophobicContact CH2-CB 4.47Å; W127-F129 AromaticContact CH2-CD2 3.96Å; W127-F129 HydrophobicContact CH2-CD2 3.96Å; W127-F129 HydrophobicContact CZ2-CB 3.69Å; W127-F129 AromaticContact CZ2-CD2 3.93Å; W127-F129 HydrophobicContact CZ2-CD2 3.93Å; W127-F129 HydrophobicContact CZ2-CG 4.28Å; W127-F129 HydrophobicContact CZ3-CD2 4.13Å; F129-L133 HydrophobicContact CB-CB 4.04Å; F129-L133 HydrophobicContact CB-CD1 3.74Å
130G89.6Confident87.9Confident25 Ų2544.4 Ų44.426%0.25825%0.253SS..Hα-helixtrans74.6172.8178.800000114.8W127 A128 C134W127-G130 PolarHBondContact NE1-O 3.24Å; A128-G130 PolarHBondContact O-N 3.23Å; G130-C134 PolarHBondContact O-N 2.92Å
131Q90.2Very high88Confident110 Ų11045.2 Ų45.251%0.51426%0.258SS..Hα-helixtrans-63.1-42.5-171.3-174.3177.8400115L133 C134 H135 Y200Q131-L133 PolarHBondContact O-N 2.9Å; Q131-C134 VanDerWaalsContact O-CB 3.29Å; Q131-C134 WeakPolarHBondContact O-CB 3.49Å; Q131-C134 PolarHBondContact O-N 3.38Å; Q131-C134 VanDerWaalsContact O-N 3.13Å; Q131-H135 PolarHBondContact O-CD2 3.21Å; Q131-H135 VanDerWaalsContact O-CD2 3.27Å; Q131-H135 PolarHBondContact O-N 2.98Å; Q131-Y200 HydrophobicContact CB-CD1 4.13Å; Q131-Y200 HydrophobicContact CB-CD2 4.24Å; Q131-Y200 HydrophobicContact CB-CG 3.97Å; Q131-Y200 HydrophobicContact CG-CD1 4.33Å; Q131-Y200 HydrophobicContact CG-CG 4.06Å
132P91.6Very high88.2Confident105 Ų10545.7 Ų45.768%0.68226%0.26SS*.Hα-helixtrans-61.6-42.7-177-24.434.8000113.1C134 H135 L136P132-C134 VanDerWaalsContact C-N 3.28Å; P132-C134 PolarHBondContact O-N 2.89Å; P132-H135 PolarHBondContact O-N 3.39Å; P132-L136 WeakPolarHBondContact O-CB 3.35Å; P132-L136 PolarHBondContact O-N 3.5Å
133L90.8Very high88.6Confident60 Ų6045.2 Ų45.231%0.31426%0.258SS..Hα-helixtrans-71.3-26.7178.8-70.5173.4000112W127 F129 Q131 H135 L136 V137W127-L133 HydrophobicContact CZ2-CB 3.69Å; W127-L133 WeakPolarHBondContact CZ2-O 3.46Å; F129-L133 HydrophobicContact CB-CB 4.04Å; F129-L133 HydrophobicContact CB-CD1 3.74Å; Q131-L133 PolarHBondContact O-N 2.9Å; L133-H135 VanDerWaalsContact C-N 3.29Å; L133-H135 PolarHBondContact O-N 3.42Å; L133-L136 HydrophobicContact CD2-CD2 4.16Å; L133-L136 PolarHBondContact O-N 3.35Å; L133-V137 WeakPolarHBondContact O-CB 3.33Å; L133-V137 WeakPolarHBondContact O-CG2 3.44Å; L133-V137 PolarHBondContact O-N 3.37Å
134C90Very high89Confident0 Ų043.2 Ų43.20%025%0.247CC..Hα-helixtrans-60.4-38.2174.8172.70000112W127 G130 Q131 P132 P138 Y200 C213W127-C134 HydrophobicContact CZ2-CB 4.31Å; W127-C134 VanDerWaalsContact CZ2-N 3.35Å; G130-C134 PolarHBondContact O-N 2.92Å; Q131-C134 VanDerWaalsContact O-CB 3.29Å; Q131-C134 WeakPolarHBondContact O-CB 3.49Å; Q131-C134 PolarHBondContact O-N 3.38Å; Q131-C134 VanDerWaalsContact O-N 3.13Å; P132-C134 VanDerWaalsContact C-N 3.28Å; P132-C134 PolarHBondContact O-N 2.89Å; C134-P138 WeakPolarHBondContact O-CD 3.21Å; C134-P138 VanDerWaalsContact O-CG 3.28Å; C134-P138 WeakPolarHBondContact O-CG 3.21Å; C134-Y200 HydrophobicContact CB-CD2 4.19Å; C134-C213 VanDerWaalsContact C-SG 3.57Å; C134-C213 WeakPolarHBondContact CA-SG 3.37Å; C134-C213 HydrophobicContact CB-CB 3.91Å; C134-C213 WeakPolarHBondContact CB-SG 3.31Å; C134-C213 PolarHBondContact O-SG 2.85Å; C134-C213 VanDerWaalsContact SG-CA 3.51Å; C134-C213 WeakPolarHBondContact SG-CB 3.28Å; C134-C213 CovalentContact SG-SG 2.02Å; C134-C213 PolarHBondContact SG-SG 3.39Å
135H90.1Very high89.5Confident55 Ų5540.3 Ų40.326%0.25523%0.227SC..Hα-helixtrans-84.2-35.9175.3-63.7-83.3000112.7Q131 P132 L133 L139 S195 T198Q131-H135 PolarHBondContact O-CD2 3.21Å; Q131-H135 VanDerWaalsContact O-CD2 3.27Å; Q131-H135 PolarHBondContact O-N 2.98Å; P132-H135 PolarHBondContact O-N 3.39Å; L133-H135 VanDerWaalsContact C-N 3.29Å; L133-H135 PolarHBondContact O-N 3.42Å; H135-L139 WeakPolarHBondContact O-CB 3.47Å; H135-L139 PolarHBondContact O-N 3.45Å; H135-S195 PolarHBondContact ND1-O 3.31Å; H135-S195 PolarHBondContact O-OG 3.43Å; H135-T198 PolarHBondContact CE1-O 3.45Å
136L91.1Very high90Very high76 Ų7636.2 Ų36.240%0.39821%0.208SC..Hα-helixtrans-72.7-40.3-173.6-175.763000112.9P132 L133 L139 L140P132-L136 WeakPolarHBondContact O-CB 3.35Å; P132-L136 PolarHBondContact O-N 3.5Å; L133-L136 HydrophobicContact CD2-CD2 4.16Å; L133-L136 PolarHBondContact O-N 3.35Å; L136-L139 WeakPolarHBondContact O-CB 3.47Å; L136-L139 PolarHBondContact O-N 2.84Å; L136-L140 HydrophobicContact CD1-CD1 3.92Å; L136-L140 HydrophobicContact CD1-CD2 4.31Å; L136-L140 HydrophobicContact CD1-CG 3.81Å; L136-L140 HydrophobicContact CD2-CD1 4.23Å; L136-L140 HydrophobicContact CG-CD1 3.75Å; L136-L140 HydrophobicContact CG-CG 4.04Å; L136-L140 WeakPolarHBondContact O-CB 3.49Å; L136-L140 VanDerWaalsContact O-CG 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.21Å; L136-L140 PolarHBondContact O-N 2.74Å
137V90.8Very high90.5Very high6 Ų636.2 Ų36.24%0.03621%0.208CC..Hα-helixtrans-65.1-50.6-176.1170.60000112.1C113 L116 W127 L133 L139 L140 Q141C113-V137 HydrophobicContact CB-CG1 4.36Å; L116-V137 HydrophobicContact CB-CG2 4.21Å; L116-V137 HydrophobicContact CD1-CG2 3.43Å; L116-V137 VanDerWaalsContact CD1-CG2 3.43Å; L116-V137 HydrophobicContact CG-CG2 4.46Å; W127-V137 HydrophobicContact CH2-CB 4.12Å; W127-V137 HydrophobicContact CH2-CG2 3.98Å; L133-V137 WeakPolarHBondContact O-CB 3.33Å; L133-V137 WeakPolarHBondContact O-CG2 3.44Å; L133-V137 PolarHBondContact O-N 3.37Å; V137-L139 VanDerWaalsContact C-N 3.3Å; V137-L139 PolarHBondContact O-N 3.06Å; V137-L140 PolarHBondContact O-N 3.13Å; V137-Q141 WeakPolarHBondContact O-CB 3.5Å; V137-Q141 PolarHBondContact O-N 2.84Å
138P86.8Confident90.7Very high35 Ų3536 Ų3623%0.22721%0.207CC..Hα-helixtrans-60.5-39.2174.8-23.635000112.5C134 Q141 C142C134-P138 WeakPolarHBondContact O-CD 3.21Å; C134-P138 VanDerWaalsContact O-CG 3.28Å; C134-P138 WeakPolarHBondContact O-CG 3.21Å; P138-Q141 PolarHBondContact O-N 3.06Å; P138-C142 WeakPolarHBondContact O-CB 3.36Å; P138-C142 PolarHBondContact O-N 3.3Å
139L90.4Very high90.9Very high36 Ų3632.6 Ų32.619%0.18818%0.18CC..Hα-helixtrans-60-52176-18065.5000111.4H135 L136 V137 Q141 C142 A143 L188 A191H135-L139 WeakPolarHBondContact O-CB 3.47Å; H135-L139 PolarHBondContact O-N 3.45Å; L136-L139 WeakPolarHBondContact O-CB 3.47Å; L136-L139 PolarHBondContact O-N 2.84Å; V137-L139 VanDerWaalsContact C-N 3.3Å; V137-L139 PolarHBondContact O-N 3.06Å; L139-Q141 VanDerWaalsContact C-N 3.34Å; L139-Q141 PolarHBondContact O-N 3.19Å; L139-C142 PolarHBondContact O-N 3.41Å; L139-A143 WeakPolarHBondContact O-CB 3.31Å; L139-A143 PolarHBondContact O-N 3.4Å; L139-L188 HydrophobicContact CD2-CD2 4.42Å; L139-L188 HydrophobicContact CG-CD2 4.31Å; L139-A191 HydrophobicContact CD1-CB 3.92Å; L139-A191 WeakPolarHBondContact CD1-O 3.41Å
140L91.8Very high91Very high34 Ų3430.8 Ų30.818%0.17817%0.173CC..Hα-helixtrans-65.4-38.4-179.7-72.3-179.7000111.6L108 L136 V137 A143 T144L108-L140 HydrophobicContact CD2-CD2 4.37Å; L136-L140 HydrophobicContact CD1-CD1 3.92Å; L136-L140 HydrophobicContact CD1-CD2 4.31Å; L136-L140 HydrophobicContact CD1-CG 3.81Å; L136-L140 HydrophobicContact CD2-CD1 4.23Å; L136-L140 HydrophobicContact CG-CD1 3.75Å; L136-L140 HydrophobicContact CG-CG 4.04Å; L136-L140 WeakPolarHBondContact O-CB 3.49Å; L136-L140 VanDerWaalsContact O-CG 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.21Å; L136-L140 PolarHBondContact O-N 2.74Å; V137-L140 PolarHBondContact O-N 3.13Å; L140-A143 PolarHBondContact O-N 3.07Å; L140-T144 WeakPolarHBondContact O-CB 3.26Å; L140-T144 VanDerWaalsContact O-CG2 3.24Å; L140-T144 WeakPolarHBondContact O-CG2 3.43Å; L140-T144 PolarHBondContact O-N 2.82Å; L140-T144 PolarHBondContact O-OG1 3.46Å
141Q89.9Confident91.2Very high35 Ų3529.7 Ų29.716%0.16416%0.161CC..Hα-helixtrans-62.2-46.1176.7-170.6170.721.300111.3C113 V137 P138 L139 T144 V145 H324C113-Q141 HydrophobicContact CB-CB 4.5Å; V137-Q141 WeakPolarHBondContact O-CB 3.5Å; V137-Q141 PolarHBondContact O-N 2.84Å; P138-Q141 PolarHBondContact O-N 3.06Å; L139-Q141 VanDerWaalsContact C-N 3.34Å; L139-Q141 PolarHBondContact O-N 3.19Å; Q141-T144 PolarHBondContact O-OG1 2.82Å; Q141-V145 VanDerWaalsContact O-CG2 3.31Å; Q141-V145 WeakPolarHBondContact O-CG2 3.3Å; Q141-V145 PolarHBondContact O-N 3Å; Q141-H324 PolarHBondContact NE2-NE2 3.5Å
142C88.9Confident91.2Very high23 Ų2324.5 Ų24.516%0.15514%0.137CC..Hα-helixtrans-69.9-41.5177-1690000112P138 L139 T144 V145 F146 A191P138-C142 WeakPolarHBondContact O-CB 3.36Å; P138-C142 PolarHBondContact O-N 3.3Å; L139-C142 PolarHBondContact O-N 3.41Å; C142-T144 PolarHBondContact O-N 3.25Å; C142-V145 WeakPolarHBondContact O-CB 3.35Å; C142-V145 PolarHBondContact O-N 3.19Å; C142-F146 VanDerWaalsContact O-CD2 3.31Å; C142-F146 WeakPolarHBondContact O-CD2 3.26Å; C142-F146 PolarHBondContact O-N 3.39Å; C142-F146 VanDerWaalsContact O-N 3.16Å; C142-F146 VanDerWaalsContact SG-CE2 3.51Å; C142-A191 HydrophobicContact CB-CB 3.72Å
143A93Very high91.2Very high0 Ų020.7 Ų20.70%011%0.112CC..Hα-helixtrans-64.4-39.6179.200000112.3L139 L140 V145 F146 A147 S187 L188 A191L139-A143 WeakPolarHBondContact O-CB 3.31Å; L139-A143 PolarHBondContact O-N 3.4Å; L140-A143 PolarHBondContact O-N 3.07Å; A143-V145 VanDerWaalsContact C-N 3.31Å; A143-V145 PolarHBondContact O-N 2.88Å; A143-F146 PolarHBondContact O-N 2.95Å; A143-A147 VanDerWaalsContact O-CB 3.26Å; A143-A147 WeakPolarHBondContact O-CB 3.43Å; A143-A147 PolarHBondContact O-N 3Å; A143-S187 VanDerWaalsContact O-CB 3.31Å; A143-S187 WeakPolarHBondContact O-CB 3.24Å; A143-L188 HydrophobicContact CB-CD2 3.85Å; A143-L188 HydrophobicContact CB-CG 4.36Å; A143-A191 HydrophobicContact CB-CB 3.88Å
144T92.6Very high91.2Very high0 Ų018.5 Ų18.50%010%0.103CC..Hα-helixtrans-67.4-31.3177.946.50000112.5L108 M109 L140 Q141 C142 S148 W184L108-T144 HydrophobicContact CD2-CG2 3.98Å; L108-T144 HydrophobicContact CG-CG2 4.35Å; M109-T144 HydrophobicContact CB-CG2 4.4Å; M109-T144 WeakPolarHBondContact CE-OG1 3.42Å; L140-T144 WeakPolarHBondContact O-CB 3.26Å; L140-T144 VanDerWaalsContact O-CG2 3.24Å; L140-T144 WeakPolarHBondContact O-CG2 3.43Å; L140-T144 PolarHBondContact O-N 2.82Å; L140-T144 PolarHBondContact O-OG1 3.46Å; Q141-T144 PolarHBondContact O-OG1 2.82Å; C142-T144 PolarHBondContact O-N 3.25Å; T144-S148 WeakPolarHBondContact O-CB 3.16Å; T144-S148 PolarHBondContact O-N 3.07Å; T144-S148 PolarHBondContact O-OG 3.4Å; T144-W184 HydrophobicContact CG2-CH2 4.07Å; T144-W184 HydrophobicContact CG2-CZ3 4.24Å
145V89.8Confident91.3Very high7 Ų718.7 Ų18.74%0.04210%0.103CC..Hα-helixtrans-62.7-53170.5172.80000110.8M109 Q141 C142 A143 A147 S148 V149 F288 W292M109-V145 HydrophobicContact CE-CG2 3.9Å; Q141-V145 VanDerWaalsContact O-CG2 3.31Å; Q141-V145 WeakPolarHBondContact O-CG2 3.3Å; Q141-V145 PolarHBondContact O-N 3Å; C142-V145 WeakPolarHBondContact O-CB 3.35Å; C142-V145 PolarHBondContact O-N 3.19Å; A143-V145 VanDerWaalsContact C-N 3.31Å; A143-V145 PolarHBondContact O-N 2.88Å; V145-A147 VanDerWaalsContact C-N 3.32Å; V145-A147 PolarHBondContact O-N 2.91Å; V145-S148 WeakPolarHBondContact O-CB 3.36Å; V145-S148 PolarHBondContact O-N 2.97Å; V145-S148 VanDerWaalsContact O-N 3.15Å; V145-V149 WeakPolarHBondContact O-CG2 3.34Å; V145-V149 PolarHBondContact O-N 2.98Å; V145-F288 HydrophobicContact CG1-CZ 4Å; V145-W292 HydrophobicContact CG2-CD2 4.33Å; V145-W292 HydrophobicContact CG2-CE3 3.97Å; V145-W292 HydrophobicContact CG2-CH2 3.05Å; V145-W292 HydrophobicContact CG2-CZ2 3.47Å; V145-W292 VanDerWaalsContact CG2-CZ2 3.47Å; V145-W292 HydrophobicContact CG2-CZ3 3.33Å
146F91.8Very high91.1Very high3 Ų316 Ų161%0.0139%0.091CC..Hα-helixtrans-62.2-40.6177.7-74.8-60.7000112.1C142 A143 S148 V149 L150 L190 A191 I231 T234C142-F146 VanDerWaalsContact O-CD2 3.31Å; C142-F146 WeakPolarHBondContact O-CD2 3.26Å; C142-F146 PolarHBondContact O-N 3.39Å; C142-F146 VanDerWaalsContact O-N 3.16Å; C142-F146 VanDerWaalsContact SG-CE2 3.51Å; A143-F146 PolarHBondContact O-N 2.95Å; F146-S148 PolarHBondContact O-N 2.77Å; F146-V149 PolarHBondContact O-N 3.47Å; F146-L150 WeakPolarHBondContact O-CB 3.34Å; F146-L150 VanDerWaalsContact O-CG 3.28Å; F146-L150 WeakPolarHBondContact O-CG 3.4Å; F146-L150 PolarHBondContact O-N 2.89Å; F146-L190 HydrophobicContact CD1-CB 4.42Å; F146-L190 HydrophobicContact CD1-CD1 3.99Å; F146-L190 HydrophobicContact CD2-CB 3.81Å; F146-L190 HydrophobicContact CE1-CB 4.27Å; F146-L190 HydrophobicContact CE1-CD1 4.11Å; F146-L190 HydrophobicContact CE2-CB 3.61Å; F146-L190 HydrophobicContact CG-CB 4.19Å; F146-L190 HydrophobicContact CG-CD1 4.3Å; F146-L190 HydrophobicContact CZ-CB 3.84Å; F146-L190 HydrophobicContact CZ-CD1 4.49Å; F146-A191 HydrophobicContact CD2-CB 4.34Å; F146-I231 HydrophobicContact CZ-CD1 4.36Å; F146-I231 HydrophobicContact CZ-CG1 3.86Å; F146-T234 HydrophobicContact CE1-CG2 4.24Å
147A94.6Very high91Very high3 Ų315.5 Ų15.53%0.0259%0.091CC..Hα-helixtrans-61.6-36.1177.600000111A143 V145 S151 V183 W184 S187A143-A147 VanDerWaalsContact O-CB 3.26Å; A143-A147 WeakPolarHBondContact O-CB 3.43Å; A143-A147 PolarHBondContact O-N 3Å; V145-A147 VanDerWaalsContact C-N 3.32Å; V145-A147 PolarHBondContact O-N 2.91Å; A147-S151 WeakPolarHBondContact O-CB 3.44Å; A147-S151 PolarHBondContact O-N 3.16Å; A147-S151 PolarHBondContact O-OG 2.72Å; A147-V183 HydrophobicContact CB-CG1 4.09Å; A147-W184 HydrophobicContact CB-CD2 4.43Å; A147-W184 HydrophobicContact CB-CE3 4.35Å; A147-W184 HydrophobicContact CB-CH2 4.38Å; A147-W184 HydrophobicContact CB-CZ2 4.44Å; A147-W184 HydrophobicContact CB-CZ3 4.33Å; A147-S187 WeakPolarHBondContact CA-OG 3.33Å; A147-S187 PolarHBondContact N-OG 3.16Å
148S93.1Very high90.8Very high3 Ų315.8 Ų15.82%0.0219%0.092CC..Hα-helixtrans-67.2-49.2175.6-60.60000112.2T144 V145 F146 L150 S151 L152T144-S148 WeakPolarHBondContact O-CB 3.16Å; T144-S148 PolarHBondContact O-N 3.07Å; T144-S148 PolarHBondContact O-OG 3.4Å; V145-S148 WeakPolarHBondContact O-CB 3.36Å; V145-S148 PolarHBondContact O-N 2.97Å; V145-S148 VanDerWaalsContact O-N 3.15Å; F146-S148 PolarHBondContact O-N 2.77Å; S148-L150 PolarHBondContact O-N 3.44Å; S148-S151 PolarHBondContact O-N 3.26Å; S148-L152 WeakPolarHBondContact O-CB 3.31Å; S148-L152 WeakPolarHBondContact O-CG 3.39Å; S148-L152 PolarHBondContact O-N 2.87Å
149V91.9Very high90.6Very high1 Ų116 Ų161%0.0069%0.088CC..Hα-helixtrans-56.5-49.3176.21690000111V145 F146 L152 T153 P239 F288V145-V149 WeakPolarHBondContact O-CG2 3.34Å; V145-V149 PolarHBondContact O-N 2.98Å; F146-V149 PolarHBondContact O-N 3.47Å; V149-L152 PolarHBondContact O-N 2.85Å; V149-T153 WeakPolarHBondContact O-CB 3.24Å; V149-T153 PolarHBondContact O-N 2.66Å; V149-T153 PolarHBondContact O-OG1 3.37Å; V149-P239 HydrophobicContact CB-CG 4.21Å; V149-P239 HydrophobicContact CG1-CG 3.41Å; V149-P239 VanDerWaalsContact CG1-CG 3.41Å; V149-P239 HydrophobicContact CG2-CG 4.37Å; V149-F288 HydrophobicContact CG2-CD1 4.41Å; V149-F288 HydrophobicContact CG2-CE1 3.47Å; V149-F288 VanDerWaalsContact CG2-CE1 3.47Å; V149-F288 HydrophobicContact CG2-CZ 3.84Å
150L93.3Very high90.3Very high30 Ų3018 Ų1816%0.1579%0.094CC..Hα-helixtrans-69.1-35.4-179.6-67.4174000111.9F146 S148 T153 A154 V183 L186F146-L150 WeakPolarHBondContact O-CB 3.34Å; F146-L150 VanDerWaalsContact O-CG 3.28Å; F146-L150 WeakPolarHBondContact O-CG 3.4Å; F146-L150 PolarHBondContact O-N 2.89Å; S148-L150 PolarHBondContact O-N 3.44Å; L150-T153 WeakPolarHBondContact O-CB 3.22Å; L150-T153 PolarHBondContact O-N 2.88Å; L150-A154 WeakPolarHBondContact O-CB 3.21Å; L150-A154 PolarHBondContact O-N 3.44Å; L150-V183 HydrophobicContact CB-CB 4.4Å; L150-V183 HydrophobicContact CB-CG1 3.81Å; L150-V183 HydrophobicContact CB-CG2 3.96Å; L150-V183 HydrophobicContact CD1-CG1 4.3Å; L150-L186 HydrophobicContact CD1-CB 4.22Å; L150-L186 HydrophobicContact CD1-CD2 3.85Å; L150-L186 HydrophobicContact CD1-CG 4.07Å; L150-L186 HydrophobicContact CD2-CD2 4.26Å
151S93.6Very high89.9Confident1 Ų118.8 Ų18.81%0.00710%0.098CC..Hα-helixtrans-67.8-44174.7-62.30000112N101 A147 S148 T153 A154 I155N101-S151 PolarHBondContact ND2-OG 3.5Å; A147-S151 WeakPolarHBondContact O-CB 3.44Å; A147-S151 PolarHBondContact O-N 3.16Å; A147-S151 PolarHBondContact O-OG 2.72Å; S148-S151 PolarHBondContact O-N 3.26Å; S151-T153 PolarHBondContact O-N 3.22Å; S151-A154 WeakPolarHBondContact O-CB 3.35Å; S151-A154 PolarHBondContact O-N 3.47Å; S151-A154 VanDerWaalsContact O-N 3.16Å; S151-I155 VanDerWaalsContact O-CG1 3.24Å; S151-I155 WeakPolarHBondContact O-CG1 3.27Å; S151-I155 PolarHBondContact O-N 3.02Å
152L90.3Very high89.4Confident2 Ų218.9 Ų18.91%0.0110%0.101CC..Hα-helixtrans-59.4-39.6173.8-73.7167.5000111.3L102 S148 V149 I155 A156 V285 F288L102-L152 HydrophobicContact CD1-CD2 3.93Å; L102-L152 HydrophobicContact CD1-CG 4.23Å; L102-L152 HydrophobicContact CD2-CG 4.31Å; S148-L152 WeakPolarHBondContact O-CB 3.31Å; S148-L152 WeakPolarHBondContact O-CG 3.39Å; S148-L152 PolarHBondContact O-N 2.87Å; V149-L152 PolarHBondContact O-N 2.85Å; L152-I155 PolarHBondContact O-N 3.18Å; L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.29Å; L152-V285 HydrophobicContact CB-CG2 4.05Å; L152-V285 HydrophobicContact CD1-CG2 4.13Å; L152-V285 HydrophobicContact CD2-CG2 4.11Å; L152-V285 HydrophobicContact CG-CG2 4.32Å; L152-F288 HydrophobicContact CD1-CB 4.29Å; L152-F288 HydrophobicContact CD1-CG 4.32Å
153T91.3Very high88.8Confident24 Ų2418.1 Ų18.115%0.14710%0.096CC..Hα-helixtrans-64.2-45.2174.5-58.80000111.3V149 L150 S151 I155 A156 V157 I238 S242V149-T153 WeakPolarHBondContact O-CB 3.24Å; V149-T153 PolarHBondContact O-N 2.66Å; V149-T153 PolarHBondContact O-OG1 3.37Å; L150-T153 WeakPolarHBondContact O-CB 3.22Å; L150-T153 PolarHBondContact O-N 2.88Å; S151-T153 PolarHBondContact O-N 3.22Å; T153-I155 VanDerWaalsContact C-N 3.32Å; T153-I155 PolarHBondContact O-N 2.84Å; T153-A156 WeakPolarHBondContact O-CB 3.28Å; T153-A156 PolarHBondContact O-N 3.45Å; T153-V157 WeakPolarHBondContact O-CG2 3.18Å; T153-V157 PolarHBondContact O-N 2.91Å; T153-I238 HydrophobicContact CG2-CG2 3.95Å; T153-S242 PolarHBondContact O-OG 3.03Å
154A91.5Very high87.9Confident15 Ų1519.9 Ų19.912%0.12411%0.11CC..Hα-helixtrans-61.8-39.4176.400000111.9F98 L150 S151 V157 D158 V179F98-A154 HydrophobicContact CD1-CB 4.21Å; F98-A154 HydrophobicContact CD2-CB 4.18Å; F98-A154 HydrophobicContact CE1-CB 4.15Å; F98-A154 HydrophobicContact CE2-CB 4.1Å; F98-A154 HydrophobicContact CG-CB 4.24Å; F98-A154 HydrophobicContact CZ-CB 4.1Å; L150-A154 WeakPolarHBondContact O-CB 3.21Å; L150-A154 PolarHBondContact O-N 3.44Å; S151-A154 WeakPolarHBondContact O-CB 3.35Å; S151-A154 PolarHBondContact O-N 3.47Å; S151-A154 VanDerWaalsContact O-N 3.16Å; A154-V157 PolarHBondContact O-N 2.91Å; A154-D158 WeakPolarHBondContact O-CB 3.38Å; A154-D158 PolarHBondContact O-N 2.94Å; A154-V179 HydrophobicContact CB-CG1 4.34Å
155I90.3Very high87.2Confident3 Ų323.7 Ų23.72%0.01513%0.128CC..Hα-helixtrans-64.2-44.8174.9-61.9162.9000110.7T95 F98 I99 L102 S151 L152 T153 D158 R159 L281T95-I155 HydrophobicContact CG2-CG2 3.56Å; F98-I155 HydrophobicContact CB-CD1 4.01Å; F98-I155 HydrophobicContact CB-CG1 3.43Å; F98-I155 VanDerWaalsContact CB-CG1 3.43Å; F98-I155 HydrophobicContact CD2-CG1 4.35Å; F98-I155 HydrophobicContact CG-CG1 4.28Å; I99-I155 HydrophobicContact CG1-CD1 3.96Å; L102-I155 HydrophobicContact CD1-CD1 3.44Å; L102-I155 VanDerWaalsContact CD1-CD1 3.44Å; S151-I155 VanDerWaalsContact O-CG1 3.24Å; S151-I155 WeakPolarHBondContact O-CG1 3.27Å; S151-I155 PolarHBondContact O-N 3.02Å; L152-I155 PolarHBondContact O-N 3.18Å; T153-I155 VanDerWaalsContact C-N 3.32Å; T153-I155 PolarHBondContact O-N 2.84Å; I155-D158 PolarHBondContact O-N 2.88Å; I155-R159 HydrophobicContact CG2-CG 4.31Å; I155-R159 VanDerWaalsContact O-CB 3.29Å; I155-R159 WeakPolarHBondContact O-CB 3.39Å; I155-R159 WeakPolarHBondContact O-CG 3.3Å; I155-R159 PolarHBondContact O-N 3.25Å; I155-L281 HydrophobicContact CB-CD1 3.83Å; I155-L281 HydrophobicContact CG2-CD1 3.25Å
156A87.6Confident86.4Confident0 Ų027.2 Ų27.20%015%0.151CC..Hα-helixtrans-60.6-45.9177.600000111.3L152 T153 R159 Y160 S242 S246 L281L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.29Å; T153-A156 WeakPolarHBondContact O-CB 3.28Å; T153-A156 PolarHBondContact O-N 3.45Å; A156-R159 WeakPolarHBondContact O-CB 3.42Å; A156-R159 PolarHBondContact O-N 3.2Å; A156-Y160 PolarHBondContact O-N 3.21Å; A156-S242 WeakPolarHBondContact CB-OG 3.46Å; A156-S246 PolarHBondContact O-OG 3.16Å; A156-L281 HydrophobicContact CB-CD1 4.4Å; A156-L281 HydrophobicContact CB-CD2 4.05Å
157V87.6Confident85.5Confident64 Ų6434 Ų3439%0.38819%0.192SC..Hα-helixtrans-64-46.5177172.40000112.3T153 A154 R159 Y160 I161T153-V157 WeakPolarHBondContact O-CG2 3.18Å; T153-V157 PolarHBondContact O-N 2.91Å; A154-V157 PolarHBondContact O-N 2.91Å; V157-R159 PolarHBondContact O-N 2.83Å; V157-Y160 WeakPolarHBondContact O-CB 3.2Å; V157-Y160 PolarHBondContact O-N 2.94Å; V157-I161 HydrophobicContact CG1-CD1 3.85Å; V157-I161 HydrophobicContact CG1-CG1 4.4Å; V157-I161 WeakPolarHBondContact O-CG1 3.33Å; V157-I161 PolarHBondContact O-N 3.16Å
158D87.1Confident84.5Confident12 Ų1242 Ų426%0.06422%0.221CC..Hα-helixtrans-54.1-45.9174.3168.173000110.7A94 T95 A154 I155 I161 V162A94-D158 WeakPolarHBondContact CB-OD1 3.22Å; T95-D158 PolarHBondContact OG1-OD2 2.93Å; A154-D158 WeakPolarHBondContact O-CB 3.38Å; A154-D158 PolarHBondContact O-N 2.94Å; I155-D158 PolarHBondContact O-N 2.88Å; D158-I161 PolarHBondContact O-N 3.03Å; D158-V162 VanDerWaalsContact O-CG2 3.29Å; D158-V162 WeakPolarHBondContact O-CG2 3.45Å; D158-V162 PolarHBondContact O-N 3.01Å
159R83.3Confident83.2Confident39 Ų3951.7 Ų51.715%0.14726%0.263CS..Hα-helixtrans-66.4-39.1179.6-72.9-82.5169.3-99.45.9112.8T95 I155 A156 V157 V163 F278T95-R159 PolarHBondContact OG1-NH1 2.93Å; T95-R159 PolarHBondContact OG1-NH2 3.46Å; I155-R159 HydrophobicContact CG2-CG 4.31Å; I155-R159 VanDerWaalsContact O-CB 3.29Å; I155-R159 WeakPolarHBondContact O-CB 3.39Å; I155-R159 WeakPolarHBondContact O-CG 3.3Å; I155-R159 PolarHBondContact O-N 3.25Å; A156-R159 WeakPolarHBondContact O-CB 3.42Å; A156-R159 PolarHBondContact O-N 3.2Å; V157-R159 PolarHBondContact O-N 2.83Å; R159-V163 VanDerWaalsContact O-CG2 3.29Å; R159-V163 WeakPolarHBondContact O-CG2 3.44Å; R159-V163 PolarHBondContact O-N 3.43Å; R159-F278 HydrophobicContact CB-CD1 4.43Å; R159-F278 HydrophobicContact CB-CE1 3.35Å; R159-F278 HydrophobicContact CB-CZ 3.62Å; R159-F278 HydrophobicContact CG-CE1 4.07Å; R159-F278 HydrophobicContact CG-CZ 4.32Å
160Y82.9Confident82.3Confident78 Ų7861 Ų6131%0.30630%0.298SS..Hα-helixtrans-58.6-51.4171.1166.6-99.7000110.9A156 V157 V162 V163 A164 A249A156-Y160 PolarHBondContact O-N 3.21Å; V157-Y160 WeakPolarHBondContact O-CB 3.2Å; V157-Y160 PolarHBondContact O-N 2.94Å; Y160-V162 VanDerWaalsContact C-N 3.33Å; Y160-V162 PolarHBondContact O-N 3.37Å; Y160-V163 PolarHBondContact O-N 2.94Å; Y160-A164 HydrophobicContact CD2-CB 4.29Å; Y160-A164 HydrophobicContact CE1-CB 4.23Å; Y160-A164 HydrophobicContact CE2-CB 3.85Å; Y160-A164 WeakPolarHBondContact O-CB 3.43Å; Y160-A164 PolarHBondContact O-N 3.04Å; Y160-A249 HydrophobicContact CD2-CB 3.4Å; Y160-A249 HydrophobicContact CE2-CB 3.33Å
161I83.2Confident81.6Confident52 Ų5262.7 Ų62.727%0.26731%0.307SS..Hα-helixtrans-58.7-45.1-178.4-66.9167.2000110.9V157 D158 V163 H165V157-I161 HydrophobicContact CG1-CD1 3.85Å; V157-I161 HydrophobicContact CG1-CG1 4.4Å; V157-I161 WeakPolarHBondContact O-CG1 3.33Å; V157-I161 PolarHBondContact O-N 3.16Å; D158-I161 PolarHBondContact O-N 3.03Å; I161-V163 PolarHBondContact O-N 3.14Å; I161-H165 CarbonylContact O-C 3.52Å; I161-H165 WeakPolarHBondContact O-CA 3.33Å; I161-H165 PolarHBondContact O-N 3.07Å
162V80.6Confident81.1Confident37 Ų3765.9 Ų65.922%0.22433%0.329CS..Hα-helixtrans-62.5-25.4179168.60000112.8D158 Y160 R274D158-V162 VanDerWaalsContact O-CG2 3.29Å; D158-V162 WeakPolarHBondContact O-CG2 3.45Å; D158-V162 PolarHBondContact O-N 3.01Å; Y160-V162 VanDerWaalsContact C-N 3.33Å; Y160-V162 PolarHBondContact O-N 3.37Å; V162-R274 PolarHBondContact O-NH2 3.44Å; V162-R274 VanDerWaalsContact O-NH2 3.14Å
163V74.6Confident80.8Confident7 Ų769.8 Ų69.84%0.04236%0.361CS..Hα-helixtrans-95.2-43.9-179.1175.50000112.1R159 Y160 I161 I250 F278R159-V163 VanDerWaalsContact O-CG2 3.29Å; R159-V163 WeakPolarHBondContact O-CG2 3.44Å; R159-V163 PolarHBondContact O-N 3.43Å; Y160-V163 PolarHBondContact O-N 2.94Å; I161-V163 PolarHBondContact O-N 3.14Å; V163-I250 HydrophobicContact CB-CG1 4.09Å; V163-I250 HydrophobicContact CG1-CB 4.21Å; V163-I250 HydrophobicContact CG1-CG1 3.78Å; V163-I250 HydrophobicContact CG1-CG2 4.35Å; V163-I250 HydrophobicContact CG2-CG1 4.06Å; V163-F278 HydrophobicContact CG2-CE2 4Å; V163-F278 HydrophobicContact CG2-CZ 3.84Å
164A75.8Confident80.6Confident37 Ų3778.8 Ų78.831%0.30639%0.393SS..Hα-helixtrans-74.4-33.3-179.500000112.4Y160Y160-A164 HydrophobicContact CD2-CB 4.29Å; Y160-A164 HydrophobicContact CE1-CB 4.23Å; Y160-A164 HydrophobicContact CE2-CB 3.85Å; Y160-A164 WeakPolarHBondContact O-CB 3.43Å; Y160-A164 PolarHBondContact O-N 3.04Å
165H78Confident80.6Confident80 Ų8078.8 Ų78.837%0.3740%0.395SS..  trans-130.771.1-174.6-57.5-59.3000111.9I161 V167 R168I161-H165 CarbonylContact O-C 3.52Å; I161-H165 WeakPolarHBondContact O-CA 3.33Å; I161-H165 PolarHBondContact O-N 3.07Å; H165-V167 PolarHBondContact O-N 2.98Å; H165-V167 VanDerWaalsContact O-N 3.08Å; H165-R168 HydrophobicContact CB-CB 4.19Å; H165-R168 HydrophobicContact CB-CG 4.07Å; H165-R168 PolarHBondContact O-N 3.06Å; H165-R168 VanDerWaalsContact O-N 3.17Å
166P71.6Confident80.6Confident81 Ų8178.8 Ų78.853%0.52640%0.395SS..THydrogen-bonded Turntrans-62.9-19.1-175.925.3-34.3000114.5
167V73.8Confident80.9Confident144 Ų14480.2 Ų80.287%0.87341%0.41SS*.THydrogen-bonded Turntrans-92.7-12.3-177.7-170.10000112.6H165H165-V167 PolarHBondContact O-N 2.98Å; H165-V167 VanDerWaalsContact O-N 3.08Å
168R72.4Confident81.2Confident171 Ų17179.5 Ų79.565%0.64541%0.41SS*.SBendtrans-70.5140.5177.2-87.4-169.8174-174-0110.8H165 R170H165-R168 HydrophobicContact CB-CB 4.19Å; H165-R168 HydrophobicContact CB-CG 4.07Å; H165-R168 PolarHBondContact O-N 3.06Å; H165-R168 VanDerWaalsContact O-N 3.17Å; R168-R170 PolarHBondContact O-N 3.33Å
169K66.6Low81.6Confident207 Ų20781.9 Ų81.990%0.943%0.425SS*.PPolyproline II helixtrans-56.9134.6171.7-77.5-175.8177.8178.30109.5
170R73.9Confident82.2Confident197 Ų19780.8 Ų80.874%0.74342%0.423SS*.PPolyproline II helixtrans-62148.9174.5-65.6-170.9179.2-165.51109.9R168 S172R168-R170 PolarHBondContact O-N 3.33Å; R170-S172 PolarHBondContact O-N 3.23Å
171I77.4Confident82.8Confident66 Ų6682.3 Ų82.334%0.33844%0.436SS..PPolyproline II helixtrans-55.8130.7174-57.5175.6000108.2A94A94-I171 HydrophobicContact CB-CB 4.37Å
172S84.3Confident83.4Confident68 Ų6881.5 Ų81.548%0.47644%0.44SS..PPolyproline II helixtrans-68.9162176.767.60000110.7R170 W174 G175 C176R170-S172 PolarHBondContact O-N 3.23Å; S172-W174 PolarHBondContact O-N 3.13Å; S172-G175 PolarHBondContact O-N 3.34Å; S172-G175 VanDerWaalsContact O-N 3.09Å; S172-G175 PolarHBondContact OG-N 3.49Å; S172-G175 VanDerWaalsContact OG-N 3.14Å; S172-C176 PolarHBondContact O-N 2.63Å; S172-C176 PolarHBondContact O-SG 3.48Å
173A82.8Confident84.2Confident83 Ų8380.3 Ų80.369%0.68643%0.433SS*.Hα-helixtrans-56.7-38.2174.200000111.9C176 G177A173-C176 PolarHBondContact O-N 3.04Å; A173-G177 PolarHBondContact O-N 2.98Å
174W88.1Confident85.3Confident213 Ų21382.5 Ų82.581%0.80744%0.44SS*.Hα-helixtrans-62.8-42.5175.4-168.585.7000112.3S172 C176 G177 A178S172-W174 PolarHBondContact O-N 3.13Å; W174-C176 VanDerWaalsContact C-N 3.35Å; W174-C176 PolarHBondContact O-N 3.48Å; W174-G177 PolarHBondContact O-N 3.06Å; W174-A178 PolarHBondContact O-N 2.89Å
175G90.3Very high86.3Confident16 Ų1685.8 Ų85.817%0.16545%0.452CS..Hα-helixtrans-62.4-39.2174.100000113S172 G177 A178 V179S172-G175 PolarHBondContact O-N 3.34Å; S172-G175 VanDerWaalsContact O-N 3.09Å; S172-G175 PolarHBondContact OG-N 3.49Å; S172-G175 VanDerWaalsContact OG-N 3.14Å; G175-G177 VanDerWaalsContact C-N 3.34Å; G175-A178 PolarHBondContact O-N 3.12Å; G175-V179 WeakPolarHBondContact O-CG2 3.43Å; G175-V179 PolarHBondContact O-N 3.49Å
176C91.1Very high87.1Confident3 Ų386 Ų862%0.0246%0.456CS..Hα-helixtrans-64.5-40.4175.3-58.50000111.7A94 F97 S172 A173 W174 T180A94-C176 VanDerWaalsContact CB-SG 3.54Å; F97-C176 HydrophobicContact CB-CB 4.32Å; F97-C176 HydrophobicContact CD1-CB 3.65Å; F97-C176 HydrophobicContact CD2-CB 4.33Å; F97-C176 HydrophobicContact CE1-CB 4Å; F97-C176 HydrophobicContact CG-CB 3.83Å; F97-C176 HydrophobicContact CZ-CB 4.47Å; S172-C176 PolarHBondContact O-N 2.63Å; S172-C176 PolarHBondContact O-SG 3.48Å; A173-C176 PolarHBondContact O-N 3.04Å; W174-C176 VanDerWaalsContact C-N 3.35Å; W174-C176 PolarHBondContact O-N 3.48Å; C176-T180 WeakPolarHBondContact O-CB 3.22Å; C176-T180 PolarHBondContact O-N 3.27Å; C176-T180 PolarHBondContact O-OG1 3.49Å
177G92.8Very high88.2Confident30 Ų3082.2 Ų82.231%0.30943%0.431SS..Hα-helixtrans-62.1-45.9173.200000112.4A173 W174 G175 T180 L181A173-G177 PolarHBondContact O-N 2.98Å; W174-G177 PolarHBondContact O-N 3.06Å; G175-G177 VanDerWaalsContact C-N 3.34Å; G177-T180 PolarHBondContact O-N 2.89Å; G177-L181 WeakPolarHBondContact O-CB 3.48Å; G177-L181 PolarHBondContact O-N 2.92Å
178A94.7Very high89.2Confident48 Ų4878.4 Ų78.440%0.39741%0.405SS..Hα-helixtrans-62.4-44.2177.400000112.5W174 G175 T180 L181 G182W174-A178 PolarHBondContact O-N 2.89Å; G175-A178 PolarHBondContact O-N 3.12Å; A178-T180 VanDerWaalsContact C-N 3.32Å; A178-T180 PolarHBondContact O-N 3.39Å; A178-L181 PolarHBondContact O-N 3.39Å; A178-G182 PolarHBondContact O-N 2.86Å
179V94.8Very high90.3Very high62 Ų6273.2 Ų73.238%0.37640%0.399SS..Hα-helixtrans-60.5-44.6174.5172.40000110.4F98 A154 G175 G182 V183F98-V179 HydrophobicContact CE1-CB 3.97Å; F98-V179 HydrophobicContact CE1-CG1 3.59Å; F98-V179 HydrophobicContact CZ-CB 4.01Å; F98-V179 HydrophobicContact CZ-CG1 3.7Å; A154-V179 HydrophobicContact CB-CG1 4.34Å; G175-V179 WeakPolarHBondContact O-CG2 3.43Å; G175-V179 PolarHBondContact O-N 3.49Å; V179-G182 PolarHBondContact O-N 2.89Å; V179-V183 HydrophobicContact CG1-CG2 4.37Å; V179-V183 VanDerWaalsContact O-CG2 3.31Å; V179-V183 WeakPolarHBondContact O-CG2 3.23Å; V179-V183 PolarHBondContact O-N 3.38Å
180T95.6Very high91.4Very high17 Ų1765.2 Ų65.210%0.10437%0.366CS..Hα-helixtrans-65-42.2-179.6-610000112.1F97 N101 C176 G177 A178 G182 V183 W184F97-T180 HydrophobicContact CE1-CG2 4.47Å; F97-T180 VanDerWaalsContact CE1-OG1 3.29Å; F97-T180 WeakPolarHBondContact CE1-OG1 3.46Å; N101-T180 HydrophobicContact CB-CG2 4.21Å; N101-T180 WeakPolarHBondContact OD1-CG2 3.24Å; C176-T180 WeakPolarHBondContact O-CB 3.22Å; C176-T180 PolarHBondContact O-N 3.27Å; C176-T180 PolarHBondContact O-OG1 3.49Å; G177-T180 PolarHBondContact O-N 2.89Å; A178-T180 VanDerWaalsContact C-N 3.32Å; A178-T180 PolarHBondContact O-N 3.39Å; T180-G182 VanDerWaalsContact C-N 3.33Å; T180-G182 PolarHBondContact O-N 3.27Å; T180-V183 WeakPolarHBondContact O-CB 3.36Å; T180-V183 PolarHBondContact O-N 3.28Å; T180-W184 PolarHBondContact O-N 2.64Å
181L96.5Very high92.2Very high110 Ų11055.9 Ų55.958%0.57633%0.331SS*.Hα-helixtrans-58.9-46.1172.6179.563000111.1G177 A178 V183 W184 L185G177-L181 WeakPolarHBondContact O-CB 3.48Å; G177-L181 PolarHBondContact O-N 2.92Å; A178-L181 PolarHBondContact O-N 3.39Å; L181-V183 VanDerWaalsContact C-N 3.32Å; L181-V183 PolarHBondContact O-N 3.03Å; L181-W184 PolarHBondContact O-N 2.95Å; L181-L185 HydrophobicContact CD1-CD1 4.23Å; L181-L185 HydrophobicContact CD1-CG 4.25Å; L181-L185 HydrophobicContact CG-CD1 4.02Å; L181-L185 HydrophobicContact CG-CG 4.43Å; L181-L185 WeakPolarHBondContact O-CG 3.26Å; L181-L185 PolarHBondContact O-N 2.81Å
182G96.7Very high92.7Very high35 Ų3554.8 Ų54.836%0.36133%0.331SS..Hα-helixtrans-59.7-40.4175.100000113A178 V179 T180 L186A178-G182 PolarHBondContact O-N 2.86Å; V179-G182 PolarHBondContact O-N 2.89Å; T180-G182 VanDerWaalsContact C-N 3.33Å; T180-G182 PolarHBondContact O-N 3.27Å; G182-L186 VanDerWaalsContact O-CB 3.24Å; G182-L186 WeakPolarHBondContact O-CB 3.39Å; G182-L186 PolarHBondContact O-N 2.91Å
183V96.2Very high92.8Very high11 Ų1153.7 Ų53.77%0.06732%0.323CS..Hα-helixtrans-57.9-49.4174.5165.40000110.7A147 L150 V179 T180 L181 S187A147-V183 HydrophobicContact CB-CG1 4.09Å; L150-V183 HydrophobicContact CB-CB 4.4Å; L150-V183 HydrophobicContact CB-CG1 3.81Å; L150-V183 HydrophobicContact CB-CG2 3.96Å; L150-V183 HydrophobicContact CD1-CG1 4.3Å; V179-V183 HydrophobicContact CG1-CG2 4.37Å; V179-V183 VanDerWaalsContact O-CG2 3.31Å; V179-V183 WeakPolarHBondContact O-CG2 3.23Å; V179-V183 PolarHBondContact O-N 3.38Å; T180-V183 WeakPolarHBondContact O-CB 3.36Å; T180-V183 PolarHBondContact O-N 3.28Å; L181-V183 VanDerWaalsContact C-N 3.32Å; L181-V183 PolarHBondContact O-N 3.03Å; V183-S187 VanDerWaalsContact O-CB 3.24Å; V183-S187 WeakPolarHBondContact O-CB 3.37Å; V183-S187 PolarHBondContact O-N 3.29Å; V183-S187 PolarHBondContact O-OG 3.46Å
184W97.4Very high92.6Very high54 Ų5450.1 Ų50.121%0.20529%0.292CS..Hα-helixtrans-67.6-44.2-179.2-78.8103.1000112.8N101 L108 T144 A147 T180 L181 L186 S187 L188N101-W184 PolarHBondContact OD1-NE1 3.31Å; L108-W184 HydrophobicContact CD2-CH2 3.93Å; L108-W184 HydrophobicContact CD2-CZ3 4.22Å; T144-W184 HydrophobicContact CG2-CH2 4.07Å; T144-W184 HydrophobicContact CG2-CZ3 4.24Å; A147-W184 HydrophobicContact CB-CD2 4.43Å; A147-W184 HydrophobicContact CB-CE3 4.35Å; A147-W184 HydrophobicContact CB-CH2 4.38Å; A147-W184 HydrophobicContact CB-CZ2 4.44Å; A147-W184 HydrophobicContact CB-CZ3 4.33Å; T180-W184 PolarHBondContact O-N 2.64Å; L181-W184 PolarHBondContact O-N 2.95Å; W184-L186 PolarHBondContact O-N 2.92Å; W184-S187 PolarHBondContact O-N 2.91Å; W184-L188 WeakPolarHBondContact O-CB 2.98Å; W184-L188 WeakPolarHBondContact O-CG 3.31Å; W184-L188 PolarHBondContact O-N 3.45Å
185L97.3Very high92.4Very high105 Ų10540.6 Ų40.655%0.5526%0.259SS..Hα-helixtrans-61.2-46177.4-69.5175.3000111.7L181 S187 L188 A189L181-L185 HydrophobicContact CD1-CD1 4.23Å; L181-L185 HydrophobicContact CD1-CG 4.25Å; L181-L185 HydrophobicContact CG-CD1 4.02Å; L181-L185 HydrophobicContact CG-CG 4.43Å; L181-L185 WeakPolarHBondContact O-CG 3.26Å; L181-L185 PolarHBondContact O-N 2.81Å; L185-S187 VanDerWaalsContact C-N 3.35Å; L185-L188 PolarHBondContact O-N 2.99Å; L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 3.39Å
186L95.3Very high92.2Very high86 Ų8647.7 Ų47.745%0.4529%0.285SS..Hα-helixtrans-64.5-41.4176.5-178.558.6000111.2L150 G182 W184 L188 A189 L190L150-L186 HydrophobicContact CD1-CB 4.22Å; L150-L186 HydrophobicContact CD1-CD2 3.85Å; L150-L186 HydrophobicContact CD1-CG 4.07Å; L150-L186 HydrophobicContact CD2-CD2 4.26Å; G182-L186 VanDerWaalsContact O-CB 3.24Å; G182-L186 WeakPolarHBondContact O-CB 3.39Å; G182-L186 PolarHBondContact O-N 2.91Å; W184-L186 PolarHBondContact O-N 2.92Å; L186-L188 PolarHBondContact O-N 2.98Å; L186-A189 PolarHBondContact O-N 3.5Å; L186-L190 HydrophobicContact CD1-CD1 4.16Å; L186-L190 HydrophobicContact CD1-CG 4.1Å; L186-L190 HydrophobicContact CG-CD1 4.03Å; L186-L190 HydrophobicContact CG-CG 4.38Å; L186-L190 WeakPolarHBondContact O-CB 3.38Å; L186-L190 VanDerWaalsContact O-CG 3.25Å; L186-L190 WeakPolarHBondContact O-CG 3.48Å; L186-L190 PolarHBondContact O-N 3.44Å
187S95.3Very high92Very high0 Ų050.6 Ų50.60%030%0.296CS..Hα-helixtrans-62.9-43.4178.6-59.80000112.4A143 A147 V183 W184 L185 L190 A191A143-S187 VanDerWaalsContact O-CB 3.31Å; A143-S187 WeakPolarHBondContact O-CB 3.24Å; A147-S187 WeakPolarHBondContact CA-OG 3.33Å; A147-S187 PolarHBondContact N-OG 3.16Å; V183-S187 VanDerWaalsContact O-CB 3.24Å; V183-S187 WeakPolarHBondContact O-CB 3.37Å; V183-S187 PolarHBondContact O-N 3.29Å; V183-S187 PolarHBondContact O-OG 3.46Å; W184-S187 PolarHBondContact O-N 2.91Å; L185-S187 VanDerWaalsContact C-N 3.35Å; S187-L190 PolarHBondContact O-N 3.35Å; S187-A191 WeakPolarHBondContact O-CB 3.47Å; S187-A191 PolarHBondContact O-N 2.91Å
188L94.8Very high91.6Very high65 Ų6549.3 Ų49.334%0.3428%0.282SS..Hα-helixtrans-64.7-41.2175.6-73.4167000111.5L139 A143 W184 L185 L186 A191 A192L139-L188 HydrophobicContact CD2-CD2 4.42Å; L139-L188 HydrophobicContact CG-CD2 4.31Å; A143-L188 HydrophobicContact CB-CD2 3.85Å; A143-L188 HydrophobicContact CB-CG 4.36Å; W184-L188 WeakPolarHBondContact O-CB 2.98Å; W184-L188 WeakPolarHBondContact O-CG 3.31Å; W184-L188 PolarHBondContact O-N 3.45Å; L185-L188 PolarHBondContact O-N 2.99Å; L186-L188 PolarHBondContact O-N 2.98Å; L188-A191 PolarHBondContact O-N 2.67Å; L188-A192 WeakPolarHBondContact O-CB 3.33Å; L188-A192 PolarHBondContact O-N 3.44Å
189A93.8Very high91.2Very high62 Ų6254.2 Ų54.251%0.51229%0.291SS..Hα-helixtrans-62.6-43.1176.300000112.1L185 L186 A191 A192L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 3.39Å; L186-A189 PolarHBondContact O-N 3.5Å; A189-A191 VanDerWaalsContact C-N 3.34Å; A189-A192 PolarHBondContact O-N 3.27Å
190L90.6Very high90.9Very high39 Ų3954 Ų5420%0.20428%0.284CS..Hα-helixtrans-70.7-29.1177.5-65.7176.3000112.9F146 L186 S187 P193 Y227 F230F146-L190 HydrophobicContact CD1-CB 4.42Å; F146-L190 HydrophobicContact CD1-CD1 3.99Å; F146-L190 HydrophobicContact CD2-CB 3.81Å; F146-L190 HydrophobicContact CE1-CB 4.27Å; F146-L190 HydrophobicContact CE1-CD1 4.11Å; F146-L190 HydrophobicContact CE2-CB 3.61Å; F146-L190 HydrophobicContact CG-CB 4.19Å; F146-L190 HydrophobicContact CG-CD1 4.3Å; F146-L190 HydrophobicContact CZ-CB 3.84Å; F146-L190 HydrophobicContact CZ-CD1 4.49Å; L186-L190 HydrophobicContact CD1-CD1 4.16Å; L186-L190 HydrophobicContact CD1-CG 4.1Å; L186-L190 HydrophobicContact CG-CD1 4.03Å; L186-L190 HydrophobicContact CG-CG 4.38Å; L186-L190 WeakPolarHBondContact O-CB 3.38Å; L186-L190 VanDerWaalsContact O-CG 3.25Å; L186-L190 WeakPolarHBondContact O-CG 3.48Å; L186-L190 PolarHBondContact O-N 3.44Å; S187-L190 PolarHBondContact O-N 3.35Å; L190-P193 WeakPolarHBondContact O-CD 3.32Å; L190-Y227 PolarHBondContact O-OH 3.46Å; L190-F230 HydrophobicContact CD2-CE1 3.97Å; L190-F230 HydrophobicContact CD2-CZ 3.91Å
191A90.3Very high90.5Very high0 Ų055.5 Ų55.50%029%0.291CS..Hα-helixtrans-85.7-10.7177.800000114.1L139 C142 A143 F146 S187 L188 A189 P194L139-A191 HydrophobicContact CD1-CB 3.92Å; L139-A191 WeakPolarHBondContact CD1-O 3.41Å; C142-A191 HydrophobicContact CB-CB 3.72Å; A143-A191 HydrophobicContact CB-CB 3.88Å; F146-A191 HydrophobicContact CD2-CB 4.34Å; S187-A191 WeakPolarHBondContact O-CB 3.47Å; S187-A191 PolarHBondContact O-N 2.91Å; L188-A191 PolarHBondContact O-N 2.67Å; A189-A191 VanDerWaalsContact C-N 3.34Å; A191-P194 WeakPolarHBondContact O-CD 3.4Å
192A88.8Confident90Very high43 Ų4352.9 Ų52.936%0.35528%0.277SS..Hα-helixtrans-63.4-40.8-177.500000114.5L188 A189 S195 F196L188-A192 WeakPolarHBondContact O-CB 3.33Å; L188-A192 PolarHBondContact O-N 3.44Å; A189-A192 PolarHBondContact O-N 3.27Å; A192-S195 PolarHBondContact O-N 2.98Å; A192-F196 PolarHBondContact O-N 3.04Å
193P86.6Confident89.4Confident45 Ų4552.2 Ų52.229%0.29227%0.265SS..Hα-helixtrans-58.5-50-173.7-2131.2000113.8L190 S195 F196 Y197 W217 Y227L190-P193 WeakPolarHBondContact O-CD 3.32Å; P193-S195 VanDerWaalsContact C-N 3.3Å; P193-S195 PolarHBondContact O-N 3.26Å; P193-F196 PolarHBondContact O-N 2.99Å; P193-Y197 WeakPolarHBondContact O-CD2 3.41Å; P193-Y197 PolarHBondContact O-N 3.38Å; P193-Y197 VanDerWaalsContact O-N 3.12Å; P193-W217 HydrophobicContact CB-CH2 4.02Å; P193-Y227 HydrophobicContact CB-CD2 4.44Å; P193-Y227 HydrophobicContact CB-CE2 4.17Å; P193-Y227 HydrophobicContact CG-CE2 4Å
194P78.6Confident88.8Confident8 Ų857.8 Ų57.85%0.05229%0.285CS..Hα-helixtrans-57.1-40.7175.7-26.635.6000113.9A191 Y197 T198 W217 Y227A191-P194 WeakPolarHBondContact O-CD 3.4Å; P194-Y197 CarbonylContact O-C 3.5Å; P194-Y197 PolarHBondContact O-N 2.76Å; P194-T198 PolarHBondContact O-N 3.46Å; P194-T198 PolarHBondContact O-OG1 3.43Å; P194-W217 HydrophobicContact CG-CZ2 4.32Å; P194-Y227 VanDerWaalsContact CD-CZ 3.43Å; P194-Y227 VanDerWaalsContact CD-OH 3.25Å; P194-Y227 WeakPolarHBondContact CD-OH 3.04Å; P194-Y227 HydrophobicContact CG-CD1 4.07Å; P194-Y227 HydrophobicContact CG-CE1 3.16Å; P194-Y227 HydrophobicContact CG-CE2 4.44Å; P194-Y227 VanDerWaalsContact CG-CZ 3.4Å; P194-Y227 VanDerWaalsContact CG-OH 3.3Å; P194-Y227 WeakPolarHBondContact CG-OH 3.39Å
195S83.7Confident88.1Confident14 Ų1460.6 Ų60.610%0.09831%0.31CS..Hα-helixtrans-68-37179.7-174.30000112.1H135 A192 P193 Y197 T198H135-S195 PolarHBondContact ND1-O 3.31Å; H135-S195 PolarHBondContact O-OG 3.43Å; A192-S195 PolarHBondContact O-N 2.98Å; P193-S195 VanDerWaalsContact C-N 3.3Å; P193-S195 PolarHBondContact O-N 3.26Å; S195-Y197 VanDerWaalsContact C-N 3.32Å; S195-Y197 PolarHBondContact O-N 3.15Å; S195-T198 VanDerWaalsContact O-CB 3.3Å; S195-T198 WeakPolarHBondContact O-CB 3.39Å; S195-T198 PolarHBondContact O-N 3.3Å; S195-T198 VanDerWaalsContact O-N 3.16Å
196F86.3Confident87.2Confident165 Ų16559 Ų5972%0.72431%0.307SS*.Hα-helixtrans-65.7-35.9175.5-171.1-97.7000112.3A192 P193 T198A192-F196 PolarHBondContact O-N 3.04Å; P193-F196 PolarHBondContact O-N 2.99Å; F196-T198 VanDerWaalsContact C-N 3.31Å
197Y85.5Confident86.5Confident63 Ų6358.2 Ų58.225%0.24732%0.321CS..THydrogen-bonded Turntrans-83.8-3.5174.7-66.3-68.3000113.5P193 P194 S195 E215 F216 W217 P218P193-Y197 WeakPolarHBondContact O-CD2 3.41Å; P193-Y197 PolarHBondContact O-N 3.38Å; P193-Y197 VanDerWaalsContact O-N 3.12Å; P194-Y197 CarbonylContact O-C 3.5Å; P194-Y197 PolarHBondContact O-N 2.76Å; S195-Y197 VanDerWaalsContact C-N 3.32Å; S195-Y197 PolarHBondContact O-N 3.15Å; Y197-E215 CarbonylContact O-C 3.59Å; Y197-E215 WeakPolarHBondContact O-CA 3.49Å; Y197-F216 PolarHBondContact O-N 2.91Å; Y197-W217 AromaticContact CD2-CD2 3.79Å; Y197-W217 HydrophobicContact CD2-CD2 3.79Å; Y197-W217 AromaticContact CD2-CE2 3.94Å; Y197-W217 AromaticContact CD2-CE3 3.48Å; Y197-W217 HydrophobicContact CD2-CE3 3.48Å; Y197-W217 VanDerWaalsContact CD2-CE3 3.48Å; Y197-W217 AromaticContact CD2-CH2 3.58Å; Y197-W217 HydrophobicContact CD2-CH2 3.58Å; Y197-W217 AromaticContact CD2-CZ2 3.87Å; Y197-W217 HydrophobicContact CD2-CZ2 3.87Å; Y197-W217 AromaticContact CD2-CZ3 3.36Å; Y197-W217 HydrophobicContact CD2-CZ3 3.36Å; Y197-W217 HydrophobicContact CE2-CD2 4.38Å; Y197-W217 AromaticContact CE2-CE3 3.61Å; Y197-W217 HydrophobicContact CE2-CE3 3.61Å; Y197-W217 AromaticContact CE2-CH2 3.83Å; Y197-W217 HydrophobicContact CE2-CH2 3.83Å; Y197-W217 AromaticContact CE2-CZ3 3.28Å; Y197-W217 HydrophobicContact CE2-CZ3 3.28Å; Y197-W217 HydrophobicContact CG-CD2 4.05Å; Y197-W217 HydrophobicContact CG-CE3 4.05Å; Y197-W217 HydrophobicContact CG-CZ3 4.36Å; Y197-P218 HydrophobicContact CE1-CG 4.3Å
198T85.5Confident85.7Confident3 Ų361.6 Ų61.62%0.01834%0.338CS..EExtended strand (participates in β ladder)trans-68.8135.5173.6-58.60000110.5H135 P194 S195 F196 E214H135-T198 PolarHBondContact CE1-O 3.45Å; P194-T198 PolarHBondContact O-N 3.46Å; P194-T198 PolarHBondContact O-OG1 3.43Å; S195-T198 VanDerWaalsContact O-CB 3.3Å; S195-T198 WeakPolarHBondContact O-CB 3.39Å; S195-T198 PolarHBondContact O-N 3.3Å; S195-T198 VanDerWaalsContact O-N 3.16Å; F196-T198 VanDerWaalsContact C-N 3.31Å; T198-E214 CarbonylContact C-O 3.58Å; T198-E214 WeakPolarHBondContact CA-O 3.22Å
199R86.5Confident85.2Confident152 Ų15263.1 Ų63.157%0.57435%0.347SS*.EExtended strand (participates in β ladder)trans-122.4142.9174.8-61-65.4-172.8170.6-0.2110.4L201 C213 E214 F216R199-L201 HydrophobicContact CB-CG 4.47Å; R199-C213 WeakPolarHBondContact O-CA 3.31Å; R199-E214 PolarHBondContact N-O 2.88Å; R199-E214 PolarHBondContact O-N 3.34Å; R199-E214 VanDerWaalsContact O-N 3.13Å; R199-F216 HydrophobicContact CB-CD2 3.56Å; R199-F216 HydrophobicContact CB-CE2 3.93Å; R199-F216 HydrophobicContact CG-CB 4.1Å; R199-F216 HydrophobicContact CG-CD2 3.68Å; R199-F216 HydrophobicContact CG-CE2 4.49Å; R199-F216 HydrophobicContact CG-CG 4.21Å
200Y88.1Confident84.6Confident58 Ų5861.7 Ų61.723%0.22733%0.33CS..EExtended strand (participates in β ladder)trans-101.1115.5169.7175.9-94.1000108W127 Q131 C134 D202 V211W127-Y200 AromaticContact CD1-CE2 3.93Å; Q131-Y200 HydrophobicContact CB-CD1 4.13Å; Q131-Y200 HydrophobicContact CB-CD2 4.24Å; Q131-Y200 HydrophobicContact CB-CG 3.97Å; Q131-Y200 HydrophobicContact CG-CD1 4.33Å; Q131-Y200 HydrophobicContact CG-CG 4.06Å; C134-Y200 HydrophobicContact CB-CD2 4.19Å; Y200-D202 HydrophobicContact CE1-CB 4.11Å; Y200-V211 HydrophobicContact CD2-CG1 4.08Å; Y200-V211 HydrophobicContact CE2-CG1 3.35Å
201L86.9Confident84.4Confident48 Ų4860.2 Ų60.225%0.25132%0.323SS..EExtended strand (participates in β ladder)trans-120.3117.2-179.9-65.8170.7000109C9 R199 V211 V212 F216C9-L201 WeakPolarHBondContact SG-CD1 3.31Å; R199-L201 HydrophobicContact CB-CG 4.47Å; L201-V211 WeakPolarHBondContact O-CA 3.31Å; L201-V212 HydrophobicContact CB-CB 4.4Å; L201-V212 PolarHBondContact N-O 3.33Å; L201-V212 PolarHBondContact O-N 3.04Å; L201-F216 HydrophobicContact CD1-CE1 4.3Å; L201-F216 HydrophobicContact CD1-CE2 3.77Å; L201-F216 HydrophobicContact CD1-CZ 3.53Å
202D86.4Confident84Confident54 Ų5460.3 Ų60.329%0.28932%0.323SS..EExtended strand (participates in β ladder)trans-100.8108.2176.2-173.8-2.1000109Y200 R204 P205Y200-D202 HydrophobicContact CE1-CB 4.11Å; D202-R204 VanDerWaalsContact OD1-CB 3.3Å; D202-R204 WeakPolarHBondContact OD1-CB 3.45Å; D202-R204 VanDerWaalsContact OD1-CG 3.29Å; D202-R204 WeakPolarHBondContact OD1-CG 3.47Å; D202-R204 IonicContact OD1-CZ 3.63Å; D202-R204 PolarHBondContact OD1-N 2.88Å; D202-R204 VanDerWaalsContact OD1-N 3.16Å; D202-R204 IonicContact OD1-NE 2.79Å; D202-R204 PolarHBondContact OD1-NE 2.99Å; D202-R204 IonicContact OD1-NH2 3.66Å; D202-R204 IonicContact OD2-CZ 3.37Å; D202-R204 IonicContact OD2-NE 3.24Å; D202-R204 PolarHBondContact OD2-NE 3.48Å; D202-R204 IonicContact OD2-NH2 2.68Å; D202-R204 PolarHBondContact OD2-NH2 2.79Å; D202-P205 WeakPolarHBondContact O-CD 3.36Å
203L83.5Confident83.9Confident22 Ų2258.6 Ų58.612%0.11531%0.309CS..  trans-93.5-1.7-176.8-57.6171.3000112.9M12 P205 S206 I208 L210 V212M12-L203 HydrophobicContact CE-CD1 3.64Å; L203-P205 VanDerWaalsContact C-N 3.32Å; L203-S206 WeakPolarHBondContact O-CA 3.42Å; L203-S206 WeakPolarHBondContact O-CB 3.39Å; L203-S206 PolarHBondContact O-N 3.3Å; L203-I208 CarbonylContact C-O 3.48Å; L203-I208 HydrophobicContact CB-CB 4.07Å; L203-I208 HydrophobicContact CB-CG2 4.49Å; L203-I208 PolarHBondContact O-N 3.13Å; L203-L210 WeakPolarHBondContact CB-O 3.18Å; L203-L210 HydrophobicContact CD1-CD2 4.36Å; L203-L210 PolarHBondContact N-O 2.95Å; L203-L210 VanDerWaalsContact N-O 3.11Å; L203-V212 HydrophobicContact CD1-CG2 4.32Å
204R83.3Confident83.7Confident128 Ų12857.4 Ų57.448%0.48330%0.299SS..G310 helixtrans-55.4-40177.8-63.8175.6-68-176-0113D202 S206 G207 I208D202-R204 VanDerWaalsContact OD1-CB 3.3Å; D202-R204 WeakPolarHBondContact OD1-CB 3.45Å; D202-R204 VanDerWaalsContact OD1-CG 3.29Å; D202-R204 WeakPolarHBondContact OD1-CG 3.47Å; D202-R204 IonicContact OD1-CZ 3.63Å; D202-R204 PolarHBondContact OD1-N 2.88Å; D202-R204 VanDerWaalsContact OD1-N 3.16Å; D202-R204 IonicContact OD1-NE 2.79Å; D202-R204 PolarHBondContact OD1-NE 2.99Å; D202-R204 IonicContact OD1-NH2 3.66Å; D202-R204 IonicContact OD2-CZ 3.37Å; D202-R204 IonicContact OD2-NE 3.24Å; D202-R204 PolarHBondContact OD2-NE 3.48Å; D202-R204 IonicContact OD2-NH2 2.68Å; D202-R204 PolarHBondContact OD2-NH2 2.79Å; R204-S206 PolarHBondContact O-N 3.24Å; R204-G207 PolarHBondContact O-N 2.89Å; R204-G207 VanDerWaalsContact O-N 3.11Å; R204-I208 VanDerWaalsContact CA-O 3.28Å; R204-I208 WeakPolarHBondContact CA-O 3.49Å; R204-I208 PolarHBondContact N-O 3.4Å; R204-I208 VanDerWaalsContact N-O 3.11Å
205P82.1Confident83.7Confident112 Ų11259.3 Ų59.373%0.72731%0.307SS*.G310 helixtrans-62.6-25175.4-22.635000114D202 L203 G207D202-P205 WeakPolarHBondContact O-CD 3.36Å; L203-P205 VanDerWaalsContact C-N 3.32Å; P205-G207 VanDerWaalsContact C-N 3.27Å; P205-G207 PolarHBondContact O-N 3.46Å
206S79.8Confident83.5Confident71 Ų7160.7 Ų60.750%0.49731%0.312SS..G310 helixtrans-87.67.4178.3-52.30000113L203 R204 I208L203-S206 WeakPolarHBondContact O-CA 3.42Å; L203-S206 WeakPolarHBondContact O-CB 3.39Å; L203-S206 PolarHBondContact O-N 3.3Å; R204-S206 PolarHBondContact O-N 3.24Å; S206-I208 VanDerWaalsContact C-N 3.34Å
207G79.3Confident83Confident71 Ų7154 Ų5473%0.73228%0.282SS*.THydrogen-bonded Turntrans834.3-179.600000114.8R204 P205R204-G207 PolarHBondContact O-N 2.89Å; R204-G207 VanDerWaalsContact O-N 3.11Å; P205-G207 VanDerWaalsContact C-N 3.27Å; P205-G207 PolarHBondContact O-N 3.46Å
208I80Confident82.5Confident71 Ų7154 Ų5436%0.36429%0.289SS..  trans-104.7113.5176.9-55.5175.6000108M12 L203 R204 S206 L210M12-I208 HydrophobicContact SD-CD1 3.62Å; L203-I208 CarbonylContact C-O 3.48Å; L203-I208 HydrophobicContact CB-CB 4.07Å; L203-I208 HydrophobicContact CB-CG2 4.49Å; L203-I208 PolarHBondContact O-N 3.13Å; R204-I208 VanDerWaalsContact CA-O 3.28Å; R204-I208 WeakPolarHBondContact CA-O 3.49Å; R204-I208 PolarHBondContact N-O 3.4Å; R204-I208 VanDerWaalsContact N-O 3.11Å; S206-I208 VanDerWaalsContact C-N 3.34Å; I208-L210 HydrophobicContact CG2-CB 3.89Å; I208-L210 PolarHBondContact O-N 3.36Å
209D82.8Confident81.4Confident97 Ų9759.8 Ų59.852%0.51932%0.32SS..  trans-77.566.2-177.6-16826.7000112.5H125H125-D209 IonicContact CE1-OD2 3.03Å; H125-D209 PolarHBondContact CE1-OD2 3.39Å; H125-D209 IonicContact ND1-OD1 3.91Å; H125-D209 IonicContact ND1-OD2 2.81Å; H125-D209 PolarHBondContact ND1-OD2 2.86Å
210L82.5Confident80.1Confident32 Ų3258.3 Ų58.317%0.16833%0.333CS..  trans-147.3132.8-174.1-178.765.1000111.3L5 H125 L203 I208 V212L5-L210 HydrophobicContact CD2-CD2 3.75Å; H125-L210 WeakPolarHBondContact O-CA 3.45Å; L203-L210 WeakPolarHBondContact CB-O 3.18Å; L203-L210 HydrophobicContact CD1-CD2 4.36Å; L203-L210 PolarHBondContact N-O 2.95Å; L203-L210 VanDerWaalsContact N-O 3.11Å; I208-L210 HydrophobicContact CG2-CB 3.89Å; I208-L210 PolarHBondContact O-N 3.36Å; L210-V212 HydrophobicContact CD2-CG2 4.12Å; L210-V212 HydrophobicContact CG-CG2 4.09Å
211V85Confident78.6Confident8 Ų857.6 Ų57.65%0.04834%0.343CS..EExtended strand (participates in β ladder)trans-114.7125.3171.8-176.90000109.5H125 G126 W127 Y200 L201H125-V211 PolarHBondContact O-N 2.86Å; G126-V211 WeakPolarHBondContact CA-O 2.92Å; W127-V211 HydrophobicContact CB-CB 4.42Å; W127-V211 HydrophobicContact CB-CG1 4.07Å; W127-V211 PolarHBondContact N-O 3.32Å; W127-V211 WeakPolarHBondContact O-CB 3.13Å; W127-V211 WeakPolarHBondContact O-CG1 3.4Å; Y200-V211 HydrophobicContact CD2-CG1 4.08Å; Y200-V211 HydrophobicContact CE2-CG1 3.35Å; L201-V211 WeakPolarHBondContact O-CA 3.31Å
212V83.8Confident78.2Confident1 Ų161.7 Ų61.71%0.00637%0.366CS..EExtended strand (participates in β ladder)trans-107.3131.4-177.4-177.60000109.8L5 L201 L203 L210 E214L5-V212 HydrophobicContact CD2-CG2 4.35Å; L201-V212 HydrophobicContact CB-CB 4.4Å; L201-V212 PolarHBondContact N-O 3.33Å; L201-V212 PolarHBondContact O-N 3.04Å; L203-V212 HydrophobicContact CD1-CG2 4.32Å; L210-V212 HydrophobicContact CD2-CG2 4.12Å; L210-V212 HydrophobicContact CG-CG2 4.09Å; V212-E214 HydrophobicContact CG1-CB 4Å; V212-E214 HydrophobicContact CG1-CG 3.66Å
213C86.8Confident77.9Confident8 Ų862.8 Ų62.85%0.05437%0.371CS..EExtended strand (participates in β ladder)trans-125.193.6174.7176.30000109Y120 W127 C134 R199Y120-C213 PolarHBondContact OH-N 3.35Å; Y120-C213 PolarHBondContact OH-O 2.96Å; W127-C213 HydrophobicContact CB-CB 3.78Å; W127-C213 HydrophobicContact CD2-CB 3.81Å; W127-C213 HydrophobicContact CE3-CB 4.09Å; W127-C213 HydrophobicContact CG-CB 3.65Å; C134-C213 VanDerWaalsContact C-SG 3.57Å; C134-C213 WeakPolarHBondContact CA-SG 3.37Å; C134-C213 HydrophobicContact CB-CB 3.91Å; C134-C213 WeakPolarHBondContact CB-SG 3.31Å; C134-C213 PolarHBondContact O-SG 2.85Å; C134-C213 VanDerWaalsContact SG-CA 3.51Å; C134-C213 WeakPolarHBondContact SG-CB 3.28Å; C134-C213 CovalentContact SG-SG 2.02Å; C134-C213 PolarHBondContact SG-SG 3.39Å; R199-C213 WeakPolarHBondContact O-CA 3.31Å
214E80.6Confident77.7Confident19 Ų1964.3 Ų64.39%0.08938%0.375CS..EExtended strand (participates in β ladder)trans-145.6158-170.5-73.1-55.3156.900113.2A2 Y120 T198 R199 V212 F216A2-E214 WeakPolarHBondContact CA-OE1 3.34Å; A2-E214 WeakPolarHBondContact CA-OE2 3.15Å; A2-E214 HydrophobicContact CB-CG 4.39Å; A2-E214 WeakPolarHBondContact CB-OE1 3.46Å; A2-E214 WeakPolarHBondContact CB-OE2 3.24Å; Y120-E214 WeakPolarHBondContact CE1-OE1 3.32Å; Y120-E214 PolarHBondContact OH-OE1 3.27Å; T198-E214 CarbonylContact C-O 3.58Å; T198-E214 WeakPolarHBondContact CA-O 3.22Å; R199-E214 PolarHBondContact N-O 2.88Å; R199-E214 PolarHBondContact O-N 3.34Å; R199-E214 VanDerWaalsContact O-N 3.13Å; V212-E214 HydrophobicContact CG1-CB 4Å; V212-E214 HydrophobicContact CG1-CG 3.66Å; E214-F216 HydrophobicContact CB-CE2 3.92Å; E214-F216 HydrophobicContact CB-CZ 4.45Å; E214-F216 WeakPolarHBondContact O-CD2 3.35Å; E214-F216 WeakPolarHBondContact O-CE2 3.34Å
215E79.2Confident77.6Confident48 Ų4860.4 Ų60.422%0.22436%0.364CS..EExtended strand (participates in β ladder)trans-72.4140.2173.3-31.6167.2170.900110.5R6 Y197 W217R6-E215 PolarHBondContact NE-O 3.37Å; R6-E215 PolarHBondContact NH1-O 3.45Å; R6-E215 PolarHBondContact NH2-O 2.82Å; R6-E215 IonicContact NH2-OE2 3.07Å; Y197-E215 CarbonylContact O-C 3.59Å; Y197-E215 WeakPolarHBondContact O-CA 3.49Å; E215-W217 PolarHBondContact OE2-NE1 3.49Å
216F78.9Confident77.7Confident43 Ų4360.5 Ų60.519%0.18936%0.358CS..  trans-129.187.4172.8-69.9-96.4000106.8R6 C9 Y197 R199 L201 E214R6-F216 HydrophobicContact CG-CD1 4.3Å; R6-F216 HydrophobicContact CG-CE1 4.06Å; C9-F216 HydrophobicContact CB-CE1 4.17Å; C9-F216 HydrophobicContact CB-CZ 4.06Å; Y197-F216 PolarHBondContact O-N 2.91Å; R199-F216 HydrophobicContact CB-CD2 3.56Å; R199-F216 HydrophobicContact CB-CE2 3.93Å; R199-F216 HydrophobicContact CG-CB 4.1Å; R199-F216 HydrophobicContact CG-CD2 3.68Å; R199-F216 HydrophobicContact CG-CE2 4.49Å; R199-F216 HydrophobicContact CG-CG 4.21Å; L201-F216 HydrophobicContact CD1-CE1 4.3Å; L201-F216 HydrophobicContact CD1-CE2 3.77Å; L201-F216 HydrophobicContact CD1-CZ 3.53Å; E214-F216 HydrophobicContact CB-CE2 3.92Å; E214-F216 HydrophobicContact CB-CZ 4.45Å; E214-F216 WeakPolarHBondContact O-CD2 3.35Å; E214-F216 WeakPolarHBondContact O-CE2 3.34Å
217W76.8Confident78Confident24 Ų2458.5 Ų58.59%0.09134%0.339CS..  trans-74.3139.7174.2-67.979.3000109.1P193 P194 Y197 E215 D219 L223 R224 Y227P193-W217 HydrophobicContact CB-CH2 4.02Å; P194-W217 HydrophobicContact CG-CZ2 4.32Å; Y197-W217 AromaticContact CD2-CD2 3.79Å; Y197-W217 HydrophobicContact CD2-CD2 3.79Å; Y197-W217 AromaticContact CD2-CE2 3.94Å; Y197-W217 AromaticContact CD2-CE3 3.48Å; Y197-W217 HydrophobicContact CD2-CE3 3.48Å; Y197-W217 VanDerWaalsContact CD2-CE3 3.48Å; Y197-W217 AromaticContact CD2-CH2 3.58Å; Y197-W217 HydrophobicContact CD2-CH2 3.58Å; Y197-W217 AromaticContact CD2-CZ2 3.87Å; Y197-W217 HydrophobicContact CD2-CZ2 3.87Å; Y197-W217 AromaticContact CD2-CZ3 3.36Å; Y197-W217 HydrophobicContact CD2-CZ3 3.36Å; Y197-W217 HydrophobicContact CE2-CD2 4.38Å; Y197-W217 AromaticContact CE2-CE3 3.61Å; Y197-W217 HydrophobicContact CE2-CE3 3.61Å; Y197-W217 AromaticContact CE2-CH2 3.83Å; Y197-W217 HydrophobicContact CE2-CH2 3.83Å; Y197-W217 AromaticContact CE2-CZ3 3.28Å; Y197-W217 HydrophobicContact CE2-CZ3 3.28Å; Y197-W217 HydrophobicContact CG-CD2 4.05Å; Y197-W217 HydrophobicContact CG-CE3 4.05Å; Y197-W217 HydrophobicContact CG-CZ3 4.36Å; E215-W217 PolarHBondContact OE2-NE1 3.49Å; W217-D219 PolarHBondContact O-N 2.88Å; W217-L223 HydrophobicContact CE3-CD2 4.09Å; W217-L223 HydrophobicContact CE3-CG 4.13Å; W217-L223 HydrophobicContact CZ3-CD2 3.83Å; W217-L223 HydrophobicContact CZ3-CG 3.78Å; W217-R224 HydrophobicContact CB-CB 4.12Å; W217-R224 HydrophobicContact CD2-CB 3.87Å; W217-R224 HydrophobicContact CD2-CG 4.11Å; W217-R224 HydrophobicContact CE3-CB 4.26Å; W217-R224 HydrophobicContact CG-CB 3.8Å; W217-R224 HydrophobicContact CG-CG 3.92Å; W217-Y227 HydrophobicContact CH2-CD1 4.34Å; W217-Y227 HydrophobicContact CH2-CG 4.1Å; W217-Y227 HydrophobicContact CZ2-CD1 4.22Å; W217-Y227 HydrophobicContact CZ2-CG 4.43Å
218P73.9Confident78.1Confident63 Ų6356.1 Ų56.141%0.40931%0.312SS..  trans-61.5131.9177.922.6-30.7000111Y197 S220Y197-P218 HydrophobicContact CE1-CG 4.3Å; P218-S220 PolarHBondContact O-N 3.44Å; P218-S220 VanDerWaalsContact O-N 3.12Å
219D63.9Low78.3Confident125 Ų12555.1 Ų55.167%0.66831%0.31SS*.THydrogen-bonded Turntrans-65.4-13.1-176-75.9-33.3000114.5K10 W217 G221K10-D219 WeakPolarHBondContact CE-OD2 3.24Å; K10-D219 IonicContact NZ-OD1 3.91Å; K10-D219 PolarHBondContact NZ-OD1 3.32Å; K10-D219 IonicContact NZ-OD2 2.82Å; K10-D219 PolarHBondContact NZ-OD2 2.81Å; W217-D219 PolarHBondContact O-N 2.88Å; D219-G221 VanDerWaalsContact C-N 3.3Å; D219-G221 PolarHBondContact O-N 3.39Å
220S58.4Low78.5Confident121 Ų12154.5 Ų54.585%0.84630%0.303SS*.THydrogen-bonded Turntrans-82.98.5-173.350.20000115P218P218-S220 PolarHBondContact O-N 3.44Å; P218-S220 VanDerWaalsContact O-N 3.12Å
221G57.7Low78.6Confident43 Ų4353.8 Ų53.844%0.44330%0.3SS..SBendtrans-159.2150.4177.800000116.6D219 L223D219-G221 VanDerWaalsContact C-N 3.3Å; D219-G221 PolarHBondContact O-N 3.39Å; G221-L223 PolarHBondContact O-N 2.81Å
222N76.8Confident78.5Confident135 Ų13555.5 Ų55.572%0.72231%0.308SS*.THydrogen-bonded Turntrans-64.219.2170.6-66.5-38.6000113.8L225 L226N222-L225 PolarHBondContact O-N 3.16Å; N222-L226 WeakPolarHBondContact O-CB 3.25Å; N222-L226 PolarHBondContact O-N 3.44Å
223L81.1Confident78.5Confident77 Ų7759.1 Ų59.140%0.40333%0.33SS..Hα-helixtrans-68.2-40-171.1-176.663.3000112.1W217 G221 L226 Y227W217-L223 HydrophobicContact CE3-CD2 4.09Å; W217-L223 HydrophobicContact CE3-CG 4.13Å; W217-L223 HydrophobicContact CZ3-CD2 3.83Å; W217-L223 HydrophobicContact CZ3-CG 3.78Å; G221-L223 PolarHBondContact O-N 2.81Å; L223-L226 PolarHBondContact O-N 2.88Å; L223-Y227 WeakPolarHBondContact O-CB 3.44Å; L223-Y227 PolarHBondContact O-N 3.37Å
224R79.1Confident78.2Confident53 Ų5359.6 Ų59.620%0.233%0.333CS..Hα-helixtrans-62.8-47.2175.3-174.1179179.9-155.2-13.3111.2W217 L226 Y227 S228 D303W217-R224 HydrophobicContact CB-CB 4.12Å; W217-R224 HydrophobicContact CD2-CB 3.87Å; W217-R224 HydrophobicContact CD2-CG 4.11Å; W217-R224 HydrophobicContact CE3-CB 4.26Å; W217-R224 HydrophobicContact CG-CB 3.8Å; W217-R224 HydrophobicContact CG-CG 3.92Å; R224-L226 VanDerWaalsContact C-N 3.35Å; R224-L226 PolarHBondContact O-N 3Å; R224-Y227 PolarHBondContact O-N 3.37Å; R224-S228 PolarHBondContact O-N 2.61Å; R224-S228 PolarHBondContact O-OG 3.27Å; R224-D303 IonicContact CZ-OD1 3.74Å; R224-D303 IonicContact NE-OD1 2.79Å; R224-D303 PolarHBondContact NE-OD1 2.78Å; R224-D303 IonicContact NE-OD2 3.34Å; R224-D303 IonicContact NH1-OD1 2.65Å; R224-D303 PolarHBondContact NH1-OD1 3.04Å; R224-D303 IonicContact NH2-OD1 2.8Å; R224-D303 PolarHBondContact NH2-OD1 3.33Å
225L81Confident78.2Confident46 Ų4659 Ų5924%0.24133%0.331CS..Hα-helixtrans-60.7-44.5175.7-179.663.8000111.4N222 Y227 S228 C229 L300 D303 L304N222-L225 PolarHBondContact O-N 3.16Å; L225-Y227 VanDerWaalsContact C-N 3.3Å; L225-Y227 PolarHBondContact O-N 3.49Å; L225-S228 PolarHBondContact O-N 2.93Å; L225-C229 WeakPolarHBondContact O-CB 3.47Å; L225-C229 PolarHBondContact O-N 2.9Å; L225-C229 PolarHBondContact O-SG 2.98Å; L225-C229 VanDerWaalsContact O-SG 3.37Å; L225-L300 HydrophobicContact CD1-CD1 3.43Å; L225-L300 VanDerWaalsContact CD1-CD1 3.43Å; L225-D303 HydrophobicContact CD1-CB 4.46Å; L225-L304 HydrophobicContact CD1-CD2 3.73Å; L225-L304 HydrophobicContact CD1-CG 4.04Å; L225-L304 HydrophobicContact CD2-CD2 3.88Å; L225-L304 HydrophobicContact CG-CD2 4.49Å
226L85.5Confident78.3Confident115 Ų11557.9 Ų57.960%0.60233%0.325SS*.Hα-helixtrans-58.8-42.8175.4-179.663.4000111.3N222 L223 R224 C229 F230N222-L226 WeakPolarHBondContact O-CB 3.25Å; N222-L226 PolarHBondContact O-N 3.44Å; L223-L226 PolarHBondContact O-N 2.88Å; R224-L226 VanDerWaalsContact C-N 3.35Å; R224-L226 PolarHBondContact O-N 3Å; L226-C229 PolarHBondContact O-N 2.92Å; L226-F230 VanDerWaalsContact O-CB 3.28Å; L226-F230 WeakPolarHBondContact O-CB 3.41Å; L226-F230 PolarHBondContact O-N 3.06Å
227Y84.4Confident78.6Confident28 Ų2860.7 Ų60.711%0.1134%0.339CS..Hα-helixtrans-67.4-43.9177.2-175.9-97.5000112.4L190 P193 P194 W217 L223 R224 L225 C229 F230 I231L190-Y227 PolarHBondContact O-OH 3.46Å; P193-Y227 HydrophobicContact CB-CD2 4.44Å; P193-Y227 HydrophobicContact CB-CE2 4.17Å; P193-Y227 HydrophobicContact CG-CE2 4Å; P194-Y227 VanDerWaalsContact CD-CZ 3.43Å; P194-Y227 VanDerWaalsContact CD-OH 3.25Å; P194-Y227 WeakPolarHBondContact CD-OH 3.04Å; P194-Y227 HydrophobicContact CG-CD1 4.07Å; P194-Y227 HydrophobicContact CG-CE1 3.16Å; P194-Y227 HydrophobicContact CG-CE2 4.44Å; P194-Y227 VanDerWaalsContact CG-CZ 3.4Å; P194-Y227 VanDerWaalsContact CG-OH 3.3Å; P194-Y227 WeakPolarHBondContact CG-OH 3.39Å; W217-Y227 HydrophobicContact CH2-CD1 4.34Å; W217-Y227 HydrophobicContact CH2-CG 4.1Å; W217-Y227 HydrophobicContact CZ2-CD1 4.22Å; W217-Y227 HydrophobicContact CZ2-CG 4.43Å; L223-Y227 WeakPolarHBondContact O-CB 3.44Å; L223-Y227 PolarHBondContact O-N 3.37Å; R224-Y227 PolarHBondContact O-N 3.37Å; L225-Y227 VanDerWaalsContact C-N 3.3Å; L225-Y227 PolarHBondContact O-N 3.49Å; Y227-C229 VanDerWaalsContact C-N 3.34Å; Y227-C229 PolarHBondContact O-N 3.29Å; Y227-F230 CarbonylContact O-C 3.58Å; Y227-F230 WeakPolarHBondContact O-CB 3.37Å; Y227-F230 PolarHBondContact O-N 2.89Å; Y227-F230 VanDerWaalsContact O-N 3.13Å; Y227-I231 HydrophobicContact CD1-CD1 3.91Å; Y227-I231 HydrophobicContact CD1-CG1 4.21Å; Y227-I231 HydrophobicContact CE1-CD1 3.12Å; Y227-I231 HydrophobicContact CE1-CG1 3.7Å; Y227-I231 HydrophobicContact CE2-CG1 4.46Å; Y227-I231 PolarHBondContact O-N 3.08Å
228S81.9Confident79Confident22 Ų2262.7 Ų62.715%0.15435%0.351CS..Hα-helixtrans-58.3-45173.9-66.30000111.4R224 L225 I231 L232 D303R224-S228 PolarHBondContact O-N 2.61Å; R224-S228 PolarHBondContact O-OG 3.27Å; L225-S228 PolarHBondContact O-N 2.93Å; S228-I231 PolarHBondContact O-N 3.41Å; S228-L232 WeakPolarHBondContact O-CB 3.38Å; S228-L232 PolarHBondContact O-N 3.44Å; S228-D303 PolarHBondContact OG-OD2 3.4Å
229C84.2Confident79.4Confident49 Ų4960 Ų6033%0.33133%0.334SS..Hα-helixtrans-63.4-40173-73.90000112.6L225 L226 Y227 L232 T233L225-C229 WeakPolarHBondContact O-CB 3.47Å; L225-C229 PolarHBondContact O-N 2.9Å; L225-C229 PolarHBondContact O-SG 2.98Å; L225-C229 VanDerWaalsContact O-SG 3.37Å; L226-C229 PolarHBondContact O-N 2.92Å; Y227-C229 VanDerWaalsContact C-N 3.34Å; Y227-C229 PolarHBondContact O-N 3.29Å; C229-L232 PolarHBondContact O-N 3.31Å; C229-T233 WeakPolarHBondContact O-CB 3.42Å; C229-T233 PolarHBondContact O-N 3.15Å; C229-T233 PolarHBondContact O-OG1 3.5Å
230F87.4Confident80.4Confident85 Ų8557.3 Ų57.337%0.37332%0.319SS..Hα-helixtrans-64.5-44.9176.8171.5-95.5000111.8L190 L226 Y227 T233 T234L190-F230 HydrophobicContact CD2-CE1 3.97Å; L190-F230 HydrophobicContact CD2-CZ 3.91Å; L226-F230 VanDerWaalsContact O-CB 3.28Å; L226-F230 WeakPolarHBondContact O-CB 3.41Å; L226-F230 PolarHBondContact O-N 3.06Å; Y227-F230 CarbonylContact O-C 3.58Å; Y227-F230 WeakPolarHBondContact O-CB 3.37Å; Y227-F230 PolarHBondContact O-N 2.89Å; Y227-F230 VanDerWaalsContact O-N 3.13Å; F230-T233 PolarHBondContact O-N 3Å; F230-T234 WeakPolarHBondContact CE2-OG1 3.48Å; F230-T234 HydrophobicContact CZ-CG2 4.42Å; F230-T234 WeakPolarHBondContact CZ-OG1 3.17Å; F230-T234 WeakPolarHBondContact O-CB 3.33Å; F230-T234 PolarHBondContact O-N 2.88Å; F230-T234 PolarHBondContact O-OG1 3.22Å
231I83.6Confident81.7Confident17 Ų1756.5 Ų56.59%0.08731%0.305CS..Hα-helixtrans-58.3-50.4173.7-77.4-169.7000110.1F146 Y227 S228 T233 T234 S235 Q296F146-I231 HydrophobicContact CZ-CD1 4.36Å; F146-I231 HydrophobicContact CZ-CG1 3.86Å; Y227-I231 HydrophobicContact CD1-CD1 3.91Å; Y227-I231 HydrophobicContact CD1-CG1 4.21Å; Y227-I231 HydrophobicContact CE1-CD1 3.12Å; Y227-I231 HydrophobicContact CE1-CG1 3.7Å; Y227-I231 HydrophobicContact CE2-CG1 4.46Å; Y227-I231 PolarHBondContact O-N 3.08Å; S228-I231 PolarHBondContact O-N 3.41Å; I231-T233 VanDerWaalsContact C-N 3.32Å; I231-T233 PolarHBondContact O-N 2.92Å; I231-T234 PolarHBondContact O-N 3.16Å; I231-S235 WeakPolarHBondContact O-CB 3.48Å; I231-S235 PolarHBondContact O-N 3.18Å; I231-S235 PolarHBondContact O-OG 3.29Å; I231-Q296 VanDerWaalsContact CG2-NE2 3.35Å
232L82.9Confident83Confident44 Ų4455.1 Ų55.123%0.2329%0.288CS..Hα-helixtrans-62.1-41.4-178.3-171.675000111.1S228 C229 Y236 L293 Q296 L300S228-L232 WeakPolarHBondContact O-CB 3.38Å; S228-L232 PolarHBondContact O-N 3.44Å; C229-L232 PolarHBondContact O-N 3.31Å; L232-Y236 HydrophobicContact CD1-CD2 4.13Å; L232-Y236 HydrophobicContact CD1-CE2 3.72Å; L232-Y236 WeakPolarHBondContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CD2 3.24Å; L232-Y236 PolarHBondContact O-N 3.41Å; L232-L293 HydrophobicContact CD1-CD1 4.47Å; L232-Q296 HydrophobicContact CD1-CB 3.73Å; L232-Q296 HydrophobicContact CD1-CG 4.46Å; L232-L300 HydrophobicContact CD2-CD2 4.32Å
233T83.5Confident83.3Confident76 Ų7649.3 Ų49.347%0.46626%0.258SS..Hα-helixtrans-69.7-49.7179.2-55.50000110.7C229 F230 I231 S235 Y236 M237C229-T233 WeakPolarHBondContact O-CB 3.42Å; C229-T233 PolarHBondContact O-N 3.15Å; C229-T233 PolarHBondContact O-OG1 3.5Å; F230-T233 PolarHBondContact O-N 3Å; I231-T233 VanDerWaalsContact C-N 3.32Å; I231-T233 PolarHBondContact O-N 2.92Å; T233-S235 PolarHBondContact O-N 2.96Å; T233-Y236 PolarHBondContact O-N 3.37Å; T233-M237 HydrophobicContact CG2-CB 4.46Å; T233-M237 HydrophobicContact CG2-CG 3.81Å; T233-M237 WeakPolarHBondContact O-CB 3.24Å; T233-M237 VanDerWaalsContact O-CG 3.27Å; T233-M237 WeakPolarHBondContact O-CG 3.23Å; T233-M237 PolarHBondContact O-N 3.42Å
234T81.8Confident83.5Confident19 Ų1948.7 Ų48.712%0.11726%0.26CS..Hα-helixtrans-64.6-43.8-176.1-58.80000111.6F146 F230 I231 Y236 I238F146-T234 HydrophobicContact CE1-CG2 4.24Å; F230-T234 WeakPolarHBondContact CE2-OG1 3.48Å; F230-T234 HydrophobicContact CZ-CG2 4.42Å; F230-T234 WeakPolarHBondContact CZ-OG1 3.17Å; F230-T234 WeakPolarHBondContact O-CB 3.33Å; F230-T234 PolarHBondContact O-N 2.88Å; F230-T234 PolarHBondContact O-OG1 3.22Å; I231-T234 PolarHBondContact O-N 3.16Å; T234-Y236 PolarHBondContact O-N 3.02Å; T234-I238 HydrophobicContact CG2-CD1 3.56Å; T234-I238 HydrophobicContact CG2-CG1 4.47Å; T234-I238 WeakPolarHBondContact O-CB 3.43Å; T234-I238 WeakPolarHBondContact O-CG1 3.48Å; T234-I238 PolarHBondContact O-N 2.84Å
235S79.7Confident83.7Confident5 Ų551.1 Ų51.14%0.03528%0.276CS..Hα-helixtrans-71.9-17.7-175.9-54.30000113.5I231 T233 P239I231-S235 WeakPolarHBondContact O-CB 3.48Å; I231-S235 PolarHBondContact O-N 3.18Å; I231-S235 PolarHBondContact O-OG 3.29Å; T233-S235 PolarHBondContact O-N 2.96Å; S235-P239 WeakPolarHBondContact O-CD 3.25Å; S235-P239 WeakPolarHBondContact O-CG 3.31Å
236Y82.3Confident83.6Confident26 Ų2649.1 Ų49.110%0.10227%0.265CS..Hα-helixtrans-111.4-48-177.1-70.5-105.7000111.9L232 T233 T234 P239 L240 A289 W292 L293L232-Y236 HydrophobicContact CD1-CD2 4.13Å; L232-Y236 HydrophobicContact CD1-CE2 3.72Å; L232-Y236 WeakPolarHBondContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CD2 3.24Å; L232-Y236 PolarHBondContact O-N 3.41Å; T233-Y236 PolarHBondContact O-N 3.37Å; T234-Y236 PolarHBondContact O-N 3.02Å; Y236-P239 WeakPolarHBondContact O-CD 3.37Å; Y236-L240 WeakPolarHBondContact O-CB 3.35Å; Y236-L240 WeakPolarHBondContact O-CD1 3.2Å; Y236-L240 WeakPolarHBondContact O-CG 3.09Å; Y236-L240 PolarHBondContact O-N 3.21Å; Y236-A289 HydrophobicContact CD1-CB 4.02Å; Y236-A289 HydrophobicContact CE1-CB 3.8Å; Y236-A289 PolarHBondContact OH-O 2.76Å; Y236-W292 VanDerWaalsContact OH-C 3.31Å; Y236-L293 HydrophobicContact CE1-CB 4.26Å; Y236-L293 HydrophobicContact CE1-CD1 3.96Å; Y236-L293 WeakPolarHBondContact OH-CA 3.38Å; Y236-L293 WeakPolarHBondContact OH-CB 3.29Å; Y236-L293 PolarHBondContact OH-N 3.33Å
237M84.7Confident83.5Confident101 Ų10150.1 Ų50.150%0.49826%0.262SS..Hα-helixtrans-67.3-42.4-176.2-62.1-60.3160.600111.6T233 L240 L241T233-M237 HydrophobicContact CG2-CB 4.46Å; T233-M237 HydrophobicContact CG2-CG 3.81Å; T233-M237 WeakPolarHBondContact O-CB 3.24Å; T233-M237 VanDerWaalsContact O-CG 3.27Å; T233-M237 WeakPolarHBondContact O-CG 3.23Å; T233-M237 PolarHBondContact O-N 3.42Å; M237-L240 PolarHBondContact O-N 3.25Å; M237-L241 HydrophobicContact CB-CD1 4.46Å; M237-L241 VanDerWaalsContact O-CB 3.23Å; M237-L241 WeakPolarHBondContact O-CB 3.21Å; M237-L241 WeakPolarHBondContact O-CD1 3.33Å; M237-L241 WeakPolarHBondContact O-CG 3.41Å; M237-L241 PolarHBondContact O-N 2.87Å
238I85.4Confident83.4Confident67 Ų6752.4 Ų52.434%0.34428%0.282SS..Hα-helixtrans-62.9-52.5-178.1-62.1179.8000111.3T153 T234 L240 S242T153-I238 HydrophobicContact CG2-CG2 3.95Å; T234-I238 HydrophobicContact CG2-CD1 3.56Å; T234-I238 HydrophobicContact CG2-CG1 4.47Å; T234-I238 WeakPolarHBondContact O-CB 3.43Å; T234-I238 WeakPolarHBondContact O-CG1 3.48Å; T234-I238 PolarHBondContact O-N 2.84Å; I238-L240 PolarHBondContact O-N 3.36Å; I238-S242 VanDerWaalsContact O-CB 3.31Å; I238-S242 WeakPolarHBondContact O-CB 3.46Å; I238-S242 PolarHBondContact O-N 3.35Å
239P82.3Confident83.2Confident5 Ų552.6 Ų52.63%0.03228%0.284CS..Hα-helixtrans-63-43.6177.1-25.837.3000112.8V149 S235 Y236 S242 V243 V285V149-P239 HydrophobicContact CB-CG 4.21Å; V149-P239 HydrophobicContact CG1-CG 3.41Å; V149-P239 VanDerWaalsContact CG1-CG 3.41Å; V149-P239 HydrophobicContact CG2-CG 4.37Å; S235-P239 WeakPolarHBondContact O-CD 3.25Å; S235-P239 WeakPolarHBondContact O-CG 3.31Å; Y236-P239 WeakPolarHBondContact O-CD 3.37Å; P239-S242 PolarHBondContact O-N 3.45Å; P239-V243 WeakPolarHBondContact O-CB 3.46Å; P239-V243 VanDerWaalsContact O-CG2 3.23Å; P239-V243 WeakPolarHBondContact O-CG2 3.5Å; P239-V243 PolarHBondContact O-N 2.81Å; P239-V285 HydrophobicContact CB-CG1 3.71Å
240L83.9Confident82.7Confident69 Ų6950.6 Ų50.636%0.36127%0.27SS..Hα-helixtrans-64.4-44-177.4-71.8172.8000111.9Y236 M237 I238 S244Y236-L240 WeakPolarHBondContact O-CB 3.35Å; Y236-L240 WeakPolarHBondContact O-CD1 3.2Å; Y236-L240 WeakPolarHBondContact O-CG 3.09Å; Y236-L240 PolarHBondContact O-N 3.21Å; M237-L240 PolarHBondContact O-N 3.25Å; I238-L240 PolarHBondContact O-N 3.36Å; L240-S244 WeakPolarHBondContact O-CB 3.36Å; L240-S244 PolarHBondContact O-N 2.92Å; L240-S244 PolarHBondContact O-OG 3.44Å
241L86.8Confident82.3Confident105 Ų10548.8 Ų48.855%0.5527%0.266SS..Hα-helixtrans-63.7-45.2176.2-71.1171000111M237 V243 S244 I245M237-L241 HydrophobicContact CB-CD1 4.46Å; M237-L241 VanDerWaalsContact O-CB 3.23Å; M237-L241 WeakPolarHBondContact O-CB 3.21Å; M237-L241 WeakPolarHBondContact O-CD1 3.33Å; M237-L241 WeakPolarHBondContact O-CG 3.41Å; M237-L241 PolarHBondContact O-N 2.87Å; L241-V243 PolarHBondContact O-N 3.43Å; L241-S244 PolarHBondContact O-N 3.01Å; L241-I245 WeakPolarHBondContact O-CB 3.35Å; L241-I245 VanDerWaalsContact O-CG1 3.26Å; L241-I245 WeakPolarHBondContact O-CG1 3.14Å; L241-I245 PolarHBondContact O-N 2.96Å
242S84.3Confident82.1Confident14 Ų1451.5 Ų51.510%0.09828%0.283CS..Hα-helixtrans-61.3-45.1179.6-1740000112.4T153 A156 I238 P239 S246T153-S242 PolarHBondContact O-OG 3.03Å; A156-S242 WeakPolarHBondContact CB-OG 3.46Å; I238-S242 VanDerWaalsContact O-CB 3.31Å; I238-S242 WeakPolarHBondContact O-CB 3.46Å; I238-S242 PolarHBondContact O-N 3.35Å; P239-S242 PolarHBondContact O-N 3.45Å; S242-S246 VanDerWaalsContact O-CB 3.3Å; S242-S246 WeakPolarHBondContact O-CB 3.47Å; S242-S246 PolarHBondContact O-N 3.45Å; S242-S246 PolarHBondContact O-OG 3.02Å
243V82.9Confident81.7Confident13 Ų1350.4 Ų50.48%0.07928%0.279CS..Hα-helixtrans-64.2-43.81751740000111.2P239 L241 S246 Y247 L281 V282 V285P239-V243 WeakPolarHBondContact O-CB 3.46Å; P239-V243 VanDerWaalsContact O-CG2 3.23Å; P239-V243 WeakPolarHBondContact O-CG2 3.5Å; P239-V243 PolarHBondContact O-N 2.81Å; L241-V243 PolarHBondContact O-N 3.43Å; V243-S246 PolarHBondContact O-N 3.45Å; V243-Y247 VanDerWaalsContact O-CB 3.26Å; V243-Y247 WeakPolarHBondContact O-CB 3.15Å; V243-Y247 PolarHBondContact O-N 2.67Å; V243-L281 HydrophobicContact CG1-CD2 4.34Å; V243-L281 HydrophobicContact CG2-CD2 3.75Å; V243-V282 HydrophobicContact CG1-CB 4.38Å; V243-V282 HydrophobicContact CG1-CG2 3.53Å; V243-V285 HydrophobicContact CG2-CB 4.06Å; V243-V285 HydrophobicContact CG2-CG1 4.12Å; V243-V285 HydrophobicContact CG2-CG2 3.63Å
244S84.9Confident81.2Confident64 Ų6448.2 Ų48.245%0.44827%0.265SS..Hα-helixtrans-63.2-48.3-178.5-61.80000111.6L240 L241 S246 Y247 C248L240-S244 WeakPolarHBondContact O-CB 3.36Å; L240-S244 PolarHBondContact O-N 2.92Å; L240-S244 PolarHBondContact O-OG 3.44Å; L241-S244 PolarHBondContact O-N 3.01Å; S244-S246 VanDerWaalsContact C-N 3.33Å; S244-S246 PolarHBondContact O-N 3.37Å; S244-Y247 PolarHBondContact O-N 3.31Å; S244-C248 WeakPolarHBondContact O-CB 3.43Å; S244-C248 PolarHBondContact O-N 2.95Å; S244-C248 PolarHBondContact O-SG 2.96Å
245I83.6Confident80.8Confident104 Ų10454.9 Ų54.953%0.53329%0.292SS..Hα-helixtrans-59.6-46.7176.5-68.1166.3000110.1L241 Y247 C248 A249L241-I245 WeakPolarHBondContact O-CB 3.35Å; L241-I245 VanDerWaalsContact O-CG1 3.26Å; L241-I245 WeakPolarHBondContact O-CG1 3.14Å; L241-I245 PolarHBondContact O-N 2.96Å; I245-Y247 PolarHBondContact O-N 2.91Å; I245-C248 PolarHBondContact O-N 2.85Å; I245-A249 WeakPolarHBondContact O-CB 3.49Å; I245-A249 PolarHBondContact O-N 2.85Å
246S80.1Confident80.4Confident3 Ų364.4 Ų64.42%0.02133%0.327CS..Hα-helixtrans-58.5-51.7177.9-59.80000110.7A156 S242 V243 S244 C248 A249 I250A156-S246 PolarHBondContact O-OG 3.16Å; S242-S246 VanDerWaalsContact O-CB 3.3Å; S242-S246 WeakPolarHBondContact O-CB 3.47Å; S242-S246 PolarHBondContact O-N 3.45Å; S242-S246 PolarHBondContact O-OG 3.02Å; V243-S246 PolarHBondContact O-N 3.45Å; S244-S246 VanDerWaalsContact C-N 3.33Å; S244-S246 PolarHBondContact O-N 3.37Å; S246-C248 PolarHBondContact O-N 2.75Å; S246-A249 PolarHBondContact O-N 3.07Å; S246-I250 VanDerWaalsContact C-CD1 3.5Å; S246-I250 WeakPolarHBondContact O-CD1 2.99Å; S246-I250 WeakPolarHBondContact O-CG1 3.26Å; S246-I250 PolarHBondContact O-N 3.48Å; S246-I250 VanDerWaalsContact O-N 3.07Å
247Y81.9Confident79.5Confident136 Ų13670.4 Ų70.453%0.53335%0.351SS..Hα-helixtrans-58.4-46.7-179.6-173.9-96.5000112.9V243 S244 I245 I250 T251V243-Y247 VanDerWaalsContact O-CB 3.26Å; V243-Y247 WeakPolarHBondContact O-CB 3.15Å; V243-Y247 PolarHBondContact O-N 2.67Å; S244-Y247 PolarHBondContact O-N 3.31Å; I245-Y247 PolarHBondContact O-N 2.91Å; Y247-I250 PolarHBondContact O-N 3.46Å; Y247-T251 WeakPolarHBondContact O-CB 3.29Å; Y247-T251 PolarHBondContact O-N 3.39Å; Y247-T251 PolarHBondContact O-OG1 3.49Å
248C82.4Confident78.3Confident77 Ų7770 Ų7052%0.5236%0.358SS..Hα-helixtrans-60-49.6176.8-73.70000111.3S244 I245 S246 I250 T251 V252S244-C248 WeakPolarHBondContact O-CB 3.43Å; S244-C248 PolarHBondContact O-N 2.95Å; S244-C248 PolarHBondContact O-SG 2.96Å; I245-C248 PolarHBondContact O-N 2.85Å; S246-C248 PolarHBondContact O-N 2.75Å; C248-I250 VanDerWaalsContact C-N 3.28Å; C248-I250 PolarHBondContact O-N 3.07Å; C248-T251 PolarHBondContact O-N 3.29Å; C248-V252 WeakPolarHBondContact O-CG2 3.23Å; C248-V252 PolarHBondContact O-N 3.05Å
249A77.8Confident77Confident26 Ų2672 Ų7222%0.21537%0.373CS..Hα-helixtrans-59.4-39.1-179.600000112.9Y160 I245 S246 S253Y160-A249 HydrophobicContact CD2-CB 3.4Å; Y160-A249 HydrophobicContact CE2-CB 3.33Å; I245-A249 WeakPolarHBondContact O-CB 3.49Å; I245-A249 PolarHBondContact O-N 2.85Å; S246-A249 PolarHBondContact O-N 3.07Å; A249-S253 VanDerWaalsContact O-CB 3.26Å; A249-S253 WeakPolarHBondContact O-CB 3.01Å; A249-S253 PolarHBondContact O-N 3.46Å
250I74.2Confident75.5Confident7 Ų778.2 Ų78.24%0.03641%0.413CS..Hα-helixtrans-69.4-44.6177.9-60.2144.6000110.8V163 S246 Y247 C248 V252 S253 L254 F278V163-I250 HydrophobicContact CB-CG1 4.09Å; V163-I250 HydrophobicContact CG1-CB 4.21Å; V163-I250 HydrophobicContact CG1-CG1 3.78Å; V163-I250 HydrophobicContact CG1-CG2 4.35Å; V163-I250 HydrophobicContact CG2-CG1 4.06Å; S246-I250 VanDerWaalsContact C-CD1 3.5Å; S246-I250 WeakPolarHBondContact O-CD1 2.99Å; S246-I250 WeakPolarHBondContact O-CG1 3.26Å; S246-I250 PolarHBondContact O-N 3.48Å; S246-I250 VanDerWaalsContact O-N 3.07Å; Y247-I250 PolarHBondContact O-N 3.46Å; C248-I250 VanDerWaalsContact C-N 3.28Å; C248-I250 PolarHBondContact O-N 3.07Å; I250-V252 VanDerWaalsContact C-N 3.26Å; I250-V252 PolarHBondContact O-N 2.89Å; I250-S253 PolarHBondContact O-N 2.68Å; I250-L254 HydrophobicContact CG2-CD1 3.83Å; I250-L254 HydrophobicContact CG2-CG 4.13Å; I250-L254 WeakPolarHBondContact O-CB 3.41Å; I250-L254 VanDerWaalsContact O-CG 3.31Å; I250-L254 WeakPolarHBondContact O-CG 3.47Å; I250-L254 PolarHBondContact O-N 3.26Å; I250-F278 HydrophobicContact CD1-CD1 3.28Å; I250-F278 HydrophobicContact CD1-CD2 3.6Å; I250-F278 HydrophobicContact CD1-CE1 3.01Å; I250-F278 HydrophobicContact CD1-CE2 3.41Å; I250-F278 VanDerWaalsContact CD1-CE2 3.41Å; I250-F278 HydrophobicContact CD1-CG 3.56Å; I250-F278 HydrophobicContact CD1-CZ 3.1Å; I250-F278 HydrophobicContact CG1-CD2 4.34Å; I250-F278 HydrophobicContact CG1-CE1 4.06Å; I250-F278 HydrophobicContact CG1-CE2 3.84Å; I250-F278 HydrophobicContact CG1-CZ 3.67Å; I250-F278 HydrophobicContact CG2-CD2 4.32Å; I250-F278 HydrophobicContact CG2-CE2 4.23Å
251T78.7Confident74.5Confident46 Ų4677.7 Ų77.728%0.28242%0.424SS..Hα-helixtrans-60-42.4179.2-59.40000110.4Y247 C248 K255Y247-T251 WeakPolarHBondContact O-CB 3.29Å; Y247-T251 PolarHBondContact O-N 3.39Å; Y247-T251 PolarHBondContact O-OG1 3.49Å; C248-T251 PolarHBondContact O-N 3.29Å; T251-K255 WeakPolarHBondContact O-CB 2.95Å; T251-K255 WeakPolarHBondContact O-CG 3.4Å; T251-K255 PolarHBondContact O-N 2.97Å; T251-K255 VanDerWaalsContact O-N 3.07Å
252V80.3Confident73.2Confident74 Ų7481.4 Ų81.445%0.44844%0.439SS..Hα-helixtrans-65.4-45.7174.3173.70000111.5C248 I250 L254 K255 R256C248-V252 WeakPolarHBondContact O-CG2 3.23Å; C248-V252 PolarHBondContact O-N 3.05Å; I250-V252 VanDerWaalsContact C-N 3.26Å; I250-V252 PolarHBondContact O-N 2.89Å; V252-L254 PolarHBondContact O-N 3.39Å; V252-K255 PolarHBondContact O-N 3.27Å; V252-R256 HydrophobicContact CG1-CG 4.44Å; V252-R256 WeakPolarHBondContact O-CG 3.22Å; V252-R256 PolarHBondContact O-N 3.5Å
253S74.9Confident72.3Confident21 Ų2183.5 Ų83.515%0.14745%0.452CS..Hα-helixtrans-60.6-44.6179-177.60000112A249 I250 K255 R256 Y257A249-S253 VanDerWaalsContact O-CB 3.26Å; A249-S253 WeakPolarHBondContact O-CB 3.01Å; A249-S253 PolarHBondContact O-N 3.46Å; I250-S253 PolarHBondContact O-N 2.68Å; S253-K255 PolarHBondContact O-N 3.24Å; S253-R256 PolarHBondContact O-N 2.79Å; S253-Y257 WeakPolarHBondContact O-CB 3.28Å; S253-Y257 PolarHBondContact O-N 2.02Å
254L72.3Confident71.6Confident31 Ų3185.6 Ų85.616%0.16247%0.467CS..Hα-helixtrans-65.5-37177-70.4177.1000112.4I250 V252 S258 S271 K275I250-L254 HydrophobicContact CG2-CD1 3.83Å; I250-L254 HydrophobicContact CG2-CG 4.13Å; I250-L254 WeakPolarHBondContact O-CB 3.41Å; I250-L254 VanDerWaalsContact O-CG 3.31Å; I250-L254 WeakPolarHBondContact O-CG 3.47Å; I250-L254 PolarHBondContact O-N 3.26Å; V252-L254 PolarHBondContact O-N 3.39Å; L254-S258 PolarHBondContact O-N 3.05Å; L254-S258 PolarHBondContact O-OG 2.9Å; L254-S271 WeakPolarHBondContact CD2-OG 3.46Å; L254-K275 HydrophobicContact CD1-CD 4.43Å; L254-K275 HydrophobicContact CD1-CG 4.06Å
255K73.6Confident70.8Confident159 Ų15986.6 Ų86.669%0.69147%0.474SS*.Hα-helixtrans-66.1-42.1173.3-76.3-178.6179.2-172.30111.7T251 V252 S253 S258T251-K255 WeakPolarHBondContact O-CB 2.95Å; T251-K255 WeakPolarHBondContact O-CG 3.4Å; T251-K255 PolarHBondContact O-N 2.97Å; T251-K255 VanDerWaalsContact O-N 3.07Å; V252-K255 PolarHBondContact O-N 3.27Å; S253-K255 PolarHBondContact O-N 3.24Å; K255-S258 PolarHBondContact O-N 3.39Å
256R70.9Confident69.9Low205 Ų20585.4 Ų85.477%0.77448%0.475SS*.Hα-helixtrans-70.1-33.8179.2-73.5-173.5-178.4-170.21.2113.8V252 S253 S258V252-R256 HydrophobicContact CG1-CG 4.44Å; V252-R256 WeakPolarHBondContact O-CG 3.22Å; V252-R256 PolarHBondContact O-N 3.5Å; S253-R256 PolarHBondContact O-N 2.79Å; R256-S258 VanDerWaalsContact C-N 3.31Å
257Y63.7Low69.4Low152 Ų15290.1 Ų90.160%0.59650%0.497SS*.Hα-helixtrans-81.2-8176.4-93.1-87.8000113.8S253 V259S253-Y257 WeakPolarHBondContact O-CB 3.28Å; S253-Y257 PolarHBondContact O-N 2.02Å; Y257-V259 PolarHBondContact O-N 3.44Å
258S58.8Low68.8Low92 Ų9288.1 Ų88.164%0.64349%0.492SS*.  trans-7969.7171.1-58.70000109.1L254 K255 R256L254-S258 PolarHBondContact O-N 3.05Å; L254-S258 PolarHBondContact O-OG 2.9Å; K255-S258 PolarHBondContact O-N 3.39Å; R256-S258 VanDerWaalsContact C-N 3.31Å
259V59.3Low68.2Low110 Ų11092.6 Ų92.667%0.66750%0.498SS*.  trans-63.1142.1168.2-177.20000107.9Y257 G261Y257-V259 PolarHBondContact O-N 3.44Å; V259-G261 PolarHBondContact O-N 3.16Å
260P50.7Low67.6Low135 Ų13597.5 Ų97.588%0.87751%0.512SS*.SBendtrans-61.9109.3178.6-1729.6000110.4
261G63Low67.4Low57 Ų5798.5 Ų98.559%0.58852%0.519SS*.SBendtrans164150.2-179.300000110.7V259 P263V259-G261 PolarHBondContact O-N 3.16Å; G261-P263 WeakPolarHBondContact O-CD 3.3Å
262E58.8Low67.1Low183 Ų183102.6 Ų102.686%0.85554%0.535SS*.  trans-56.6111.3179-168.685.1-139.600109.3S264E262-S264 PolarHBondContact O-N 3.49Å
263P64.4Low66.7Low59 Ų59107.9 Ų107.938%0.38355%0.547SS..  trans-66.2129.3-179.426.6-32.6000108.7G261 S265 Q268G261-P263 WeakPolarHBondContact O-CD 3.3Å; P263-S265 PolarHBondContact O-N 2.96Å; P263-Q268 HydrophobicContact CB-CG 4.08Å; P263-Q268 HydrophobicContact CG-CG 3.75Å
264S68.5Low66.6Low56 Ų56108.7 Ų108.739%0.39255%0.547SS..  trans-53.3143.5176.6710000110.8E262 S266 Q267 Q268E262-S264 PolarHBondContact O-N 3.49Å; S264-S266 PolarHBondContact O-N 3.31Å; S264-S266 PolarHBondContact OG-OG 3.32Å; S264-S266 VanDerWaalsContact OG-OG 3.09Å; S264-Q267 WeakPolarHBondContact O-CA 3.42Å; S264-Q267 WeakPolarHBondContact O-CB 3.45Å; S264-Q267 PolarHBondContact O-N 3.39Å; S264-Q267 WeakPolarHBondContact OG-CB 3.42Å; S264-Q267 PolarHBondContact OG-OE1 3.19Å; S264-Q268 PolarHBondContact O-N 2.93Å; S264-Q268 VanDerWaalsContact O-N 3.1Å
265S69.6Low66.7Low85 Ų85112.8 Ų112.859%0.59456%0.563SS**Hα-helixtrans-56.1-27.6-176.263.30000113.3P263 R269P263-S265 PolarHBondContact O-N 2.96Å; S265-R269 WeakPolarHBondContact O-CB 3.48Å; S265-R269 VanDerWaalsContact O-CG 3.32Å; S265-R269 WeakPolarHBondContact O-CG 3.49Å; S265-R269 PolarHBondContact O-N 3.45Å
266S64.9Low67Low80 Ų80109 Ų10956%0.55955%0.547SS*.Hα-helixtrans-70.5-38.2173.760.10000112.5S264 R269 W270S264-S266 PolarHBondContact O-N 3.31Å; S264-S266 PolarHBondContact OG-OG 3.32Å; S264-S266 VanDerWaalsContact OG-OG 3.09Å; S266-R269 PolarHBondContact O-N 3.09Å; S266-W270 WeakPolarHBondContact O-CB 3.39Å; S266-W270 PolarHBondContact O-N 3.31Å
267Q68.1Low67.3Low101 Ų101100.5 Ų100.547%0.47252%0.518SS..Hα-helixtrans-73.4-39.5-179.6-152.8146.1-4.600111.9S264 W270 S271S264-Q267 WeakPolarHBondContact O-CA 3.42Å; S264-Q267 WeakPolarHBondContact O-CB 3.45Å; S264-Q267 PolarHBondContact O-N 3.39Å; S264-Q267 WeakPolarHBondContact OG-CB 3.42Å; S264-Q267 PolarHBondContact OG-OE1 3.19Å; Q267-W270 PolarHBondContact O-N 3.28Å; Q267-S271 WeakPolarHBondContact O-CB 3.19Å; Q267-S271 PolarHBondContact O-N 3.31Å
268Q70.2Confident67.9Low94 Ų9493.8 Ų93.844%0.43949%0.492SS..Hα-helixtrans-60.4-49.4169.2-88.1-179-19.700111.9P263 S264 W270 S271 Q272P263-Q268 HydrophobicContact CB-CG 4.08Å; P263-Q268 HydrophobicContact CG-CG 3.75Å; S264-Q268 PolarHBondContact O-N 2.93Å; S264-Q268 VanDerWaalsContact O-N 3.1Å; Q268-W270 VanDerWaalsContact C-N 3.28Å; Q268-W270 PolarHBondContact O-N 2.92Å; Q268-S271 PolarHBondContact O-N 2.99Å; Q268-Q272 WeakPolarHBondContact O-CG 3.45Å; Q268-Q272 PolarHBondContact O-N 3.48Å
269R68.9Low69Low171 Ų17193.8 Ų93.865%0.64549%0.488SS*.Hα-helixtrans-60.6-37.3178-79.1174.7175.3179.60.6112.3S265 S266 R273S265-R269 WeakPolarHBondContact O-CB 3.48Å; S265-R269 VanDerWaalsContact O-CG 3.32Å; S265-R269 WeakPolarHBondContact O-CG 3.49Å; S265-R269 PolarHBondContact O-N 3.45Å; S266-R269 PolarHBondContact O-N 3.09Å; R269-R273 WeakPolarHBondContact O-CG 3.38Å; R269-R273 PolarHBondContact O-N 3.21Å
270W65Low70.1Confident130 Ų13089.7 Ų89.749%0.49246%0.462SS..Hα-helixtrans-69.1-43.1177.5-177.389.6000112.7S266 Q267 Q268 R273 R274S266-W270 WeakPolarHBondContact O-CB 3.39Å; S266-W270 PolarHBondContact O-N 3.31Å; Q267-W270 PolarHBondContact O-N 3.28Å; Q268-W270 VanDerWaalsContact C-N 3.28Å; Q268-W270 PolarHBondContact O-N 2.92Å; W270-R273 PolarHBondContact O-N 3.24Å; W270-R274 PolarHBondContact O-N 2.91Å
271S70.1Confident71.6Confident28 Ų2883.6 Ų83.620%0.19642%0.422CS..Hα-helixtrans-59.8-44.5173.2177.20000111.9L254 Q267 Q268 R274 K275L254-S271 WeakPolarHBondContact CD2-OG 3.46Å; Q267-S271 WeakPolarHBondContact O-CB 3.19Å; Q267-S271 PolarHBondContact O-N 3.31Å; Q268-S271 PolarHBondContact O-N 2.99Å; S271-R274 PolarHBondContact O-N 3.41Å; S271-K275 WeakPolarHBondContact O-CG 3.39Å; S271-K275 PolarHBondContact O-N 3.04Å
272Q72.6Confident72.6Confident131 Ų13182.9 Ų82.961%0.61241%0.406SS*.Hα-helixtrans-63.3-43176.6-72.7-176.6-0.400112.7Q268 R274 K275 K276Q268-Q272 WeakPolarHBondContact O-CG 3.45Å; Q268-Q272 PolarHBondContact O-N 3.48Å; Q272-R274 VanDerWaalsContact C-N 3.34Å; Q272-R274 PolarHBondContact O-N 2.88Å; Q272-K275 PolarHBondContact O-N 3.46Å; Q272-K276 WeakPolarHBondContact O-CB 3.3Å; Q272-K276 PolarHBondContact O-N 3.28Å
273R72.4Confident74Confident186 Ų18676 Ų7670%0.70238%0.38SS*.Hα-helixtrans-62.2-40.8176-76.2178.2-177.7-172.82.3112R269 W270 T277R269-R273 WeakPolarHBondContact O-CG 3.38Å; R269-R273 PolarHBondContact O-N 3.21Å; W270-R273 PolarHBondContact O-N 3.24Å; R273-T277 PolarHBondContact O-N 3.42Å; R273-T277 PolarHBondContact O-OG1 3.25Å
274R73.1Confident75.1Confident38 Ų3873.1 Ų73.114%0.14336%0.362CS..Hα-helixtrans-60.3-57.2173.4-79.8-177.6165.3-158.5-7.3110.4V162 W270 S271 Q272 K276 T277 F278V162-R274 PolarHBondContact O-NH2 3.44Å; V162-R274 VanDerWaalsContact O-NH2 3.14Å; W270-R274 PolarHBondContact O-N 2.91Å; S271-R274 PolarHBondContact O-N 3.41Å; Q272-R274 VanDerWaalsContact C-N 3.34Å; Q272-R274 PolarHBondContact O-N 2.88Å; R274-K276 VanDerWaalsContact C-N 3.29Å; R274-K276 PolarHBondContact O-N 2.87Å; R274-T277 WeakPolarHBondContact O-CA 3.45Å; R274-T277 WeakPolarHBondContact O-CB 3.31Å; R274-T277 PolarHBondContact O-N 2.94Å; R274-F278 HydrophobicContact CB-CD2 4.48Å; R274-F278 HydrophobicContact CB-CE2 4.32Å; R274-F278 WeakPolarHBondContact O-CD2 3.43Å; R274-F278 PolarHBondContact O-N 3.27Å
275K74.6Confident76Confident117 Ų11770.7 Ų70.751%0.50935%0.345SS..Hα-helixtrans-50.6-48.3178.4-74-175.2-177.1-175.30111.9L254 S271 Q272 T277 F278 T279L254-K275 HydrophobicContact CD1-CD 4.43Å; L254-K275 HydrophobicContact CD1-CG 4.06Å; S271-K275 WeakPolarHBondContact O-CG 3.39Å; S271-K275 PolarHBondContact O-N 3.04Å; Q272-K275 PolarHBondContact O-N 3.46Å; K275-T277 PolarHBondContact O-N 3.38Å; K275-F278 WeakPolarHBondContact O-CB 3.23Å; K275-F278 PolarHBondContact O-N 3.31Å; K275-F278 VanDerWaalsContact O-N 3.14Å; K275-T279 PolarHBondContact O-N 3.44Å; K275-T279 PolarHBondContact O-OG1 2.85Å
276K80.1Confident76.9Confident78 Ų7870.6 Ų70.634%0.33934%0.337SS..Hα-helixtrans-58.5-44.3176.9-176.4-179.5175.3-167.10112.7Q272 R274 F278 T279 L280 S340Q272-K276 WeakPolarHBondContact O-CB 3.3Å; Q272-K276 PolarHBondContact O-N 3.28Å; R274-K276 VanDerWaalsContact C-N 3.29Å; R274-K276 PolarHBondContact O-N 2.87Å; K276-F278 VanDerWaalsContact C-N 3.27Å; K276-F278 PolarHBondContact O-N 3.3Å; K276-T279 PolarHBondContact O-N 3.3Å; K276-L280 HydrophobicContact CG-CD1 4.28Å; K276-L280 VanDerWaalsContact O-CG 3.27Å; K276-L280 WeakPolarHBondContact O-CG 3.41Å; K276-L280 PolarHBondContact O-N 2.97Å; K276-S340 PolarHBondContact NZ-O 3.26Å; K276-S340 VanDerWaalsContact NZ-O 3.13Å
277T76.8Confident78.1Confident28 Ų2867.9 Ų67.917%0.17232%0.32CS..Hα-helixtrans-60.1-40177.4-51.50000111.3R273 R274 K275 L280 L281 L341R273-T277 PolarHBondContact O-N 3.42Å; R273-T277 PolarHBondContact O-OG1 3.25Å; R274-T277 WeakPolarHBondContact O-CA 3.45Å; R274-T277 WeakPolarHBondContact O-CB 3.31Å; R274-T277 PolarHBondContact O-N 2.94Å; K275-T277 PolarHBondContact O-N 3.38Å; T277-L280 PolarHBondContact O-N 2.91Å; T277-L281 PolarHBondContact O-N 3.4Å; T277-L341 HydrophobicContact CG2-CD1 4.05Å; T277-L341 HydrophobicContact CG2-CD2 4.17Å; T277-L341 WeakPolarHBondContact OG1-CD1 3.01Å
278F75.3Confident79Confident10 Ų1063.6 Ų63.64%0.04430%0.3CS..Hα-helixtrans-71.2-42.5176.8-73.5-70.9000113.3R159 V163 I250 R274 K275 K276 L280 L281 V282R159-F278 HydrophobicContact CB-CD1 4.43Å; R159-F278 HydrophobicContact CB-CE1 3.35Å; R159-F278 HydrophobicContact CB-CZ 3.62Å; R159-F278 HydrophobicContact CG-CE1 4.07Å; R159-F278 HydrophobicContact CG-CZ 4.32Å; V163-F278 HydrophobicContact CG2-CE2 4Å; V163-F278 HydrophobicContact CG2-CZ 3.84Å; I250-F278 HydrophobicContact CD1-CD1 3.28Å; I250-F278 HydrophobicContact CD1-CD2 3.6Å; I250-F278 HydrophobicContact CD1-CE1 3.01Å; I250-F278 HydrophobicContact CD1-CE2 3.41Å; I250-F278 VanDerWaalsContact CD1-CE2 3.41Å; I250-F278 HydrophobicContact CD1-CG 3.56Å; I250-F278 HydrophobicContact CD1-CZ 3.1Å; I250-F278 HydrophobicContact CG1-CD2 4.34Å; I250-F278 HydrophobicContact CG1-CE1 4.06Å; I250-F278 HydrophobicContact CG1-CE2 3.84Å; I250-F278 HydrophobicContact CG1-CZ 3.67Å; I250-F278 HydrophobicContact CG2-CD2 4.32Å; I250-F278 HydrophobicContact CG2-CE2 4.23Å; R274-F278 HydrophobicContact CB-CD2 4.48Å; R274-F278 HydrophobicContact CB-CE2 4.32Å; R274-F278 WeakPolarHBondContact O-CD2 3.43Å; R274-F278 PolarHBondContact O-N 3.27Å; K275-F278 WeakPolarHBondContact O-CB 3.23Å; K275-F278 PolarHBondContact O-N 3.31Å; K275-F278 VanDerWaalsContact O-N 3.14Å; K276-F278 VanDerWaalsContact C-N 3.27Å; K276-F278 PolarHBondContact O-N 3.3Å; F278-L280 PolarHBondContact O-N 2.81Å; F278-L281 WeakPolarHBondContact O-CB 3.35Å; F278-L281 PolarHBondContact O-N 3.25Å; F278-V282 WeakPolarHBondContact O-CG2 3.3Å; F278-V282 PolarHBondContact O-N 3.09Å
279T81.8Confident79.9Confident92 Ų9259.9 Ų59.956%0.56429%0.285SS*.Hα-helixtrans-56.7-39.9173.3-55.90000110.7K275 K276 V282 A283K275-T279 PolarHBondContact O-N 3.44Å; K275-T279 PolarHBondContact O-OG1 2.85Å; K276-T279 PolarHBondContact O-N 3.3Å; T279-V282 PolarHBondContact O-N 2.88Å; T279-A283 VanDerWaalsContact O-CB 3.29Å; T279-A283 WeakPolarHBondContact O-CB 3.28Å; T279-A283 PolarHBondContact O-N 2.92Å
280L83.9Confident80.9Confident25 Ų2557.2 Ų57.213%0.13128%0.283CS..Hα-helixtrans-68.1-36.5175.7-68.1173.3000112.7K276 T277 F278 A283 S284 I337 S340 L341K276-L280 HydrophobicContact CG-CD1 4.28Å; K276-L280 VanDerWaalsContact O-CG 3.27Å; K276-L280 WeakPolarHBondContact O-CG 3.41Å; K276-L280 PolarHBondContact O-N 2.97Å; T277-L280 PolarHBondContact O-N 2.91Å; F278-L280 PolarHBondContact O-N 2.81Å; L280-A283 PolarHBondContact O-N 3.11Å; L280-S284 PolarHBondContact O-N 3.44Å; L280-S284 PolarHBondContact O-OG 3.11Å; L280-I337 HydrophobicContact CB-CG2 3.86Å; L280-I337 HydrophobicContact CD2-CG2 3.96Å; L280-I337 HydrophobicContact CG-CG2 4.45Å; L280-I337 VanDerWaalsContact O-CG2 3.31Å; L280-I337 WeakPolarHBondContact O-CG2 3.31Å; L280-S340 WeakPolarHBondContact CD1-OG 3.32Å; L280-S340 VanDerWaalsContact CD2-OG 3.28Å; L280-S340 WeakPolarHBondContact CD2-OG 3.38Å; L280-L341 HydrophobicContact CD1-CB 3.78Å; L280-L341 HydrophobicContact CD1-CD1 3.79Å; L280-L341 HydrophobicContact CD1-CG 4.36Å
281L82.1Confident82.1Confident7 Ų751.6 Ų51.64%0.03726%0.263CS..Hα-helixtrans-67.5-42174.3-179.6129.1000112.7I155 A156 V243 T277 F278 A283 S284 V285I155-L281 HydrophobicContact CB-CD1 3.83Å; I155-L281 HydrophobicContact CG2-CD1 3.25Å; A156-L281 HydrophobicContact CB-CD1 4.4Å; A156-L281 HydrophobicContact CB-CD2 4.05Å; V243-L281 HydrophobicContact CG1-CD2 4.34Å; V243-L281 HydrophobicContact CG2-CD2 3.75Å; T277-L281 PolarHBondContact O-N 3.4Å; F278-L281 WeakPolarHBondContact O-CB 3.35Å; F278-L281 PolarHBondContact O-N 3.25Å; L281-A283 VanDerWaalsContact C-N 3.32Å; L281-S284 WeakPolarHBondContact CA-OG 3.46Å; L281-S284 PolarHBondContact O-N 2.85Å; L281-S284 PolarHBondContact O-OG 3.42Å; L281-V285 WeakPolarHBondContact O-CG2 2.98Å; L281-V285 PolarHBondContact O-N 3.33Å
282V84.3Confident83Confident41 Ų4150.8 Ų50.825%0.24826%0.256CS..Hα-helixtrans-60.8-46.1172.2174.30000109.4V243 F278 T279 S284 V285 L286V243-V282 HydrophobicContact CG1-CB 4.38Å; V243-V282 HydrophobicContact CG1-CG2 3.53Å; F278-V282 WeakPolarHBondContact O-CG2 3.3Å; F278-V282 PolarHBondContact O-N 3.09Å; T279-V282 PolarHBondContact O-N 2.88Å; V282-S284 VanDerWaalsContact C-N 3.35Å; V282-S284 PolarHBondContact O-N 3.39Å; V282-V285 PolarHBondContact O-N 3.24Å; V282-L286 HydrophobicContact CG1-CD1 3.76Å; V282-L286 HydrophobicContact CG1-CG 4.21Å; V282-L286 WeakPolarHBondContact O-CB 2.91Å; V282-L286 WeakPolarHBondContact O-CG 3.41Å; V282-L286 PolarHBondContact O-N 3.45Å
283A87.9Confident83.8Confident38 Ų3847.9 Ų47.931%0.31424%0.244SC..Hα-helixtrans-60.2-41.3177.600000112.4T279 L280 L281 A287T279-A283 VanDerWaalsContact O-CB 3.29Å; T279-A283 WeakPolarHBondContact O-CB 3.28Å; T279-A283 PolarHBondContact O-N 2.92Å; L280-A283 PolarHBondContact O-N 3.11Å; L281-A283 VanDerWaalsContact C-N 3.32Å; A283-A287 WeakPolarHBondContact O-CB 3.15Å; A283-A287 PolarHBondContact O-N 3.11Å
284S86.9Confident84.6Confident0 Ų041.5 Ų41.50%023%0.226CC..Hα-helixtrans-65.8-41.4176.856.60000112.3L280 L281 V282 A287 F288 Y338L280-S284 PolarHBondContact O-N 3.44Å; L280-S284 PolarHBondContact O-OG 3.11Å; L281-S284 WeakPolarHBondContact CA-OG 3.46Å; L281-S284 PolarHBondContact O-N 2.85Å; L281-S284 PolarHBondContact O-OG 3.42Å; V282-S284 VanDerWaalsContact C-N 3.35Å; V282-S284 PolarHBondContact O-N 3.39Å; S284-A287 PolarHBondContact O-N 3.25Å; S284-F288 WeakPolarHBondContact O-CB 3.03Å; S284-F288 PolarHBondContact O-N 2.86Å; S284-Y338 WeakPolarHBondContact CB-OH 3.28Å; S284-Y338 PolarHBondContact OG-OH 2.82Å; S284-Y338 VanDerWaalsContact OG-OH 3.13Å
285V87.3Confident85.3Confident5 Ų540.4 Ų40.43%0.0322%0.223CC..Hα-helixtrans-67.1-42.7178171.10000111.5L152 P239 V243 L281 V282 F288 A289L152-V285 HydrophobicContact CB-CG2 4.05Å; L152-V285 HydrophobicContact CD1-CG2 4.13Å; L152-V285 HydrophobicContact CD2-CG2 4.11Å; L152-V285 HydrophobicContact CG-CG2 4.32Å; P239-V285 HydrophobicContact CB-CG1 3.71Å; V243-V285 HydrophobicContact CG2-CB 4.06Å; V243-V285 HydrophobicContact CG2-CG1 4.12Å; V243-V285 HydrophobicContact CG2-CG2 3.63Å; L281-V285 WeakPolarHBondContact O-CG2 2.98Å; L281-V285 PolarHBondContact O-N 3.33Å; V282-V285 PolarHBondContact O-N 3.24Å; V285-F288 PolarHBondContact O-N 2.9Å; V285-A289 WeakPolarHBondContact O-CB 3.34Å; V285-A289 PolarHBondContact O-N 2.99Å
286L87.8Confident85.8Confident82 Ų8236.1 Ų36.143%0.42921%0.205SC..Hα-helixtrans-66.3-42.9176.2-69.7176.8000111.9V282 F288 A289 L290V282-L286 HydrophobicContact CG1-CD1 3.76Å; V282-L286 HydrophobicContact CG1-CG 4.21Å; V282-L286 WeakPolarHBondContact O-CB 2.91Å; V282-L286 WeakPolarHBondContact O-CG 3.41Å; V282-L286 PolarHBondContact O-N 3.45Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.13Å; L286-A289 PolarHBondContact O-N 2.83Å; L286-L290 WeakPolarHBondContact O-CB 2.99Å; L286-L290 VanDerWaalsContact O-CG 3.24Å; L286-L290 WeakPolarHBondContact O-CG 3.27Å; L286-L290 PolarHBondContact O-N 2.84Å
287A90.2Very high86.1Confident23 Ų2335.3 Ų35.319%0.1921%0.206CC..Hα-helixtrans-59.9-46.1176.600000111A283 S284 C291 Y333 I337A283-A287 WeakPolarHBondContact O-CB 3.15Å; A283-A287 PolarHBondContact O-N 3.11Å; S284-A287 PolarHBondContact O-N 3.25Å; A287-C291 VanDerWaalsContact O-CB 3.3Å; A287-C291 WeakPolarHBondContact O-CB 3.19Å; A287-C291 PolarHBondContact O-N 3.16Å; A287-C291 PolarHBondContact O-SG 2.82Å; A287-Y333 HydrophobicContact CB-CD2 4.25Å; A287-I337 HydrophobicContact CB-CD1 4.44Å
288F88.8Confident86.5Confident12 Ų1234.3 Ų34.35%0.05320%0.2CC..Hα-helixtrans-59-54.2174.3-175.6-91.7000111.3V145 V149 L152 S284 V285 L286 L290 C291 W292V145-F288 HydrophobicContact CG1-CZ 4Å; V149-F288 HydrophobicContact CG2-CD1 4.41Å; V149-F288 HydrophobicContact CG2-CE1 3.47Å; V149-F288 VanDerWaalsContact CG2-CE1 3.47Å; V149-F288 HydrophobicContact CG2-CZ 3.84Å; L152-F288 HydrophobicContact CD1-CB 4.29Å; L152-F288 HydrophobicContact CD1-CG 4.32Å; S284-F288 WeakPolarHBondContact O-CB 3.03Å; S284-F288 PolarHBondContact O-N 2.86Å; V285-F288 PolarHBondContact O-N 2.9Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.13Å; F288-L290 PolarHBondContact O-N 2.72Å; F288-C291 PolarHBondContact O-N 2.77Å; F288-W292 AromaticContact CD2-CD1 3.72Å; F288-W292 AromaticContact CD2-NE1 3.67Å; F288-W292 HydrophobicContact CE1-CG 4.45Å; F288-W292 AromaticContact CE2-CD1 3.66Å; F288-W292 AromaticContact CE2-NE1 3.35Å; F288-W292 VanDerWaalsContact CE2-NE1 3.35Å; F288-W292 AromaticContact CG-CD1 3.99Å; F288-W292 AromaticContact CZ-CD1 3.86Å; F288-W292 HydrophobicContact CZ-CG 4.33Å; F288-W292 AromaticContact CZ-NE1 3.83Å; F288-W292 PolarHBondContact O-N 2.76Å; F288-W292 VanDerWaalsContact O-N 3.07Å
289A87.2Confident86.7Confident15 Ų1536 Ų3612%0.12421%0.21CC..Hα-helixtrans-57.4-47.2-178.700000112.7Y236 V285 L286 C291 W292 L293Y236-A289 HydrophobicContact CD1-CB 4.02Å; Y236-A289 HydrophobicContact CE1-CB 3.8Å; Y236-A289 PolarHBondContact OH-O 2.76Å; V285-A289 WeakPolarHBondContact O-CB 3.34Å; V285-A289 PolarHBondContact O-N 2.99Å; L286-A289 PolarHBondContact O-N 2.83Å; A289-C291 VanDerWaalsContact C-N 3.34Å; A289-C291 PolarHBondContact O-N 2.84Å; A289-W292 PolarHBondContact O-N 3.03Å; A289-L293 VanDerWaalsContact O-CB 3.3Å; A289-L293 WeakPolarHBondContact O-CB 3.3Å; A289-L293 PolarHBondContact O-N 2.86Å
290L89.9Confident86.6Confident116 Ų11633.2 Ų33.261%0.60719%0.191SC*.Hα-helixtrans-68.1-32.9-178.4-68.5173.9000112.9L286 F288 P294L286-L290 WeakPolarHBondContact O-CB 2.99Å; L286-L290 VanDerWaalsContact O-CG 3.24Å; L286-L290 WeakPolarHBondContact O-CG 3.27Å; L286-L290 PolarHBondContact O-N 2.84Å; F288-L290 PolarHBondContact O-N 2.72Å; L290-P294 VanDerWaalsContact O-CD 3.24Å; L290-P294 WeakPolarHBondContact O-CD 3.46Å
291C91.8Very high86.4Confident11 Ų1135.7 Ų35.77%0.07420%0.204CC..Hα-helixtrans-74.9-35.4178.9-68.60000112.5A287 F288 A289 V326 A327 Y333A287-C291 VanDerWaalsContact O-CB 3.3Å; A287-C291 WeakPolarHBondContact O-CB 3.19Å; A287-C291 PolarHBondContact O-N 3.16Å; A287-C291 PolarHBondContact O-SG 2.82Å; F288-C291 PolarHBondContact O-N 2.77Å; A289-C291 VanDerWaalsContact C-N 3.34Å; A289-C291 PolarHBondContact O-N 2.84Å; C291-V326 HydrophobicContact CB-CG1 4.45Å; C291-V326 WeakPolarHBondContact CB-O 3.46Å; C291-A327 VanDerWaalsContact O-CA 3.25Å; C291-A327 WeakPolarHBondContact O-CA 3.43Å; C291-A327 PolarHBondContact O-N 3.13Å; C291-Y333 WeakPolarHBondContact SG-CE2 3.42Å
292W89Confident86Confident12 Ų1235.7 Ų35.75%0.04520%0.204CC..Hα-helixtrans-83.8-22.4-179.3-76.285.6000113M109 V145 Y236 F288 A289 L295 Q296 A327 M328 S330M109-W292 HydrophobicContact CE-CH2 3.95Å; M109-W292 HydrophobicContact CE-CZ2 3.77Å; M109-W292 HydrophobicContact SD-CH2 4.35Å; M109-W292 HydrophobicContact SD-CZ2 4.05Å; V145-W292 HydrophobicContact CG2-CD2 4.33Å; V145-W292 HydrophobicContact CG2-CE3 3.97Å; V145-W292 HydrophobicContact CG2-CH2 3.05Å; V145-W292 HydrophobicContact CG2-CZ2 3.47Å; V145-W292 VanDerWaalsContact CG2-CZ2 3.47Å; V145-W292 HydrophobicContact CG2-CZ3 3.33Å; Y236-W292 VanDerWaalsContact OH-C 3.31Å; F288-W292 AromaticContact CD2-CD1 3.72Å; F288-W292 AromaticContact CD2-NE1 3.67Å; F288-W292 HydrophobicContact CE1-CG 4.45Å; F288-W292 AromaticContact CE2-CD1 3.66Å; F288-W292 AromaticContact CE2-NE1 3.35Å; F288-W292 VanDerWaalsContact CE2-NE1 3.35Å; F288-W292 AromaticContact CG-CD1 3.99Å; F288-W292 AromaticContact CZ-CD1 3.86Å; F288-W292 HydrophobicContact CZ-CG 4.33Å; F288-W292 AromaticContact CZ-NE1 3.83Å; F288-W292 PolarHBondContact O-N 2.76Å; F288-W292 VanDerWaalsContact O-N 3.07Å; A289-W292 PolarHBondContact O-N 3.03Å; W292-L295 HydrophobicContact CE3-CD2 4.44Å; W292-L295 HydrophobicContact CZ3-CD2 4.25Å; W292-L295 PolarHBondContact O-N 3.31Å; W292-Q296 WeakPolarHBondContact O-CG 3.38Å; W292-Q296 PolarHBondContact O-N 3.42Å; W292-Q296 VanDerWaalsContact O-N 3.09Å; W292-A327 HydrophobicContact CD2-CB 3.98Å; W292-A327 HydrophobicContact CE3-CB 4.01Å; W292-A327 HydrophobicContact CG-CB 4.44Å; W292-A327 HydrophobicContact CH2-CB 4.46Å; W292-A327 HydrophobicContact CZ2-CB 4.44Å; W292-A327 HydrophobicContact CZ3-CB 4.26Å; W292-M328 HydrophobicContact CH2-CE 3.58Å; W292-M328 HydrophobicContact CZ2-CE 4.01Å; W292-M328 HydrophobicContact CZ3-CE 4.34Å; W292-S330 PolarHBondContact NE1-OG 3.33Å
293L88.6Confident85.5Confident70 Ų7035.1 Ų35.137%0.36620%0.2SC..Hα-helixtrans-57.6-47-175.9-175.569.3000114.2L232 Y236 A289 L295 Q296 V297L232-L293 HydrophobicContact CD1-CD1 4.47Å; Y236-L293 HydrophobicContact CE1-CB 4.26Å; Y236-L293 HydrophobicContact CE1-CD1 3.96Å; Y236-L293 WeakPolarHBondContact OH-CA 3.38Å; Y236-L293 WeakPolarHBondContact OH-CB 3.29Å; Y236-L293 PolarHBondContact OH-N 3.33Å; A289-L293 VanDerWaalsContact O-CB 3.3Å; A289-L293 WeakPolarHBondContact O-CB 3.3Å; A289-L293 PolarHBondContact O-N 2.86Å; L293-L295 VanDerWaalsContact C-N 3.28Å; L293-L295 PolarHBondContact O-N 2.99Å; L293-Q296 PolarHBondContact O-N 3.28Å; L293-V297 HydrophobicContact CD1-CG2 3.74Å; L293-V297 HydrophobicContact CG-CG2 4.03Å; L293-V297 WeakPolarHBondContact O-CB 3.47Å; L293-V297 VanDerWaalsContact O-CG2 3.3Å; L293-V297 WeakPolarHBondContact O-CG2 3.45Å; L293-V297 PolarHBondContact O-N 3.12Å
294P90.3Very high84.8Confident51 Ų5138.1 Ų38.133%0.33121%0.21SC..Hα-helixtrans-58.8-41.4-179.1-24.234.6000112.4L290 L298 C323 V326L290-P294 VanDerWaalsContact O-CD 3.24Å; L290-P294 WeakPolarHBondContact O-CD 3.46Å; P294-L298 VanDerWaalsContact O-CB 3.23Å; P294-L298 WeakPolarHBondContact O-CB 3.18Å; P294-L298 PolarHBondContact O-N 3.2Å; P294-C323 HydrophobicContact CB-CB 4.21Å; P294-V326 HydrophobicContact CG-CG1 4.36Å
295L87.2Confident83.9Confident15 Ų1539.4 Ų39.48%0.07922%0.217CC..Hα-helixtrans-68.5-44.1179.6-176.763.5000111.6W292 L293 L298 N299 C323 H324 A327W292-L295 HydrophobicContact CE3-CD2 4.44Å; W292-L295 HydrophobicContact CZ3-CD2 4.25Å; W292-L295 PolarHBondContact O-N 3.31Å; L293-L295 VanDerWaalsContact C-N 3.28Å; L293-L295 PolarHBondContact O-N 2.99Å; L295-L298 PolarHBondContact O-N 2.95Å; L295-N299 WeakPolarHBondContact O-CB 3.41Å; L295-N299 PolarHBondContact O-N 3.26Å; L295-N299 PolarHBondContact O-ND2 3.21Å; L295-C323 HydrophobicContact CB-CB 4.14Å; L295-C323 HydrophobicContact CD1-CB 4.15Å; L295-H324 HydrophobicContact CD1-CB 4.39Å; L295-A327 HydrophobicContact CB-CB 4.28Å; L295-A327 HydrophobicContact CD2-CB 3.89Å
296Q85.1Confident82.8Confident27 Ų2743 Ų4313%0.12624%0.24CC..Hα-helixtrans-67.8-40.2-179.9-60.9-66.114.900112.2I231 L232 W292 L293 N299 L300I231-Q296 VanDerWaalsContact CG2-NE2 3.35Å; L232-Q296 HydrophobicContact CD1-CB 3.73Å; L232-Q296 HydrophobicContact CD1-CG 4.46Å; W292-Q296 WeakPolarHBondContact O-CG 3.38Å; W292-Q296 PolarHBondContact O-N 3.42Å; W292-Q296 VanDerWaalsContact O-N 3.09Å; L293-Q296 PolarHBondContact O-N 3.28Å; Q296-N299 PolarHBondContact O-N 3.16Å; Q296-L300 WeakPolarHBondContact O-CB 3.35Å; Q296-L300 PolarHBondContact O-N 3.47Å
297V86.1Confident81.4Confident61 Ų6145.2 Ų45.237%0.3725%0.248SC..Hα-helixtrans-64.9-43.5175.1171.80000110.5L293 L300 L301L293-V297 HydrophobicContact CD1-CG2 3.74Å; L293-V297 HydrophobicContact CG-CG2 4.03Å; L293-V297 WeakPolarHBondContact O-CB 3.47Å; L293-V297 VanDerWaalsContact O-CG2 3.3Å; L293-V297 WeakPolarHBondContact O-CG2 3.45Å; L293-V297 PolarHBondContact O-N 3.12Å; V297-L300 PolarHBondContact O-N 2.93Å; V297-L301 HydrophobicContact CG1-CD1 3.96Å; V297-L301 HydrophobicContact CG1-CG 4.3Å; V297-L301 WeakPolarHBondContact O-CB 3.3Å; V297-L301 VanDerWaalsContact O-CG 3.31Å; V297-L301 WeakPolarHBondContact O-CG 3.25Å; V297-L301 PolarHBondContact O-N 3.19Å
298L84.3Confident80.1Confident7 Ų744.9 Ų44.94%0.03724%0.242CC..Hα-helixtrans-61.8-45.1177.1-177.765.3000112P294 L295 L300 L301 L302 I311 I316 L319 Q320 C323P294-L298 VanDerWaalsContact O-CB 3.23Å; P294-L298 WeakPolarHBondContact O-CB 3.18Å; P294-L298 PolarHBondContact O-N 3.2Å; L295-L298 PolarHBondContact O-N 2.95Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 3.29Å; L298-L301 PolarHBondContact O-N 3.15Å; L298-L302 HydrophobicContact CG-CD1 4.33Å; L298-L302 WeakPolarHBondContact O-CB 3.45Å; L298-L302 WeakPolarHBondContact O-CG 3.14Å; L298-L302 PolarHBondContact O-N 2.72Å; L298-I311 HydrophobicContact CD1-CD1 4.39Å; L298-I316 HydrophobicContact CD1-CD1 3.96Å; L298-L319 HydrophobicContact CD1-CD2 3.56Å; L298-L319 HydrophobicContact CD1-CG 4.02Å; L298-L319 HydrophobicContact CD2-CB 4.45Å; L298-L319 HydrophobicContact CD2-CD2 4.45Å; L298-L319 HydrophobicContact CD2-CG 3.98Å; L298-Q320 HydrophobicContact CD2-CB 4.01Å; L298-Q320 HydrophobicContact CD2-CG 4.47Å; L298-C323 HydrophobicContact CD2-CB 4.2Å
299N80.1Confident78.5Confident46 Ų4651.3 Ų51.325%0.24628%0.277CS..Hα-helixtrans-61.8-40.9176.8-71.2-18.4000111.5L295 Q296 L302 D303L295-N299 WeakPolarHBondContact O-CB 3.41Å; L295-N299 PolarHBondContact O-N 3.26Å; L295-N299 PolarHBondContact O-ND2 3.21Å; Q296-N299 PolarHBondContact O-N 3.16Å; N299-L302 PolarHBondContact O-N 2.97Å; N299-D303 PolarHBondContact O-N 3.25Å
300L80.2Confident77.1Confident34 Ų3457.1 Ų57.118%0.17830%0.304CS..Hα-helixtrans-65.2-43176.1-178.764.7000112.3L225 L232 Q296 V297 L298 L302 D303 L304L225-L300 HydrophobicContact CD1-CD1 3.43Å; L225-L300 VanDerWaalsContact CD1-CD1 3.43Å; L232-L300 HydrophobicContact CD2-CD2 4.32Å; Q296-L300 WeakPolarHBondContact O-CB 3.35Å; Q296-L300 PolarHBondContact O-N 3.47Å; V297-L300 PolarHBondContact O-N 2.93Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 3.29Å; L300-L302 VanDerWaalsContact C-N 3.32Å; L300-L302 PolarHBondContact O-N 2.87Å; L300-D303 PolarHBondContact O-N 3.31Å; L300-L304 HydrophobicContact CD1-CD1 4.35Å; L300-L304 HydrophobicContact CG-CD1 4.06Å; L300-L304 WeakPolarHBondContact O-CG 3.08Å; L300-L304 PolarHBondContact O-N 2.94Å
301L79.3Confident75.7Confident77 Ų7753.6 Ų53.640%0.40329%0.286SS..Hα-helixtrans-62.7-41.1176.5-73.6173.4000111.3V297 L298 D303 L304 D305V297-L301 HydrophobicContact CG1-CD1 3.96Å; V297-L301 HydrophobicContact CG1-CG 4.3Å; V297-L301 WeakPolarHBondContact O-CB 3.3Å; V297-L301 VanDerWaalsContact O-CG 3.31Å; V297-L301 WeakPolarHBondContact O-CG 3.25Å; V297-L301 PolarHBondContact O-N 3.19Å; L298-L301 PolarHBondContact O-N 3.15Å; L301-D303 VanDerWaalsContact C-N 3.3Å; L301-D303 PolarHBondContact O-N 3.32Å; L301-L304 PolarHBondContact O-N 3.46Å; L301-D305 PolarHBondContact O-N 3.29Å
302L74.6Confident74.4Confident7 Ų755.1 Ų55.14%0.03730%0.303CS..Hα-helixtrans-63.3-35.5173.9-77.8176.6000112.7F3 L298 N299 L300 L304 F308 I316F3-L302 HydrophobicContact CB-CD1 4.28Å; F3-L302 HydrophobicContact CD1-CD2 4.16Å; F3-L302 HydrophobicContact CD2-CB 4.16Å; F3-L302 HydrophobicContact CE1-CD2 4.45Å; F3-L302 HydrophobicContact CE2-CB 4.15Å; F3-L302 WeakPolarHBondContact CE2-O 3.24Å; F3-L302 HydrophobicContact CG-CB 4.41Å; F3-L302 HydrophobicContact CG-CD1 4.44Å; F3-L302 HydrophobicContact CG-CD2 4.45Å; F3-L302 HydrophobicContact CZ-CB 4.45Å; F3-L302 WeakPolarHBondContact CZ-O 3.5Å; L298-L302 HydrophobicContact CG-CD1 4.33Å; L298-L302 WeakPolarHBondContact O-CB 3.45Å; L298-L302 WeakPolarHBondContact O-CG 3.14Å; L298-L302 PolarHBondContact O-N 2.72Å; N299-L302 PolarHBondContact O-N 2.97Å; L300-L302 VanDerWaalsContact C-N 3.32Å; L300-L302 PolarHBondContact O-N 2.87Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L302-F308 HydrophobicContact CD2-CD1 4.28Å; L302-F308 HydrophobicContact CD2-CE1 3.94Å; L302-I316 HydrophobicContact CD1-CD1 4.07Å; L302-I316 HydrophobicContact CD1-CG1 4.15Å; L302-I316 HydrophobicContact CD2-CD1 3.49Å; L302-I316 VanDerWaalsContact CD2-CD1 3.49Å; L302-I316 HydrophobicContact CD2-CG1 3.8Å; L302-I316 HydrophobicContact CG-CD1 4Å; L302-I316 HydrophobicContact CG-CG1 4.45Å
303D72.2Confident73.3Confident28 Ų2856.7 Ų56.715%0.1531%0.31CS..Hα-helixtrans-72.1-27.8175.6-69.2-17.4000112.6R224 L225 S228 N299 L300 L301R224-D303 IonicContact CZ-OD1 3.74Å; R224-D303 IonicContact NE-OD1 2.79Å; R224-D303 PolarHBondContact NE-OD1 2.78Å; R224-D303 IonicContact NE-OD2 3.34Å; R224-D303 IonicContact NH1-OD1 2.65Å; R224-D303 PolarHBondContact NH1-OD1 3.04Å; R224-D303 IonicContact NH2-OD1 2.8Å; R224-D303 PolarHBondContact NH2-OD1 3.33Å; L225-D303 HydrophobicContact CD1-CB 4.46Å; S228-D303 PolarHBondContact OG-OD2 3.4Å; N299-D303 PolarHBondContact O-N 3.25Å; L300-D303 PolarHBondContact O-N 3.31Å; L301-D303 VanDerWaalsContact C-N 3.3Å; L301-D303 PolarHBondContact O-N 3.32Å
304L74Confident72.4Confident102 Ų10259.4 Ų59.453%0.53432%0.316SS..Hα-helixtrans-87.6-28.3-179.7-71.7170.2000113.9L225 L300 L301 L302 P306L225-L304 HydrophobicContact CD1-CD2 3.73Å; L225-L304 HydrophobicContact CD1-CG 4.04Å; L225-L304 HydrophobicContact CD2-CD2 3.88Å; L225-L304 HydrophobicContact CG-CD2 4.49Å; L300-L304 HydrophobicContact CD1-CD1 4.35Å; L300-L304 HydrophobicContact CG-CD1 4.06Å; L300-L304 WeakPolarHBondContact O-CG 3.08Å; L300-L304 PolarHBondContact O-N 2.94Å; L301-L304 PolarHBondContact O-N 3.46Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L304-P306 VanDerWaalsContact C-CD 3.42Å; L304-P306 VanDerWaalsContact O-CD 3.29Å; L304-P306 WeakPolarHBondContact O-CD 3.41Å
305D69.2Low71.8Confident26 Ų2663.6 Ų63.614%0.13933%0.326CS..  trans-119.172.9-178.6-175.221.4000111.1L301 E307 F308 L309 I310L301-D305 PolarHBondContact O-N 3.29Å; D305-E307 PolarHBondContact O-N 2.82Å; D305-F308 PolarHBondContact O-N 2.72Å; D305-F308 PolarHBondContact OD1-N 3.07Å; D305-L309 PolarHBondContact OD1-N 2.98Å; D305-L309 PolarHBondContact OD2-N 3.2Å; D305-I310 WeakPolarHBondContact OD2-CB 3.46Å; D305-I310 WeakPolarHBondContact OD2-CG1 3.49Å; D305-I310 PolarHBondContact OD2-N 3.5Å
306P62.3Low71.4Confident80 Ų8063 Ų6352%0.51932%0.323SS..THydrogen-bonded Turntrans-65.6-19.5179.425.9-33.1000113.3L304 F308L304-P306 VanDerWaalsContact C-CD 3.42Å; L304-P306 VanDerWaalsContact O-CD 3.29Å; L304-P306 WeakPolarHBondContact O-CD 3.41Å; P306-F308 WeakPolarHBondContact O-CD2 3.32Å
307E59.6Low71Confident130 Ų13061.9 Ų61.961%0.60732%0.318SS*.THydrogen-bonded Turntrans-88.5-3.1180-66.2-65.4152.300113D305 L309D305-E307 PolarHBondContact O-N 2.82Å; E307-L309 HydrophobicContact CB-CD1 3.93Å; E307-L309 HydrophobicContact CB-CG 3.93Å; E307-L309 PolarHBondContact O-N 3.44Å
308F62.3Low70.9Confident15 Ų1560 Ų607%0.06631%0.306CS..  trans54.334.4-179.3-53.9-93.7000114F3 L4 L302 D305 P306 I310 K313F3-F308 AromaticContact CD1-CE1 3.79Å; F3-F308 HydrophobicContact CD1-CE1 3.79Å; F3-F308 HydrophobicContact CD1-CE2 4.38Å; F3-F308 AromaticContact CD1-CZ 3.44Å; F3-F308 HydrophobicContact CD1-CZ 3.44Å; F3-F308 VanDerWaalsContact CD1-CZ 3.44Å; F3-F308 HydrophobicContact CE1-CE1 4.07Å; F3-F308 HydrophobicContact CE1-CE2 4.2Å; F3-F308 AromaticContact CE1-CZ 3.64Å; F3-F308 HydrophobicContact CE1-CZ 3.64Å; L4-F308 HydrophobicContact CD2-CE1 3.92Å; L4-F308 HydrophobicContact CD2-CE2 4.18Å; L4-F308 HydrophobicContact CD2-CZ 3.56Å; L4-F308 HydrophobicContact CG-CE1 4.43Å; L4-F308 HydrophobicContact CG-CZ 4.28Å; L302-F308 HydrophobicContact CD2-CD1 4.28Å; L302-F308 HydrophobicContact CD2-CE1 3.94Å; D305-F308 PolarHBondContact O-N 2.72Å; D305-F308 PolarHBondContact OD1-N 3.07Å; P306-F308 WeakPolarHBondContact O-CD2 3.32Å; F308-I310 PolarHBondContact O-N 3.34Å; F308-K313 HydrophobicContact CB-CG 3.89Å; F308-K313 HydrophobicContact CD1-CG 4.2Å; F308-K313 HydrophobicContact CD2-CD 4.26Å; F308-K313 HydrophobicContact CD2-CG 4.03Å; F308-K313 HydrophobicContact CG-CG 3.81Å
309L55.8Low71Confident148 Ų14862.9 Ų62.978%0.77532%0.321SS*.SBendtrans-68.6-23.5-178-73162.7000112.4D305 E307D305-L309 PolarHBondContact OD1-N 2.98Å; D305-L309 PolarHBondContact OD2-N 3.2Å; E307-L309 HydrophobicContact CB-CD1 3.93Å; E307-L309 HydrophobicContact CB-CG 3.93Å; E307-L309 PolarHBondContact O-N 3.44Å
310I56.7Low71.2Confident137 Ų13762.4 Ų62.470%0.70332%0.318SS*.SBendtrans-101.4-36.5-174.2-55173.9000112.2D305 F308D305-I310 WeakPolarHBondContact OD2-CB 3.46Å; D305-I310 WeakPolarHBondContact OD2-CG1 3.49Å; D305-I310 PolarHBondContact OD2-N 3.5Å; F308-I310 PolarHBondContact O-N 3.34Å
311I61.3Low71.5Confident42 Ų4261.2 Ų61.222%0.21531%0.312CS..SBendtrans-122.6107.7-177.2-63.9162000108.7L298 K313 I316L298-I311 HydrophobicContact CD1-CD1 4.39Å; I311-K313 PolarHBondContact O-N 2.94Å; I311-I316 HydrophobicContact CB-CD1 4.41Å; I311-I316 HydrophobicContact CG2-CB 4.48Å; I311-I316 HydrophobicContact CG2-CD1 3.68Å
312G63.9Low72Confident43 Ų4359.8 Ų59.844%0.44331%0.308SS..  trans-53.2133.6-179.300000112.7R314 Y315G312-R314 PolarHBondContact O-N 2.83Å; G312-Y315 PolarHBondContact O-N 2.97Å
313K66.3Low72.8Confident45 Ų4560 Ų6020%0.19631%0.31CS..Hα-helixtrans-49.7-27.9-178.6-65.1177.9178.8172.30113.3L4 S44 F308 I311 Y315 I316L4-K313 HydrophobicContact CD2-CB 4.1Å; L4-K313 HydrophobicContact CD2-CD 4.4Å; L4-K313 HydrophobicContact CD2-CG 4.07Å; S44-K313 PolarHBondContact OG-NZ 2.94Å; F308-K313 HydrophobicContact CB-CG 3.89Å; F308-K313 HydrophobicContact CD1-CG 4.2Å; F308-K313 HydrophobicContact CD2-CD 4.26Å; F308-K313 HydrophobicContact CD2-CG 4.03Å; F308-K313 HydrophobicContact CG-CG 3.81Å; I311-K313 PolarHBondContact O-N 2.94Å; K313-Y315 PolarHBondContact O-N 3.06Å; K313-I316 WeakPolarHBondContact O-CG2 3.29Å
314R68.8Low73.6Confident126 Ų12659.6 Ų59.648%0.47531%0.307SS..Hα-helixtrans-61.1-36.8177.4-174.7169.5-173.1169.15.2114.8V51 G52 L55 G312V51-R314 HydrophobicContact CG1-CG 4.01Å; G52-R314 WeakPolarHBondContact CA-O 3.04Å; L55-R314 HydrophobicContact CD2-CG 4.15Å; G312-R314 PolarHBondContact O-N 2.83Å
315Y77.6Confident74.5Confident140 Ų14056 Ų5655%0.54929%0.288SS..Hα-helixtrans-102.5-12.9-171-62.7-71000114L55 G312 K313 N317 V318 L319L55-Y315 HydrophobicContact CD2-CD1 3.85Å; L55-Y315 HydrophobicContact CD2-CE1 3.96Å; G312-Y315 PolarHBondContact O-N 2.97Å; K313-Y315 PolarHBondContact O-N 3.06Å; Y315-N317 VanDerWaalsContact C-N 3.3Å; Y315-N317 PolarHBondContact O-N 3.45Å; Y315-V318 PolarHBondContact O-N 3.49Å; Y315-L319 WeakPolarHBondContact O-CB 3.48Å; Y315-L319 PolarHBondContact O-N 2.87Å
316I78.9Confident75.7Confident3 Ų357.6 Ų57.62%0.01530%0.299CS..Hα-helixtrans-62.1-36.9-171.5-164.271.6000113.1L4 L298 L302 I311 K313 L319 Q320L4-I316 HydrophobicContact CD1-CG2 3.23Å; L4-I316 HydrophobicContact CD2-CG2 4.4Å; L4-I316 HydrophobicContact CG-CG2 3.72Å; L298-I316 HydrophobicContact CD1-CD1 3.96Å; L302-I316 HydrophobicContact CD1-CD1 4.07Å; L302-I316 HydrophobicContact CD1-CG1 4.15Å; L302-I316 HydrophobicContact CD2-CD1 3.49Å; L302-I316 VanDerWaalsContact CD2-CD1 3.49Å; L302-I316 HydrophobicContact CD2-CG1 3.8Å; L302-I316 HydrophobicContact CG-CD1 4Å; L302-I316 HydrophobicContact CG-CG1 4.45Å; I311-I316 HydrophobicContact CB-CD1 4.41Å; I311-I316 HydrophobicContact CG2-CB 4.48Å; I311-I316 HydrophobicContact CG2-CD1 3.68Å; K313-I316 WeakPolarHBondContact O-CG2 3.29Å; I316-L319 PolarHBondContact O-N 2.84Å; I316-Q320 VanDerWaalsContact O-CB 3.31Å; I316-Q320 WeakPolarHBondContact O-CB 3.44Å; I316-Q320 PolarHBondContact O-N 3.14Å
317N77.6Confident77.1Confident3 Ų353.8 Ų53.82%0.01627%0.274CS..Hα-helixtrans-64.9-44.7178-75.1-26.8000111.7F1 L56 Y315 Q320 V321F1-N317 VanDerWaalsContact CA-OD1 3.29Å; F1-N317 WeakPolarHBondContact CA-OD1 3.39Å; F1-N317 PolarHBondContact N-OD1 3.32Å; L56-N317 HydrophobicContact CB-CB 4.31Å; L56-N317 HydrophobicContact CD2-CB 4.24Å; Y315-N317 VanDerWaalsContact C-N 3.3Å; Y315-N317 PolarHBondContact O-N 3.45Å; N317-Q320 PolarHBondContact O-N 2.89Å; N317-V321 WeakPolarHBondContact O-CG2 3.38Å; N317-V321 PolarHBondContact O-N 2.84Å
318V83.9Confident78.6Confident21 Ų2147.7 Ų47.713%0.12725%0.246CC..Hα-helixtrans-65-45.4176.9179.70000110L55 L56 F59 F63 Y315 Q320 V321 C322L55-V318 HydrophobicContact CD2-CG2 4.04Å; L55-V318 HydrophobicContact CG-CG2 4.12Å; L56-V318 HydrophobicContact CD1-CG2 4.45Å; F59-V318 HydrophobicContact CD2-CG1 4.49Å; F59-V318 HydrophobicContact CD2-CG2 4.18Å; F63-V318 HydrophobicContact CE2-CG1 4.24Å; F63-V318 HydrophobicContact CZ-CG1 4.12Å; Y315-V318 PolarHBondContact O-N 3.49Å; V318-Q320 PolarHBondContact O-N 3.13Å; V318-V321 PolarHBondContact O-N 3.18Å; V318-C322 WeakPolarHBondContact O-CB 3.31Å; V318-C322 PolarHBondContact O-N 3.41Å; V318-C322 PolarHBondContact O-SG 3.32Å
319L86.2Confident80Confident68 Ų6847.8 Ų47.836%0.35625%0.248SC..Hα-helixtrans-61.4-42.9178.3-172.359.5000111.7L298 Y315 I316 C322 C323L298-L319 HydrophobicContact CD1-CD2 3.56Å; L298-L319 HydrophobicContact CD1-CG 4.02Å; L298-L319 HydrophobicContact CD2-CB 4.45Å; L298-L319 HydrophobicContact CD2-CD2 4.45Å; L298-L319 HydrophobicContact CD2-CG 3.98Å; Y315-L319 WeakPolarHBondContact O-CB 3.48Å; Y315-L319 PolarHBondContact O-N 2.87Å; I316-L319 PolarHBondContact O-N 2.84Å; L319-C322 WeakPolarHBondContact O-CB 3.47Å; L319-C322 PolarHBondContact O-N 2.94Å; L319-C323 WeakPolarHBondContact O-CB 3.36Å; L319-C323 PolarHBondContact O-N 3.47Å; L319-C323 PolarHBondContact O-SG 2.77Å
320Q83.7Confident81.7Confident35 Ų3541 Ų4116%0.16421%0.213CC..Hα-helixtrans-62.5-43.9176.4-170.7177.84.200111.9L298 I316 N317 V318 C323 H324L298-Q320 HydrophobicContact CD2-CB 4.01Å; L298-Q320 HydrophobicContact CD2-CG 4.47Å; I316-Q320 VanDerWaalsContact O-CB 3.31Å; I316-Q320 WeakPolarHBondContact O-CB 3.44Å; I316-Q320 PolarHBondContact O-N 3.14Å; N317-Q320 PolarHBondContact O-N 2.89Å; V318-Q320 PolarHBondContact O-N 3.13Å; Q320-C323 PolarHBondContact O-N 3.41Å; Q320-H324 WeakPolarHBondContact O-CB 3.24Å; Q320-H324 PolarHBondContact O-N 3.28Å
321V86.6Confident83.4Confident10 Ų1034.5 Ų34.56%0.06118%0.18CC..Hα-helixtrans-67-37.1177.3172.20000111.7L56 F63 Y67 F122 N317 V318 L325L56-V321 HydrophobicContact CD1-CB 4.09Å; L56-V321 HydrophobicContact CD1-CG1 4.41Å; L56-V321 HydrophobicContact CD1-CG2 3.76Å; L56-V321 HydrophobicContact CD2-CG2 4.28Å; F63-V321 HydrophobicContact CB-CG1 4.36Å; F63-V321 HydrophobicContact CD1-CG1 3.8Å; F63-V321 HydrophobicContact CD2-CG1 4.1Å; F63-V321 HydrophobicContact CE1-CG1 4.06Å; F63-V321 HydrophobicContact CE2-CG1 4.34Å; F63-V321 HydrophobicContact CG-CG1 3.83Å; F63-V321 HydrophobicContact CZ-CG1 4.33Å; Y67-V321 HydrophobicContact CE2-CG1 3.86Å; Y67-V321 PolarHBondContact OH-O 3.43Å; F122-V321 HydrophobicContact CZ-CG1 4.24Å; N317-V321 WeakPolarHBondContact O-CG2 3.38Å; N317-V321 PolarHBondContact O-N 2.84Å; V318-V321 PolarHBondContact O-N 3.18Å; V321-L325 WeakPolarHBondContact O-CB 3.41Å; V321-L325 PolarHBondContact O-N 3.02Å
322C90.8Very high84.9Confident46 Ų4633.1 Ų33.131%0.31117%0.174SC..Hα-helixtrans-61.5-53.1172-72.90000111.8F63 V318 L319 H324 L325 V326F63-C322 WeakPolarHBondContact CZ-SG 3.4Å; V318-C322 WeakPolarHBondContact O-CB 3.31Å; V318-C322 PolarHBondContact O-N 3.41Å; V318-C322 PolarHBondContact O-SG 3.32Å; L319-C322 WeakPolarHBondContact O-CB 3.47Å; L319-C322 PolarHBondContact O-N 2.94Å; C322-H324 VanDerWaalsContact C-N 3.31Å; C322-H324 PolarHBondContact O-N 3.42Å; C322-L325 WeakPolarHBondContact O-CB 3.41Å; C322-L325 PolarHBondContact O-N 3.36Å; C322-V326 WeakPolarHBondContact O-CG2 3.36Å; C322-V326 PolarHBondContact O-N 3.39Å
323C90.9Very high86.1Confident13 Ų1335.6 Ų35.69%0.08817%0.17CC..Hα-helixtrans-62.2-40179.8-69.20000111.7P294 L295 L298 L319 Q320 V326 A327P294-C323 HydrophobicContact CB-CB 4.21Å; L295-C323 HydrophobicContact CB-CB 4.14Å; L295-C323 HydrophobicContact CD1-CB 4.15Å; L298-C323 HydrophobicContact CD2-CB 4.2Å; L319-C323 WeakPolarHBondContact O-CB 3.36Å; L319-C323 PolarHBondContact O-N 3.47Å; L319-C323 PolarHBondContact O-SG 2.77Å; Q320-C323 PolarHBondContact O-N 3.41Å; C323-V326 PolarHBondContact O-N 2.92Å; C323-A327 PolarHBondContact O-N 3.41Å
324H89.8Confident87.1Confident19 Ų1933.7 Ų33.79%0.08816%0.162CC..Hα-helixtrans-63-43.9174.7-178.1-93.3000111.6Y67 Q141 L295 Q320 C322 V326 A327 M328Y67-H324 AromaticContact CE1-ND1 3.55Å; Y67-H324 AromaticContact CZ-ND1 3.62Å; Y67-H324 PolarHBondContact OH-ND1 2.67Å; Q141-H324 PolarHBondContact NE2-NE2 3.5Å; L295-H324 HydrophobicContact CD1-CB 4.39Å; Q320-H324 WeakPolarHBondContact O-CB 3.24Å; Q320-H324 PolarHBondContact O-N 3.28Å; C322-H324 VanDerWaalsContact C-N 3.31Å; C322-H324 PolarHBondContact O-N 3.42Å; H324-V326 VanDerWaalsContact C-N 3.33Å; H324-V326 PolarHBondContact O-N 3.01Å; H324-A327 WeakPolarHBondContact O-CB 3.45Å; H324-A327 PolarHBondContact O-N 3.41Å; H324-M328 VanDerWaalsContact O-CG 3.31Å; H324-M328 WeakPolarHBondContact O-CG 3.1Å; H324-M328 PolarHBondContact O-N 3.5Å
325L92.2Very high87.9Confident25 Ų2528.1 Ų28.113%0.13114%0.142CC..Hα-helixtrans-59.4-44176-179.268.2000111.6F63 L66 Y67 V70 V321 C322 M328 S329F63-L325 HydrophobicContact CD1-CD2 4.33Å; L66-L325 HydrophobicContact CB-CD1 4.19Å; L66-L325 HydrophobicContact CB-CD2 3.86Å; L66-L325 HydrophobicContact CD1-CD2 3.87Å; L66-L325 HydrophobicContact CG-CD2 4.45Å; Y67-L325 HydrophobicContact CD1-CD1 3.76Å; Y67-L325 HydrophobicContact CD2-CD1 4.1Å; Y67-L325 HydrophobicContact CE1-CB 4.27Å; Y67-L325 HydrophobicContact CE1-CD1 3.77Å; Y67-L325 HydrophobicContact CE2-CB 4.33Å; Y67-L325 HydrophobicContact CE2-CD1 4.08Å; Y67-L325 HydrophobicContact CG-CD1 3.93Å; Y67-L325 PolarHBondContact OH-N 3.01Å; V70-L325 HydrophobicContact CG2-CD1 4Å; V321-L325 WeakPolarHBondContact O-CB 3.41Å; V321-L325 PolarHBondContact O-N 3.02Å; C322-L325 WeakPolarHBondContact O-CB 3.41Å; C322-L325 PolarHBondContact O-N 3.36Å; L325-M328 PolarHBondContact O-N 2.93Å; L325-S329 PolarHBondContact O-N 3.48Å
326V94.4Very high88.3Confident61 Ų6127.3 Ų27.337%0.3714%0.142SC..Hα-helixtrans-61.5-44.1175.9175.50000110.7C291 P294 C322 C323 H324 M328 S329C291-V326 HydrophobicContact CB-CG1 4.45Å; C291-V326 WeakPolarHBondContact CB-O 3.46Å; P294-V326 HydrophobicContact CG-CG1 4.36Å; C322-V326 WeakPolarHBondContact O-CG2 3.36Å; C322-V326 PolarHBondContact O-N 3.39Å; C323-V326 PolarHBondContact O-N 2.92Å; H324-V326 VanDerWaalsContact C-N 3.33Å; H324-V326 PolarHBondContact O-N 3.01Å; V326-M328 PolarHBondContact O-N 3.21Å; V326-S329 WeakPolarHBondContact O-CB 3.38Å; V326-S329 PolarHBondContact O-N 3.34Å; V326-S329 PolarHBondContact O-OG 2.77Å
327A91.1Very high88.7Confident0 Ų028.2 Ų28.20%015%0.147CC..Hα-helixtrans-60.4-46.1175.800000112.1C291 W292 L295 C323 H324 S329 S330C291-A327 VanDerWaalsContact O-CA 3.25Å; C291-A327 WeakPolarHBondContact O-CA 3.43Å; C291-A327 PolarHBondContact O-N 3.13Å; W292-A327 HydrophobicContact CD2-CB 3.98Å; W292-A327 HydrophobicContact CE3-CB 4.01Å; W292-A327 HydrophobicContact CG-CB 4.44Å; W292-A327 HydrophobicContact CH2-CB 4.46Å; W292-A327 HydrophobicContact CZ2-CB 4.44Å; W292-A327 HydrophobicContact CZ3-CB 4.26Å; L295-A327 HydrophobicContact CB-CB 4.28Å; L295-A327 HydrophobicContact CD2-CB 3.89Å; C323-A327 PolarHBondContact O-N 3.41Å; H324-A327 WeakPolarHBondContact O-CB 3.45Å; H324-A327 PolarHBondContact O-N 3.41Å; A327-S329 VanDerWaalsContact C-N 3.26Å; A327-S329 PolarHBondContact O-N 3.37Å; A327-S330 WeakPolarHBondContact O-CB 3.4Å; A327-S330 PolarHBondContact O-N 2.84Å; A327-S330 VanDerWaalsContact O-N 3.12Å; A327-S330 PolarHBondContact O-OG 2.94Å
328M90.8Very high88.9Confident2 Ų228.5 Ų28.51%0.0115%0.148CC..Hα-helixtrans-65.5-28.8178.3-63.9-54113.200112.8Y67 V70 M109 V114 W292 H324 L325 V326 S330 A331Y67-M328 HydrophobicContact CE1-CG 4.41Å; V70-M328 HydrophobicContact CG1-CB 4.11Å; M109-M328 HydrophobicContact CG-SD 4.3Å; M109-M328 HydrophobicContact SD-CE 4.18Å; M109-M328 HydrophobicContact SD-SD 3.82Å; V114-M328 HydrophobicContact CG2-CB 4.32Å; V114-M328 HydrophobicContact CG2-CG 3.79Å; V114-M328 HydrophobicContact CG2-SD 3.43Å; V114-M328 WeakPolarHBondContact CG2-SD 3.38Å; W292-M328 HydrophobicContact CH2-CE 3.58Å; W292-M328 HydrophobicContact CZ2-CE 4.01Å; W292-M328 HydrophobicContact CZ3-CE 4.34Å; H324-M328 VanDerWaalsContact O-CG 3.31Å; H324-M328 WeakPolarHBondContact O-CG 3.1Å; H324-M328 PolarHBondContact O-N 3.5Å; L325-M328 PolarHBondContact O-N 2.93Å; V326-M328 PolarHBondContact O-N 3.21Å; M328-S330 PolarHBondContact O-N 3.46Å; M328-S330 VanDerWaalsContact O-N 3.13Å; M328-A331 PolarHBondContact O-N 2.82Å
329S93.2Very high88.5Confident17 Ų1728.2 Ų28.212%0.11915%0.147CC..Hα-helixtrans-62.1-19.5175.381.80000113.2L325 V326 A327 A331 C332 Y333L325-S329 PolarHBondContact O-N 3.48Å; V326-S329 WeakPolarHBondContact O-CB 3.38Å; V326-S329 PolarHBondContact O-N 3.34Å; V326-S329 PolarHBondContact O-OG 2.77Å; A327-S329 VanDerWaalsContact C-N 3.26Å; A327-S329 PolarHBondContact O-N 3.37Å; S329-A331 PolarHBondContact O-N 3.02Å; S329-C332 VanDerWaalsContact O-CB 3.23Å; S329-C332 WeakPolarHBondContact O-CB 3.3Å; S329-C332 PolarHBondContact O-N 3.37Å; S329-Y333 WeakPolarHBondContact O-CD2 3.28Å; S329-Y333 WeakPolarHBondContact O-CE2 3.33Å; S329-Y333 PolarHBondContact OG-OH 2.77Å; S329-Y333 VanDerWaalsContact OG-OH 3.07Å
330S91.8Very high87.8Confident4 Ų426.5 Ų26.53%0.02814%0.141CC..Hα-helixtrans-54-38.7178.163.40000113.2W292 A327 M328 C332 Y333W292-S330 PolarHBondContact NE1-OG 3.33Å; A327-S330 WeakPolarHBondContact O-CB 3.4Å; A327-S330 PolarHBondContact O-N 2.84Å; A327-S330 VanDerWaalsContact O-N 3.12Å; A327-S330 PolarHBondContact O-OG 2.94Å; M328-S330 PolarHBondContact O-N 3.46Å; M328-S330 VanDerWaalsContact O-N 3.13Å; S330-C332 PolarHBondContact O-N 3.45Å; S330-Y333 PolarHBondContact O-N 2.77Å
331A91.6Very high87Confident2 Ų226.5 Ų26.52%0.01714%0.142CC..Hα-helixtrans-64-22.6177.600000113.3A74 N78 D106 M328 S329 P335A74-A331 HydrophobicContact CB-CB 3.94Å; N78-A331 PolarHBondContact ND2-O 3.2Å; D106-A331 HydrophobicContact CB-CB 3.99Å; M328-A331 PolarHBondContact O-N 2.82Å; S329-A331 PolarHBondContact O-N 3.02Å; A331-P335 WeakPolarHBondContact O-CD 3.17Å
332C92.7Very high85.9Confident13 Ų1327.5 Ų27.59%0.08815%0.146CC..Hα-helixtrans-73.5-34178.1-63.40000111.8V73 S329 S330 P335 F336V73-C332 HydrophobicContact CG1-CB 3.9Å; S329-C332 VanDerWaalsContact O-CB 3.23Å; S329-C332 WeakPolarHBondContact O-CB 3.3Å; S329-C332 PolarHBondContact O-N 3.37Å; S330-C332 PolarHBondContact O-N 3.45Å; C332-P335 WeakPolarHBondContact O-CD 3Å; C332-F336 WeakPolarHBondContact O-CD2 3.33Å; C332-F336 VanDerWaalsContact O-CE2 3.26Å; C332-F336 WeakPolarHBondContact O-CE2 3.24Å
333Y90.1Very high84.4Confident95 Ų9529.6 Ų29.637%0.37316%0.161SC..Hα-helixtrans-74.9-32.5-172.8-51.3-61.7000112.9A287 C291 S329 S330 F336 I337A287-Y333 HydrophobicContact CB-CD2 4.25Å; C291-Y333 WeakPolarHBondContact SG-CE2 3.42Å; S329-Y333 WeakPolarHBondContact O-CD2 3.28Å; S329-Y333 WeakPolarHBondContact O-CE2 3.33Å; S329-Y333 PolarHBondContact OG-OH 2.77Å; S329-Y333 VanDerWaalsContact OG-OH 3.07Å; S330-Y333 PolarHBondContact O-N 2.77Å; Y333-F336 PolarHBondContact O-N 3.47Å; Y333-F336 VanDerWaalsContact O-N 3.1Å; Y333-I337 VanDerWaalsContact O-CG1 3.28Å; Y333-I337 WeakPolarHBondContact O-CG1 3.34Å; Y333-I337 PolarHBondContact O-N 3.41Å
334N87.1Confident82.6Confident5 Ų533.9 Ų33.93%0.02718%0.178CC..Hα-helixtrans-53.4-52.9-175.9-71-18000112.4D106 F336 I337 Y338D106-N334 PolarHBondContact OD2-ND2 3.36Å; N334-F336 PolarHBondContact O-N 2.86Å; N334-I337 PolarHBondContact O-N 3.4Å; N334-Y338 HydrophobicContact CB-CD2 4.39Å; N334-Y338 HydrophobicContact CB-CE2 4.21Å; N334-Y338 WeakPolarHBondContact O-CD2 3.29Å; N334-Y338 PolarHBondContact O-N 3.26Å
335P85.8Confident81Confident8 Ų833.4 Ų33.45%0.05218%0.176CC..Hα-helixtrans-53.4-46.4173.4-29.935.8000114.3N78 A331 C332 A339N78-P335 HydrophobicContact CB-CG 4.27Å; N78-P335 VanDerWaalsContact CG-CG 3.47Å; N78-P335 WeakPolarHBondContact OD1-CD 3.44Å; N78-P335 VanDerWaalsContact OD1-CG 3.29Å; N78-P335 WeakPolarHBondContact OD1-CG 3.29Å; A331-P335 WeakPolarHBondContact O-CD 3.17Å; C332-P335 WeakPolarHBondContact O-CD 3Å; P335-A339 WeakPolarHBondContact O-CA 3.33Å; P335-A339 WeakPolarHBondContact O-CB 3.48Å; P335-A339 PolarHBondContact O-N 2.97Å
336F85.1Confident79.5Confident123 Ų12338.1 Ų38.154%0.53919%0.193SC..Hα-helixtrans-68-41-177.5-62.8-72.2000111.9V73 C332 Y333 N334 S340V73-F336 HydrophobicContact CG1-CE2 3.79Å; V73-F336 HydrophobicContact CG1-CZ 4.02Å; C332-F336 WeakPolarHBondContact O-CD2 3.33Å; C332-F336 VanDerWaalsContact O-CE2 3.26Å; C332-F336 WeakPolarHBondContact O-CE2 3.24Å; Y333-F336 PolarHBondContact O-N 3.47Å; Y333-F336 VanDerWaalsContact O-N 3.1Å; N334-F336 PolarHBondContact O-N 2.86Å; F336-S340 WeakPolarHBondContact O-CB 3.4Å; F336-S340 PolarHBondContact O-N 3.38Å; F336-S340 VanDerWaalsContact O-N 3.08Å
337I86.7Confident77.7Confident23 Ų2340.1 Ų40.112%0.11821%0.205CC..Hα-helixtrans-60.4-52.5177.3-67.9170000109.6L280 A287 Y333 N334 S340L280-I337 HydrophobicContact CB-CG2 3.86Å; L280-I337 HydrophobicContact CD2-CG2 3.96Å; L280-I337 HydrophobicContact CG-CG2 4.45Å; L280-I337 VanDerWaalsContact O-CG2 3.31Å; L280-I337 WeakPolarHBondContact O-CG2 3.31Å; A287-I337 HydrophobicContact CB-CD1 4.44Å; Y333-I337 VanDerWaalsContact O-CG1 3.28Å; Y333-I337 WeakPolarHBondContact O-CG1 3.34Å; Y333-I337 PolarHBondContact O-N 3.41Å; N334-I337 PolarHBondContact O-N 3.4Å; I337-S340 WeakPolarHBondContact O-CB 3.49Å; I337-S340 PolarHBondContact O-N 3.13Å; I337-S340 PolarHBondContact O-OG 2.95Å
338Y81.8Confident76.1Confident9 Ų945.4 Ų45.44%0.03523%0.229CC..Hα-helixtrans-77.8-31.1-176.9-59.8-57.9000113.4L81 I99 L102 S284 N334 S340 L341 H342L81-Y338 HydrophobicContact CD2-CD2 4.16Å; I99-Y338 HydrophobicContact CD1-CD1 3.72Å; I99-Y338 HydrophobicContact CD1-CE1 3.94Å; I99-Y338 HydrophobicContact CD1-CG 4.22Å; I99-Y338 HydrophobicContact CG1-CD1 4.13Å; I99-Y338 HydrophobicContact CG1-CE1 4.03Å; I99-Y338 HydrophobicContact CG1-CE2 4.42Å; I99-Y338 HydrophobicContact CG1-CG 4.41Å; I99-Y338 HydrophobicContact CG2-CD1 4.43Å; I99-Y338 HydrophobicContact CG2-CD2 3.76Å; I99-Y338 HydrophobicContact CG2-CE2 4.22Å; I99-Y338 HydrophobicContact CG2-CG 3.89Å; L102-Y338 HydrophobicContact CD1-CE2 4.49Å; S284-Y338 WeakPolarHBondContact CB-OH 3.28Å; S284-Y338 PolarHBondContact OG-OH 2.82Å; S284-Y338 VanDerWaalsContact OG-OH 3.13Å; N334-Y338 HydrophobicContact CB-CD2 4.39Å; N334-Y338 HydrophobicContact CB-CE2 4.21Å; N334-Y338 WeakPolarHBondContact O-CD2 3.29Å; N334-Y338 PolarHBondContact O-N 3.26Å; Y338-S340 PolarHBondContact O-N 2.95Å; Y338-L341 WeakPolarHBondContact O-CB 3.29Å; Y338-L341 PolarHBondContact O-N 3.35Å; Y338-H342 PolarHBondContact O-CD2 3.12Å
339A75.9Confident74.4Confident14 Ų1448.2 Ų48.212%0.11624%0.244CC..Hα-helixtrans-59.8-35.9170.100000111.6P335 L341 H342 V345P335-A339 WeakPolarHBondContact O-CA 3.33Å; P335-A339 WeakPolarHBondContact O-CB 3.48Å; P335-A339 PolarHBondContact O-N 2.97Å; A339-L341 PolarHBondContact O-N 2.93Å; A339-H342 PolarHBondContact O-N 2.84Å; A339-V345 HydrophobicContact CB-CG1 3.54Å
340S71.6Confident72.5Confident33 Ų3353.5 Ų53.523%0.23127%0.265CS..THydrogen-bonded Turntrans-67.2-19.9176.888.20000113.2K276 L280 F336 I337 Y338 R346K276-S340 PolarHBondContact NZ-O 3.26Å; K276-S340 VanDerWaalsContact NZ-O 3.13Å; L280-S340 WeakPolarHBondContact CD1-OG 3.32Å; L280-S340 VanDerWaalsContact CD2-OG 3.28Å; L280-S340 WeakPolarHBondContact CD2-OG 3.38Å; F336-S340 WeakPolarHBondContact O-CB 3.4Å; F336-S340 PolarHBondContact O-N 3.38Å; F336-S340 VanDerWaalsContact O-N 3.08Å; I337-S340 WeakPolarHBondContact O-CB 3.49Å; I337-S340 PolarHBondContact O-N 3.13Å; I337-S340 PolarHBondContact O-OG 2.95Å; Y338-S340 PolarHBondContact O-N 2.95Å; S340-R346 VanDerWaalsContact O-CZ 3.26Å; S340-R346 PolarHBondContact O-NE 2.89Å; S340-R346 PolarHBondContact O-NH2 3.21Å
341L66.4Low70.6Confident35 Ų3555.3 Ų55.318%0.18328%0.284CS..THydrogen-bonded Turntrans-73.4-38.4176.8-17365.3000111.7T277 L280 Y338 A339T277-L341 HydrophobicContact CG2-CD1 4.05Å; T277-L341 HydrophobicContact CG2-CD2 4.17Å; T277-L341 WeakPolarHBondContact OG1-CD1 3.01Å; L280-L341 HydrophobicContact CD1-CB 3.78Å; L280-L341 HydrophobicContact CD1-CD1 3.79Å; L280-L341 HydrophobicContact CD1-CG 4.36Å; Y338-L341 WeakPolarHBondContact O-CB 3.29Å; Y338-L341 PolarHBondContact O-N 3.35Å; A339-L341 PolarHBondContact O-N 2.93Å
342H64.9Low68.7Low31 Ų3164.5 Ų64.514%0.14432%0.32CS..  trans-92.5111.7-174.6-64.1-69000111.5L91 Y338 A339 K344 V345 R346L91-H342 VanDerWaalsContact CD2-CE1 3.4Å; L91-H342 WeakPolarHBondContact CD2-CE1 3.48Å; L91-H342 WeakPolarHBondContact CD2-ND1 3.41Å; Y338-H342 PolarHBondContact O-CD2 3.12Å; A339-H342 PolarHBondContact O-N 2.84Å; H342-K344 PolarHBondContact O-N 3.23Å; H342-V345 HydrophobicContact CB-CB 3.92Å; H342-V345 HydrophobicContact CB-CG2 3.64Å; H342-V345 PolarHBondContact O-N 3.43Å; H342-V345 VanDerWaalsContact O-N 3.09Å; H342-R346 PolarHBondContact O-N 2.85Å
343S58Low66.8Low90 Ų9070.1 Ų70.163%0.62935%0.348SS*.Hα-helixtrans-56.9-32.8175.852.90000113R346 V347S343-R346 WeakPolarHBondContact O-CB 3.28Å; S343-R346 PolarHBondContact O-N 3.49Å; S343-V347 WeakPolarHBondContact O-CG2 3.41Å; S343-V347 PolarHBondContact O-N 2.79Å
344K54.7Low64.6Low102 Ų10268.9 Ų68.944%0.44335%0.353SS..Hα-helixtrans-69.2-38.2175.9-62.4-173.1-173.6176.40113D88 H342 R346 V347 H348D88-K344 IonicContact OD2-NZ 2.72Å; D88-K344 PolarHBondContact OD2-NZ 3.12Å; H342-K344 PolarHBondContact O-N 3.23Å; K344-R346 VanDerWaalsContact C-N 3.31Å; K344-R346 PolarHBondContact O-N 3.32Å; K344-V347 PolarHBondContact O-N 3.24Å; K344-V347 VanDerWaalsContact O-N 3.15Å; K344-H348 PolarHBondContact O-N 2.65Å
345V54.8Low62.8Low9 Ų973.2 Ų73.26%0.05538%0.381CS..Hα-helixtrans-63.7-41175171.30000109.7F80 A339 H342 V347 H348 L349F80-V345 HydrophobicContact CE1-CG1 3.77Å; F80-V345 HydrophobicContact CZ-CG1 4.38Å; A339-V345 HydrophobicContact CB-CG1 3.54Å; H342-V345 HydrophobicContact CB-CB 3.92Å; H342-V345 HydrophobicContact CB-CG2 3.64Å; H342-V345 PolarHBondContact O-N 3.43Å; H342-V345 VanDerWaalsContact O-N 3.09Å; V345-V347 VanDerWaalsContact C-N 3.26Å; V345-V347 PolarHBondContact O-N 2.83Å; V345-H348 PolarHBondContact O-N 2.98Å; V345-L349 HydrophobicContact CG1-CD1 4.13Å; V345-L349 WeakPolarHBondContact O-CB 3.15Å; V345-L349 PolarHBondContact O-N 3.44Å
346R61.7Low61Low125 Ų12578.8 Ų78.847%0.47242%0.419SS..Hα-helixtrans-58.4-37173.7-62.1177.8-176.9-155.7-15.1112.9S340 H342 S343 K344 K350S340-R346 VanDerWaalsContact O-CZ 3.26Å; S340-R346 PolarHBondContact O-NE 2.89Å; S340-R346 PolarHBondContact O-NH2 3.21Å; H342-R346 PolarHBondContact O-N 2.85Å; S343-R346 WeakPolarHBondContact O-CB 3.28Å; S343-R346 PolarHBondContact O-N 3.49Å; K344-R346 VanDerWaalsContact C-N 3.31Å; K344-R346 PolarHBondContact O-N 3.32Å; R346-K350 WeakPolarHBondContact O-CB 2.93Å; R346-K350 PolarHBondContact O-N 2.9Å
347V57Low59.2Low102 Ų10282.2 Ų82.262%0.61843%0.428SS*.Hα-helixtrans-70.3-45.2178.2174.40000110.7S343 K344 V345 K350 G351S343-V347 WeakPolarHBondContact O-CG2 3.41Å; S343-V347 PolarHBondContact O-N 2.79Å; K344-V347 PolarHBondContact O-N 3.24Å; K344-V347 VanDerWaalsContact O-N 3.15Å; V345-V347 VanDerWaalsContact C-N 3.26Å; V345-V347 PolarHBondContact O-N 2.83Å; V347-K350 PolarHBondContact O-N 2.89Å; V347-G351 PolarHBondContact O-N 2.74Å
348H56.5Low57.1Low112 Ų11285.7 Ų85.752%0.51945%0.454SS..Hα-helixtrans-66.3-46175.5-69.1153.5000112.4K344 V345 K350 G351 Y352K344-H348 PolarHBondContact O-N 2.65Å; V345-H348 PolarHBondContact O-N 2.98Å; H348-K350 VanDerWaalsContact C-N 3.29Å; H348-K350 PolarHBondContact O-N 3.32Å; H348-G351 PolarHBondContact O-N 3.3Å; H348-G351 VanDerWaalsContact O-N 3.09Å; H348-Y352 VanDerWaalsContact O-CD2 3.24Å; H348-Y352 WeakPolarHBondContact O-CD2 3.46Å; H348-Y352 PolarHBondContact O-N 3.29Å
349L54.6Low55.1Low60 Ų6095.9 Ų95.931%0.31449%0.493SS..Hα-helixtrans-59.3-40.6176.3-128.788.1000111.4F80 V345 G351 Y352 L353F80-L349 HydrophobicContact CD1-CD1 4.48Å; F80-L349 HydrophobicContact CE1-CD1 3.87Å; F80-L349 HydrophobicContact CZ-CD1 4.26Å; V345-L349 HydrophobicContact CG1-CD1 4.13Å; V345-L349 WeakPolarHBondContact O-CB 3.15Å; V345-L349 PolarHBondContact O-N 3.44Å; L349-G351 VanDerWaalsContact C-N 3.34Å; L349-Y352 PolarHBondContact O-N 3.5Å; L349-L353 HydrophobicContact CB-CD1 4.46Å; L349-L353 HydrophobicContact CD2-CD1 3.84Å; L349-L353 HydrophobicContact CG-CD1 4Å; L349-L353 VanDerWaalsContact O-CB 3.24Å; L349-L353 WeakPolarHBondContact O-CB 3.1Å; L349-L353 WeakPolarHBondContact O-CD1 3.38Å; L349-L353 WeakPolarHBondContact O-CG 3.21Å; L349-L353 PolarHBondContact O-N 3.47Å
350K54.5Low53.3Low129 Ų129105.9 Ų105.956%0.56153%0.527SS*.Hα-helixtrans-73-27178.1-160.8175.8-168.4-179.60112.3R346 V347 H348 C354R346-K350 WeakPolarHBondContact O-CB 2.93Å; R346-K350 PolarHBondContact O-N 2.9Å; V347-K350 PolarHBondContact O-N 2.89Å; H348-K350 VanDerWaalsContact C-N 3.29Å; H348-K350 PolarHBondContact O-N 3.32Å; K350-C354 CarbonylContact O-C 3.58Å; K350-C354 WeakPolarHBondContact O-CA 3.48Å; K350-C354 WeakPolarHBondContact O-CB 3.41Å; K350-C354 PolarHBondContact O-N 2.95Å
351G52.2Low51.7Low42 Ų42107.1 Ų107.143%0.43355%0.545SS..Hα-helixtrans-67.7-41.3169.900000112.8V347 H348 L349V347-G351 PolarHBondContact O-N 2.74Å; H348-G351 PolarHBondContact O-N 3.3Å; H348-G351 VanDerWaalsContact O-N 3.09Å; L349-G351 VanDerWaalsContact C-N 3.34Å
352Y51.8Low50.4Low195 Ų195112.2 Ų112.277%0.76557%0.568SS**Hα-helixtrans-75.8-39.9176.5-78.4-76.1000113.4H348 L349H348-Y352 VanDerWaalsContact O-CD2 3.24Å; H348-Y352 WeakPolarHBondContact O-CD2 3.46Å; H348-Y352 PolarHBondContact O-N 3.29Å; L349-Y352 PolarHBondContact O-N 3.5Å
353L52Low48.9Very low131 Ų131118.7 Ų118.769%0.68660%0.601SS**Hα-helixtrans-84.7-18.6-178.3-69.3163.4000113.7L349L349-L353 HydrophobicContact CB-CD1 4.46Å; L349-L353 HydrophobicContact CD2-CD1 3.84Å; L349-L353 HydrophobicContact CG-CD1 4Å; L349-L353 VanDerWaalsContact O-CB 3.24Å; L349-L353 WeakPolarHBondContact O-CB 3.1Å; L349-L353 WeakPolarHBondContact O-CD1 3.38Å; L349-L353 WeakPolarHBondContact O-CG 3.21Å; L349-L353 PolarHBondContact O-N 3.47Å
354C43.7Very low48.1Very low69 Ų69120.6 Ų120.647%0.46661%0.608SS.*  trans-140.978.8176.1-78.10000110.8K350 C356K350-C354 CarbonylContact O-C 3.58Å; K350-C354 WeakPolarHBondContact O-CA 3.48Å; K350-C354 WeakPolarHBondContact O-CB 3.41Å; K350-C354 PolarHBondContact O-N 2.95Å; C354-C356 PolarHBondContact O-N 3Å
355P49.6Very low47.3Very low96 Ų96124.3 Ų124.362%0.62363%0.627SS**G310 helixtrans-58.2-22.8176.8-21.831.9000113.3R357P355-R357 PolarHBondContact O-N 3.3Å
356C46.7Very low46.2Very low125 Ų125134 Ų13485%0.84566%0.662SS**G310 helixtrans-80-6.9-166.7-63.10000115.7C354C354-C356 PolarHBondContact O-N 3Å
357R47.4Very low44.7Very low195 Ų195132.3 Ų132.374%0.73668%0.676SS**G310 helixtrans-103.8-13.9-175.5-158.2167.5175.9169.4-0.8114.9P355P355-R357 PolarHBondContact O-N 3.3Å
358S43.6Very low43.8Very low95 Ų95133.1 Ų133.166%0.66468%0.683SS**G310 helixtrans-75.4-26.6-178.2-158.10000113.4R360S358-R360 PolarHBondContact O-N 2.96Å
359R39.4Very low42.8Very low223 Ų223133.4 Ų133.484%0.84270%0.698SS**G310 helixtrans-77.6-11.4-179.2-90.2-173.2176.8-167.6-0.1115.5
360R38.6Very low41.9Very low224 Ų224142.2 Ų142.285%0.84573%0.727SS**G310 helixtrans-88.7-7.7-176.8-137.8174.4-164.8-179.44114S358S358-R360 PolarHBondContact O-N 2.96Å
361G37.2Very low41Very low59 Ų59141.4 Ų141.461%0.60874%0.737SS**SBendtrans-92.5-24.2178.400000114.9
362E38.8Very low40Very low143 Ų143143 Ų14367%0.66875%0.753SS**THydrogen-bonded Turntrans-85.6-8.6-177.7-91.2-178.9118.900114.5
363M35Very low39.2Very low167 Ų167139.7 Ų139.782%0.82375%0.754SS**THydrogen-bonded Turntrans-96.8-4.5-174.5-154.4171.2172.500114.4
364V39.6Very low38.3Very low129 Ų129143.4 Ų143.478%0.78277%0.765SS**SBendtrans-91.1-11.7176.3-179.40000112.3
365E37.7Very low37.8Very low181 Ų181147.3 Ų147.385%0.84678%0.781SS**SBendtrans-10627.3-177.8-149167.7167.800113.5
366R32.1Very low36.9Very low211 Ų211146.8 Ų146.880%0.79678%0.784SS**  trans-133.764.4167.6-76.6-168.8-178.6116.6-1.1110.9
367A31.8Very low36.2Very low91 Ų91146.9 Ų146.975%0.75278%0.781SS**  trans-86.6124.1150.600000107.4S369A367-S369 PolarHBondContact O-N 3.44Å
368P36.8Very low35.4Very low119 Ų119142.6 Ų142.677%0.77378%0.781SS**  trans-73.5126.9178.312.4-1.7000109.7R370P368-R370 PolarHBondContact O-N 3.23Å; P368-R370 VanDerWaalsContact O-N 3.08Å
369S36Very low34.9Very low118 Ų118144.2 Ų144.283%0.82579%0.787SS**  trans-50.8110154.91650000108.2A367A367-S369 PolarHBondContact O-N 3.44Å
370R34.6Very low34.6Very low244 Ų244139.8 Ų139.892%0.92179%0.785SS**  trans-96.298.8172.3-134.1179.8175.9-173.8-2.7107.3P368 G372P368-R370 PolarHBondContact O-N 3.23Å; P368-R370 VanDerWaalsContact O-N 3.08Å; R370-G372 PolarHBondContact O-N 2.99Å
371S36.2Very low34.2Very low112 Ų112133.3 Ų133.378%0.78378%0.779SS**  trans-59.2121.215938.70000109.1
372G31.7Very low34.4Very low75 Ų75136 Ų13677%0.77379%0.786SS**  trans-132.395.3170.500000108.2R370R370-G372 PolarHBondContact O-N 2.99Å
373V35Very low34Very low127 Ų127135 Ų13577%0.7779%0.789SS**  trans-67.3127.6164.2170.30000107.6
374F33.2Very low33.7Very low209 Ų209136.3 Ų136.392%0.91780%0.796SS**  trans-151.2123.7150.4-117-81.9000109.3
375D33Very low33.3Very low151 Ų151137.9 Ų137.981%0.80779%0.794SS**  trans-58.6146.8173.3-77.5-50000112.5
376A31.4Very low32.9Very low84 Ų84133.1 Ų133.169%0.69478%0.781SS**  172.3137.6114.200000113.1
377T31.6Very low32.9Very low127 Ų127131.6 Ų131.678%0.77978%0.783SS**  trans76.2100.3149.746.90000120.6
378S30.2Very low33.2Very low106 Ų106133.1 Ų133.174%0.74178%0.783SS**  51.8123.6123.6680000119.5
379V33.6Very low33.2Very low128 Ų128134.7 Ų134.778%0.77678%0.783SS**  -178.5111.4110.6155.30000108.5
380T32.1Very low33.2Very low131 Ų131136 Ų13680%0.80478%0.781SS**  trans41.1122.7151.649.50000122.6
381A30Very low33.6Very low87 Ų87128.8 Ų128.872%0.71977%0.766SS**  trans-58.1176.6151.200000112.1
382P41.2Very low33.6Very low116 Ų116130.1 Ų130.175%0.75376%0.764SS**  cis-132.2148.827.6224.7000115.8
383V31.4Very low33.8Very low122 Ų122138.3 Ų138.374%0.73979%0.787SS**  56.7113.994-171.40000114.9
384M29.2Very low33.7Very low195 Ų195138.9 Ų138.996%0.96179%0.788SS**  trans-146.3124.4130.1-161.1144176.300110.5
385Q29.6Very low33.8Very low161 Ų161135.2 Ų135.275%0.75278%0.782SS**  trans-77.6151.2-176.9-96.9169.4-33.400112.6
386S29.3Very low33.8Very low81 Ų81134.3 Ų134.357%0.56678%0.78SS**  trans19.9136.1143.164.70000119.8
387H32.8Very low34Very low179 Ų179137.2 Ų137.283%0.82979%0.785SS**  -150.3116.3119.3-97.4-69.4000111
388T38.7Very low34.1Very low123 Ų123137.9 Ų137.976%0.75579%0.786SS**  trans-53.9138.9151.8-120000109.3
389I36.1Very low34.4Very low153 Ų153140 Ų14079%0.78579%0.789SS**  trans-165.1117.8137.6-85136.9000107
390N37.1Very low34.4Very low145 Ų145140.9 Ų140.978%0.77579%0.789SS**  trans-116.4132.5149-168.63.4000103.9
391P42.6Very low34.6Very low93 Ų93141.6 Ų141.660%0.60479%0.788SS**  -149.5153.2100.534-15000114.9
392N36.2Very low35Very low140 Ų140146.2 Ų146.275%0.74979%0.794SS**  trans45.5108.3143.4-61.6-22.8000119.3
393I35.8Very low34.4Very low246 Ų246148.9 Ų148.9100%1.26280%0.798SS**  -169.30109.1-88.9156.6000108.1

Retrieved 393 of 393 residues in 416.6 ms (Link to these results)

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