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Phosphatidylserine synthase

Catalyzes a base-exchange reaction in which the polar head group of phosphatidylethanolamine (PE) is replaced by L-serine.

AlphaFold DB , UniProt , Accession A0A060XQT7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ptdss1b, Length 463 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.9Very low47.9Very low248 Ų248131.5 Ų131.5100%1.22278%0.779SS**  0100.50-84.6173.5171.400107.9
2A32.5Very low50Low96 Ų96130.3 Ų130.379%0.79377%0.774SS**PPolyproline II helixtrans-84.3136.8169.100000108A4A2-A4 PolarHBondContact O-N 3.17Å
3P41.4Very low51.6Low126 Ų126128.8 Ų128.882%0.81876%0.76SS**PPolyproline II helixtrans-70.3134.8175.630.3-30.4000108.7L5P3-L5 PolarHBondContact O-N 2.95Å
4A43.6Very low53.1Low98 Ų98125.3 Ų125.381%0.8174%0.736SS**PPolyproline II helixtrans-59.3127176.600000110A2 G6A2-A4 PolarHBondContact O-N 3.17Å; A4-G6 PolarHBondContact O-N 3.29Å
5L44.5Very low54.6Low179 Ų179120.9 Ų120.994%0.93771%0.711SS**  trans-64.896.9171-162.379000107.9P3 S7P3-L5 PolarHBondContact O-N 2.95Å; L5-S7 PolarHBondContact O-N 3.1Å
6G39.6Very low55.9Low63 Ų63118.8 Ų118.865%0.64970%0.696SS**  trans-61.5118.5175.600000109.9A4 H8A4-G6 PolarHBondContact O-N 3.29Å; G6-H8 VanDerWaalsContact C-N 3.34Å; G6-H8 PolarHBondContact O-N 3.27Å
7S46.7Very low56.9Low105 Ų105113.3 Ų113.373%0.73466%0.663SS**  trans-59.997.6163.8170.20000108L5 K9L5-S7 PolarHBondContact O-N 3.1Å; S7-K9 VanDerWaalsContact C-N 3.34Å; S7-K9 PolarHBondContact O-N 3.48Å
8H50.8Low57.7Low182 Ų182113.3 Ų113.384%0.84366%0.657SS**  trans-61.496.6170.1-124.7-82.1000107.6G6 L10G6-H8 VanDerWaalsContact C-N 3.34Å; G6-H8 PolarHBondContact O-N 3.27Å; H8-L10 PolarHBondContact O-N 3.48Å
9K53.2Low58.6Low185 Ų185112.1 Ų112.180%0.80465%0.647SS**PPolyproline II helixtrans-68.1121.2167.7-70.3-175.4178.3-178.90106.1S7 S11S7-K9 VanDerWaalsContact C-N 3.34Å; S7-K9 PolarHBondContact O-N 3.48Å; K9-S11 PolarHBondContact O-N 3.38Å
10L60Low59.4Low108 Ų108109.6 Ų109.657%0.56563%0.629SS**PPolyproline II helixtrans-52.7135.5172.3-100.285.4000108.9H8 D14 V15H8-L10 PolarHBondContact O-N 3.48Å; L10-D14 HydrophobicContact CB-CB 4.22Å; L10-D14 HydrophobicContact CD2-CB 3.78Å; L10-D14 HydrophobicContact CG-CB 4Å; L10-V15 HydrophobicContact CB-CG2 4.07Å; L10-V15 HydrophobicContact CD2-CG2 4.28Å
11S76.4Confident60.1Low56 Ų56106.3 Ų106.339%0.39261%0.608SS.*PPolyproline II helixtrans-63.3153.4172-178.80000109.8K9 D13 D14 V15K9-S11 PolarHBondContact O-N 3.38Å; S11-D13 PolarHBondContact O-N 3.09Å; S11-D13 PolarHBondContact OG-N 2.94Å; S11-D14 VanDerWaalsContact CB-OD2 3.28Å; S11-D14 WeakPolarHBondContact CB-OD2 3.4Å; S11-D14 PolarHBondContact N-OD2 3.49Å; S11-D14 WeakPolarHBondContact O-CB 3.47Å; S11-D14 PolarHBondContact O-N 2.92Å; S11-V15 PolarHBondContact O-N 2.97Å; S11-V15 VanDerWaalsContact O-N 3.09Å
12T73.8Confident61.8Low117 Ų117101.6 Ų101.672%0.71858%0.576SS**Hα-helixtrans-53.3-36171.6-54.30000111.3V15 N16T12-V15 PolarHBondContact O-N 3.16Å; T12-N16 PolarHBondContact O-N 2.92Å
13D70.5Confident63.6Low112 Ų112103.6 Ų103.660%0.59957%0.571SS**Hα-helixtrans-66.6-40.2176.6-60.9-26.8000111.7S11 V15 N16 D17S11-D13 PolarHBondContact O-N 3.09Å; S11-D13 PolarHBondContact OG-N 2.94Å; D13-V15 VanDerWaalsContact C-N 3.29Å; D13-V15 PolarHBondContact O-N 2.9Å; D13-N16 PolarHBondContact O-N 3.33Å; D13-D17 WeakPolarHBondContact O-CB 2.97Å; D13-D17 PolarHBondContact O-N 3.43Å
14D72.8Confident64.9Low79 Ų7998.7 Ų98.742%0.42254%0.538SS..Hα-helixtrans-65.2-35.6177.1-59.5-40.3000111.5L10 S11 M18L10-D14 HydrophobicContact CB-CB 4.22Å; L10-D14 HydrophobicContact CD2-CB 3.78Å; L10-D14 HydrophobicContact CG-CB 4Å; S11-D14 VanDerWaalsContact CB-OD2 3.28Å; S11-D14 WeakPolarHBondContact CB-OD2 3.4Å; S11-D14 PolarHBondContact N-OD2 3.49Å; S11-D14 WeakPolarHBondContact O-CB 3.47Å; S11-D14 PolarHBondContact O-N 2.92Å; D14-M18 VanDerWaalsContact O-CB 3.29Å; D14-M18 WeakPolarHBondContact O-CB 3.06Å; D14-M18 PolarHBondContact O-N 3.31Å
15V75.7Confident66.4Low59 Ų5994.4 Ų94.436%0.35850%0.501SS..Hα-helixtrans-69.2-42.4176.1178.20000110.7L10 S11 T12 D13 M18 L19L10-V15 HydrophobicContact CB-CG2 4.07Å; L10-V15 HydrophobicContact CD2-CG2 4.28Å; S11-V15 PolarHBondContact O-N 2.97Å; S11-V15 VanDerWaalsContact O-N 3.09Å; T12-V15 PolarHBondContact O-N 3.16Å; D13-V15 VanDerWaalsContact C-N 3.29Å; D13-V15 PolarHBondContact O-N 2.9Å; V15-M18 PolarHBondContact O-N 3.45Å; V15-L19 HydrophobicContact CG1-CD1 4.05Å; V15-L19 WeakPolarHBondContact O-CB 3.4Å; V15-L19 WeakPolarHBondContact O-CG 3.49Å; V15-L19 PolarHBondContact O-N 3.34Å
16N75.3Confident67.8Low88 Ų8888.8 Ų88.847%0.47147%0.47SS..Hα-helixtrans-66.2-44.1178.2-164.155.7000111.5T12 D13 M18 L19 H20T12-N16 PolarHBondContact O-N 2.92Å; D13-N16 PolarHBondContact O-N 3.33Å; N16-M18 VanDerWaalsContact C-N 3.32Å; N16-M18 PolarHBondContact O-N 3.37Å; N16-L19 PolarHBondContact O-N 3.16Å; N16-H20 WeakPolarHBondContact O-CB 3.42Å; N16-H20 PolarHBondContact O-N 2.96Å
17D72.3Confident69.3Low25 Ų2588.5 Ų88.513%0.13445%0.452CS..Hα-helixtrans-57.4-44.8173.1-78-1.1000111.1D13 H20 F21 Q346 K348D13-D17 WeakPolarHBondContact O-CB 2.97Å; D13-D17 PolarHBondContact O-N 3.43Å; D17-H20 PolarHBondContact O-N 3.43Å; D17-F21 VanDerWaalsContact O-CB 3.32Å; D17-F21 WeakPolarHBondContact O-CB 3.43Å; D17-F21 PolarHBondContact O-N 3.3Å; D17-Q346 PolarHBondContact OD1-OE1 3.4Å; D17-K348 IonicContact OD2-NZ 3.62Å; D17-K348 PolarHBondContact OD2-NZ 3.48Å
18M71.4Confident70Confident114 Ų11491.6 Ų91.656%0.56246%0.455SS*.Hα-helixtrans-65.2-43.3178.9-171.9-178.17600112.3D14 V15 N16 R22D14-M18 VanDerWaalsContact O-CB 3.29Å; D14-M18 WeakPolarHBondContact O-CB 3.06Å; D14-M18 PolarHBondContact O-N 3.31Å; V15-M18 PolarHBondContact O-N 3.45Å; N16-M18 VanDerWaalsContact C-N 3.32Å; N16-M18 PolarHBondContact O-N 3.37Å; M18-R22 WeakPolarHBondContact O-CB 3.39Å; M18-R22 PolarHBondContact O-N 3.35Å
19L74.4Confident70.5Confident90 Ų9084.8 Ų84.847%0.47143%0.426SS..Hα-helixtrans-64.3-42.8176.7-74.4169.1000111.2V15 N16 R22 M23V15-L19 HydrophobicContact CG1-CD1 4.05Å; V15-L19 WeakPolarHBondContact O-CB 3.4Å; V15-L19 WeakPolarHBondContact O-CG 3.49Å; V15-L19 PolarHBondContact O-N 3.34Å; N16-L19 PolarHBondContact O-N 3.16Å; L19-R22 WeakPolarHBondContact O-CB 3.39Å; L19-R22 PolarHBondContact O-N 3.13Å; L19-M23 WeakPolarHBondContact O-CG 3.4Å; L19-M23 PolarHBondContact O-N 3.34Å
20H74.9Confident70.6Confident62 Ų6284.5 Ų84.529%0.28743%0.427SS..Hα-helixtrans-65.9-42.9178.7-161.5-30.9000111.9N16 D17 R22 M23 I24 D344N16-H20 WeakPolarHBondContact O-CB 3.42Å; N16-H20 PolarHBondContact O-N 2.96Å; D17-H20 PolarHBondContact O-N 3.43Å; H20-R22 VanDerWaalsContact C-N 3.27Å; H20-R22 PolarHBondContact O-N 3.16Å; H20-M23 PolarHBondContact O-N 2.93Å; H20-I24 WeakPolarHBondContact ND1-CD1 3.3Å; H20-I24 WeakPolarHBondContact O-CG1 3.48Å; H20-I24 PolarHBondContact O-N 3.48Å; H20-I24 VanDerWaalsContact O-N 3.15Å; H20-D344 IonicContact CE1-OD2 2.81Å; H20-D344 PolarHBondContact CE1-OD2 3.1Å; H20-D344 VanDerWaalsContact CE1-OD2 3.22Å; H20-D344 IonicContact NE2-OD2 3.22Å
21F75.1Confident70.3Confident40 Ų4082.6 Ų82.618%0.17543%0.434CS..Hα-helixtrans-58.8-41.1173.1177.9-94.4000111.4D17 I24 N25 R349D17-F21 VanDerWaalsContact O-CB 3.32Å; D17-F21 WeakPolarHBondContact O-CB 3.43Å; D17-F21 PolarHBondContact O-N 3.3Å; F21-I24 PolarHBondContact O-N 3.26Å; F21-N25 WeakPolarHBondContact CD2-ND2 3.46Å; F21-N25 HydrophobicContact CE1-CB 4.48Å; F21-N25 WeakPolarHBondContact CE2-ND2 3.24Å; F21-N25 WeakPolarHBondContact CZ-ND2 3.36Å; F21-N25 WeakPolarHBondContact O-CB 3.45Å; F21-N25 PolarHBondContact O-N 3.08Å; F21-N25 PolarHBondContact O-ND2 3.12Å; F21-R349 HydrophobicContact CD2-CB 4.09Å; F21-R349 HydrophobicContact CE2-CB 3.66Å; F21-R349 HydrophobicContact CE2-CG 3.99Å; F21-R349 WeakPolarHBondContact CE2-O 3.31Å; F21-R349 HydrophobicContact CZ-CB 4.25Å; F21-R349 HydrophobicContact CZ-CG 4.1Å
22R73.4Confident69.4Low149 Ų14983.2 Ų83.256%0.56243%0.432SS*.Hα-helixtrans-65.8-41.6176.9-167.7177.3-171.1179.72.7111.9M18 L19 H20 I24 N25 E26M18-R22 WeakPolarHBondContact O-CB 3.39Å; M18-R22 PolarHBondContact O-N 3.35Å; L19-R22 WeakPolarHBondContact O-CB 3.39Å; L19-R22 PolarHBondContact O-N 3.13Å; H20-R22 VanDerWaalsContact C-N 3.27Å; H20-R22 PolarHBondContact O-N 3.16Å; R22-I24 VanDerWaalsContact C-N 3.3Å; R22-I24 PolarHBondContact O-N 3.01Å; R22-N25 PolarHBondContact O-N 3.23Å; R22-E26 HydrophobicContact CG-CB 4.08Å; R22-E26 HydrophobicContact CG-CG 4.13Å; R22-E26 WeakPolarHBondContact CG-OE2 3.3Å; R22-E26 IonicContact CZ-OE2 3.54Å; R22-E26 IonicContact NE-OE2 3.71Å; R22-E26 PolarHBondContact NE-OE2 3.03Å; R22-E26 IonicContact NH2-OE2 3.37Å; R22-E26 PolarHBondContact NH2-OE2 3.34Å; R22-E26 CarbonylContact O-C 3.5Å; R22-E26 VanDerWaalsContact O-CA 3.3Å; R22-E26 WeakPolarHBondContact O-CA 3.26Å; R22-E26 WeakPolarHBondContact O-CB 3.5Å; R22-E26 PolarHBondContact O-N 3.39Å
23M69.3Low68.5Low139 Ų13978.6 Ų78.669%0.68540%0.404SS*.Hα-helixtrans-62.2-36.5177.7-75.3-179.959.700113.1L19 H20L19-M23 WeakPolarHBondContact O-CG 3.4Å; L19-M23 PolarHBondContact O-N 3.34Å; H20-M23 PolarHBondContact O-N 2.93Å
24I70.6Confident68Low23 Ų2376.2 Ų76.212%0.11839%0.391CS..Hα-helixtrans-74.2-43179-65.9168.5000111.3H20 F21 R22 A340 D344 C347H20-I24 WeakPolarHBondContact ND1-CD1 3.3Å; H20-I24 WeakPolarHBondContact O-CG1 3.48Å; H20-I24 PolarHBondContact O-N 3.48Å; H20-I24 VanDerWaalsContact O-N 3.15Å; F21-I24 PolarHBondContact O-N 3.26Å; R22-I24 VanDerWaalsContact C-N 3.3Å; R22-I24 PolarHBondContact O-N 3.01Å; I24-A340 HydrophobicContact CG2-CB 3.57Å; I24-D344 VanDerWaalsContact CD1-OD2 3.24Å; I24-D344 WeakPolarHBondContact CD1-OD2 3.42Å; I24-C347 HydrophobicContact CD1-CB 4.37Å
25N73.4Confident67.4Low7 Ų777.1 Ų77.14%0.03740%0.396CS..Hα-helixtrans-90.9-26.9-172.3-71-70000114F21 R22 G91 Q337 G351F21-N25 WeakPolarHBondContact CD2-ND2 3.46Å; F21-N25 HydrophobicContact CE1-CB 4.48Å; F21-N25 WeakPolarHBondContact CE2-ND2 3.24Å; F21-N25 WeakPolarHBondContact CZ-ND2 3.36Å; F21-N25 WeakPolarHBondContact O-CB 3.45Å; F21-N25 PolarHBondContact O-N 3.08Å; F21-N25 PolarHBondContact O-ND2 3.12Å; R22-N25 PolarHBondContact O-N 3.23Å; N25-G91 CarbonylContact O-C 3.54Å; N25-G91 VanDerWaalsContact O-CA 3.24Å; N25-G91 WeakPolarHBondContact O-CA 3.35Å; N25-Q337 WeakPolarHBondContact OD1-CG 3.18Å; N25-Q337 PolarHBondContact OD1-NE2 3.45Å; N25-Q337 VanDerWaalsContact OD1-NE2 3.12Å; N25-G351 WeakPolarHBondContact OD1-CA 3.46Å
26E74.6Confident66.6Low61 Ų6180.8 Ų80.829%0.28541%0.408SS..SBendtrans-124.476.1-178.4-52.2-173.6176.500110.3R22 Q28 P89 N90R22-E26 HydrophobicContact CG-CB 4.08Å; R22-E26 HydrophobicContact CG-CG 4.13Å; R22-E26 WeakPolarHBondContact CG-OE2 3.3Å; R22-E26 IonicContact CZ-OE2 3.54Å; R22-E26 IonicContact NE-OE2 3.71Å; R22-E26 PolarHBondContact NE-OE2 3.03Å; R22-E26 IonicContact NH2-OE2 3.37Å; R22-E26 PolarHBondContact NH2-OE2 3.34Å; R22-E26 CarbonylContact O-C 3.5Å; R22-E26 VanDerWaalsContact O-CA 3.3Å; R22-E26 WeakPolarHBondContact O-CA 3.26Å; R22-E26 WeakPolarHBondContact O-CB 3.5Å; R22-E26 PolarHBondContact O-N 3.39Å; E26-Q28 PolarHBondContact O-N 3.09Å; E26-P89 HydrophobicContact CG-CB 4Å; E26-P89 WeakPolarHBondContact OE1-CB 3.35Å; E26-N90 WeakPolarHBondContact CA-O 3.26Å; E26-N90 HydrophobicContact CB-CB 4.46Å; E26-N90 WeakPolarHBondContact CG-O 3.32Å
27Q70.6Confident65.9Low58 Ų5882.6 Ų82.627%0.27141%0.411SS..  trans-65134179.4-76.7-162.8-27.100111.6N90 G91 P92 T94Q27-N90 PolarHBondContact O-ND2 3.03Å; Q27-G91 PolarHBondContact N-O 3.36Å; Q27-P92 PolarHBondContact OE1-O 3.36Å; Q27-T94 HydrophobicContact CB-CG2 3.65Å
28Q61.5Low65.5Low170 Ų17084.2 Ų84.279%0.79442%0.416SS*.  trans-77.5148.9169.5-65.6-171.9-9.300110.1E26E26-Q28 PolarHBondContact O-N 3.09Å
29V62.7Low65.2Low39 Ų3985.4 Ų85.424%0.23642%0.418CS..  trans-88.8113.7177.5-173.50000109.2I32 Y38 T94 P98V29-I32 HydrophobicContact CG1-CG1 4.35Å; V29-Y38 HydrophobicContact CB-CD1 4.37Å; V29-Y38 HydrophobicContact CB-CE1 4.17Å; V29-Y38 HydrophobicContact CG1-CD1 4.15Å; V29-Y38 HydrophobicContact CG1-CE1 3.59Å; V29-Y38 HydrophobicContact CG2-CD1 4.25Å; V29-Y38 HydrophobicContact CG2-CE1 3.96Å; V29-T94 HydrophobicContact CG2-CG2 4.11Å; V29-P98 HydrophobicContact CG2-CG 3.38Å
30E54.6Low64.9Low178 Ų17886.2 Ų86.283%0.83243%0.428SS*.  trans-88.8146172.9-62.7179.5-173.600111.1
31G52.5Low65Low68 Ų6887.1 Ų87.170%0.70143%0.433SS*.SBendtrans68.255.4170.700000115.2S33G31-S33 PolarHBondContact O-N 3.43Å; G31-S33 VanDerWaalsContact O-N 3.13Å
32I58.9Low65.1Low69 Ų6988.9 Ų88.935%0.35445%0.447SS..  trans-67.1109.4179.1-60.3166.1000110.6V29 N35 Y38V29-I32 HydrophobicContact CG1-CG1 4.35Å; I32-N35 VanDerWaalsContact CG2-OD1 3.24Å; I32-N35 WeakPolarHBondContact CG2-OD1 3.48Å; I32-Y38 HydrophobicContact CB-CD2 4.42Å; I32-Y38 HydrophobicContact CD1-CG 4.25Å; I32-Y38 HydrophobicContact CG1-CD1 4.41Å; I32-Y38 HydrophobicContact CG1-CD2 4.33Å; I32-Y38 HydrophobicContact CG1-CG 4.1Å; I32-Y38 HydrophobicContact CG2-CD2 3.43Å; I32-Y38 VanDerWaalsContact CG2-CD2 3.43Å; I32-Y38 HydrophobicContact CG2-CE2 4.08Å; I32-Y38 HydrophobicContact CG2-CG 3.88Å
33S55.2Low65.5Low20 Ų2087.7 Ų87.714%0.1445%0.451CS..SBendtrans-78.1-30.1178.457.30000113.3G31G31-S33 PolarHBondContact O-N 3.43Å; G31-S33 VanDerWaalsContact O-N 3.13Å
34I59.9Low66.1Low62 Ų6285.5 Ų85.532%0.31845%0.445SS..  trans-131.994.7178.7-52.8174.1000109.6F36 F37 Y38 I250I34-F36 HydrophobicContact CG2-CB 4.13Å; I34-F36 PolarHBondContact O-N 3.46Å; I34-F37 HydrophobicContact CB-CD2 3.85Å; I34-F37 HydrophobicContact CB-CE2 4.41Å; I34-F37 HydrophobicContact CD1-CD2 4.07Å; I34-F37 HydrophobicContact CD1-CE2 3.91Å; I34-F37 HydrophobicContact CG2-CD2 3.52Å; I34-F37 HydrophobicContact CG2-CE2 3.86Å; I34-F37 PolarHBondContact O-N 3.17Å; I34-Y38 WeakPolarHBondContact O-CD2 3.25Å; I34-I250 HydrophobicContact CD1-CD1 4.38Å
35N58.6Low66.6Low99 Ų9987.1 Ų87.153%0.52945%0.454SS..Hα-helixtrans-56.2-24-178.3-78.4-28.1000114.8I32 Y38 K39I32-N35 VanDerWaalsContact CG2-OD1 3.24Å; I32-N35 WeakPolarHBondContact CG2-OD1 3.48Å; N35-Y38 PolarHBondContact O-N 3.21Å; N35-K39 WeakPolarHBondContact O-CG 3.34Å; N35-K39 PolarHBondContact O-N 3.13Å; N35-K39 VanDerWaalsContact O-N 3.09Å
36F60.2Low67.1Low136 Ų13691.6 Ų91.660%0.59648%0.478SS*.Hα-helixtrans-63.2-41178.8-178.1-99.2000113.1I34 Y38 H41I34-F36 HydrophobicContact CG2-CB 4.13Å; I34-F36 PolarHBondContact O-N 3.46Å; F36-Y38 VanDerWaalsContact C-N 3.28Å; F36-Y38 PolarHBondContact O-N 3.03Å; F36-H41 AromaticContact CD2-NE2 3.61Å; F36-H41 AromaticContact CE2-NE2 3.64Å
37F59.9Low67.6Low125 Ų12592.9 Ų92.955%0.54849%0.49SS..Hα-helixtrans-74.8-18.8-178.4-69.4-65.8000113.7I34 H97I34-F37 HydrophobicContact CB-CD2 3.85Å; I34-F37 HydrophobicContact CB-CE2 4.41Å; I34-F37 HydrophobicContact CD1-CD2 4.07Å; I34-F37 HydrophobicContact CD1-CE2 3.91Å; I34-F37 HydrophobicContact CG2-CD2 3.52Å; I34-F37 HydrophobicContact CG2-CE2 3.86Å; I34-F37 PolarHBondContact O-N 3.17Å; F37-H97 PolarHBondContact O-NE2 3.21Å
38Y63.6Low68.3Low60 Ų6097.2 Ų97.224%0.23551%0.508CS..Hα-helixtrans-105.4-9.9-176.4-67.4-90.6000113.4V29 I32 I34 N35 F36 H97 P98V29-Y38 HydrophobicContact CB-CD1 4.37Å; V29-Y38 HydrophobicContact CB-CE1 4.17Å; V29-Y38 HydrophobicContact CG1-CD1 4.15Å; V29-Y38 HydrophobicContact CG1-CE1 3.59Å; V29-Y38 HydrophobicContact CG2-CD1 4.25Å; V29-Y38 HydrophobicContact CG2-CE1 3.96Å; I32-Y38 HydrophobicContact CB-CD2 4.42Å; I32-Y38 HydrophobicContact CD1-CG 4.25Å; I32-Y38 HydrophobicContact CG1-CD1 4.41Å; I32-Y38 HydrophobicContact CG1-CD2 4.33Å; I32-Y38 HydrophobicContact CG1-CG 4.1Å; I32-Y38 HydrophobicContact CG2-CD2 3.43Å; I32-Y38 VanDerWaalsContact CG2-CD2 3.43Å; I32-Y38 HydrophobicContact CG2-CE2 4.08Å; I32-Y38 HydrophobicContact CG2-CG 3.88Å; I34-Y38 WeakPolarHBondContact O-CD2 3.25Å; N35-Y38 PolarHBondContact O-N 3.21Å; F36-Y38 VanDerWaalsContact C-N 3.28Å; F36-Y38 PolarHBondContact O-N 3.03Å; Y38-H97 AromaticContact CE1-CD2 3.94Å; Y38-H97 AromaticContact CE1-NE2 3.79Å; Y38-H97 AromaticContact CZ-CD2 3.81Å; Y38-H97 AromaticContact CZ-NE2 3.95Å; Y38-P98 HydrophobicContact CE1-CG 4.2Å
39K66.2Low69.4Low139 Ų13989.8 Ų89.860%0.60447%0.474SS*.SBendtrans-81127.1169.7-81.9-171.6176.6-171.70109.7N35 H41N35-K39 WeakPolarHBondContact O-CG 3.34Å; N35-K39 PolarHBondContact O-N 3.13Å; N35-K39 VanDerWaalsContact O-N 3.09Å; K39-H41 PolarHBondContact O-CD2 3.26Å; K39-H41 PolarHBondContact O-N 2.71Å
40P67.1Low70.6Confident106 Ų10691.2 Ų91.269%0.68848%0.483SS*.  trans-72.3103.3179.429.1-33.5000110.1T42P40-T42 HydrophobicContact CB-CG2 4.01Å; P40-T42 PolarHBondContact O-N 3.45Å; P40-T42 VanDerWaalsContact O-N 3.12Å
41H76.3Confident72.2Confident82 Ų8285.2 Ų85.238%0.3846%0.464SS..  trans-85.258.5174-70.3-79.4000111.1F36 K39 L43 T44 L45F36-H41 AromaticContact CD2-NE2 3.61Å; F36-H41 AromaticContact CE2-NE2 3.64Å; K39-H41 PolarHBondContact O-CD2 3.26Å; K39-H41 PolarHBondContact O-N 2.71Å; H41-L43 PolarHBondContact O-N 3.02Å; H41-T44 PolarHBondContact O-N 3.02Å; H41-L45 WeakPolarHBondContact O-CB 3.31Å; H41-L45 PolarHBondContact O-N 3.45Å
42T78.9Confident73.7Confident76 Ų7683.6 Ų83.647%0.46644%0.441SS..Hα-helixtrans-61.5-41.9-169.757.90000113.3P40 L45 L46 L86P40-T42 HydrophobicContact CB-CG2 4.01Å; P40-T42 PolarHBondContact O-N 3.45Å; P40-T42 VanDerWaalsContact O-N 3.12Å; T42-L45 PolarHBondContact O-N 2.77Å; T42-L46 WeakPolarHBondContact O-CB 3.19Å; T42-L46 PolarHBondContact O-N 2.97Å; T42-L86 HydrophobicContact CG2-CD2 3.89Å
43L81.5Confident75Confident124 Ų12483.6 Ų83.665%0.64944%0.442SS*.Hα-helixtrans-67.3-43.7178.4-173.664.4000111.5H41 L45 L46 T47H41-L43 PolarHBondContact O-N 3.02Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.23Å; L43-L46 WeakPolarHBondContact O-CB 3.49Å; L43-L46 PolarHBondContact O-N 3.08Å; L43-T47 PolarHBondContact O-N 2.96Å; L43-T47 PolarHBondContact O-OG1 3.18Å
44T81.9Confident76.6Confident93 Ų9387.7 Ų87.757%0.57146%0.46SS*.Hα-helixtrans-62.9-42.7177.2-46.90000111.3H41 T47 F48H41-T44 PolarHBondContact O-N 3.02Å; T44-T47 PolarHBondContact O-N 3.08Å; T44-F48 WeakPolarHBondContact O-CB 3.4Å; T44-F48 PolarHBondContact O-N 3.04Å
45L80.9Confident77.9Confident57 Ų5792 Ų9230%0.29847%0.473SS..Hα-helixtrans-63.4-43.6175.2-172.761.1000110.8H41 T42 L43 F48 T49 V82 L86H41-L45 WeakPolarHBondContact O-CB 3.31Å; H41-L45 PolarHBondContact O-N 3.45Å; T42-L45 PolarHBondContact O-N 2.77Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.23Å; L45-F48 PolarHBondContact O-N 3.12Å; L45-T49 WeakPolarHBondContact O-CB 3.39Å; L45-T49 PolarHBondContact O-N 3.12Å; L45-T49 PolarHBondContact O-OG1 3.27Å; L45-V82 HydrophobicContact CD1-CG1 4.22Å; L45-V82 HydrophobicContact CD2-CG1 3.76Å; L45-V82 HydrophobicContact CG-CG1 3.85Å; L45-L86 HydrophobicContact CD2-CD1 4.09Å; L45-L86 HydrophobicContact CD2-CD2 3.85Å; L45-L86 HydrophobicContact CD2-CG 4Å
46L82.8Confident79.2Confident102 Ų10291.2 Ų91.253%0.53447%0.466SS..Hα-helixtrans-59.9-49.9175.4179.664.4000111.6T42 L43 F48 T49 V50T42-L46 WeakPolarHBondContact O-CB 3.19Å; T42-L46 PolarHBondContact O-N 2.97Å; L43-L46 WeakPolarHBondContact O-CB 3.49Å; L43-L46 PolarHBondContact O-N 3.08Å; L46-F48 PolarHBondContact O-N 3.32Å; L46-T49 PolarHBondContact O-N 3.5Å; L46-V50 HydrophobicContact CD1-CG2 4.05Å; L46-V50 HydrophobicContact CG-CG2 4.46Å; L46-V50 WeakPolarHBondContact O-CB 3.2Å; L46-V50 WeakPolarHBondContact O-CG2 3.43Å; L46-V50 PolarHBondContact O-N 3.48Å
47T85Confident80.5Confident87 Ų8789.1 Ų89.153%0.53446%0.464SS..Hα-helixtrans-59.3-45.7179.1-54.30000111.4L43 T44 V50 A51L43-T47 PolarHBondContact O-N 2.96Å; L43-T47 PolarHBondContact O-OG1 3.18Å; T44-T47 PolarHBondContact O-N 3.08Å; T47-V50 PolarHBondContact O-N 3.01Å; T47-A51 VanDerWaalsContact O-CB 3.25Å; T47-A51 WeakPolarHBondContact O-CB 3.44Å; T47-A51 PolarHBondContact O-N 3.11Å
48F86.4Confident81.8Confident149 Ų14991 Ų9165%0.65447%0.472SS*.Hα-helixtrans-63.9-44.4177.8-178.2-98.9000111.8T44 L45 L46 A51 S52T44-F48 WeakPolarHBondContact O-CB 3.4Å; T44-F48 PolarHBondContact O-N 3.04Å; L45-F48 PolarHBondContact O-N 3.12Å; L46-F48 PolarHBondContact O-N 3.32Å; F48-A51 PolarHBondContact O-N 2.75Å; F48-S52 VanDerWaalsContact O-CB 3.26Å; F48-S52 WeakPolarHBondContact O-CB 3.47Å; F48-S52 PolarHBondContact O-N 3.07Å
49T84.5Confident82.9Confident15 Ų1591.3 Ų91.39%0.09248%0.483CS..Hα-helixtrans-64.4-42.8-179.9-42.90000110.9L45 L46 S52 L53 F79L45-T49 WeakPolarHBondContact O-CB 3.39Å; L45-T49 PolarHBondContact O-N 3.12Å; L45-T49 PolarHBondContact O-OG1 3.27Å; L46-T49 PolarHBondContact O-N 3.5Å; T49-S52 PolarHBondContact O-N 2.96Å; T49-L53 PolarHBondContact O-N 3.45Å; T49-F79 HydrophobicContact CG2-CD1 3.48Å; T49-F79 VanDerWaalsContact CG2-CD1 3.48Å; T49-F79 HydrophobicContact CG2-CD2 4.17Å; T49-F79 HydrophobicContact CG2-CE1 3.09Å; T49-F79 HydrophobicContact CG2-CE2 3.86Å; T49-F79 HydrophobicContact CG2-CG 4.02Å; T49-F79 HydrophobicContact CG2-CZ 3.3Å; T49-F79 VanDerWaalsContact O-CZ 3.32Å; T49-F79 WeakPolarHBondContact O-CZ 3.45Å
50V86.9Confident83.8Confident68 Ų6887.6 Ų87.641%0.41247%0.465SS..Hα-helixtrans-66.9-44.4176172.90000111.9L46 T47 S52 L53 M54L46-V50 HydrophobicContact CD1-CG2 4.05Å; L46-V50 HydrophobicContact CG-CG2 4.46Å; L46-V50 WeakPolarHBondContact O-CB 3.2Å; L46-V50 WeakPolarHBondContact O-CG2 3.43Å; L46-V50 PolarHBondContact O-N 3.48Å; T47-V50 PolarHBondContact O-N 3.01Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.41Å; V50-L53 WeakPolarHBondContact O-CB 3.31Å; V50-L53 PolarHBondContact O-N 3.37Å; V50-L53 VanDerWaalsContact O-N 3.17Å; V50-M54 HydrophobicContact CG1-SD 4.38Å; V50-M54 WeakPolarHBondContact O-CG 3.34Å; V50-M54 PolarHBondContact O-N 3.31Å
51A88Confident84.6Confident52 Ų5288 Ų8843%0.4346%0.462SS..Hα-helixtrans-63-39.2177.400000111.9T47 F48 M54 Y55T47-A51 VanDerWaalsContact O-CB 3.25Å; T47-A51 WeakPolarHBondContact O-CB 3.44Å; T47-A51 PolarHBondContact O-N 3.11Å; F48-A51 PolarHBondContact O-N 2.75Å; A51-M54 PolarHBondContact O-N 2.83Å; A51-Y55 PolarHBondContact O-N 3.27Å
52S84.8Confident85.1Confident34 Ų3490 Ų9024%0.23848%0.475CS..Hα-helixtrans-60.9-44.1172.6-177.20000111.3F48 T49 V50 M54 Y55 F56F48-S52 VanDerWaalsContact O-CB 3.26Å; F48-S52 WeakPolarHBondContact O-CB 3.47Å; F48-S52 PolarHBondContact O-N 3.07Å; T49-S52 PolarHBondContact O-N 2.96Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.41Å; S52-M54 PolarHBondContact O-N 2.93Å; S52-Y55 WeakPolarHBondContact O-CB 3.46Å; S52-Y55 PolarHBondContact O-N 3.29Å; S52-F56 VanDerWaalsContact O-CD2 3.26Å; S52-F56 WeakPolarHBondContact O-CD2 3.41Å; S52-F56 PolarHBondContact O-N 2.92Å
53L87.2Confident85.6Confident70 Ų7090.1 Ų90.137%0.36648%0.484SS..Hα-helixtrans-58.6-49.1174.4-16562.8000111.6T49 V50 Y55 F56 V57 L75 F79T49-L53 PolarHBondContact O-N 3.45Å; V50-L53 WeakPolarHBondContact O-CB 3.31Å; V50-L53 PolarHBondContact O-N 3.37Å; V50-L53 VanDerWaalsContact O-N 3.17Å; L53-Y55 VanDerWaalsContact C-N 3.28Å; L53-Y55 PolarHBondContact O-N 3.48Å; L53-F56 PolarHBondContact O-N 2.75Å; L53-V57 HydrophobicContact CG-CG2 4.3Å; L53-V57 WeakPolarHBondContact O-CB 3.33Å; L53-V57 VanDerWaalsContact O-CG2 3.25Å; L53-V57 WeakPolarHBondContact O-CG2 3.44Å; L53-V57 PolarHBondContact O-N 2.98Å; L53-L75 HydrophobicContact CD1-CD1 4.38Å; L53-F79 HydrophobicContact CB-CZ 3.85Å; L53-F79 HydrophobicContact CD1-CE2 4.14Å; L53-F79 HydrophobicContact CD1-CZ 3.96Å; L53-F79 HydrophobicContact CD2-CZ 4.37Å; L53-F79 HydrophobicContact CG-CZ 4.28Å
54M88.3Confident86Confident105 Ų10588.4 Ų88.452%0.51748%0.475SS..Hα-helixtrans-57.8-44.1178.7-70179.670.200110.8V50 A51 S52 V57 F58V50-M54 HydrophobicContact CG1-SD 4.38Å; V50-M54 WeakPolarHBondContact O-CG 3.34Å; V50-M54 PolarHBondContact O-N 3.31Å; A51-M54 PolarHBondContact O-N 2.83Å; S52-M54 PolarHBondContact O-N 2.93Å; M54-V57 PolarHBondContact O-N 3.5Å; M54-F58 HydrophobicContact CB-CD2 4.36Å; M54-F58 HydrophobicContact CB-CE2 4.49Å; M54-F58 HydrophobicContact CE-CE2 4.43Å; M54-F58 WeakPolarHBondContact O-CD2 3.41Å; M54-F58 PolarHBondContact O-N 2.98Å
55Y87.7Confident86.3Confident153 Ų15388.8 Ų88.860%0.648%0.477SS*.Hα-helixtrans-57.3-52.5175.5175.5-97.8000111.6A51 S52 L53 V57 F58 S59A51-Y55 PolarHBondContact O-N 3.27Å; S52-Y55 WeakPolarHBondContact O-CB 3.46Å; S52-Y55 PolarHBondContact O-N 3.29Å; L53-Y55 VanDerWaalsContact C-N 3.28Å; L53-Y55 PolarHBondContact O-N 3.48Å; Y55-V57 VanDerWaalsContact C-N 3.31Å; Y55-V57 PolarHBondContact O-N 3.35Å; Y55-F58 PolarHBondContact O-N 3.2Å; Y55-S59 WeakPolarHBondContact O-CB 3.43Å; Y55-S59 PolarHBondContact O-N 3.46Å; Y55-S59 PolarHBondContact O-OG 3.41Å
56F85.3Confident86.6Confident83 Ų8389.8 Ų89.836%0.36448%0.483SS..Hα-helixtrans-66-31.4-179.2-80.2-71.3000113.7S52 L53 R60 L75S52-F56 VanDerWaalsContact O-CD2 3.26Å; S52-F56 WeakPolarHBondContact O-CD2 3.41Å; S52-F56 PolarHBondContact O-N 2.92Å; L53-F56 PolarHBondContact O-N 2.75Å; F56-R60 WeakPolarHBondContact O-CB 3.37Å; F56-L75 HydrophobicContact CB-CD1 4.18Å; F56-L75 HydrophobicContact CD2-CD2 4.1Å; F56-L75 HydrophobicContact CE2-CD2 4.46Å
57V86.7Confident86.8Confident92 Ų9288.3 Ų88.356%0.55848%0.475SS*.Hα-helixtrans-70.6-40.5177.4169.20000111.5L53 M54 Y55L53-V57 HydrophobicContact CG-CG2 4.3Å; L53-V57 WeakPolarHBondContact O-CB 3.33Å; L53-V57 VanDerWaalsContact O-CG2 3.25Å; L53-V57 WeakPolarHBondContact O-CG2 3.44Å; L53-V57 PolarHBondContact O-N 2.98Å; M54-V57 PolarHBondContact O-N 3.5Å; Y55-V57 VanDerWaalsContact C-N 3.31Å; Y55-V57 PolarHBondContact O-N 3.35Å
58F88.5Confident87.1Confident165 Ų16586.7 Ų86.772%0.72446%0.463SS*.Hα-helixtrans-98.6-17.2-173-65.9-64000115.2M54 Y55M54-F58 HydrophobicContact CB-CD2 4.36Å; M54-F58 HydrophobicContact CB-CE2 4.49Å; M54-F58 HydrophobicContact CE-CE2 4.43Å; M54-F58 WeakPolarHBondContact O-CD2 3.41Å; M54-F58 PolarHBondContact O-N 2.98Å; Y55-F58 PolarHBondContact O-N 3.2Å
59S85.4Confident87.2Confident66 Ų6684.2 Ų84.246%0.46246%0.456SS..Hα-helixtrans-96.6-11.9-178.365.80000114.3Y55Y55-S59 WeakPolarHBondContact O-CB 3.43Å; Y55-S59 PolarHBondContact O-N 3.46Å; Y55-S59 PolarHBondContact O-OG 3.41Å
60R85.9Confident87.4Confident61 Ų6188.6 Ų88.623%0.2347%0.471CS..SBendtrans-98.4141.1-169.2-151.5-163100.9140.120.4111.3F56 N67 N68F56-R60 WeakPolarHBondContact O-CB 3.37Å; R60-N67 PolarHBondContact NH1-O 3.17Å; R60-N67 PolarHBondContact NH2-ND2 2.92Å; R60-N67 VanDerWaalsContact NH2-ND2 3.14Å; R60-N67 PolarHBondContact NH2-O 2.9Å; R60-N68 VanDerWaalsContact CZ-OD1 3.28Å; R60-N68 PolarHBondContact NH2-OD1 2.95Å
61D84Confident87.5Confident115 Ų11587 Ų8762%0.61546%0.461SS*.  trans-71.1129.3167-170.6-3.4000109.8A63D61-A63 VanDerWaalsContact OD1-CB 3.29Å; D61-A63 WeakPolarHBondContact OD1-CB 3.31Å; D61-A63 PolarHBondContact OD1-N 2.98Å
62D85.9Confident87.6Confident123 Ų12386 Ų8666%0.65846%0.457SS*.  trans-106.710.9-178.567.4-14.6000113.4D64 N68D62-D64 PolarHBondContact O-N 3.42Å; D62-N68 WeakPolarHBondContact CA-OD1 3.33Å; D62-N68 PolarHBondContact O-ND2 3.43Å
63A89.8Confident87.8Confident79 Ų7990.5 Ų90.565%0.65347%0.473SS*.  trans-62.5-34.8178.100000114.3D61D61-A63 VanDerWaalsContact OD1-CB 3.29Å; D61-A63 WeakPolarHBondContact OD1-CB 3.31Å; D61-A63 PolarHBondContact OD1-N 2.98Å
64D90.1Very high88Confident87 Ų8792.8 Ų92.847%0.46548%0.484SS..  trans-96.1110.7-179.8179.9-0.3000112.2D62 D66 N67 N68D62-D64 PolarHBondContact O-N 3.42Å; D64-D66 PolarHBondContact O-N 3.48Å; D64-D66 PolarHBondContact OD1-N 2.76Å; D64-N67 HydrophobicContact CB-CB 3.95Å; D64-N67 PolarHBondContact O-N 3.03Å; D64-N67 PolarHBondContact OD1-N 3.22Å; D64-N67 WeakPolarHBondContact OD2-CB 3.35Å; D64-N68 WeakPolarHBondContact O-CB 3.25Å; D64-N68 PolarHBondContact O-N 3.33Å; D64-N68 PolarHBondContact O-ND2 3.43Å; D64-N68 PolarHBondContact O-OD1 3.49Å
65V88.8Confident88.1Confident101 Ų10189.3 Ų89.361%0.61247%0.468SS*.Hα-helixtrans-59.2-42.2178.9-178.50000112.5N68 L69V65-N68 WeakPolarHBondContact O-CB 3.26Å; V65-N68 PolarHBondContact O-N 3.42Å; V65-L69 HydrophobicContact CG1-CD1 4.26Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 2.98Å
66D86.7Confident88.3Confident79 Ų7986.7 Ų86.742%0.42247%0.467SS..Hα-helixtrans-70-42.2-176.9-83-38.2000110.6D64 N68 L69 R70 W132D64-D66 PolarHBondContact O-N 3.48Å; D64-D66 PolarHBondContact OD1-N 2.76Å; D66-N68 VanDerWaalsContact C-N 3.31Å; D66-N68 PolarHBondContact O-N 2.89Å; D66-L69 PolarHBondContact O-N 3.43Å; D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.44Å; D66-W132 PolarHBondContact OD1-NE1 2.84Å
67N87.3Confident88.6Confident71 Ų7184.3 Ų84.338%0.3846%0.46SS..Hα-helixtrans-64-37.9173.6-169.835.9000111.6R60 D64 R70 V71R60-N67 PolarHBondContact NH1-O 3.17Å; R60-N67 PolarHBondContact NH2-ND2 2.92Å; R60-N67 VanDerWaalsContact NH2-ND2 3.14Å; R60-N67 PolarHBondContact NH2-O 2.9Å; D64-N67 HydrophobicContact CB-CB 3.95Å; D64-N67 PolarHBondContact O-N 3.03Å; D64-N67 PolarHBondContact OD1-N 3.22Å; D64-N67 WeakPolarHBondContact OD2-CB 3.35Å; N67-R70 PolarHBondContact O-N 3.48Å; N67-V71 PolarHBondContact O-N 2.87Å; N67-V71 VanDerWaalsContact O-N 3.14Å
68N90.4Very high88.8Confident52 Ų5282.9 Ų82.928%0.27845%0.454SS..Hα-helixtrans-58-50175.8-71.8-24.9000110.7R60 D62 D64 V65 D66 G72R60-N68 VanDerWaalsContact CZ-OD1 3.28Å; R60-N68 PolarHBondContact NH2-OD1 2.95Å; D62-N68 WeakPolarHBondContact CA-OD1 3.33Å; D62-N68 PolarHBondContact O-ND2 3.43Å; D64-N68 WeakPolarHBondContact O-CB 3.25Å; D64-N68 PolarHBondContact O-N 3.33Å; D64-N68 PolarHBondContact O-ND2 3.43Å; D64-N68 PolarHBondContact O-OD1 3.49Å; V65-N68 WeakPolarHBondContact O-CB 3.26Å; V65-N68 PolarHBondContact O-N 3.42Å; D66-N68 VanDerWaalsContact C-N 3.31Å; D66-N68 PolarHBondContact O-N 2.89Å; N68-G72 PolarHBondContact O-N 3.48Å
69L90.1Very high88.9Confident97 Ų9777.5 Ų77.551%0.50843%0.43SS..Hα-helixtrans-64.7-41.3-179.9-69.6175.3000112.4V65 D66 G72 F73 W132V65-L69 HydrophobicContact CG1-CD1 4.26Å; V65-L69 WeakPolarHBondContact O-CG 3.47Å; V65-L69 PolarHBondContact O-N 2.98Å; D66-L69 PolarHBondContact O-N 3.43Å; L69-G72 PolarHBondContact O-N 3.3Å; L69-F73 WeakPolarHBondContact O-CB 3.39Å; L69-F73 PolarHBondContact O-N 2.89Å; L69-W132 HydrophobicContact CB-CH2 4.32Å; L69-W132 HydrophobicContact CB-CZ2 3.62Å
70R88Confident89.3Confident107 Ų10776.7 Ų76.740%0.40442%0.418SS..Hα-helixtrans-61.4-48178.7-75.9176.2176.3173.8-1.9112.6D66 N67 F73 L74 W132D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.44Å; N67-R70 PolarHBondContact O-N 3.48Å; R70-F73 PolarHBondContact O-N 2.55Å; R70-L74 WeakPolarHBondContact O-CB 3.33Å; R70-L74 PolarHBondContact O-N 3.49Å; R70-W132 HydrophobicContact CB-CZ2 4.45Å; R70-W132 HydrophobicContact CG-CH2 3.91Å; R70-W132 HydrophobicContact CG-CZ2 3.56Å; R70-W132 PolarHBondContact NH2-O 2.86Å
71V88.3Confident89.6Confident34 Ų3475.4 Ų75.421%0.20642%0.416CS..Hα-helixtrans-71.6-39.1178.5174.70000111.2N67 F73 L74 L75N67-V71 PolarHBondContact O-N 2.87Å; N67-V71 VanDerWaalsContact O-N 3.14Å; V71-F73 VanDerWaalsContact C-N 3.3Å; V71-F73 PolarHBondContact O-N 2.88Å; V71-L74 PolarHBondContact O-N 3.26Å; V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.18Å; V71-L75 WeakPolarHBondContact O-CB 3.43Å; V71-L75 WeakPolarHBondContact O-CG 3.42Å; V71-L75 PolarHBondContact O-N 3.25Å
72G90Very high89.8Confident33 Ų3371.6 Ų71.634%0.3440%0.397SS..Hα-helixtrans-56.1-46.7174.300000111.6N68 L69 L75 V76N68-G72 PolarHBondContact O-N 3.48Å; L69-G72 PolarHBondContact O-N 3.3Å; G72-L75 PolarHBondContact O-N 3.4Å; G72-V76 WeakPolarHBondContact O-CG2 3.49Å; G72-V76 PolarHBondContact O-N 2.87Å
73F90.5Very high90Very high128 Ų12870.2 Ų70.256%0.56139%0.389SS*.Hα-helixtrans-61.8-46174.7-177.8-100.1000112.4L69 R70 V71 L75 V76 V77L69-F73 WeakPolarHBondContact O-CB 3.39Å; L69-F73 PolarHBondContact O-N 2.89Å; R70-F73 PolarHBondContact O-N 2.55Å; V71-F73 VanDerWaalsContact C-N 3.3Å; V71-F73 PolarHBondContact O-N 2.88Å; F73-L75 VanDerWaalsContact C-N 3.31Å; F73-L75 PolarHBondContact O-N 2.76Å; F73-V76 PolarHBondContact O-N 3.24Å; F73-V77 HydrophobicContact CD1-CG2 4.33Å; F73-V77 HydrophobicContact CE1-CG2 3.91Å; F73-V77 HydrophobicContact CE2-CG2 4.43Å; F73-V77 HydrophobicContact CZ-CG2 3.97Å; F73-V77 WeakPolarHBondContact O-CG2 3.49Å; F73-V77 PolarHBondContact O-N 3.07Å
74L90.4Very high90Very high117 Ų11766.5 Ų66.561%0.61336%0.358SS*.Hα-helixtrans-60.4-40.6177.9-174.667.1000112.1R70 V71 V77 S78R70-L74 WeakPolarHBondContact O-CB 3.33Å; R70-L74 PolarHBondContact O-N 3.49Å; V71-L74 PolarHBondContact O-N 3.26Å; L74-V77 PolarHBondContact O-N 2.93Å; L74-S78 WeakPolarHBondContact O-CB 3.41Å; L74-S78 PolarHBondContact O-N 2.72Å
75L89.5Confident90Very high32 Ų3263.9 Ų63.917%0.16835%0.345CS..Hα-helixtrans-65.5-45.6175.7-72.2174.7000111L53 F56 V71 G72 F73 V77 S78 F79L53-L75 HydrophobicContact CD1-CD1 4.38Å; F56-L75 HydrophobicContact CB-CD1 4.18Å; F56-L75 HydrophobicContact CD2-CD2 4.1Å; F56-L75 HydrophobicContact CE2-CD2 4.46Å; V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.18Å; V71-L75 WeakPolarHBondContact O-CB 3.43Å; V71-L75 WeakPolarHBondContact O-CG 3.42Å; V71-L75 PolarHBondContact O-N 3.25Å; G72-L75 PolarHBondContact O-N 3.4Å; F73-L75 VanDerWaalsContact C-N 3.31Å; F73-L75 PolarHBondContact O-N 2.76Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.27Å; L75-S78 PolarHBondContact O-N 3.11Å; L75-S78 VanDerWaalsContact O-N 3.15Å; L75-F79 HydrophobicContact CD2-CE2 4.44Å; L75-F79 WeakPolarHBondContact O-CB 3.4Å; L75-F79 WeakPolarHBondContact O-CD2 3.23Å; L75-F79 PolarHBondContact O-N 3.04Å
76V92.1Very high89.7Confident98 Ų9862.9 Ų62.959%0.59434%0.336SS*.Hα-helixtrans-57.1-45.7175.71700000111.2G72 F73 F80G72-V76 WeakPolarHBondContact O-CG2 3.49Å; G72-V76 PolarHBondContact O-N 2.87Å; F73-V76 PolarHBondContact O-N 3.24Å; V76-F80 WeakPolarHBondContact O-CB 3.36Å; V76-F80 PolarHBondContact O-N 3.32Å
77V93.3Very high89.7Confident34 Ų3462.5 Ų62.521%0.20634%0.343CS..Hα-helixtrans-61.3-47175.6170.60000111F73 L74 L75 F79 F80 L81 L110F73-V77 HydrophobicContact CD1-CG2 4.33Å; F73-V77 HydrophobicContact CE1-CG2 3.91Å; F73-V77 HydrophobicContact CE2-CG2 4.43Å; F73-V77 HydrophobicContact CZ-CG2 3.97Å; F73-V77 WeakPolarHBondContact O-CG2 3.49Å; F73-V77 PolarHBondContact O-N 3.07Å; L74-V77 PolarHBondContact O-N 2.93Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.27Å; V77-F79 PolarHBondContact O-N 2.84Å; V77-F80 PolarHBondContact O-N 3.24Å; V77-L81 HydrophobicContact CG1-CD1 4.43Å; V77-L81 WeakPolarHBondContact O-CG 3.3Å; V77-L81 PolarHBondContact O-N 2.99Å; V77-L110 HydrophobicContact CG1-CD1 3.95Å; V77-L110 HydrophobicContact CG2-CD1 4.49Å
78S90.7Very high89.7Confident62 Ų6261.2 Ų61.243%0.43434%0.335SS..Hα-helixtrans-59.3-47.8179.4-175.50000112.2L74 L75 F80 L81 V82L74-S78 WeakPolarHBondContact O-CB 3.41Å; L74-S78 PolarHBondContact O-N 2.72Å; L75-S78 PolarHBondContact O-N 3.11Å; L75-S78 VanDerWaalsContact O-N 3.15Å; S78-F80 PolarHBondContact O-N 3.47Å; S78-L81 WeakPolarHBondContact O-CB 3.44Å; S78-L81 PolarHBondContact O-N 3.39Å; S78-L81 VanDerWaalsContact O-N 3.17Å; S78-V82 WeakPolarHBondContact O-CG2 3.13Å; S78-V82 PolarHBondContact O-N 2.7Å
79F89.6Confident89.3Confident51 Ų5161.2 Ų61.222%0.22434%0.337CS..Hα-helixtrans-65.2-39177.6-85.6-111.2000112T49 L53 L75 V77 L81 V82 I83T49-F79 HydrophobicContact CG2-CD1 3.48Å; T49-F79 VanDerWaalsContact CG2-CD1 3.48Å; T49-F79 HydrophobicContact CG2-CD2 4.17Å; T49-F79 HydrophobicContact CG2-CE1 3.09Å; T49-F79 HydrophobicContact CG2-CE2 3.86Å; T49-F79 HydrophobicContact CG2-CG 4.02Å; T49-F79 HydrophobicContact CG2-CZ 3.3Å; T49-F79 VanDerWaalsContact O-CZ 3.32Å; T49-F79 WeakPolarHBondContact O-CZ 3.45Å; L53-F79 HydrophobicContact CB-CZ 3.85Å; L53-F79 HydrophobicContact CD1-CE2 4.14Å; L53-F79 HydrophobicContact CD1-CZ 3.96Å; L53-F79 HydrophobicContact CD2-CZ 4.37Å; L53-F79 HydrophobicContact CG-CZ 4.28Å; L75-F79 HydrophobicContact CD2-CE2 4.44Å; L75-F79 WeakPolarHBondContact O-CB 3.4Å; L75-F79 WeakPolarHBondContact O-CD2 3.23Å; L75-F79 PolarHBondContact O-N 3.04Å; V77-F79 PolarHBondContact O-N 2.84Å; F79-L81 VanDerWaalsContact C-N 3.28Å; F79-L81 PolarHBondContact O-N 3.22Å; F79-V82 WeakPolarHBondContact O-CB 3.36Å; F79-V82 PolarHBondContact O-N 2.94Å; F79-I83 WeakPolarHBondContact O-CG1 3.4Å; F79-I83 PolarHBondContact O-N 3.35Å
80F93.1Very high89Confident49 Ų4958.2 Ų58.222%0.21532%0.322CS..Hα-helixtrans-60.3-40.6173.7-174.8-85.1000111.3V76 V77 S78 I83 S84 F88 G106 V109 L110V76-F80 WeakPolarHBondContact O-CB 3.36Å; V76-F80 PolarHBondContact O-N 3.32Å; V77-F80 PolarHBondContact O-N 3.24Å; S78-F80 PolarHBondContact O-N 3.47Å; F80-I83 PolarHBondContact O-N 3.15Å; F80-S84 WeakPolarHBondContact O-CB 3.25Å; F80-S84 PolarHBondContact O-N 2.93Å; F80-F88 HydrophobicContact CE1-CE2 4.47Å; F80-F88 HydrophobicContact CE1-CZ 4.49Å; F80-F88 HydrophobicContact CZ-CZ 4.12Å; F80-G106 WeakPolarHBondContact CE1-O 3.5Å; F80-V109 HydrophobicContact CE1-CB 4.45Å; F80-V109 HydrophobicContact CZ-CB 4.2Å; F80-V109 HydrophobicContact CZ-CG1 3.83Å; F80-L110 HydrophobicContact CB-CD1 4.35Å; F80-L110 HydrophobicContact CB-CD2 4.21Å; F80-L110 HydrophobicContact CD1-CD1 3.54Å; F80-L110 HydrophobicContact CD1-CD2 3.62Å; F80-L110 HydrophobicContact CD1-CG 3.4Å; F80-L110 HydrophobicContact CD2-CD2 4.06Å; F80-L110 HydrophobicContact CE1-CD1 4.16Å; F80-L110 HydrophobicContact CE1-CD2 3.95Å; F80-L110 HydrophobicContact CE1-CG 3.58Å; F80-L110 HydrophobicContact CE2-CD2 4.34Å; F80-L110 HydrophobicContact CG-CD1 4.15Å; F80-L110 HydrophobicContact CG-CD2 3.68Å; F80-L110 HydrophobicContact CG-CG 4Å; F80-L110 HydrophobicContact CZ-CD2 4.29Å; F80-L110 HydrophobicContact CZ-CG 4.3Å
81L92.8Very high88.8Confident34 Ų3453.8 Ų53.818%0.17831%0.31CS..Hα-helixtrans-64.9-39.2175.1-65.6178.5000112.2V77 S78 F79 I83 S84 V85 M103 L107 L110V77-L81 HydrophobicContact CG1-CD1 4.43Å; V77-L81 WeakPolarHBondContact O-CG 3.3Å; V77-L81 PolarHBondContact O-N 2.99Å; S78-L81 WeakPolarHBondContact O-CB 3.44Å; S78-L81 PolarHBondContact O-N 3.39Å; S78-L81 VanDerWaalsContact O-N 3.17Å; F79-L81 VanDerWaalsContact C-N 3.28Å; F79-L81 PolarHBondContact O-N 3.22Å; L81-I83 PolarHBondContact O-N 2.92Å; L81-S84 WeakPolarHBondContact CA-OG 3.21Å; L81-S84 WeakPolarHBondContact O-CB 3.48Å; L81-S84 PolarHBondContact O-N 3.41Å; L81-S84 PolarHBondContact O-OG 2.72Å; L81-V85 WeakPolarHBondContact O-CG2 3.25Å; L81-V85 PolarHBondContact O-N 3.21Å; L81-V85 VanDerWaalsContact O-N 3.09Å; L81-M103 HydrophobicContact CD2-CB 4.48Å; L81-L107 HydrophobicContact CD1-CD2 4.19Å; L81-L107 HydrophobicContact CD2-CD2 3.8Å; L81-L107 HydrophobicContact CD2-CG 3.81Å; L81-L110 HydrophobicContact CD2-CD1 4.38Å
82V89.5Confident88.6Confident35 Ų3552.5 Ų52.521%0.21230%0.302CS..Hα-helixtrans-59.1-46.9172.11730000110.9L45 S78 F79 S84 V85 L86L45-V82 HydrophobicContact CD1-CG1 4.22Å; L45-V82 HydrophobicContact CD2-CG1 3.76Å; L45-V82 HydrophobicContact CG-CG1 3.85Å; S78-V82 WeakPolarHBondContact O-CG2 3.13Å; S78-V82 PolarHBondContact O-N 2.7Å; F79-V82 WeakPolarHBondContact O-CB 3.36Å; F79-V82 PolarHBondContact O-N 2.94Å; V82-S84 VanDerWaalsContact C-N 3.31Å; V82-S84 PolarHBondContact O-N 3.47Å; V82-V85 PolarHBondContact O-N 3.41Å; V82-L86 PolarHBondContact O-N 2.86Å
83I88.5Confident88.4Confident95 Ų9553.1 Ų53.149%0.48730%0.295SS..Hα-helixtrans-62.1-40.5176.4-67.4167000110.7F79 F80 L81 V85 L86 A87F79-I83 WeakPolarHBondContact O-CG1 3.4Å; F79-I83 PolarHBondContact O-N 3.35Å; F80-I83 PolarHBondContact O-N 3.15Å; L81-I83 PolarHBondContact O-N 2.92Å; I83-V85 VanDerWaalsContact C-N 3.27Å; I83-V85 PolarHBondContact O-N 3.41Å; I83-L86 PolarHBondContact O-N 3.03Å; I83-A87 HydrophobicContact CG2-CB 4.26Å; I83-A87 WeakPolarHBondContact O-CB 3.44Å; I83-A87 PolarHBondContact O-N 2.89Å
84S91.1Very high87.9Confident1 Ų147.6 Ų47.61%0.00727%0.272CS..Hα-helixtrans-59-39.9177.980.70000111.7F80 L81 V82 L86 F88F80-S84 WeakPolarHBondContact O-CB 3.25Å; F80-S84 PolarHBondContact O-N 2.93Å; L81-S84 WeakPolarHBondContact CA-OG 3.21Å; L81-S84 WeakPolarHBondContact O-CB 3.48Å; L81-S84 PolarHBondContact O-N 3.41Å; L81-S84 PolarHBondContact O-OG 2.72Å; V82-S84 VanDerWaalsContact C-N 3.31Å; V82-S84 PolarHBondContact O-N 3.47Å; S84-L86 VanDerWaalsContact C-N 3.28Å; S84-L86 PolarHBondContact O-N 3.34Å; S84-F88 VanDerWaalsContact O-CB 3.22Å; S84-F88 WeakPolarHBondContact O-CB 3.18Å; S84-F88 PolarHBondContact O-N 2.97Å
85V88.6Confident87.5Confident31 Ų3143.6 Ų43.619%0.18825%0.249CC..Hα-helixtrans-63.2-36.3175.8173.20000111.5L81 V82 I83 A99 R102 M103L81-V85 WeakPolarHBondContact O-CG2 3.25Å; L81-V85 PolarHBondContact O-N 3.21Å; L81-V85 VanDerWaalsContact O-N 3.09Å; V82-V85 PolarHBondContact O-N 3.41Å; I83-V85 VanDerWaalsContact C-N 3.27Å; I83-V85 PolarHBondContact O-N 3.41Å; V85-A99 HydrophobicContact CG1-CB 3.8Å; V85-A99 HydrophobicContact CG2-CB 4.17Å; V85-R102 WeakPolarHBondContact O-CD 3.28Å; V85-R102 PolarHBondContact O-NH1 3.44Å; V85-M103 HydrophobicContact CG2-CG 3.42Å; V85-M103 VanDerWaalsContact CG2-CG 3.42Å; V85-M103 HydrophobicContact CG2-SD 4.07Å
86L84.3Confident87Confident81 Ų8143.7 Ų43.742%0.42425%0.251SS..Hα-helixtrans-82.3-43.2-176.7-67.2-179.8000113.5T42 L45 V82 I83 S84T42-L86 HydrophobicContact CG2-CD2 3.89Å; L45-L86 HydrophobicContact CD2-CD1 4.09Å; L45-L86 HydrophobicContact CD2-CD2 3.85Å; L45-L86 HydrophobicContact CD2-CG 4Å; V82-L86 PolarHBondContact O-N 2.86Å; I83-L86 PolarHBondContact O-N 3.03Å; S84-L86 VanDerWaalsContact C-N 3.28Å; S84-L86 PolarHBondContact O-N 3.34Å
87A85.3Confident86.6Confident71 Ų7141.3 Ų41.359%0.58723%0.234SC*.Hα-helixtrans-99.1-29.5-16700000113.4I83I83-A87 HydrophobicContact CG2-CB 4.26Å; I83-A87 WeakPolarHBondContact O-CB 3.44Å; I83-A87 PolarHBondContact O-N 2.89Å
88F87.6Confident86.2Confident44 Ų4440 Ų4019%0.19323%0.226CC..SBendtrans-80.8143.7-174.4-65.1-10.9000112F80 S84 R102 F105 V109F80-F88 HydrophobicContact CE1-CE2 4.47Å; F80-F88 HydrophobicContact CE1-CZ 4.49Å; F80-F88 HydrophobicContact CZ-CZ 4.12Å; S84-F88 VanDerWaalsContact O-CB 3.22Å; S84-F88 WeakPolarHBondContact O-CB 3.18Å; S84-F88 PolarHBondContact O-N 2.97Å; F88-R102 VanDerWaalsContact O-CD 3.28Å; F88-R102 WeakPolarHBondContact O-CD 3.48Å; F88-R102 PolarHBondContact O-NE 2.9Å; F88-F105 HydrophobicContact CB-CD1 4.07Å; F88-F105 HydrophobicContact CD2-CB 4.34Å; F88-F105 AromaticContact CD2-CD1 3.35Å; F88-F105 HydrophobicContact CD2-CD1 3.35Å; F88-F105 HydrophobicContact CD2-CE1 4Å; F88-F105 HydrophobicContact CD2-CG 4.21Å; F88-F105 AromaticContact CE2-CD1 3.81Å; F88-F105 HydrophobicContact CE2-CD1 3.81Å; F88-F105 HydrophobicContact CE2-CE1 4.19Å; F88-F105 AromaticContact CG-CD1 3.83Å; F88-F105 HydrophobicContact CG-CD1 3.83Å; F88-F105 HydrophobicContact CG-CE1 4.24Å; F88-V109 HydrophobicContact CE2-CG2 4.14Å; F88-V109 HydrophobicContact CZ-CG2 4.29Å
89P83.2Confident86Confident52 Ų5238 Ų3834%0.33821%0.213SC..PPolyproline II helixtrans-65161.3177.828.4-34.7000110.9E26E26-P89 HydrophobicContact CG-CB 4Å; E26-P89 WeakPolarHBondContact OE1-CB 3.35Å
90N82.3Confident86.1Confident34 Ų3438.7 Ų38.718%0.18222%0.218CC..PPolyproline II helixtrans-62.1146.4168.9-73.2-26.5000110E26 Q27 P98 R102E26-N90 WeakPolarHBondContact CA-O 3.26Å; E26-N90 HydrophobicContact CB-CB 4.46Å; E26-N90 WeakPolarHBondContact CG-O 3.32Å; Q27-N90 PolarHBondContact O-ND2 3.03Å; N90-P98 WeakPolarHBondContact OD1-CB 3.45Å; N90-R102 PolarHBondContact OD1-NE 3.5Å; N90-R102 PolarHBondContact OD1-NH2 3.24Å
91G84.6Confident86Confident14 Ų1438.3 Ų38.314%0.14422%0.215CC..  trans-88-171.4171.200000112.5N25 Q27 F93N25-G91 CarbonylContact O-C 3.54Å; N25-G91 VanDerWaalsContact O-CA 3.24Å; N25-G91 WeakPolarHBondContact O-CA 3.35Å; Q27-G91 PolarHBondContact N-O 3.36Å; G91-F93 PolarHBondContact O-N 2.6Å; G91-F93 VanDerWaalsContact O-N 3.13Å
92P84.7Confident86Confident6 Ų639.6 Ų39.64%0.03922%0.218CC..SBendtrans-70.9-3.7177.132.1-38.7000113.2Q27 P333 R336 Q337Q27-P92 PolarHBondContact OE1-O 3.36Å; P92-P333 HydrophobicContact CG-CB 3.64Å; P92-R336 HydrophobicContact CB-CG 3.97Å; P92-R336 HydrophobicContact CG-CG 4.42Å; P92-Q337 HydrophobicContact CG-CG 4.14Å
93F85.7Confident86.2Confident46 Ų4641 Ų4120%0.20222%0.223CC..  trans-122.7139.4-180-59-38.1000111G91 W101 A332 P333 R336G91-F93 PolarHBondContact O-N 2.6Å; G91-F93 VanDerWaalsContact O-N 3.13Å; F93-W101 HydrophobicContact CB-CD2 3.8Å; F93-W101 VanDerWaalsContact CB-CE2 3.4Å; F93-W101 HydrophobicContact CB-CG 3.95Å; F93-W101 HydrophobicContact CB-CZ2 3.88Å; F93-W101 VanDerWaalsContact CB-NE1 3.32Å; F93-W101 AromaticContact CD2-CD2 3.99Å; F93-W101 HydrophobicContact CD2-CD2 3.99Å; F93-W101 AromaticContact CD2-CE2 3.83Å; F93-W101 AromaticContact CD2-CE3 3.93Å; F93-W101 HydrophobicContact CD2-CE3 3.93Å; F93-W101 AromaticContact CD2-CH2 3.58Å; F93-W101 HydrophobicContact CD2-CH2 3.58Å; F93-W101 AromaticContact CD2-CZ2 3.63Å; F93-W101 HydrophobicContact CD2-CZ2 3.63Å; F93-W101 AromaticContact CD2-CZ3 3.73Å; F93-W101 HydrophobicContact CD2-CZ3 3.73Å; F93-W101 HydrophobicContact CE2-CH2 4.11Å; F93-W101 HydrophobicContact CE2-CZ2 4.5Å; F93-W101 HydrophobicContact CE2-CZ3 4.28Å; F93-W101 HydrophobicContact CG-CD2 4.43Å; F93-W101 HydrophobicContact CG-CH2 4.47Å; F93-W101 HydrophobicContact CG-CZ2 4.09Å; F93-A332 VanDerWaalsContact CE2-C 3.4Å; F93-A332 HydrophobicContact CE2-CB 3.72Å; F93-A332 HydrophobicContact CZ-CB 4.31Å; F93-A332 WeakPolarHBondContact CZ-O 3.36Å; F93-P333 HydrophobicContact CD2-CB 4.1Å; F93-P333 HydrophobicContact CE2-CB 3.97Å; F93-P333 HydrophobicContact CE2-CG 4.49Å; F93-P333 VanDerWaalsContact CE2-N 3.28Å; F93-R336 HydrophobicContact CE1-CB 4.23Å; F93-R336 HydrophobicContact CE1-CG 4.17Å; F93-R336 HydrophobicContact CZ-CB 4.06Å
94T79.3Confident86.5Confident13 Ų1337 Ų378%0.0820%0.203CC..  trans-109.5-12.3-179.1540000113.1Q27 V29 H97 P98Q27-T94 HydrophobicContact CB-CG2 3.65Å; V29-T94 HydrophobicContact CG2-CG2 4.11Å; T94-H97 CarbonylContact O-C 3.49Å; T94-H97 WeakPolarHBondContact O-CA 3.48Å; T94-P98 WeakPolarHBondContact O-CD 3.35Å
95R81.3Confident86.7Confident32 Ų3238.3 Ų38.312%0.12121%0.209CC..SBendtrans-125.4145.5-174.2-71.4-168.2-171.7-163.74.7113.9W101 W247 T268 A270R95-W101 VanDerWaalsContact O-CE2 3.26Å; R95-W101 VanDerWaalsContact O-CZ2 3.3Å; R95-W101 WeakPolarHBondContact O-CZ2 3.48Å; R95-W101 PolarHBondContact O-NE1 3.17Å; R95-W247 VanDerWaalsContact NH1-CD2 3.33Å; R95-W247 VanDerWaalsContact NH1-CE3 3.29Å; R95-W247 VanDerWaalsContact NH2-NE1 3.14Å; R95-T268 WeakPolarHBondContact CD-O 3.34Å; R95-A270 HydrophobicContact CG-CB 4.06Å
96P78.8Confident87.1Confident35 Ų3536.9 Ų36.923%0.22720%0.2CC..SBendcis-71.7-24.710.918.9-25000114.9I100 Q266 F267P96-I100 HydrophobicContact CB-CD1 4.33Å; P96-I100 HydrophobicContact CG-CD1 3.69Å; P96-Q266 PolarHBondContact O-NE2 3.37Å; P96-Q266 VanDerWaalsContact O-NE2 3.11Å; P96-F267 HydrophobicContact CB-CD1 3.95Å; P96-F267 HydrophobicContact CB-CE1 4.19Å; P96-F267 HydrophobicContact CG-CD1 4.19Å; P96-F267 HydrophobicContact CG-CE1 4.47Å
97H83.4Confident87.7Confident47 Ų4735.9 Ų35.922%0.21820%0.195CC..  trans-154.5147.1168.9-167.9-96.2000111F37 Y38 T94 A99 I100F37-H97 PolarHBondContact O-NE2 3.21Å; Y38-H97 AromaticContact CE1-CD2 3.94Å; Y38-H97 AromaticContact CE1-NE2 3.79Å; Y38-H97 AromaticContact CZ-CD2 3.81Å; Y38-H97 AromaticContact CZ-NE2 3.95Å; T94-H97 CarbonylContact O-C 3.49Å; T94-H97 WeakPolarHBondContact O-CA 3.48Å; H97-A99 VanDerWaalsContact C-N 3.26Å; H97-A99 WeakPolarHBondContact ND1-CB 3.48Å; H97-A99 PolarHBondContact ND1-N 2.89Å; H97-A99 VanDerWaalsContact ND1-N 3.12Å; H97-A99 PolarHBondContact O-N 3.27Å; H97-I100 HydrophobicContact CB-CD1 4.12Å; H97-I100 HydrophobicContact CB-CG1 4.37Å; H97-I100 WeakPolarHBondContact O-CB 3.48Å; H97-I100 PolarHBondContact O-N 2.93Å
98P85.1Confident88.2Confident8 Ų832.5 Ų32.55%0.05217%0.167CC..Hα-helixtrans-60.6-34.1179.2-22.232000113.6V29 Y38 N90 T94 I100 W101 R102V29-P98 HydrophobicContact CG2-CG 3.38Å; Y38-P98 HydrophobicContact CE1-CG 4.2Å; N90-P98 WeakPolarHBondContact OD1-CB 3.45Å; T94-P98 WeakPolarHBondContact O-CD 3.35Å; P98-I100 PolarHBondContact O-N 3.17Å; P98-W101 PolarHBondContact O-N 3.01Å; P98-W101 VanDerWaalsContact O-N 3.11Å; P98-R102 WeakPolarHBondContact O-CG 3.21Å; P98-R102 PolarHBondContact O-N 3.37Å
99A87.6Confident88.7Confident18 Ų1831.5 Ų31.515%0.14916%0.164CC..Hα-helixtrans-57.2-34.517600000112.4V85 H97 R102 M103V85-A99 HydrophobicContact CG1-CB 3.8Å; V85-A99 HydrophobicContact CG2-CB 4.17Å; H97-A99 VanDerWaalsContact C-N 3.26Å; H97-A99 WeakPolarHBondContact ND1-CB 3.48Å; H97-A99 PolarHBondContact ND1-N 2.89Å; H97-A99 VanDerWaalsContact ND1-N 3.12Å; H97-A99 PolarHBondContact O-N 3.27Å; A99-R102 PolarHBondContact O-N 3.47Å; A99-M103 WeakPolarHBondContact O-CG 3.46Å; A99-M103 PolarHBondContact O-N 3.3Å
100I90.5Very high89.4Confident66 Ų6630.9 Ų30.934%0.33816%0.158SC..Hα-helixtrans-64.7-45.4177.8-67.7167.5000109.9P96 H97 P98 R102 M103 V104P96-I100 HydrophobicContact CB-CD1 4.33Å; P96-I100 HydrophobicContact CG-CD1 3.69Å; H97-I100 HydrophobicContact CB-CD1 4.12Å; H97-I100 HydrophobicContact CB-CG1 4.37Å; H97-I100 WeakPolarHBondContact O-CB 3.48Å; H97-I100 PolarHBondContact O-N 2.93Å; P98-I100 PolarHBondContact O-N 3.17Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.01Å; I100-M103 HydrophobicContact CB-CE 4.46Å; I100-M103 HydrophobicContact CG1-CE 4.04Å; I100-M103 WeakPolarHBondContact O-CB 3.22Å; I100-M103 PolarHBondContact O-N 3.2Å; I100-V104 WeakPolarHBondContact O-CG2 3.46Å; I100-V104 PolarHBondContact O-N 2.81Å
101W91.6Very high90.1Very high41 Ų4131 Ų3116%0.15516%0.156CC..Hα-helixtrans-69-32.8178.6-61112.4000113.3F93 R95 P98 V104 F105 I329F93-W101 HydrophobicContact CB-CD2 3.8Å; F93-W101 VanDerWaalsContact CB-CE2 3.4Å; F93-W101 HydrophobicContact CB-CG 3.95Å; F93-W101 HydrophobicContact CB-CZ2 3.88Å; F93-W101 VanDerWaalsContact CB-NE1 3.32Å; F93-W101 AromaticContact CD2-CD2 3.99Å; F93-W101 HydrophobicContact CD2-CD2 3.99Å; F93-W101 AromaticContact CD2-CE2 3.83Å; F93-W101 AromaticContact CD2-CE3 3.93Å; F93-W101 HydrophobicContact CD2-CE3 3.93Å; F93-W101 AromaticContact CD2-CH2 3.58Å; F93-W101 HydrophobicContact CD2-CH2 3.58Å; F93-W101 AromaticContact CD2-CZ2 3.63Å; F93-W101 HydrophobicContact CD2-CZ2 3.63Å; F93-W101 AromaticContact CD2-CZ3 3.73Å; F93-W101 HydrophobicContact CD2-CZ3 3.73Å; F93-W101 HydrophobicContact CE2-CH2 4.11Å; F93-W101 HydrophobicContact CE2-CZ2 4.5Å; F93-W101 HydrophobicContact CE2-CZ3 4.28Å; F93-W101 HydrophobicContact CG-CD2 4.43Å; F93-W101 HydrophobicContact CG-CH2 4.47Å; F93-W101 HydrophobicContact CG-CZ2 4.09Å; R95-W101 VanDerWaalsContact O-CE2 3.26Å; R95-W101 VanDerWaalsContact O-CZ2 3.3Å; R95-W101 WeakPolarHBondContact O-CZ2 3.48Å; R95-W101 PolarHBondContact O-NE1 3.17Å; P98-W101 PolarHBondContact O-N 3.01Å; P98-W101 VanDerWaalsContact O-N 3.11Å; W101-V104 HydrophobicContact CE3-CB 4.41Å; W101-V104 HydrophobicContact CE3-CG2 4.26Å; W101-V104 PolarHBondContact O-N 3.02Å; W101-F105 PolarHBondContact O-N 3.48Å; W101-I329 HydrophobicContact CZ3-CG2 4.33Å
102R92.8Very high90.7Very high61 Ų6132.5 Ų32.523%0.2316%0.158CC..Hα-helixtrans-63.7-42.1170.1-67.7-179.7-168.6-173.9-4.8111.6V85 F88 N90 P98 A99 I100 F105 G106V85-R102 WeakPolarHBondContact O-CD 3.28Å; V85-R102 PolarHBondContact O-NH1 3.44Å; F88-R102 VanDerWaalsContact O-CD 3.28Å; F88-R102 WeakPolarHBondContact O-CD 3.48Å; F88-R102 PolarHBondContact O-NE 2.9Å; N90-R102 PolarHBondContact OD1-NE 3.5Å; N90-R102 PolarHBondContact OD1-NH2 3.24Å; P98-R102 WeakPolarHBondContact O-CG 3.21Å; P98-R102 PolarHBondContact O-N 3.37Å; A99-R102 PolarHBondContact O-N 3.47Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.01Å; R102-F105 PolarHBondContact O-N 3.01Å; R102-G106 PolarHBondContact O-N 3.26Å
103M93.9Very high91.3Very high65 Ų6536.6 Ų36.632%0.3218%0.18SC..Hα-helixtrans-64.4-39.9172.6-70.9-174.2-63.300112.3L81 V85 A99 I100 F105 G106 L107L81-M103 HydrophobicContact CD2-CB 4.48Å; V85-M103 HydrophobicContact CG2-CG 3.42Å; V85-M103 VanDerWaalsContact CG2-CG 3.42Å; V85-M103 HydrophobicContact CG2-SD 4.07Å; A99-M103 WeakPolarHBondContact O-CG 3.46Å; A99-M103 PolarHBondContact O-N 3.3Å; I100-M103 HydrophobicContact CB-CE 4.46Å; I100-M103 HydrophobicContact CG1-CE 4.04Å; I100-M103 WeakPolarHBondContact O-CB 3.22Å; I100-M103 PolarHBondContact O-N 3.2Å; M103-F105 VanDerWaalsContact C-N 3.29Å; M103-F105 PolarHBondContact O-N 3.37Å; M103-G106 CarbonylContact O-C 3.42Å; M103-G106 VanDerWaalsContact O-CA 3.28Å; M103-G106 WeakPolarHBondContact O-CA 3.47Å; M103-G106 PolarHBondContact O-N 3.07Å; M103-L107 WeakPolarHBondContact O-CG 3.33Å; M103-L107 PolarHBondContact O-N 3.37Å
104V95.5Very high91.8Very high12 Ų1238.2 Ų38.27%0.07319%0.187CC..Hα-helixtrans-59.7-42174.3169.50000110.7I100 W101 L107 S108 I329 I330I100-V104 WeakPolarHBondContact O-CG2 3.46Å; I100-V104 PolarHBondContact O-N 2.81Å; W101-V104 HydrophobicContact CE3-CB 4.41Å; W101-V104 HydrophobicContact CE3-CG2 4.26Å; W101-V104 PolarHBondContact O-N 3.02Å; V104-L107 PolarHBondContact O-N 2.85Å; V104-S108 PolarHBondContact O-N 3.46Å; V104-I329 HydrophobicContact CB-CG2 4.4Å; V104-I329 HydrophobicContact CG1-CG2 3.86Å; V104-I329 HydrophobicContact CG2-CG2 3.54Å; V104-I330 HydrophobicContact CG1-CG1 3.88Å
105F95.5Very high92.7Very high28 Ų2837.8 Ų37.812%0.12318%0.184CC..Hα-helixtrans-65.1-41.4171.4-171.1-128.2000112.1F88 W101 R102 M103 L107 S108 V109 Q353 M356F88-F105 HydrophobicContact CB-CD1 4.07Å; F88-F105 HydrophobicContact CD2-CB 4.34Å; F88-F105 AromaticContact CD2-CD1 3.35Å; F88-F105 HydrophobicContact CD2-CD1 3.35Å; F88-F105 HydrophobicContact CD2-CE1 4Å; F88-F105 HydrophobicContact CD2-CG 4.21Å; F88-F105 AromaticContact CE2-CD1 3.81Å; F88-F105 HydrophobicContact CE2-CD1 3.81Å; F88-F105 HydrophobicContact CE2-CE1 4.19Å; F88-F105 AromaticContact CG-CD1 3.83Å; F88-F105 HydrophobicContact CG-CD1 3.83Å; F88-F105 HydrophobicContact CG-CE1 4.24Å; W101-F105 PolarHBondContact O-N 3.48Å; R102-F105 PolarHBondContact O-N 3.01Å; M103-F105 VanDerWaalsContact C-N 3.29Å; M103-F105 PolarHBondContact O-N 3.37Å; F105-L107 PolarHBondContact O-N 3.35Å; F105-S108 WeakPolarHBondContact CA-OG 3.33Å; F105-S108 WeakPolarHBondContact CD2-OG 3.34Å; F105-S108 PolarHBondContact O-N 3.39Å; F105-S108 VanDerWaalsContact O-N 3.16Å; F105-S108 PolarHBondContact O-OG 2.63Å; F105-V109 HydrophobicContact CE1-CG2 4.42Å; F105-V109 HydrophobicContact CE2-CG2 4.33Å; F105-V109 HydrophobicContact CZ-CG2 4.25Å; F105-V109 WeakPolarHBondContact O-CG2 3.49Å; F105-V109 PolarHBondContact O-N 3.09Å; F105-Q353 VanDerWaalsContact CB-NE2 3.27Å; F105-Q353 HydrophobicContact CD2-CG 3.72Å; F105-Q353 HydrophobicContact CE2-CG 4.32Å; F105-Q353 HydrophobicContact CG-CG 4.37Å; F105-M356 HydrophobicContact CE2-CB 4.07Å; F105-M356 HydrophobicContact CE2-CE 4.48Å; F105-M356 HydrophobicContact CE2-CG 4.29Å
106G96.2Very high93.5Very high0 Ų038.6 Ų38.60%019%0.192CC..Hα-helixtrans-47.4-54.216800000113.6F80 R102 M103 S108 V109 L110F80-G106 WeakPolarHBondContact CE1-O 3.5Å; R102-G106 PolarHBondContact O-N 3.26Å; M103-G106 CarbonylContact O-C 3.42Å; M103-G106 VanDerWaalsContact O-CA 3.28Å; M103-G106 WeakPolarHBondContact O-CA 3.47Å; M103-G106 PolarHBondContact O-N 3.07Å; G106-S108 VanDerWaalsContact C-N 3.33Å; G106-S108 PolarHBondContact O-N 2.83Å; G106-V109 PolarHBondContact O-N 3.3Å; G106-L110 PolarHBondContact O-N 2.9Å
107L96.8Very high94.4Very high61 Ų6142.3 Ų42.332%0.31921%0.205SC..Hα-helixtrans-62.9-38.2179.5-69170.4000112.1L81 M103 V104 F105 V109 L110 Y111 L326L81-L107 HydrophobicContact CD1-CD2 4.19Å; L81-L107 HydrophobicContact CD2-CD2 3.8Å; L81-L107 HydrophobicContact CD2-CG 3.81Å; M103-L107 WeakPolarHBondContact O-CG 3.33Å; M103-L107 PolarHBondContact O-N 3.37Å; V104-L107 PolarHBondContact O-N 2.85Å; F105-L107 PolarHBondContact O-N 3.35Å; L107-V109 PolarHBondContact O-N 3.19Å; L107-L110 PolarHBondContact O-N 2.92Å; L107-Y111 WeakPolarHBondContact O-CB 3.49Å; L107-Y111 PolarHBondContact O-N 2.74Å; L107-L326 HydrophobicContact CB-CD1 3.77Å; L107-L326 HydrophobicContact CD1-CD1 4.19Å
108S96.9Very high95Very high0 Ų040.5 Ų40.50%020%0.197CC..Hα-helixtrans-62.2-42.3174.973.80000112V104 F105 G106 Y111 F112 Q353 M356 I360V104-S108 PolarHBondContact O-N 3.46Å; F105-S108 WeakPolarHBondContact CA-OG 3.33Å; F105-S108 WeakPolarHBondContact CD2-OG 3.34Å; F105-S108 PolarHBondContact O-N 3.39Å; F105-S108 VanDerWaalsContact O-N 3.16Å; F105-S108 PolarHBondContact O-OG 2.63Å; G106-S108 VanDerWaalsContact C-N 3.33Å; G106-S108 PolarHBondContact O-N 2.83Å; S108-Y111 PolarHBondContact O-N 3.4Å; S108-F112 WeakPolarHBondContact O-CB 3.3Å; S108-F112 PolarHBondContact O-N 3.3Å; S108-Q353 PolarHBondContact OG-OE1 2.97Å; S108-M356 WeakPolarHBondContact OG-CG 3.44Å; S108-I360 WeakPolarHBondContact O-CD1 3.42Å
109V97.3Very high95.5Very high23 Ų2341.3 Ų41.314%0.13920%0.201CC..Hα-helixtrans-66.4-44.4177.1175.50000111F80 F88 F105 G106 L107 Y111 F112 L113 M356F80-V109 HydrophobicContact CE1-CB 4.45Å; F80-V109 HydrophobicContact CZ-CB 4.2Å; F80-V109 HydrophobicContact CZ-CG1 3.83Å; F88-V109 HydrophobicContact CE2-CG2 4.14Å; F88-V109 HydrophobicContact CZ-CG2 4.29Å; F105-V109 HydrophobicContact CE1-CG2 4.42Å; F105-V109 HydrophobicContact CE2-CG2 4.33Å; F105-V109 HydrophobicContact CZ-CG2 4.25Å; F105-V109 WeakPolarHBondContact O-CG2 3.49Å; F105-V109 PolarHBondContact O-N 3.09Å; G106-V109 PolarHBondContact O-N 3.3Å; L107-V109 PolarHBondContact O-N 3.19Å; V109-Y111 VanDerWaalsContact C-N 3.32Å; V109-Y111 PolarHBondContact O-N 3.05Å; V109-F112 WeakPolarHBondContact O-CB 3.32Å; V109-F112 PolarHBondContact O-N 2.81Å; V109-L113 HydrophobicContact CG1-CD1 4.08Å; V109-L113 HydrophobicContact CG1-CG 4.37Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.31Å; V109-L113 PolarHBondContact O-N 3.13Å; V109-M356 HydrophobicContact CG2-CE 3.81Å; V109-M356 HydrophobicContact CG2-SD 4.49Å
110L97Very high96Very high39 Ų3948.5 Ų48.520%0.20423%0.229CC..Hα-helixtrans-59.9-44176-76.2174.4000111.6V77 F80 L81 G106 L107 L113 F114V77-L110 HydrophobicContact CG1-CD1 3.95Å; V77-L110 HydrophobicContact CG2-CD1 4.49Å; F80-L110 HydrophobicContact CB-CD1 4.35Å; F80-L110 HydrophobicContact CB-CD2 4.21Å; F80-L110 HydrophobicContact CD1-CD1 3.54Å; F80-L110 HydrophobicContact CD1-CD2 3.62Å; F80-L110 HydrophobicContact CD1-CG 3.4Å; F80-L110 HydrophobicContact CD2-CD2 4.06Å; F80-L110 HydrophobicContact CE1-CD1 4.16Å; F80-L110 HydrophobicContact CE1-CD2 3.95Å; F80-L110 HydrophobicContact CE1-CG 3.58Å; F80-L110 HydrophobicContact CE2-CD2 4.34Å; F80-L110 HydrophobicContact CG-CD1 4.15Å; F80-L110 HydrophobicContact CG-CD2 3.68Å; F80-L110 HydrophobicContact CG-CG 4Å; F80-L110 HydrophobicContact CZ-CD2 4.29Å; F80-L110 HydrophobicContact CZ-CG 4.3Å; L81-L110 HydrophobicContact CD2-CD1 4.38Å; G106-L110 PolarHBondContact O-N 2.9Å; L107-L110 PolarHBondContact O-N 2.92Å; L110-L113 PolarHBondContact O-N 3.26Å; L110-F114 WeakPolarHBondContact O-CB 3.24Å; L110-F114 PolarHBondContact O-N 3.22Å
111Y97.4Very high96.2Very high36 Ų3646.4 Ų46.414%0.14122%0.218CC..Hα-helixtrans-65.5-43178.6-174.2-128.9000111.9L107 S108 V109 L113 F114 L115 R323 L326 L327 I360 E364L107-Y111 WeakPolarHBondContact O-CB 3.49Å; L107-Y111 PolarHBondContact O-N 2.74Å; S108-Y111 PolarHBondContact O-N 3.4Å; V109-Y111 VanDerWaalsContact C-N 3.32Å; V109-Y111 PolarHBondContact O-N 3.05Å; Y111-L113 PolarHBondContact O-N 3.37Å; Y111-F114 HydrophobicContact CD2-CD1 4.25Å; Y111-F114 HydrophobicContact CE2-CD1 4.24Å; Y111-F114 WeakPolarHBondContact O-CB 3.21Å; Y111-F114 PolarHBondContact O-N 3.42Å; Y111-L115 HydrophobicContact CD1-CD1 4.11Å; Y111-L115 HydrophobicContact CD2-CG 4.42Å; Y111-L115 HydrophobicContact CE1-CD1 3.73Å; Y111-L115 HydrophobicContact CE1-CG 4.37Å; Y111-L115 HydrophobicContact CE2-CD1 4.32Å; Y111-L115 HydrophobicContact CE2-CD2 4.14Å; Y111-L115 HydrophobicContact CE2-CG 4.07Å; Y111-L115 WeakPolarHBondContact O-CG 3.24Å; Y111-L115 PolarHBondContact O-N 3.44Å; Y111-R323 PolarHBondContact OH-NE 3.45Å; Y111-L326 HydrophobicContact CD1-CD2 4.39Å; Y111-L326 HydrophobicContact CG-CD2 4.17Å; Y111-L327 HydrophobicContact CE1-CD2 4.39Å; Y111-I360 HydrophobicContact CD1-CD1 4.23Å; Y111-I360 HydrophobicContact CD1-CG1 4.35Å; Y111-I360 HydrophobicContact CD1-CG2 3.63Å; Y111-I360 HydrophobicContact CE1-CG2 3.52Å; Y111-E364 HydrophobicContact CE1-CG 4.5Å; Y111-E364 WeakPolarHBondContact CE1-OE1 3.44Å; Y111-E364 PolarHBondContact OH-OE1 3.15Å
112F97.9Very high96.4Very high45 Ų4548.4 Ų48.420%0.19723%0.232CC..Hα-helixtrans-55.9-50.6172.5170.6-93.4000111.9S108 V109 F114 L115 V116 M356 A359 I360 L363S108-F112 WeakPolarHBondContact O-CB 3.3Å; S108-F112 PolarHBondContact O-N 3.3Å; V109-F112 WeakPolarHBondContact O-CB 3.32Å; V109-F112 PolarHBondContact O-N 2.81Å; F112-F114 VanDerWaalsContact C-N 3.31Å; F112-F114 PolarHBondContact O-N 2.89Å; F112-L115 PolarHBondContact O-N 3.31Å; F112-V116 HydrophobicContact CD1-CG2 4.41Å; F112-V116 HydrophobicContact CE1-CG2 3.94Å; F112-V116 HydrophobicContact CE2-CG2 4.33Å; F112-V116 HydrophobicContact CZ-CG2 3.89Å; F112-V116 WeakPolarHBondContact O-CG2 3.42Å; F112-V116 PolarHBondContact O-N 3.23Å; F112-M356 HydrophobicContact CB-SD 3.61Å; F112-M356 HydrophobicContact CD1-SD 4.32Å; F112-M356 HydrophobicContact CD2-SD 4.07Å; F112-M356 HydrophobicContact CG-SD 3.74Å; F112-A359 HydrophobicContact CD2-CB 3.94Å; F112-A359 HydrophobicContact CE2-CB 3.71Å; F112-I360 HydrophobicContact CB-CD1 4.47Å; F112-I360 HydrophobicContact CB-CG1 3.93Å; F112-I360 HydrophobicContact CD2-CG1 4.44Å; F112-L363 HydrophobicContact CD2-CD1 3.38Å; F112-L363 HydrophobicContact CE2-CD1 3.27Å; F112-L363 HydrophobicContact CE2-CG 4.3Å; F112-L363 HydrophobicContact CG-CD1 4.27Å; F112-L363 HydrophobicContact CZ-CD1 4.09Å
113L97.8Very high96.4Very high92 Ų9249.8 Ų49.848%0.48224%0.237SC..Hα-helixtrans-63.2-38179-68.5175.8000112V109 L110 Y111 V116 F117V109-L113 HydrophobicContact CG1-CD1 4.08Å; V109-L113 HydrophobicContact CG1-CG 4.37Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.31Å; V109-L113 PolarHBondContact O-N 3.13Å; L110-L113 PolarHBondContact O-N 3.26Å; Y111-L113 PolarHBondContact O-N 3.37Å; L113-V116 PolarHBondContact O-N 2.91Å; L113-F117 PolarHBondContact O-N 3.39Å
114F96.2Very high96.5Very high81 Ų8149.5 Ų49.536%0.35525%0.245SC..Hα-helixtrans-61.4-44.9173.4172.1-101.1000111.7L110 Y111 F112 F117 L118 L129L110-F114 WeakPolarHBondContact O-CB 3.24Å; L110-F114 PolarHBondContact O-N 3.22Å; Y111-F114 HydrophobicContact CD2-CD1 4.25Å; Y111-F114 HydrophobicContact CE2-CD1 4.24Å; Y111-F114 WeakPolarHBondContact O-CB 3.21Å; Y111-F114 PolarHBondContact O-N 3.42Å; F112-F114 VanDerWaalsContact C-N 3.31Å; F112-F114 PolarHBondContact O-N 2.89Å; F114-F117 WeakPolarHBondContact O-CB 3.45Å; F114-F117 PolarHBondContact O-N 2.88Å; F114-L118 HydrophobicContact CE1-CD2 4.21Å; F114-L118 HydrophobicContact CZ-CD1 4.08Å; F114-L118 VanDerWaalsContact O-CB 3.28Å; F114-L118 WeakPolarHBondContact O-CB 3.41Å; F114-L118 PolarHBondContact O-N 3.42Å; F114-L129 HydrophobicContact CE2-CD2 4.1Å; F114-L129 HydrophobicContact CZ-CD2 4.37Å
115L97.2Very high96.5Very high3 Ų353.1 Ų53.12%0.01626%0.261CS..Hα-helixtrans-63.7-41.3176.8-70.9173.2000111.9Y111 F112 F117 L118 I119 I360 L363 E364Y111-L115 HydrophobicContact CD1-CD1 4.11Å; Y111-L115 HydrophobicContact CD2-CG 4.42Å; Y111-L115 HydrophobicContact CE1-CD1 3.73Å; Y111-L115 HydrophobicContact CE1-CG 4.37Å; Y111-L115 HydrophobicContact CE2-CD1 4.32Å; Y111-L115 HydrophobicContact CE2-CD2 4.14Å; Y111-L115 HydrophobicContact CE2-CG 4.07Å; Y111-L115 WeakPolarHBondContact O-CG 3.24Å; Y111-L115 PolarHBondContact O-N 3.44Å; F112-L115 PolarHBondContact O-N 3.31Å; L115-F117 VanDerWaalsContact C-N 3.34Å; L115-F117 PolarHBondContact O-N 2.88Å; L115-L118 HydrophobicContact CD2-CD2 4.36Å; L115-L118 PolarHBondContact O-N 3.16Å; L115-I119 VanDerWaalsContact O-CG1 3.26Å; L115-I119 WeakPolarHBondContact O-CG1 3.45Å; L115-I119 PolarHBondContact O-N 3.22Å; L115-I360 HydrophobicContact CD1-CG2 3.96Å; L115-L363 HydrophobicContact CB-CB 4.07Å; L115-L363 HydrophobicContact CB-CD1 4.12Å; L115-L363 HydrophobicContact CD1-CB 4.12Å; L115-E364 HydrophobicContact CD1-CG 3.67Å; L115-E364 HydrophobicContact CD2-CG 4.25Å
116V97.9Very high96.4Very high50 Ų5051.9 Ų51.930%0.30326%0.256SS..Hα-helixtrans-56.5-50.8173.3172.20000110F112 L113 I119 F120 L363F112-V116 HydrophobicContact CD1-CG2 4.41Å; F112-V116 HydrophobicContact CE1-CG2 3.94Å; F112-V116 HydrophobicContact CE2-CG2 4.33Å; F112-V116 HydrophobicContact CZ-CG2 3.89Å; F112-V116 WeakPolarHBondContact O-CG2 3.42Å; F112-V116 PolarHBondContact O-N 3.23Å; L113-V116 PolarHBondContact O-N 2.91Å; V116-I119 PolarHBondContact O-N 3.04Å; V116-F120 HydrophobicContact CG1-CE2 4.2Å; V116-F120 WeakPolarHBondContact O-CD2 3.17Å; V116-L363 HydrophobicContact CG2-CD1 3.63Å; V116-L363 HydrophobicContact CG2-CD2 4.44Å
117F97.2Very high96.3Very high112 Ų11255.4 Ų55.449%0.49127%0.271SS..Hα-helixtrans-58.9-48.2176.4168.1-105.2000112.4L113 F114 L115 I119 F120 L121 L129L113-F117 PolarHBondContact O-N 3.39Å; F114-F117 WeakPolarHBondContact O-CB 3.45Å; F114-F117 PolarHBondContact O-N 2.88Å; L115-F117 VanDerWaalsContact C-N 3.34Å; L115-F117 PolarHBondContact O-N 2.88Å; F117-I119 VanDerWaalsContact C-N 3.27Å; F117-I119 PolarHBondContact O-N 2.79Å; F117-F120 PolarHBondContact O-N 3.36Å; F117-L121 HydrophobicContact CD1-CD1 4.43Å; F117-L121 HydrophobicContact CE1-CD1 3.77Å; F117-L121 HydrophobicContact CE1-CD2 4.41Å; F117-L121 HydrophobicContact CE1-CG 4.32Å; F117-L121 HydrophobicContact CE2-CD2 4.1Å; F117-L121 HydrophobicContact CZ-CD1 4.02Å; F117-L121 HydrophobicContact CZ-CD2 3.87Å; F117-L121 HydrophobicContact CZ-CG 4.28Å; F117-L129 HydrophobicContact CE1-CD2 4.38Å
118L96.3Very high96.1Very high10 Ų1061.4 Ų61.45%0.05229%0.29CS..Hα-helixtrans-56.5-41.9-178.3-171.874.9000111.4F114 L115 F120 L121 V126 L129 F311 F371F114-L118 HydrophobicContact CE1-CD2 4.21Å; F114-L118 HydrophobicContact CZ-CD1 4.08Å; F114-L118 VanDerWaalsContact O-CB 3.28Å; F114-L118 WeakPolarHBondContact O-CB 3.41Å; F114-L118 PolarHBondContact O-N 3.42Å; L115-L118 HydrophobicContact CD2-CD2 4.36Å; L115-L118 PolarHBondContact O-N 3.16Å; L118-F120 PolarHBondContact O-N 3.03Å; L118-L121 HydrophobicContact CD1-CD1 4.41Å; L118-L121 WeakPolarHBondContact O-CB 3.24Å; L118-L121 PolarHBondContact O-N 3.38Å; L118-V126 HydrophobicContact CD1-CG1 4.08Å; L118-V126 HydrophobicContact CD1-CG2 3.99Å; L118-L129 HydrophobicContact CD1-CD2 4.14Å; L118-F311 HydrophobicContact CD2-CE2 4.42Å; L118-F311 HydrophobicContact CD2-CZ 3.99Å; L118-F371 HydrophobicContact CG-CE2 4.32Å; L118-F371 WeakPolarHBondContact O-CZ 3.48Å
119I96.4Very high95.9Very high24 Ų2463.5 Ų63.512%0.12330%0.301CS..Hα-helixtrans-65.6-17.3-179.4-70.7167.6000112.7L115 V116 F117 L363 L366 A367 K370L115-I119 VanDerWaalsContact O-CG1 3.26Å; L115-I119 WeakPolarHBondContact O-CG1 3.45Å; L115-I119 PolarHBondContact O-N 3.22Å; V116-I119 PolarHBondContact O-N 3.04Å; F117-I119 VanDerWaalsContact C-N 3.27Å; F117-I119 PolarHBondContact O-N 2.79Å; I119-L363 HydrophobicContact CD1-CB 4.16Å; I119-L363 HydrophobicContact CD1-CD2 3.62Å; I119-L363 HydrophobicContact CD1-CG 4.46Å; I119-L363 WeakPolarHBondContact CD1-O 3.38Å; I119-L366 HydrophobicContact CD1-CB 4.25Å; I119-L366 HydrophobicContact CD1-CD2 4.02Å; I119-L366 HydrophobicContact CD1-CG 4.16Å; I119-L366 HydrophobicContact CG2-CD2 4.29Å; I119-A367 HydrophobicContact CD1-CB 4.45Å; I119-A367 HydrophobicContact CG1-CB 4.06Å; I119-K370 HydrophobicContact CG2-CD 4.38Å; I119-K370 WeakPolarHBondContact O-CD 3.2Å; I119-K370 WeakPolarHBondContact O-CE 3.39Å; I119-K370 PolarHBondContact O-NZ 3.45Å
120F96.9Very high95.7Very high169 Ų16963.5 Ų63.574%0.74130%0.3SS*.Hα-helixtrans-88-14.2173-72.8-78.7000113.6V116 F117 L118V116-F120 HydrophobicContact CG1-CE2 4.2Å; V116-F120 WeakPolarHBondContact O-CD2 3.17Å; F117-F120 PolarHBondContact O-N 3.36Å; L118-F120 PolarHBondContact O-N 3.03Å
121L96.7Very high95.5Very high23 Ų2364.9 Ų64.912%0.1230%0.302CS..SBendtrans-75.1149.2178.9-58.3-174.3000112.2F117 L118 Q125 V126 L129 K370 F371F117-L121 HydrophobicContact CD1-CD1 4.43Å; F117-L121 HydrophobicContact CE1-CD1 3.77Å; F117-L121 HydrophobicContact CE1-CD2 4.41Å; F117-L121 HydrophobicContact CE1-CG 4.32Å; F117-L121 HydrophobicContact CE2-CD2 4.1Å; F117-L121 HydrophobicContact CZ-CD1 4.02Å; F117-L121 HydrophobicContact CZ-CD2 3.87Å; F117-L121 HydrophobicContact CZ-CG 4.28Å; L118-L121 HydrophobicContact CD1-CD1 4.41Å; L118-L121 WeakPolarHBondContact O-CB 3.24Å; L118-L121 PolarHBondContact O-N 3.38Å; L121-Q125 HydrophobicContact CB-CB 4.13Å; L121-Q125 HydrophobicContact CD2-CB 4.49Å; L121-V126 HydrophobicContact CB-CG2 3.7Å; L121-V126 HydrophobicContact CD1-CG2 4.27Å; L121-L129 HydrophobicContact CD1-CD2 4.05Å; L121-K370 PolarHBondContact O-NZ 3.01Å; L121-F371 VanDerWaalsContact O-CE1 3.31Å; L121-F371 WeakPolarHBondContact O-CE1 3.2Å; L121-F371 WeakPolarHBondContact O-CZ 3.29Å
122N95Very high95.2Very high82 Ų8266.4 Ų66.444%0.43931%0.308SS..  trans-80.8165167.272.239.6000111.3A124 Q125 V126N122-A124 VanDerWaalsContact C-N 3.3Å; N122-A124 PolarHBondContact O-N 3.45Å; N122-A124 PolarHBondContact OD1-N 2.83Å; N122-A124 VanDerWaalsContact OD1-N 3.16Å; N122-Q125 PolarHBondContact ND2-OE1 3.44Å; N122-Q125 WeakPolarHBondContact O-CB 3.28Å; N122-Q125 PolarHBondContact O-N 2.84Å; N122-Q125 VanDerWaalsContact O-N 3.11Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.43Å; N122-Q125 VanDerWaalsContact OD1-CG 3.28Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.3Å; N122-Q125 PolarHBondContact OD1-N 3.12Å; N122-Q125 PolarHBondContact OD1-OE1 3.44Å; N122-V126 WeakPolarHBondContact O-CG2 3.35Å; N122-V126 PolarHBondContact O-N 3.08Å
123W93.3Very high94.8Very high91 Ų9168.1 Ų68.135%0.34532%0.322SS..Hα-helixtrans-58.6-39-175.7-177.1-126.9000113.8Q125 V126 K127 I310 F311 F371W123-Q125 VanDerWaalsContact C-N 3.34Å; W123-Q125 PolarHBondContact O-N 2.88Å; W123-V126 HydrophobicContact CE3-CB 4.44Å; W123-V126 HydrophobicContact CZ3-CG1 4.48Å; W123-V126 PolarHBondContact O-N 3.43Å; W123-K127 HydrophobicContact CD2-CG 4.39Å; W123-K127 HydrophobicContact CZ2-CD 4.15Å; W123-K127 HydrophobicContact CZ2-CG 4.12Å; W123-K127 PolarHBondContact O-N 3.13Å; W123-I310 HydrophobicContact CH2-CG2 4.37Å; W123-I310 WeakPolarHBondContact CH2-O 3.23Å; W123-I310 HydrophobicContact CZ3-CG2 4.36Å; W123-F311 AromaticContact CH2-CD1 3.87Å; W123-F311 HydrophobicContact CH2-CD1 3.87Å; W123-F311 HydrophobicContact CH2-CE1 4.41Å; W123-F311 AromaticContact CZ3-CD1 3.55Å; W123-F311 HydrophobicContact CZ3-CD1 3.55Å; W123-F311 AromaticContact CZ3-CE1 3.65Å; W123-F311 HydrophobicContact CZ3-CE1 3.65Å; W123-F371 HydrophobicContact CE3-CB 3.98Å; W123-F371 AromaticContact CE3-CD1 3.74Å; W123-F371 HydrophobicContact CE3-CD1 3.74Å; W123-F371 HydrophobicContact CE3-CG 4.09Å; W123-F371 HydrophobicContact CZ3-CB 3.87Å; W123-F371 HydrophobicContact CZ3-CD1 4.34Å; W123-F371 HydrophobicContact CZ3-CG 4.24Å
124A94.6Very high94.4Very high59 Ų5965.6 Ų65.649%0.48831%0.309SS..Hα-helixtrans-65.8-37.5178.200000112.2N122 R128N122-A124 VanDerWaalsContact C-N 3.3Å; N122-A124 PolarHBondContact O-N 3.45Å; N122-A124 PolarHBondContact OD1-N 2.83Å; N122-A124 VanDerWaalsContact OD1-N 3.16Å; A124-R128 PolarHBondContact O-N 3.36Å; A124-R128 VanDerWaalsContact O-N 3.08Å
125Q95.9Very high94Very high88 Ų8864.7 Ų64.741%0.41131%0.311SS..Hα-helixtrans-68.4-41.8175-72.5168.7-38.500111.6L121 N122 W123 R128 L129L121-Q125 HydrophobicContact CB-CB 4.13Å; L121-Q125 HydrophobicContact CD2-CB 4.49Å; N122-Q125 PolarHBondContact ND2-OE1 3.44Å; N122-Q125 WeakPolarHBondContact O-CB 3.28Å; N122-Q125 PolarHBondContact O-N 2.84Å; N122-Q125 VanDerWaalsContact O-N 3.11Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.43Å; N122-Q125 VanDerWaalsContact OD1-CG 3.28Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.3Å; N122-Q125 PolarHBondContact OD1-N 3.12Å; N122-Q125 PolarHBondContact OD1-OE1 3.44Å; W123-Q125 VanDerWaalsContact C-N 3.34Å; W123-Q125 PolarHBondContact O-N 2.88Å; Q125-R128 WeakPolarHBondContact O-CB 3.34Å; Q125-R128 PolarHBondContact O-N 3.13Å; Q125-L129 WeakPolarHBondContact O-CB 3.2Å; Q125-L129 PolarHBondContact O-N 2.8Å
126V94.7Very high93.6Very high1 Ų170 Ų701%0.00634%0.339CS..Hα-helixtrans-61.2-46.9176176.50000110.9L118 L121 N122 W123 R128 L129 M130 F311 F371L118-V126 HydrophobicContact CD1-CG1 4.08Å; L118-V126 HydrophobicContact CD1-CG2 3.99Å; L121-V126 HydrophobicContact CB-CG2 3.7Å; L121-V126 HydrophobicContact CD1-CG2 4.27Å; N122-V126 WeakPolarHBondContact O-CG2 3.35Å; N122-V126 PolarHBondContact O-N 3.08Å; W123-V126 HydrophobicContact CE3-CB 4.44Å; W123-V126 HydrophobicContact CZ3-CG1 4.48Å; W123-V126 PolarHBondContact O-N 3.43Å; V126-R128 VanDerWaalsContact C-N 3.3Å; V126-R128 PolarHBondContact O-N 3.48Å; V126-L129 WeakPolarHBondContact O-CB 3.47Å; V126-L129 PolarHBondContact O-N 3.34Å; V126-L129 VanDerWaalsContact O-N 3.14Å; V126-M130 HydrophobicContact CG1-CG 4.34Å; V126-M130 HydrophobicContact CG1-SD 4.18Å; V126-M130 WeakPolarHBondContact O-CG 3.22Å; V126-M130 PolarHBondContact O-N 3.08Å; V126-F311 HydrophobicContact CG1-CD1 3.92Å; V126-F311 HydrophobicContact CG1-CE1 3.58Å; V126-F371 HydrophobicContact CG2-CE1 3.74Å; V126-F371 HydrophobicContact CG2-CE2 4.29Å; V126-F371 HydrophobicContact CG2-CZ 3.62Å
127K92.8Very high93.2Very high75 Ų7568 Ų6833%0.32633%0.328SS..Hα-helixtrans-58.1-43.4175.2-73.1-168.9-65.9178.20112.1W123 L129 M130 Y131W123-K127 HydrophobicContact CD2-CG 4.39Å; W123-K127 HydrophobicContact CZ2-CD 4.15Å; W123-K127 HydrophobicContact CZ2-CG 4.12Å; W123-K127 PolarHBondContact O-N 3.13Å; K127-L129 VanDerWaalsContact C-N 3.33Å; K127-L129 PolarHBondContact O-N 2.71Å; K127-M130 PolarHBondContact O-N 3.22Å; K127-Y131 HydrophobicContact CB-CE2 3.89Å; K127-Y131 WeakPolarHBondContact O-CD1 3.31Å; K127-Y131 WeakPolarHBondContact O-CD2 3.49Å; K127-Y131 PolarHBondContact O-N 3.18Å
128R93.4Very high92.7Very high187 Ų18770.1 Ų70.171%0.70633%0.332SS*.Hα-helixtrans-60.7-43.1176.3-168.8-176.6-59.1-175.80.5111.9A124 Q125 V126 Y131 W132A124-R128 PolarHBondContact O-N 3.36Å; A124-R128 VanDerWaalsContact O-N 3.08Å; Q125-R128 WeakPolarHBondContact O-CB 3.34Å; Q125-R128 PolarHBondContact O-N 3.13Å; V126-R128 VanDerWaalsContact C-N 3.3Å; V126-R128 PolarHBondContact O-N 3.48Å; R128-Y131 PolarHBondContact O-N 2.91Å; R128-W132 WeakPolarHBondContact O-CB 3.33Å; R128-W132 PolarHBondContact O-N 2.97Å
129L93Very high92.2Very high43 Ų4378.8 Ų78.823%0.22537%0.365CS..Hα-helixtrans-61.2-46.4175.4177.763.8000111F114 F117 L118 L121 Q125 V126 K127 Y131 W132 V133F114-L129 HydrophobicContact CE2-CD2 4.1Å; F114-L129 HydrophobicContact CZ-CD2 4.37Å; F117-L129 HydrophobicContact CE1-CD2 4.38Å; L118-L129 HydrophobicContact CD1-CD2 4.14Å; L121-L129 HydrophobicContact CD1-CD2 4.05Å; Q125-L129 WeakPolarHBondContact O-CB 3.2Å; Q125-L129 PolarHBondContact O-N 2.8Å; V126-L129 WeakPolarHBondContact O-CB 3.47Å; V126-L129 PolarHBondContact O-N 3.34Å; V126-L129 VanDerWaalsContact O-N 3.14Å; K127-L129 VanDerWaalsContact C-N 3.33Å; K127-L129 PolarHBondContact O-N 2.71Å; L129-Y131 PolarHBondContact O-N 3.26Å; L129-W132 HydrophobicContact CD1-CE3 4.35Å; L129-W132 WeakPolarHBondContact O-CB 3.31Å; L129-W132 PolarHBondContact O-N 2.99Å; L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.44Å
130M92Very high91.5Very high24 Ų2479.2 Ų79.212%0.11837%0.373CS..Hα-helixtrans-60.8-45.1177.4-70.6-176.962.400112.2V126 K127 W132 V133 D134 L137 F311 F313V126-M130 HydrophobicContact CG1-CG 4.34Å; V126-M130 HydrophobicContact CG1-SD 4.18Å; V126-M130 WeakPolarHBondContact O-CG 3.22Å; V126-M130 PolarHBondContact O-N 3.08Å; K127-M130 PolarHBondContact O-N 3.22Å; M130-W132 PolarHBondContact O-N 2.89Å; M130-V133 PolarHBondContact O-N 3.27Å; M130-D134 PolarHBondContact O-N 3.46Å; M130-L137 HydrophobicContact CB-CD1 4.15Å; M130-L137 HydrophobicContact CE-CD1 3.89Å; M130-F311 HydrophobicContact CE-CB 3.86Å; M130-F311 WeakPolarHBondContact CE-O 3.46Å; M130-F311 HydrophobicContact SD-CB 3.81Å; M130-F311 HydrophobicContact SD-CD1 3.9Å; M130-F311 HydrophobicContact SD-CG 4.11Å; M130-F313 HydrophobicContact CE-CD1 4.09Å
131Y92.1Very high90.5Very high67 Ų6774.5 Ų74.526%0.26336%0.358SS..Hα-helixtrans-67.9-23.2177.8-57-26000113.5K127 R128 L129 D134 P135 L137 R138K127-Y131 HydrophobicContact CB-CE2 3.89Å; K127-Y131 WeakPolarHBondContact O-CD1 3.31Å; K127-Y131 WeakPolarHBondContact O-CD2 3.49Å; K127-Y131 PolarHBondContact O-N 3.18Å; R128-Y131 PolarHBondContact O-N 2.91Å; L129-Y131 PolarHBondContact O-N 3.26Å; Y131-D134 WeakPolarHBondContact CA-O 3.3Å; Y131-D134 CarbonylContact O-C 3.33Å; Y131-P135 WeakPolarHBondContact O-CA 3.44Å; Y131-L137 HydrophobicContact CD1-CB 3.95Å; Y131-L137 HydrophobicContact CE1-CB 4.18Å; Y131-L137 WeakPolarHBondContact CE1-O 3.47Å; Y131-R138 HydrophobicContact CD1-CB 4.46Å; Y131-R138 HydrophobicContact CD1-CG 3.62Å; Y131-R138 HydrophobicContact CD2-CG 3.86Å; Y131-R138 HydrophobicContact CE1-CB 4.47Å; Y131-R138 HydrophobicContact CE1-CG 3.99Å; Y131-R138 HydrophobicContact CE2-CG 4.2Å; Y131-R138 HydrophobicContact CG-CG 3.56Å
132W91.1Very high89.4Confident68 Ų6877.7 Ų77.726%0.25837%0.368SS..Hα-helixtrans-77-36.9173.5-18078.9000111.6D66 L69 R70 R128 L129 M130D66-W132 PolarHBondContact OD1-NE1 2.84Å; L69-W132 HydrophobicContact CB-CH2 4.32Å; L69-W132 HydrophobicContact CB-CZ2 3.62Å; R70-W132 HydrophobicContact CB-CZ2 4.45Å; R70-W132 HydrophobicContact CG-CH2 3.91Å; R70-W132 HydrophobicContact CG-CZ2 3.56Å; R70-W132 PolarHBondContact NH2-O 2.86Å; R128-W132 WeakPolarHBondContact O-CB 3.33Å; R128-W132 PolarHBondContact O-N 2.97Å; L129-W132 HydrophobicContact CD1-CE3 4.35Å; L129-W132 WeakPolarHBondContact O-CB 3.31Å; L129-W132 PolarHBondContact O-N 2.99Å; M130-W132 PolarHBondContact O-N 2.89Å
133V89.6Confident88.1Confident82 Ų8275.1 Ų75.150%0.49735%0.354SS..Hα-helixtrans-66.9-51.1173.11730000110.8L129 M130L129-V133 WeakPolarHBondContact O-CG2 3.38Å; L129-V133 PolarHBondContact O-N 3.44Å; M130-V133 PolarHBondContact O-N 3.27Å
134D89.4Confident86.6Confident38 Ų3872.2 Ų72.220%0.20335%0.346CS..  trans-137.6109.9174.2-170.8-19000110.7M130 Y131 N136 L137 H317M130-D134 PolarHBondContact O-N 3.46Å; Y131-D134 WeakPolarHBondContact CA-O 3.3Å; Y131-D134 CarbonylContact O-C 3.33Å; D134-N136 PolarHBondContact O-N 2.97Å; D134-N136 VanDerWaalsContact OD1-CB 3.26Å; D134-N136 WeakPolarHBondContact OD1-CB 3.15Å; D134-N136 PolarHBondContact OD1-N 3.46Å; D134-N136 PolarHBondContact OD1-ND2 3.41Å; D134-L137 HydrophobicContact CB-CD1 3.91Å; D134-L137 HydrophobicContact CB-CG 4.06Å; D134-L137 WeakPolarHBondContact O-CB 3.26Å; D134-L137 PolarHBondContact O-N 2.99Å; D134-H317 IonicContact OD2-CE1 3.59Å; D134-H317 IonicContact OD2-NE2 3.2Å; D134-H317 PolarHBondContact OD2-NE2 3.29Å; D134-H317 VanDerWaalsContact OD2-NE2 3.15Å
135P89.2Confident85.2Confident63 Ų6374.9 Ų74.941%0.40935%0.352SS..G310 helixtrans-58.8-26.4177.4-25.535.3000114.5Y131 L137 R138Y131-P135 WeakPolarHBondContact O-CA 3.44Å; P135-L137 PolarHBondContact O-N 3.06Å; P135-R138 WeakPolarHBondContact O-CB 3.43Å; P135-R138 WeakPolarHBondContact O-CG 3.46Å; P135-R138 PolarHBondContact O-N 3.21Å
136N88.5Confident83.6Confident113 Ų11374.8 Ų74.860%0.60436%0.357SS*.G310 helixtrans-68-22.4-177.7-61.1-54.6000112.5D134 R138 Y139D134-N136 PolarHBondContact O-N 2.97Å; D134-N136 VanDerWaalsContact OD1-CB 3.26Å; D134-N136 WeakPolarHBondContact OD1-CB 3.15Å; D134-N136 PolarHBondContact OD1-N 3.46Å; D134-N136 PolarHBondContact OD1-ND2 3.41Å; N136-R138 PolarHBondContact O-N 3.33Å; N136-Y139 PolarHBondContact O-N 3.45Å
137L88.6Confident82.4Confident10 Ų1080 Ų805%0.05238%0.383CS..G310 helixtrans-62.2-13.8176.3-69171.3000113.2M130 Y131 D134 P135 Y139 A140 F313 L319M130-L137 HydrophobicContact CB-CD1 4.15Å; M130-L137 HydrophobicContact CE-CD1 3.89Å; Y131-L137 HydrophobicContact CD1-CB 3.95Å; Y131-L137 HydrophobicContact CE1-CB 4.18Å; Y131-L137 WeakPolarHBondContact CE1-O 3.47Å; D134-L137 HydrophobicContact CB-CD1 3.91Å; D134-L137 HydrophobicContact CB-CG 4.06Å; D134-L137 WeakPolarHBondContact O-CB 3.26Å; D134-L137 PolarHBondContact O-N 2.99Å; P135-L137 PolarHBondContact O-N 3.06Å; L137-Y139 PolarHBondContact O-N 2.95Å; L137-A140 HydrophobicContact CD2-CB 4.3Å; L137-A140 PolarHBondContact O-N 2.82Å; L137-F313 HydrophobicContact CD2-CB 3.79Å; L137-L319 HydrophobicContact CD1-CD1 3.95Å
138R86.9Confident81.4Confident156 Ų15684.5 Ų84.559%0.58941%0.405SS*.G310 helixtrans-64.9-28.2172.1-67179.3-174.5-167.94113.2Y131 P135 N136Y131-R138 HydrophobicContact CD1-CB 4.46Å; Y131-R138 HydrophobicContact CD1-CG 3.62Å; Y131-R138 HydrophobicContact CD2-CG 3.86Å; Y131-R138 HydrophobicContact CE1-CB 4.47Å; Y131-R138 HydrophobicContact CE1-CG 3.99Å; Y131-R138 HydrophobicContact CE2-CG 4.2Å; Y131-R138 HydrophobicContact CG-CG 3.56Å; P135-R138 WeakPolarHBondContact O-CB 3.43Å; P135-R138 WeakPolarHBondContact O-CG 3.46Å; P135-R138 PolarHBondContact O-N 3.21Å; N136-R138 PolarHBondContact O-N 3.33Å
139Y85.6Confident80.6Confident191 Ų19178.5 Ų78.575%0.74938%0.383SS*.SBendtrans-108.42.5-177.1-50.5-73.5000112.2N136 L137 T141N136-Y139 PolarHBondContact O-N 3.45Å; L137-Y139 PolarHBondContact O-N 2.95Å; Y139-T141 PolarHBondContact O-N 3.28Å
140A81.5Confident79.9Confident34 Ų3478.6 Ų78.628%0.28139%0.39SS..PPolyproline II helixtrans-65.9127.5178.600000110.1L137L137-A140 HydrophobicContact CD2-CB 4.3Å; L137-A140 PolarHBondContact O-N 2.82Å
141T76.6Confident79.2Confident70 Ų7080.2 Ų80.243%0.42940%0.401SS..PPolyproline II helixtrans-93.1153.1169.952.30000109.9Y139Y139-T141 PolarHBondContact O-N 3.28Å
142R72.8Confident78.7Confident90 Ų9082.7 Ų82.734%0.3442%0.419SS..PPolyproline II helixtrans-73.8138.7174.8-155.2-176.6-93.9154.3-4.9108.4T144 D145 H309 V312R142-T144 WeakPolarHBondContact CD-OG1 3.33Å; R142-T144 WeakPolarHBondContact CG-OG1 3.29Å; R142-T144 PolarHBondContact O-N 2.92Å; R142-D145 WeakPolarHBondContact CB-OD2 3.19Å; R142-D145 WeakPolarHBondContact O-CB 3.45Å; R142-D145 PolarHBondContact O-N 3.02Å; R142-H309 PolarHBondContact NE-O 3.39Å; R142-V312 HydrophobicContact CB-CG1 4.24Å
143E69.6Low78.2Confident28 Ų2880.3 Ų80.313%0.13141%0.412CS..G310 helixtrans-58.2-35-179-66.6177.8155.300112.4D145 V146 M147 K308 Q314 A315E143-D145 PolarHBondContact O-N 3Å; E143-D145 VanDerWaalsContact O-N 3.08Å; E143-V146 PolarHBondContact O-N 3.2Å; E143-V146 VanDerWaalsContact O-N 3.1Å; E143-M147 WeakPolarHBondContact O-CB 3.5Å; E143-M147 PolarHBondContact O-N 3.47Å; E143-K308 IonicContact OE2-NZ 2.69Å; E143-K308 PolarHBondContact OE2-NZ 2.76Å; E143-Q314 HydrophobicContact CG-CG 4.34Å; E143-Q314 WeakPolarHBondContact OE1-CA 3.08Å; E143-A315 WeakPolarHBondContact OE1-CB 3.26Å; E143-A315 PolarHBondContact OE1-N 3.19Å
144T61.6Low77.9Confident29 Ų2984.5 Ų84.518%0.17843%0.426CS..G310 helixtrans-56.8-22.7174.555.30000114.6R142 P208 N209R142-T144 WeakPolarHBondContact CD-OG1 3.33Å; R142-T144 WeakPolarHBondContact CG-OG1 3.29Å; R142-T144 PolarHBondContact O-N 2.92Å; T144-P208 HydrophobicContact CG2-CB 4.03Å; T144-P208 HydrophobicContact CG2-CG 3.92Å; T144-N209 WeakPolarHBondContact CG2-OD1 3.43Å
145D63.9Low77.6Confident115 Ų11586.9 Ų86.962%0.61544%0.442SS*.G310 helixtrans-95.3-8.3-174.3-52.1-15.5000111.4R142 E143R142-D145 WeakPolarHBondContact CB-OD2 3.19Å; R142-D145 WeakPolarHBondContact O-CB 3.45Å; R142-D145 PolarHBondContact O-N 3.02Å; E143-D145 PolarHBondContact O-N 3Å; E143-D145 VanDerWaalsContact O-N 3.08Å
146V63.5Low77.3Confident87 Ų8787.7 Ų87.753%0.52744%0.442SS..THydrogen-bonded Turntrans-120.3-28.1-175.4-168.90000111.9E143E143-V146 PolarHBondContact O-N 3.2Å; E143-V146 VanDerWaalsContact O-N 3.1Å
147M69.3Low77.2Confident111 Ų11185.4 Ų85.455%0.54743%0.432SS..  trans-105.1140.5-175.6-63-63.4147.900111.7E143 Y149E143-M147 WeakPolarHBondContact O-CB 3.5Å; E143-M147 PolarHBondContact O-N 3.47Å; M147-Y149 HydrophobicContact CB-CD2 4.42Å; M147-Y149 HydrophobicContact CB-CE1 4.35Å; M147-Y149 HydrophobicContact CB-CE2 3.63Å; M147-Y149 WeakPolarHBondContact CB-OH 3.46Å; M147-Y149 WeakPolarHBondContact O-CD2 3.34Å; M147-Y149 WeakPolarHBondContact O-CE2 3.37Å
148E71.5Confident77.1Confident168 Ų16893.7 Ų93.779%0.78546%0.463SS*.  trans-92.7123.2172-68.8-173170.500110.2V151E148-V151 HydrophobicContact CB-CG2 3.94Å
149Y76.5Confident77Confident62 Ų6294 Ų9424%0.24347%0.471CS..  trans-106.6133-175.6-67.9-75.4000111.2M147 V151 P208 N209 A211M147-Y149 HydrophobicContact CB-CD2 4.42Å; M147-Y149 HydrophobicContact CB-CE1 4.35Å; M147-Y149 HydrophobicContact CB-CE2 3.63Å; M147-Y149 WeakPolarHBondContact CB-OH 3.46Å; M147-Y149 WeakPolarHBondContact O-CD2 3.34Å; M147-Y149 WeakPolarHBondContact O-CE2 3.37Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.34Å; Y149-P208 WeakPolarHBondContact CB-O 3.28Å; Y149-P208 HydrophobicContact CD2-CB 4.39Å; Y149-N209 HydrophobicContact CE1-CB 4.15Å; Y149-N209 VanDerWaalsContact CE2-OD1 3.23Å; Y149-N209 WeakPolarHBondContact CE2-OD1 3.5Å; Y149-N209 PolarHBondContact OH-OD1 2.75Å; Y149-A211 CarbonylContact C-O 3.49Å; Y149-A211 WeakPolarHBondContact CB-O 3.38Å
150A77.6Confident76.8Confident45 Ų4587.5 Ų87.537%0.37245%0.445SS..SBendtrans51.535.317800000117C153 A211A150-C153 VanDerWaalsContact C-SG 3.6Å; A150-C153 PolarHBondContact O-SG 3.27Å; A150-A211 HydrophobicContact CB-CB 4.06Å; A150-A211 VanDerWaalsContact CB-O 3.32Å; A150-A211 WeakPolarHBondContact CB-O 3.34Å; A150-A211 PolarHBondContact N-O 3.38Å
151V78.1Confident76.8Confident58 Ų5887.9 Ų87.935%0.35244%0.442SS..  trans-83.5134.8177.8-176.30000110.7E148 Y149 C153 R160E148-V151 HydrophobicContact CB-CG2 3.94Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.34Å; V151-C153 PolarHBondContact O-N 3.09Å; V151-R160 PolarHBondContact O-NH2 3.4Å
152N80.6Confident77.2Confident119 Ų11988.8 Ų88.864%0.63644%0.444SS*.SBendtrans54.542171.7-67-39.4000116.3H154 V155 R160N152-H154 PolarHBondContact O-N 3.36Å; N152-V155 PolarHBondContact O-N 2.96Å; N152-R160 PolarHBondContact O-NH1 3.41Å
153C81.9Confident77.6Confident18 Ų1888 Ų8812%0.12245%0.452CS..THydrogen-bonded Turntrans-66.33-174.2-61.50000117.2A150 V151 C213 W214A150-C153 VanDerWaalsContact C-SG 3.6Å; A150-C153 PolarHBondContact O-SG 3.27Å; V151-C153 PolarHBondContact O-N 3.09Å; C153-C213 WeakPolarHBondContact CA-SG 3.45Å; C153-C213 HydrophobicContact CB-CB 3.58Å; C153-C213 WeakPolarHBondContact CB-SG 3.35Å; C153-C213 WeakPolarHBondContact SG-CA 3.38Å; C153-C213 WeakPolarHBondContact SG-CB 3.41Å; C153-C213 CovalentContact SG-SG 2.05Å; C153-C213 PolarHBondContact SG-SG 2.83Å; C153-W214 PolarHBondContact O-NE1 3.43Å
154H83.6Confident78.1Confident170 Ų17089.1 Ų89.179%0.78746%0.457SS*.THydrogen-bonded Turntrans-93.3-19.4176.1-61.7-67.1000113.3N152 I156N152-H154 PolarHBondContact O-N 3.36Å; H154-I156 PolarHBondContact O-N 3.17Å
155V83.2Confident79Confident88 Ų8892.2 Ų92.253%0.53347%0.468SS..  trans-95.6100.6-179.4-176.20000108.8N152 T157 R160N152-V155 PolarHBondContact O-N 2.96Å; V155-T157 HydrophobicContact CG1-CG2 4.1Å; V155-R160 WeakPolarHBondContact O-CD 3.28Å; V155-R160 PolarHBondContact O-NH1 2.84Å
156I82.8Confident79.7Confident79 Ų7989.8 Ų89.841%0.40546%0.456SS..  trans-102.9100.7-180-56.5174.9000108.1H154 I161 W214 W215H154-I156 PolarHBondContact O-N 3.17Å; I156-I161 HydrophobicContact CG2-CD1 3.65Å; I156-I161 HydrophobicContact CG2-CG1 3.97Å; I156-W214 HydrophobicContact CD1-CZ2 4.02Å; I156-W215 HydrophobicContact CD1-CB 4.22Å; I156-W215 HydrophobicContact CD1-CG 3.98Å; I156-W215 HydrophobicContact CG1-CG 4.3Å
157T86.4Confident80.4Confident65 Ų6590.1 Ų90.140%0.39945%0.453SS..  trans-107.5157.9173.159.60000110.5V155 E159 R160 I161V155-T157 HydrophobicContact CG1-CG2 4.1Å; T157-E159 PolarHBondContact O-N 3.17Å; T157-R160 WeakPolarHBondContact O-CB 3.39Å; T157-R160 PolarHBondContact O-N 3Å; T157-R160 VanDerWaalsContact OG1-CB 3.3Å; T157-R160 WeakPolarHBondContact OG1-CB 3.48Å; T157-R160 PolarHBondContact OG1-N 2.88Å; T157-I161 PolarHBondContact O-N 2.83Å
158W85.4Confident80.9Confident184 Ų18489.4 Ų89.470%0.69745%0.447SS*.Hα-helixtrans-62.5-41.7179.7-174.6-113.1000112.8R160 I161 L162W158-R160 PolarHBondContact O-N 3.25Å; W158-I161 HydrophobicContact CE3-CD1 4.34Å; W158-I161 PolarHBondContact O-N 3.37Å; W158-L162 HydrophobicContact CD2-CG 4.47Å; W158-L162 HydrophobicContact CZ2-CD1 4.47Å; W158-L162 HydrophobicContact CZ2-CD2 4.06Å; W158-L162 HydrophobicContact CZ2-CG 4.3Å; W158-L162 VanDerWaalsContact NE1-CD1 3.32Å; W158-L162 WeakPolarHBondContact O-CG 3.44Å; W158-L162 PolarHBondContact O-N 3.19Å
159E85Confident81.5Confident163 Ų16381.7 Ų81.776%0.76241%0.412SS*.Hα-helixtrans-58.4-39.6175.2-66.3175.1-18000111.5T157 L162 S163T157-E159 PolarHBondContact O-N 3.17Å; E159-L162 PolarHBondContact O-N 3.24Å; E159-S163 PolarHBondContact O-N 3.45Å
160R81.5Confident81.9Confident55 Ų5585.6 Ų85.621%0.20843%0.431CS..Hα-helixtrans-67.2-48.4177.4-169175-156.1172.97.1111.6V151 N152 V155 T157 W158 L162 S163 H164 W215V151-R160 PolarHBondContact O-NH2 3.4Å; N152-R160 PolarHBondContact O-NH1 3.41Å; V155-R160 WeakPolarHBondContact O-CD 3.28Å; V155-R160 PolarHBondContact O-NH1 2.84Å; T157-R160 WeakPolarHBondContact O-CB 3.39Å; T157-R160 PolarHBondContact O-N 3Å; T157-R160 VanDerWaalsContact OG1-CB 3.3Å; T157-R160 WeakPolarHBondContact OG1-CB 3.48Å; T157-R160 PolarHBondContact OG1-N 2.88Å; W158-R160 PolarHBondContact O-N 3.25Å; R160-L162 VanDerWaalsContact C-N 3.27Å; R160-L162 PolarHBondContact O-N 3.4Å; R160-S163 WeakPolarHBondContact CA-OG 3.43Å; R160-S163 PolarHBondContact O-N 2.99Å; R160-S163 VanDerWaalsContact O-N 3.08Å; R160-S163 PolarHBondContact O-OG 2.93Å; R160-H164 PolarHBondContact O-CD2 3.14Å; R160-H164 PolarHBondContact O-N 3.47Å; R160-W215 HydrophobicContact CG-CZ2 4.29Å
161I82.4Confident82.3Confident41 Ų4184.9 Ų84.921%0.2143%0.428CS..Hα-helixtrans-55.5-47175.8-67.5166.2000110.3I156 T157 W158 S163 H164 F165 W215I156-I161 HydrophobicContact CG2-CD1 3.65Å; I156-I161 HydrophobicContact CG2-CG1 3.97Å; T157-I161 PolarHBondContact O-N 2.83Å; W158-I161 HydrophobicContact CE3-CD1 4.34Å; W158-I161 PolarHBondContact O-N 3.37Å; I161-S163 VanDerWaalsContact C-N 3.29Å; I161-S163 PolarHBondContact O-N 3.27Å; I161-H164 PolarHBondContact O-N 2.85Å; I161-H164 VanDerWaalsContact O-N 3.13Å; I161-F165 HydrophobicContact CG2-CD2 4.11Å; I161-F165 HydrophobicContact CG2-CE2 3.9Å; I161-F165 WeakPolarHBondContact O-CD2 3.4Å; I161-F165 PolarHBondContact O-N 3.15Å; I161-W215 HydrophobicContact CG1-CH2 4.44Å; I161-W215 HydrophobicContact CG1-CZ3 4.3Å
162L83.9Confident82.9Confident89 Ų8983.8 Ų83.847%0.46642%0.419SS..Hα-helixtrans-63.6-33178.8-72.5-179.9000113.3W158 E159 R160 H164 F165W158-L162 HydrophobicContact CD2-CG 4.47Å; W158-L162 HydrophobicContact CZ2-CD1 4.47Å; W158-L162 HydrophobicContact CZ2-CD2 4.06Å; W158-L162 HydrophobicContact CZ2-CG 4.3Å; W158-L162 VanDerWaalsContact NE1-CD1 3.32Å; W158-L162 WeakPolarHBondContact O-CG 3.44Å; W158-L162 PolarHBondContact O-N 3.19Å; E159-L162 PolarHBondContact O-N 3.24Å; R160-L162 VanDerWaalsContact C-N 3.27Å; R160-L162 PolarHBondContact O-N 3.4Å; L162-H164 VanDerWaalsContact C-N 3.25Å; L162-H164 PolarHBondContact O-N 2.88Å; L162-F165 PolarHBondContact O-N 2.97Å
163S81.3Confident83.5Confident75 Ų7581.8 Ų81.852%0.52441%0.405SS..Hα-helixtrans-67.6-25175.868.90000113.6E159 R160 I161E159-S163 PolarHBondContact O-N 3.45Å; R160-S163 WeakPolarHBondContact CA-OG 3.43Å; R160-S163 PolarHBondContact O-N 2.99Å; R160-S163 VanDerWaalsContact O-N 3.08Å; R160-S163 PolarHBondContact O-OG 2.93Å; I161-S163 VanDerWaalsContact C-N 3.29Å; I161-S163 PolarHBondContact O-N 3.27Å
164H79.8Confident84Confident50 Ų5082.7 Ų82.723%0.23142%0.417CS..Hα-helixtrans-86.9-10175.2-74.7-111.9000112.9R160 I161 L162 D166 W215 D216 L220R160-H164 PolarHBondContact O-CD2 3.14Å; R160-H164 PolarHBondContact O-N 3.47Å; I161-H164 PolarHBondContact O-N 2.85Å; I161-H164 VanDerWaalsContact O-N 3.13Å; L162-H164 VanDerWaalsContact C-N 3.25Å; L162-H164 PolarHBondContact O-N 2.88Å; H164-D166 PolarHBondContact O-N 3.36Å; H164-W215 HydrophobicContact CB-CH2 4.19Å; H164-W215 AromaticContact CD2-CH2 3.81Å; H164-W215 AromaticContact CG-CH2 3.78Å; H164-D216 IonicContact CE1-OD2 3.14Å; H164-D216 PolarHBondContact CE1-OD2 2.88Å; H164-D216 VanDerWaalsContact CE1-OD2 3.29Å; H164-D216 IonicContact ND1-OD1 2.76Å; H164-D216 IonicContact ND1-OD2 2.73Å; H164-D216 PolarHBondContact ND1-OD2 3.32Å; H164-L220 HydrophobicContact CB-CD2 3.91Å
165F81.1Confident84.4Confident94 Ų9475.9 Ų75.941%0.41239%0.392SS..SBendtrans-80.159.6168.9-89.6-83.4000111.4I161 L162 A169 L220I161-F165 HydrophobicContact CG2-CD2 4.11Å; I161-F165 HydrophobicContact CG2-CE2 3.9Å; I161-F165 WeakPolarHBondContact O-CD2 3.4Å; I161-F165 PolarHBondContact O-N 3.15Å; L162-F165 PolarHBondContact O-N 2.97Å; F165-A169 HydrophobicContact CD1-CB 4.42Å; F165-L220 HydrophobicContact CD2-CD1 4.33Å; F165-L220 HydrophobicContact CE1-CD1 3.96Å; F165-L220 HydrophobicContact CE2-CD1 3.68Å; F165-L220 HydrophobicContact CZ-CD1 3.47Å; F165-L220 VanDerWaalsContact CZ-CD1 3.47Å
166D78.9Confident85Confident65 Ų6572.2 Ų72.235%0.34837%0.369SS..SBendtrans-104-165.9-177.171.49.2000112.1H164 F168 A169 F170H164-D166 PolarHBondContact O-N 3.36Å; D166-F168 PolarHBondContact O-N 3.42Å; D166-F168 VanDerWaalsContact O-N 3.16Å; D166-F168 WeakPolarHBondContact OD1-CA 3.48Å; D166-F168 VanDerWaalsContact OD1-CB 3.26Å; D166-F168 WeakPolarHBondContact OD1-CB 3.17Å; D166-F168 WeakPolarHBondContact OD1-CD2 3.29Å; D166-F168 PolarHBondContact OD1-N 3.33Å; D166-F168 WeakPolarHBondContact OD2-CD2 3.16Å; D166-A169 PolarHBondContact O-N 2.98Å; D166-A169 PolarHBondContact OD1-N 3.22Å; D166-F170 WeakPolarHBondContact O-CD2 3.27Å; D166-F170 PolarHBondContact O-N 2.81Å
167I78.7Confident85.6Confident93 Ų9369 Ų6948%0.47735%0.354SS..Hα-helixtrans-58.8-25.5179.6-165.3164.5000112.9G171 W321I167-G171 PolarHBondContact O-N 2.79Å; I167-W321 HydrophobicContact CD1-CH2 4.25Å; I167-W321 HydrophobicContact CD1-CZ2 3.77Å; I167-W321 HydrophobicContact CG1-CH2 4.14Å; I167-W321 HydrophobicContact CG1-CZ2 4Å
168F78.6Confident85.9Confident96 Ų9670 Ų7042%0.42136%0.355SS..Hα-helixtrans-74-42.4177.4-61-75.2000110.9D166 F170 G171 H172 A315D166-F168 PolarHBondContact O-N 3.42Å; D166-F168 VanDerWaalsContact O-N 3.16Å; D166-F168 WeakPolarHBondContact OD1-CA 3.48Å; D166-F168 VanDerWaalsContact OD1-CB 3.26Å; D166-F168 WeakPolarHBondContact OD1-CB 3.17Å; D166-F168 WeakPolarHBondContact OD1-CD2 3.29Å; D166-F168 PolarHBondContact OD1-N 3.33Å; D166-F168 WeakPolarHBondContact OD2-CD2 3.16Å; F168-F170 VanDerWaalsContact C-N 3.33Å; F168-F170 PolarHBondContact O-N 3.42Å; F168-G171 CarbonylContact O-C 3.55Å; F168-G171 WeakPolarHBondContact O-CA 3.48Å; F168-G171 PolarHBondContact O-N 2.95Å; F168-H172 PolarHBondContact O-CD2 3.05Å; F168-H172 PolarHBondContact O-N 3.16Å; F168-A315 HydrophobicContact CE1-CB 3.59Å; F168-A315 HydrophobicContact CZ-CB 3.68Å
169A84.2Confident86.3Confident6 Ų662.8 Ų62.85%0.0533%0.329CS..Hα-helixtrans-58.5-43.9173.600000112.1F165 D166 H172 F173F165-A169 HydrophobicContact CD1-CB 4.42Å; D166-A169 PolarHBondContact O-N 2.98Å; D166-A169 PolarHBondContact OD1-N 3.22Å; A169-H172 PolarHBondContact O-N 3.2Å; A169-F173 PolarHBondContact O-N 3.41Å
170F85.6Confident86.8Confident144 Ų14455 Ų5563%0.63229%0.293SS*.Hα-helixtrans-67.3-36.1173.7-69.9-70.4000112.7D166 F168 G174D166-F170 WeakPolarHBondContact O-CD2 3.27Å; D166-F170 PolarHBondContact O-N 2.81Å; F168-F170 VanDerWaalsContact C-N 3.33Å; F168-F170 PolarHBondContact O-N 3.42Å; F170-G174 PolarHBondContact O-N 3.4Å
171G86.1Confident87.2Confident30 Ų3055.2 Ų55.231%0.30930%0.297SS..Hα-helixtrans-62.2-42.3173.900000112.3I167 F168 G175I167-G171 PolarHBondContact O-N 2.79Å; F168-G171 CarbonylContact O-C 3.55Å; F168-G171 WeakPolarHBondContact O-CA 3.48Å; F168-G171 PolarHBondContact O-N 2.95Å; G171-G175 VanDerWaalsContact O-CA 3.29Å; G171-G175 WeakPolarHBondContact O-CA 3.39Å; G171-G175 PolarHBondContact O-N 3Å
172H89.6Confident87.7Confident35 Ų3554.9 Ų54.916%0.16230%0.295CS..Hα-helixtrans-63.5-55.1174.9-79-139.5000109.4F168 A169 G174 G175 W176 D221 C225F168-H172 PolarHBondContact O-CD2 3.05Å; F168-H172 PolarHBondContact O-N 3.16Å; A169-H172 PolarHBondContact O-N 3.2Å; H172-G174 PolarHBondContact O-N 3.07Å; H172-G175 PolarHBondContact O-N 2.62Å; H172-W176 WeakPolarHBondContact O-CB 3.28Å; H172-W176 PolarHBondContact O-N 3Å; H172-D221 IonicContact CE1-OD1 2.56Å; H172-D221 PolarHBondContact CE1-OD1 3.44Å; H172-D221 IonicContact CG-OD1 2.8Å; H172-D221 IonicContact ND1-OD1 3.29Å; H172-D221 PolarHBondContact ND1-OD1 3.32Å; H172-C225 HydrophobicContact CB-CB 3.77Å
173F93.8Very high88Confident78 Ų7850.7 Ų50.734%0.34227%0.273SS..Hα-helixtrans-56.2-53.2179.3179-92.2000113.3A169 W176 A177 C225 G228 G229 L232A169-F173 PolarHBondContact O-N 3.41Å; F173-W176 PolarHBondContact O-N 2.94Å; F173-A177 PolarHBondContact O-N 3.09Å; F173-C225 WeakPolarHBondContact CA-O 3.34Å; F173-G228 VanDerWaalsContact CE2-C 3.43Å; F173-G229 WeakPolarHBondContact O-CA 3.32Å; F173-L232 HydrophobicContact CE1-CD2 3.67Å; F173-L232 HydrophobicContact CZ-CB 4.3Å; F173-L232 HydrophobicContact CZ-CD2 3.67Å
174G92Very high88.5Confident37 Ų3748.7 Ų48.738%0.38125%0.254SS..Hα-helixtrans-67.8-39.4-178.900000112.7F170 H172 A177 M178F170-G174 PolarHBondContact O-N 3.4Å; H172-G174 PolarHBondContact O-N 3.07Å; G174-A177 PolarHBondContact O-N 3.4Å; G174-M178 PolarHBondContact O-N 3.24Å
175G91.9Very high89Confident26 Ų2647.1 Ų47.127%0.26825%0.249SC..Hα-helixtrans-59.7-49.2174.500000111.2G171 H172 A177 M178 K179G171-G175 VanDerWaalsContact O-CA 3.29Å; G171-G175 WeakPolarHBondContact O-CA 3.39Å; G171-G175 PolarHBondContact O-N 3Å; H172-G175 PolarHBondContact O-N 2.62Å; G175-A177 PolarHBondContact O-N 3.36Å; G175-M178 PolarHBondContact O-N 3.31Å; G175-M178 VanDerWaalsContact O-N 3.16Å; G175-K179 WeakPolarHBondContact O-CG 3.35Å; G175-K179 PolarHBondContact O-N 3.43Å
176W95.3Very high89.4Confident12 Ų1245.9 Ų45.95%0.04524%0.242CC..Hα-helixtrans-65.7-35.1178.1-81.4102.6000113.5H172 F173 K179 A180 C189 I192 S193 N226 I230H172-W176 WeakPolarHBondContact O-CB 3.28Å; H172-W176 PolarHBondContact O-N 3Å; F173-W176 PolarHBondContact O-N 2.94Å; W176-K179 HydrophobicContact CD2-CD 4.15Å; W176-K179 HydrophobicContact CE3-CB 4.36Å; W176-K179 HydrophobicContact CE3-CD 4.12Å; W176-K179 HydrophobicContact CH2-CD 4.47Å; W176-K179 HydrophobicContact CZ3-CD 4.29Å; W176-K179 PolarHBondContact O-N 3.3Å; W176-A180 VanDerWaalsContact O-CB 3.24Å; W176-A180 WeakPolarHBondContact O-CB 3.22Å; W176-A180 PolarHBondContact O-N 3.36Å; W176-C189 HydrophobicContact CZ3-CB 4.3Å; W176-C189 WeakPolarHBondContact CZ3-O 3.47Å; W176-I192 HydrophobicContact CH2-CB 3.9Å; W176-I192 HydrophobicContact CH2-CG2 3.65Å; W176-I192 HydrophobicContact CZ3-CB 4.37Å; W176-I192 HydrophobicContact CZ3-CG2 4.39Å; W176-S193 VanDerWaalsContact CZ2-CB 3.49Å; W176-N226 HydrophobicContact CD2-CB 4.02Å; W176-N226 HydrophobicContact CG-CB 3.82Å; W176-N226 PolarHBondContact NE1-ND2 3.08Å; W176-N226 PolarHBondContact NE1-OD1 2.77Å; W176-I230 HydrophobicContact CB-CG1 4.41Å; W176-I230 HydrophobicContact CD2-CD1 4.5Å; W176-I230 HydrophobicContact CD2-CG1 4.4Å; W176-I230 HydrophobicContact CE3-CD1 3.81Å; W176-I230 HydrophobicContact CE3-CG1 3.7Å; W176-I230 HydrophobicContact CZ3-CD1 4.17Å; W176-I230 HydrophobicContact CZ3-CG1 4.42Å
177A95.3Very high90Very high12 Ų1244.2 Ų44.210%0.09924%0.237CC..Hα-helixtrans-59.7-46.5170.100000111.9F173 G174 G175 A180 M181 G229 L232F173-A177 PolarHBondContact O-N 3.09Å; G174-A177 PolarHBondContact O-N 3.4Å; G175-A177 PolarHBondContact O-N 3.36Å; A177-A180 PolarHBondContact O-N 3.39Å; A177-M181 WeakPolarHBondContact O-CG 3.42Å; A177-M181 PolarHBondContact O-N 3.43Å; A177-M181 VanDerWaalsContact O-N 3.13Å; A177-G229 WeakPolarHBondContact CA-O 3.01Å; A177-L232 HydrophobicContact CB-CB 4.47Å; A177-L232 HydrophobicContact CB-CD2 4.12Å; A177-L232 HydrophobicContact CB-CG 4.43Å
178M92.8Very high90.6Very high85 Ų8539.9 Ų39.942%0.41922%0.215SC..Hα-helixtrans-64.2-47.4176.3-173.2178.9-179.900111.7G174 G175 A180 M181 L182 G328G174-M178 PolarHBondContact O-N 3.24Å; G175-M178 PolarHBondContact O-N 3.31Å; G175-M178 VanDerWaalsContact O-N 3.16Å; M178-A180 VanDerWaalsContact C-N 3.3Å; M178-A180 PolarHBondContact O-N 3.32Å; M178-M181 WeakPolarHBondContact O-CB 3.23Å; M178-M181 PolarHBondContact O-N 3.21Å; M178-M181 VanDerWaalsContact O-N 3.08Å; M178-L182 WeakPolarHBondContact O-CG 3.32Å; M178-L182 PolarHBondContact O-N 3.35Å; M178-L182 VanDerWaalsContact O-N 3.13Å; M178-G328 WeakPolarHBondContact CE-O 3.23Å
179K94.7Very high91.3Very high33 Ų3335.3 Ų35.314%0.14320%0.195CC..Hα-helixtrans-57.9-43.1178.6-67.5172.9-179.6-77.70111.5G175 W176 M181 L182 I183 W297 E301G175-K179 WeakPolarHBondContact O-CG 3.35Å; G175-K179 PolarHBondContact O-N 3.43Å; W176-K179 HydrophobicContact CD2-CD 4.15Å; W176-K179 HydrophobicContact CE3-CB 4.36Å; W176-K179 HydrophobicContact CE3-CD 4.12Å; W176-K179 HydrophobicContact CH2-CD 4.47Å; W176-K179 HydrophobicContact CZ3-CD 4.29Å; W176-K179 PolarHBondContact O-N 3.3Å; K179-M181 VanDerWaalsContact C-N 3.33Å; K179-M181 PolarHBondContact O-N 2.95Å; K179-L182 PolarHBondContact O-N 3.08Å; K179-L182 VanDerWaalsContact O-N 3.12Å; K179-I183 PolarHBondContact O-N 2.82Å; K179-W297 HydrophobicContact CB-CH2 4.48Å; K179-W297 HydrophobicContact CB-CZ2 4.01Å; K179-W297 HydrophobicContact CD-CZ2 3.95Å; K179-W297 HydrophobicContact CG-CH2 4.34Å; K179-W297 HydrophobicContact CG-CZ2 3.67Å; K179-E301 IonicContact NZ-OE1 3.77Å; K179-E301 PolarHBondContact NZ-OE1 3.39Å; K179-E301 IonicContact NZ-OE2 3.47Å
180A94.4Very high91.8Very high0 Ų038.8 Ų38.80%021%0.207CC..Hα-helixtrans-63.6-35.8176.200000112.7W176 A177 M178 L182 R184 M234W176-A180 VanDerWaalsContact O-CB 3.24Å; W176-A180 WeakPolarHBondContact O-CB 3.22Å; W176-A180 PolarHBondContact O-N 3.36Å; A177-A180 PolarHBondContact O-N 3.39Å; M178-A180 VanDerWaalsContact C-N 3.3Å; M178-A180 PolarHBondContact O-N 3.32Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.24Å; A180-R184 VanDerWaalsContact O-CA 3.28Å; A180-R184 WeakPolarHBondContact O-CA 3.34Å; A180-R184 PolarHBondContact O-N 2.89Å; A180-M234 HydrophobicContact CB-CG 4.37Å; A180-M234 HydrophobicContact CB-SD 4.49Å
181M91.5Very high92.2Very high58 Ų5832.3 Ų32.329%0.28618%0.179SC..Hα-helixtrans-66.7-29.6173.2-70.7179.463.800113.7A177 M178 K179 R184 V236 L240 W272A177-M181 WeakPolarHBondContact O-CG 3.42Å; A177-M181 PolarHBondContact O-N 3.43Å; A177-M181 VanDerWaalsContact O-N 3.13Å; M178-M181 WeakPolarHBondContact O-CB 3.23Å; M178-M181 PolarHBondContact O-N 3.21Å; M178-M181 VanDerWaalsContact O-N 3.08Å; K179-M181 VanDerWaalsContact C-N 3.33Å; K179-M181 PolarHBondContact O-N 2.95Å; M181-R184 VanDerWaalsContact O-CG 3.23Å; M181-R184 WeakPolarHBondContact O-CG 3.38Å; M181-R184 PolarHBondContact O-NE 3.42Å; M181-V236 HydrophobicContact CE-CG1 3.76Å; M181-V236 HydrophobicContact CG-CG1 4.47Å; M181-V236 HydrophobicContact SD-CB 4.35Å; M181-V236 HydrophobicContact SD-CG1 3.9Å; M181-L240 HydrophobicContact CE-CD1 4.47Å; M181-W272 HydrophobicContact CE-CH2 4.23Å
182L91.8Very high92.6Very high35 Ų3530.9 Ų30.918%0.18316%0.164CC..Hα-helixtrans-80-47.5178-61.4-176.9000111.9M178 K179 A180 T331 A332M178-L182 WeakPolarHBondContact O-CG 3.32Å; M178-L182 PolarHBondContact O-N 3.35Å; M178-L182 VanDerWaalsContact O-N 3.13Å; K179-L182 PolarHBondContact O-N 3.08Å; K179-L182 VanDerWaalsContact O-N 3.12Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.24Å; L182-T331 HydrophobicContact CD1-CG2 3.77Å; L182-A332 HydrophobicContact CD2-CB 3.55Å
183I91.6Very high92.8Very high0 Ų029.2 Ų29.20%016%0.157CC..Hα-helixtrans-80-38.7-176.5-63.3160.2000111.1K179 S185 L188 I192 W277 F293 W297K179-I183 PolarHBondContact O-N 2.82Å; I183-S185 VanDerWaalsContact C-N 3.3Å; I183-S185 PolarHBondContact O-N 3.12Å; I183-L188 HydrophobicContact CG2-CB 3.81Å; I183-L188 HydrophobicContact CG2-CD1 4.1Å; I183-I192 HydrophobicContact CD1-CD1 3.51Å; I183-W277 HydrophobicContact CG2-CZ2 4.46Å; I183-W277 PolarHBondContact O-NE1 2.91Å; I183-F293 HydrophobicContact CG1-CE1 4.45Å; I183-F293 HydrophobicContact CG1-CZ 4.18Å; I183-W297 HydrophobicContact CD1-CH2 3.68Å; I183-W297 HydrophobicContact CD1-CZ2 3.78Å; I183-W297 HydrophobicContact CD1-CZ3 4.16Å; I183-W297 HydrophobicContact CG1-CH2 3.98Å; I183-W297 HydrophobicContact CG1-CZ3 4.19Å
184R91.3Very high92.8Very high33 Ų3329 Ų2913%0.12516%0.158CC..  trans57.935.9179.2-49-177.3-170.4162.80.9114.3A180 M181 W272 T273 V275A180-R184 VanDerWaalsContact O-CA 3.28Å; A180-R184 WeakPolarHBondContact O-CA 3.34Å; A180-R184 PolarHBondContact O-N 2.89Å; M181-R184 VanDerWaalsContact O-CG 3.23Å; M181-R184 WeakPolarHBondContact O-CG 3.38Å; M181-R184 PolarHBondContact O-NE 3.42Å; R184-W272 VanDerWaalsContact NH2-CZ3 3.3Å; R184-T273 PolarHBondContact NH1-O 2.87Å; R184-V275 HydrophobicContact CB-CB 4.12Å; R184-V275 HydrophobicContact CB-CG2 4.35Å; R184-V275 HydrophobicContact CG-CG2 4.49Å
185S89.7Confident92.9Very high17 Ų1727.3 Ų27.312%0.11914%0.14CC..  trans-145121.9174.5170.70000110.9I183 A187 L188 C189I183-S185 VanDerWaalsContact C-N 3.3Å; I183-S185 PolarHBondContact O-N 3.12Å; S185-A187 VanDerWaalsContact C-N 3.34Å; S185-A187 PolarHBondContact O-N 3.26Å; S185-L188 PolarHBondContact OG-N 3.36Å; S185-C189 WeakPolarHBondContact O-CB 3.28Å; S185-C189 PolarHBondContact O-N 3.01Å; S185-C189 PolarHBondContact O-SG 3.45Å
186Y90.8Very high93.1Very high68 Ų6826.7 Ų26.727%0.26713%0.13SC..Hα-helixtrans-56.5-49.3175.3-83.7-76.2000111.4L188 C189 W190 I230 M234Y186-L188 PolarHBondContact O-N 2.95Å; Y186-C189 PolarHBondContact O-N 3.4Å; Y186-W190 WeakPolarHBondContact O-CB 3.38Å; Y186-W190 PolarHBondContact O-N 2.83Å; Y186-I230 HydrophobicContact CD1-CG2 3.63Å; Y186-I230 HydrophobicContact CE1-CG2 3.88Å; Y186-M234 HydrophobicContact CD1-CG 4Å; Y186-M234 HydrophobicContact CD2-CB 4.37Å; Y186-M234 HydrophobicContact CD2-CE 3.79Å; Y186-M234 HydrophobicContact CD2-CG 3.95Å; Y186-M234 HydrophobicContact CE1-CB 3.91Å; Y186-M234 HydrophobicContact CE1-CG 3.71Å; Y186-M234 HydrophobicContact CE2-CB 3.57Å; Y186-M234 HydrophobicContact CE2-CE 3.87Å; Y186-M234 HydrophobicContact CE2-CG 3.65Å; Y186-M234 HydrophobicContact CG-CG 4.12Å; Y186-M234 VanDerWaalsContact OH-CB 3.25Å; Y186-M234 WeakPolarHBondContact OH-CB 3.47Å
187A90Very high92.9Very high30 Ų3026.4 Ų26.425%0.24813%0.129CC..Hα-helixtrans-61.8-45.3-174.500000112.2S185 T191 C398 M402S185-A187 VanDerWaalsContact C-N 3.34Å; S185-A187 PolarHBondContact O-N 3.26Å; A187-T191 WeakPolarHBondContact O-CB 3.42Å; A187-T191 PolarHBondContact O-N 3.44Å; A187-T191 PolarHBondContact O-OG1 2.87Å; A187-C398 PolarHBondContact O-SG 3.43Å; A187-M402 HydrophobicContact CB-CG 3.59Å; A187-M402 HydrophobicContact CB-SD 3.37Å; A187-M402 WeakPolarHBondContact CB-SD 3.49Å
188L90.9Very high92.8Very high2 Ų227.8 Ų27.81%0.0114%0.135CC..Hα-helixtrans-68.7-40.3176.8-62-172000111.9I183 S185 Y186 T191 I192 W277 I290 M294 M402I183-L188 HydrophobicContact CG2-CB 3.81Å; I183-L188 HydrophobicContact CG2-CD1 4.1Å; S185-L188 PolarHBondContact OG-N 3.36Å; Y186-L188 PolarHBondContact O-N 2.95Å; L188-T191 PolarHBondContact O-N 3.03Å; L188-I192 VanDerWaalsContact O-CG1 3.28Å; L188-I192 WeakPolarHBondContact O-CG1 3.42Å; L188-I192 PolarHBondContact O-N 3.3Å; L188-W277 HydrophobicContact CD1-CB 3.71Å; L188-W277 HydrophobicContact CD1-CD2 3.5Å; L188-W277 VanDerWaalsContact CD1-CD2 3.5Å; L188-W277 HydrophobicContact CD1-CE3 4.15Å; L188-W277 HydrophobicContact CD1-CG 3.27Å; L188-W277 HydrophobicContact CG-CG 4.41Å; L188-I290 HydrophobicContact CD2-CG2 3.96Å; L188-M294 HydrophobicContact CB-CE 3.87Å; L188-M294 HydrophobicContact CD1-CE 4.16Å; L188-M294 HydrophobicContact CD2-CE 3.53Å; L188-M294 HydrophobicContact CG-CE 4.03Å; L188-M402 HydrophobicContact CD2-CE 4Å
189C94.6Very high92.8Very high0 Ų023.8 Ų23.80%012%0.115CC..Hα-helixtrans-64.2-46.3178.7-65.80000111.8W176 S185 Y186 T191 I192 S193 I230W176-C189 HydrophobicContact CZ3-CB 4.3Å; W176-C189 WeakPolarHBondContact CZ3-O 3.47Å; S185-C189 WeakPolarHBondContact O-CB 3.28Å; S185-C189 PolarHBondContact O-N 3.01Å; S185-C189 PolarHBondContact O-SG 3.45Å; Y186-C189 PolarHBondContact O-N 3.4Å; C189-T191 VanDerWaalsContact C-N 3.3Å; C189-T191 PolarHBondContact O-N 2.81Å; C189-I192 PolarHBondContact O-N 2.89Å; C189-S193 WeakPolarHBondContact O-CB 3.43Å; C189-S193 PolarHBondContact O-N 3.34Å; C189-I230 HydrophobicContact CB-CD1 3.77Å; C189-I230 HydrophobicContact CB-CG1 3.84Å; C189-I230 HydrophobicContact CB-CG2 4.06Å
190W94.2Very high92.7Very high79 Ų7922.3 Ų22.330%0.29911%0.108SC..Hα-helixtrans-61.6-39.6175.3-82.7108.6000112Y186 S193 I194 I222 G227 I230Y186-W190 WeakPolarHBondContact O-CB 3.38Å; Y186-W190 PolarHBondContact O-N 2.83Å; W190-S193 PolarHBondContact O-N 2.85Å; W190-I194 WeakPolarHBondContact O-CB 3.36Å; W190-I194 VanDerWaalsContact O-CG1 3.3Å; W190-I194 WeakPolarHBondContact O-CG1 3.48Å; W190-I194 PolarHBondContact O-N 2.85Å; W190-I222 HydrophobicContact CE3-CG2 4.48Å; W190-I222 HydrophobicContact CZ3-CG2 3.81Å; W190-I222 WeakPolarHBondContact CZ3-O 3.41Å; W190-G227 VanDerWaalsContact CH2-CA 3.48Å; W190-I230 HydrophobicContact CD2-CD1 4.2Å; W190-I230 HydrophobicContact CG-CD1 4.31Å
191T93.8Very high92.5Very high8 Ų826 Ų265%0.04913%0.128CC..Hα-helixtrans-61.2-48.1175.5-62.50000111.5A187 L188 C189 S193 T195 I394 C398A187-T191 WeakPolarHBondContact O-CB 3.42Å; A187-T191 PolarHBondContact O-N 3.44Å; A187-T191 PolarHBondContact O-OG1 2.87Å; L188-T191 PolarHBondContact O-N 3.03Å; C189-T191 VanDerWaalsContact C-N 3.3Å; C189-T191 PolarHBondContact O-N 2.81Å; T191-S193 VanDerWaalsContact C-N 3.27Å; T191-S193 PolarHBondContact O-N 3.23Å; T191-T195 HydrophobicContact CG2-CG2 4.37Å; T191-T195 WeakPolarHBondContact O-CB 3.24Å; T191-T195 VanDerWaalsContact O-CG2 3.28Å; T191-T195 WeakPolarHBondContact O-CG2 3.29Å; T191-T195 PolarHBondContact O-N 3.42Å; T191-T195 PolarHBondContact O-OG1 3.22Å; T191-I394 HydrophobicContact CG2-CG2 4.21Å; T191-C398 HydrophobicContact CG2-CB 4.45Å; T191-C398 VanDerWaalsContact OG1-CB 3.22Å; T191-C398 WeakPolarHBondContact OG1-CB 3.46Å; T191-C398 PolarHBondContact OG1-SG 3.28Å
192I94.6Very high92.5Very high1 Ų124.9 Ų24.91%0.00512%0.121CC..Hα-helixtrans-61.9-39.9176.7-65.3166.8000110.1W176 I183 L188 C189 T195 W196 F293 M294 W297W176-I192 HydrophobicContact CH2-CB 3.9Å; W176-I192 HydrophobicContact CH2-CG2 3.65Å; W176-I192 HydrophobicContact CZ3-CB 4.37Å; W176-I192 HydrophobicContact CZ3-CG2 4.39Å; I183-I192 HydrophobicContact CD1-CD1 3.51Å; L188-I192 VanDerWaalsContact O-CG1 3.28Å; L188-I192 WeakPolarHBondContact O-CG1 3.42Å; L188-I192 PolarHBondContact O-N 3.3Å; C189-I192 PolarHBondContact O-N 2.89Å; I192-T195 WeakPolarHBondContact CA-OG1 3.32Å; I192-T195 PolarHBondContact O-N 2.81Å; I192-T195 PolarHBondContact O-OG1 3.13Å; I192-W196 VanDerWaalsContact O-CB 3.26Å; I192-W196 WeakPolarHBondContact O-CB 3.4Å; I192-W196 PolarHBondContact O-N 2.82Å; I192-F293 HydrophobicContact CD1-CE1 4.14Å; I192-M294 HydrophobicContact CD1-CE 4.11Å; I192-M294 HydrophobicContact CD1-SD 3.69Å; I192-M294 HydrophobicContact CG1-CE 4.08Å; I192-M294 HydrophobicContact CG1-SD 3.23Å; I192-M294 WeakPolarHBondContact CG1-SD 3.47Å; I192-W297 HydrophobicContact CD1-CD2 4.28Å; I192-W297 HydrophobicContact CD1-CG 4.24Å; I192-W297 HydrophobicContact CG2-CG 4.25Å; I192-W297 VanDerWaalsContact CG2-NE1 3.33Å
193S95.1Very high92.6Very high0 Ų023.8 Ų23.80%012%0.115CC..Hα-helixtrans-64.2-49.8-178.6-179.90000111.5W176 C189 W190 T191 T195 W196 E197 N226W176-S193 VanDerWaalsContact CZ2-CB 3.49Å; C189-S193 WeakPolarHBondContact O-CB 3.43Å; C189-S193 PolarHBondContact O-N 3.34Å; W190-S193 PolarHBondContact O-N 2.85Å; T191-S193 VanDerWaalsContact C-N 3.27Å; T191-S193 PolarHBondContact O-N 3.23Å; S193-T195 PolarHBondContact O-N 3.3Å; S193-W196 WeakPolarHBondContact O-CB 3.26Å; S193-W196 PolarHBondContact O-N 2.97Å; S193-E197 PolarHBondContact O-N 3.38Å; S193-N226 VanDerWaalsContact OG-CB 3.24Å; S193-N226 WeakPolarHBondContact OG-CB 3.45Å; S193-N226 PolarHBondContact OG-ND2 2.96Å
194I93.4Very high92.5Very high74 Ų7428.2 Ų28.238%0.37914%0.137SC..Hα-helixtrans-65.6-41.5178.4-65.7164.1000111W190 W196 L198 I222W190-I194 WeakPolarHBondContact O-CB 3.36Å; W190-I194 VanDerWaalsContact O-CG1 3.3Å; W190-I194 WeakPolarHBondContact O-CG1 3.48Å; W190-I194 PolarHBondContact O-N 2.85Å; I194-W196 VanDerWaalsContact C-N 3.28Å; I194-W196 PolarHBondContact O-N 3.35Å; I194-L198 PolarHBondContact O-N 3.13Å; I194-L198 VanDerWaalsContact O-N 3.15Å; I194-I222 HydrophobicContact CG1-CG2 4.47Å
195T94.3Very high92.3Very high0 Ų029.5 Ų29.50%014%0.144CC..Hα-helixtrans-71.4-23.5178.954.20000112.6T191 I192 S193 T199 Q298 V391 I394T191-T195 HydrophobicContact CG2-CG2 4.37Å; T191-T195 WeakPolarHBondContact O-CB 3.24Å; T191-T195 VanDerWaalsContact O-CG2 3.28Å; T191-T195 WeakPolarHBondContact O-CG2 3.29Å; T191-T195 PolarHBondContact O-N 3.42Å; T191-T195 PolarHBondContact O-OG1 3.22Å; I192-T195 WeakPolarHBondContact CA-OG1 3.32Å; I192-T195 PolarHBondContact O-N 2.81Å; I192-T195 PolarHBondContact O-OG1 3.13Å; S193-T195 PolarHBondContact O-N 3.3Å; T195-T199 WeakPolarHBondContact O-CB 3.44Å; T195-T199 PolarHBondContact O-N 3.42Å; T195-T199 PolarHBondContact O-OG1 3.09Å; T195-Q298 VanDerWaalsContact C-NE2 3.28Å; T195-Q298 PolarHBondContact O-NE2 3.04Å; T195-Q298 VanDerWaalsContact O-NE2 3.13Å; T195-V391 HydrophobicContact CG2-CG2 4.39Å; T195-I394 HydrophobicContact CG2-CB 4.09Å; T195-I394 HydrophobicContact CG2-CD1 4.02Å; T195-I394 HydrophobicContact CG2-CG2 3.93Å
196W94.5Very high92.4Very high14 Ų1429.1 Ų29.15%0.05314%0.141CC..Hα-helixtrans-64.6-55171-178.9-100.6000111.6I192 S193 I194 L198 T199 E200 Q298 E301 F305I192-W196 VanDerWaalsContact O-CB 3.26Å; I192-W196 WeakPolarHBondContact O-CB 3.4Å; I192-W196 PolarHBondContact O-N 2.82Å; S193-W196 WeakPolarHBondContact O-CB 3.26Å; S193-W196 PolarHBondContact O-N 2.97Å; I194-W196 VanDerWaalsContact C-N 3.28Å; I194-W196 PolarHBondContact O-N 3.35Å; W196-L198 PolarHBondContact O-N 3.45Å; W196-T199 HydrophobicContact CZ3-CG2 4.46Å; W196-T199 WeakPolarHBondContact O-CA 3.13Å; W196-T199 WeakPolarHBondContact O-CB 3.26Å; W196-T199 PolarHBondContact O-N 3.18Å; W196-E200 HydrophobicContact CZ2-CG 4.25Å; W196-E200 PolarHBondContact NE1-OE1 2.97Å; W196-E200 PolarHBondContact O-N 3.48Å; W196-Q298 VanDerWaalsContact CA-NE2 3.28Å; W196-E301 HydrophobicContact CE3-CB 3.65Å; W196-E301 HydrophobicContact CE3-CG 4.27Å; W196-E301 HydrophobicContact CH2-CB 3.52Å; W196-E301 HydrophobicContact CZ2-CB 4.39Å; W196-E301 HydrophobicContact CZ3-CB 3.1Å; W196-E301 HydrophobicContact CZ3-CG 4.17Å; W196-F305 AromaticContact CH2-CD2 3.68Å; W196-F305 HydrophobicContact CH2-CD2 3.68Å; W196-F305 AromaticContact CH2-CE2 3.69Å; W196-F305 HydrophobicContact CH2-CE2 3.69Å; W196-F305 AromaticContact CZ2-CD2 3.67Å; W196-F305 HydrophobicContact CZ2-CD2 3.67Å; W196-F305 AromaticContact CZ2-CE2 3.24Å; W196-F305 HydrophobicContact CZ2-CE2 3.24Å; W196-F305 AromaticContact CZ2-CZ 3.97Å; W196-F305 HydrophobicContact CZ2-CZ 3.97Å
197E92.8Very high92.3Very high6 Ų626 Ų263%0.02813%0.129CC..Hα-helixtrans-57.4-38.5175.8-55.1-46136.800112S193 T199 E200 L201 I222 N226S193-E197 PolarHBondContact O-N 3.38Å; E197-T199 VanDerWaalsContact C-N 3.3Å; E197-T199 PolarHBondContact O-N 2.92Å; E197-E200 WeakPolarHBondContact O-CB 3.39Å; E197-E200 PolarHBondContact O-N 2.94Å; E197-L201 WeakPolarHBondContact O-CG 3.37Å; E197-L201 PolarHBondContact O-N 3.43Å; E197-I222 HydrophobicContact CB-CD1 4Å; E197-I222 HydrophobicContact CB-CG1 4.44Å; E197-I222 HydrophobicContact CG-CD1 3.35Å; E197-I222 HydrophobicContact CG-CG1 3.31Å; E197-N226 PolarHBondContact OE1-ND2 3.36Å
198L91.9Very high92.1Very high41 Ų4127.2 Ų27.222%0.21513%0.134CC..Hα-helixtrans-65.1-36.6175.5-174.961000112.1I194 W196 E200 L201 F202 C390 I394I194-L198 PolarHBondContact O-N 3.13Å; I194-L198 VanDerWaalsContact O-N 3.15Å; W196-L198 PolarHBondContact O-N 3.45Å; L198-E200 VanDerWaalsContact C-N 3.31Å; L198-L201 PolarHBondContact O-N 3.26Å; L198-F202 HydrophobicContact CD1-CD2 3.93Å; L198-F202 HydrophobicContact CD1-CE2 3.58Å; L198-F202 HydrophobicContact CD2-CE2 3.96Å; L198-F202 HydrophobicContact CG-CD2 3.76Å; L198-F202 HydrophobicContact CG-CE2 3.57Å; L198-F202 WeakPolarHBondContact O-CD2 3.24Å; L198-F202 PolarHBondContact O-N 3.38Å; L198-C390 HydrophobicContact CD2-CB 3.75Å; L198-I394 HydrophobicContact CD2-CD1 3.64Å
199T93.8Very high91.7Very high0 Ų027.7 Ų27.70%014%0.137CC..Hα-helixtrans-62.4-42.7175.8-600000110.1T195 W196 E197 F202 F203 Q298 L302 W387T195-T199 WeakPolarHBondContact O-CB 3.44Å; T195-T199 PolarHBondContact O-N 3.42Å; T195-T199 PolarHBondContact O-OG1 3.09Å; W196-T199 HydrophobicContact CZ3-CG2 4.46Å; W196-T199 WeakPolarHBondContact O-CA 3.13Å; W196-T199 WeakPolarHBondContact O-CB 3.26Å; W196-T199 PolarHBondContact O-N 3.18Å; E197-T199 VanDerWaalsContact C-N 3.3Å; E197-T199 PolarHBondContact O-N 2.92Å; T199-F202 PolarHBondContact O-N 2.85Å; T199-F203 HydrophobicContact CG2-CD2 3.66Å; T199-F203 HydrophobicContact CG2-CE2 3.95Å; T199-F203 VanDerWaalsContact O-CD2 3.23Å; T199-F203 WeakPolarHBondContact O-CD2 3.44Å; T199-F203 PolarHBondContact O-N 2.94Å; T199-Q298 PolarHBondContact OG1-NE2 2.91Å; T199-L302 HydrophobicContact CG2-CD1 4.12Å; T199-W387 HydrophobicContact CG2-CZ2 4.31Å; T199-W387 PolarHBondContact OG1-NE1 3.01Å
200E91.8Very high91.4Very high2 Ų227.8 Ų27.81%0.00914%0.137CC..Hα-helixtrans-59.9-47.1175.2-67.7-173.2162.600111.6W196 E197 L198 F202 F203 M204 F210W196-E200 HydrophobicContact CZ2-CG 4.25Å; W196-E200 PolarHBondContact NE1-OE1 2.97Å; W196-E200 PolarHBondContact O-N 3.48Å; E197-E200 WeakPolarHBondContact O-CB 3.39Å; E197-E200 PolarHBondContact O-N 2.94Å; L198-E200 VanDerWaalsContact C-N 3.31Å; E200-F202 VanDerWaalsContact C-N 3.35Å; E200-F202 PolarHBondContact O-N 3.37Å; E200-F203 CarbonylContact O-C 3.5Å; E200-F203 PolarHBondContact O-N 3.46Å; E200-F203 VanDerWaalsContact O-N 3.14Å; E200-M204 PolarHBondContact O-N 2.94Å; E200-F210 HydrophobicContact CB-CB 3.83Å; E200-F210 HydrophobicContact CB-CD1 4.26Å; E200-F210 HydrophobicContact CB-CD2 4.34Å; E200-F210 HydrophobicContact CB-CG 3.94Å; E200-F210 HydrophobicContact CG-CB 4.3Å; E200-F210 HydrophobicContact CG-CD1 3.75Å; E200-F210 HydrophobicContact CG-CD2 4.35Å; E200-F210 HydrophobicContact CG-CE1 4.06Å; E200-F210 HydrophobicContact CG-CG 3.91Å; E200-F210 HydrophobicContact CG-CZ 4.48Å
201L90.5Very high91.1Very high78 Ų7825.2 Ų25.241%0.40813%0.133SC..Hα-helixtrans-58.8-41.8174.9-69.1175.4000113.2E197 L198 F203 M204E197-L201 WeakPolarHBondContact O-CG 3.37Å; E197-L201 PolarHBondContact O-N 3.43Å; L198-L201 PolarHBondContact O-N 3.26Å; L201-F203 VanDerWaalsContact C-N 3.33Å; L201-F203 PolarHBondContact O-N 3.07Å; L201-M204 WeakPolarHBondContact O-CG 3.08Å
202F92.1Very high90.7Very high34 Ų3427.5 Ų27.515%0.14914%0.143CC..Hα-helixtrans-68-33.1177.8-85.4-69.5000112.6L198 T199 E200 H205 Q386 W387 C390L198-F202 HydrophobicContact CD1-CD2 3.93Å; L198-F202 HydrophobicContact CD1-CE2 3.58Å; L198-F202 HydrophobicContact CD2-CE2 3.96Å; L198-F202 HydrophobicContact CG-CD2 3.76Å; L198-F202 HydrophobicContact CG-CE2 3.57Å; L198-F202 WeakPolarHBondContact O-CD2 3.24Å; L198-F202 PolarHBondContact O-N 3.38Å; T199-F202 PolarHBondContact O-N 2.85Å; E200-F202 VanDerWaalsContact C-N 3.35Å; E200-F202 PolarHBondContact O-N 3.37Å; F202-H205 PolarHBondContact O-CE1 3.16Å; F202-H205 PolarHBondContact O-ND1 2.83Å; F202-Q386 HydrophobicContact CE1-CB 3.61Å; F202-Q386 HydrophobicContact CZ-CB 4.03Å; F202-W387 HydrophobicContact CB-CB 4.1Å; F202-W387 HydrophobicContact CB-CG 4.42Å; F202-W387 HydrophobicContact CD1-CB 4.13Å; F202-W387 HydrophobicContact CD2-CB 3.78Å; F202-W387 AromaticContact CD2-CD1 3.75Å; F202-W387 HydrophobicContact CD2-CG 4.18Å; F202-W387 HydrophobicContact CE2-CB 4.21Å; F202-W387 HydrophobicContact CG-CB 3.75Å; F202-W387 HydrophobicContact CG-CG 4.37Å; F202-C390 HydrophobicContact CE2-CB 4.07Å; F202-C390 HydrophobicContact CZ-CB 4.36Å
203F92.5Very high90.4Very high12 Ų1227.6 Ų27.65%0.05314%0.144CC..Hα-helixtrans-105.54.3-173.8-67.8-66.5000115T199 E200 L201 H205 L206 L207 F210 L302 V384 W387T199-F203 HydrophobicContact CG2-CD2 3.66Å; T199-F203 HydrophobicContact CG2-CE2 3.95Å; T199-F203 VanDerWaalsContact O-CD2 3.23Å; T199-F203 WeakPolarHBondContact O-CD2 3.44Å; T199-F203 PolarHBondContact O-N 2.94Å; E200-F203 CarbonylContact O-C 3.5Å; E200-F203 PolarHBondContact O-N 3.46Å; E200-F203 VanDerWaalsContact O-N 3.14Å; L201-F203 VanDerWaalsContact C-N 3.33Å; L201-F203 PolarHBondContact O-N 3.07Å; F203-H205 PolarHBondContact O-N 3.3Å; F203-H205 VanDerWaalsContact O-N 3.08Å; F203-L206 HydrophobicContact CD1-CD1 3.9Å; F203-L206 HydrophobicContact CE1-CD1 4.48Å; F203-L206 WeakPolarHBondContact O-CB 3.48Å; F203-L206 PolarHBondContact O-N 3.12Å; F203-L207 PolarHBondContact O-N 3.4Å; F203-F210 HydrophobicContact CB-CD2 3.99Å; F203-F210 HydrophobicContact CB-CE2 4.02Å; F203-L302 HydrophobicContact CD2-CD1 4.17Å; F203-L302 HydrophobicContact CD2-CD2 4.22Å; F203-L302 HydrophobicContact CE2-CD2 4.03Å; F203-L302 HydrophobicContact CZ-CD2 4.44Å; F203-V384 HydrophobicContact CE1-CG2 4.02Å; F203-V384 HydrophobicContact CZ-CG2 4.36Å; F203-W387 AromaticContact CE2-CD2 3.76Å; F203-W387 HydrophobicContact CE2-CD2 3.76Å; F203-W387 AromaticContact CE2-CE2 3.91Å; F203-W387 HydrophobicContact CE2-CE3 4.11Å; F203-W387 AromaticContact CE2-CG 3.99Å; F203-W387 HydrophobicContact CE2-CG 3.99Å; F203-W387 HydrophobicContact CE2-CZ2 4.4Å; F203-W387 HydrophobicContact CZ-CD2 4.1Å; F203-W387 HydrophobicContact CZ-CE3 4.02Å; F203-W387 HydrophobicContact CZ-CG 4.42Å; F203-W387 HydrophobicContact CZ-CZ3 4.5Å
204M90.4Very high90.1Very high93 Ų9333.5 Ų33.546%0.45817%0.166SC..THydrogen-bonded Turntrans-57.2-26.6176.671.1179.3-17800113.7E200 L201 L206 L207 F210E200-M204 PolarHBondContact O-N 2.94Å; L201-M204 WeakPolarHBondContact O-CG 3.08Å; M204-L206 PolarHBondContact O-N 2.76Å; M204-L207 WeakPolarHBondContact CA-O 3.42Å; M204-L207 CarbonylContact O-C 3.37Å; M204-F210 HydrophobicContact CB-CB 4.16Å
205H87.6Confident89.9Confident60 Ų6030.5 Ų30.528%0.27815%0.15SC..THydrogen-bonded Turntrans-67.5-22.8174.670-78.7000113.6F202 F203 Q380F202-H205 PolarHBondContact O-CE1 3.16Å; F202-H205 PolarHBondContact O-ND1 2.83Å; F203-H205 PolarHBondContact O-N 3.3Å; F203-H205 VanDerWaalsContact O-N 3.08Å; H205-Q380 PolarHBondContact NE2-N 3.37Å
206L90.4Very high89.6Confident10 Ų1031.1 Ų31.15%0.05215%0.154CC..THydrogen-bonded Turntrans-95.2-39.4175.3-63.3-176.6000111.7F203 M204 F306 V375 K378 T379F203-L206 HydrophobicContact CD1-CD1 3.9Å; F203-L206 HydrophobicContact CE1-CD1 4.48Å; F203-L206 WeakPolarHBondContact O-CB 3.48Å; F203-L206 PolarHBondContact O-N 3.12Å; M204-L206 PolarHBondContact O-N 2.76Å; L206-F306 HydrophobicContact CB-CE1 4.29Å; L206-F306 HydrophobicContact CB-CZ 4.34Å; L206-F306 HydrophobicContact CD1-CE1 4.43Å; L206-F306 HydrophobicContact CD1-CZ 3.99Å; L206-V375 HydrophobicContact CB-CG1 4.08Å; L206-V375 HydrophobicContact CD2-CG1 4.32Å; L206-V375 WeakPolarHBondContact CD2-O 3.21Å; L206-K378 HydrophobicContact CD2-CB 3.98Å; L206-T379 HydrophobicContact CD1-CG2 4.5Å
207L89Confident89.2Confident2 Ų231.1 Ų31.11%0.0115%0.154CC..  trans-123.1101.9-176.4-69.1174000109.3F203 M204 N209 F210 F305 F306 H309F203-L207 PolarHBondContact O-N 3.4Å; M204-L207 WeakPolarHBondContact CA-O 3.42Å; M204-L207 CarbonylContact O-C 3.37Å; L207-N209 PolarHBondContact O-N 2.99Å; L207-N209 VanDerWaalsContact O-N 3.09Å; L207-F210 HydrophobicContact CB-CD2 3.75Å; L207-F210 HydrophobicContact CB-CE2 3.98Å; L207-F210 HydrophobicContact CB-CG 4.12Å; L207-F210 HydrophobicContact CD1-CD2 4.12Å; L207-F210 HydrophobicContact CD1-CE1 4.38Å; L207-F210 HydrophobicContact CD1-CE2 3.43Å; L207-F210 VanDerWaalsContact CD1-CE2 3.43Å; L207-F210 HydrophobicContact CD1-CZ 3.59Å; L207-F210 HydrophobicContact CG-CE2 4.28Å; L207-F210 WeakPolarHBondContact O-CB 3.2Å; L207-F210 PolarHBondContact O-N 3.46Å; L207-F305 HydrophobicContact CD1-CB 4.11Å; L207-F306 HydrophobicContact CD1-CD1 3.81Å; L207-F306 HydrophobicContact CD1-CD2 4.34Å; L207-F306 HydrophobicContact CD1-CE1 3.66Å; L207-F306 HydrophobicContact CD1-CE2 4.22Å; L207-F306 HydrophobicContact CD1-CG 4.13Å; L207-F306 HydrophobicContact CD1-CZ 3.87Å; L207-F306 HydrophobicContact CD2-CD1 4.11Å; L207-F306 HydrophobicContact CD2-CE1 4.11Å; L207-F306 HydrophobicContact CG-CD1 4.14Å; L207-F306 HydrophobicContact CG-CE1 3.76Å; L207-F306 HydrophobicContact CG-CZ 4.25Å; L207-H309 HydrophobicContact CD2-CB 3.58Å
208P85.4Confident89Confident56 Ų5635.2 Ų35.236%0.36418%0.176SC..G310 helixtrans-57-26.3176.9-25.233.4000113.4T144 Y149 F210 A211T144-P208 HydrophobicContact CG2-CB 4.03Å; T144-P208 HydrophobicContact CG2-CG 3.92Å; Y149-P208 WeakPolarHBondContact CB-O 3.28Å; Y149-P208 HydrophobicContact CD2-CB 4.39Å; P208-F210 PolarHBondContact O-N 3.34Å; P208-F210 VanDerWaalsContact O-N 3.12Å; P208-A211 WeakPolarHBondContact O-CB 3.1Å; P208-A211 PolarHBondContact O-N 2.67Å
209N83.7Confident88.9Confident12 Ų1236.9 Ų36.96%0.06418%0.184CC..G310 helixtrans-58.7-21.7176.1-63.3-6.3000114T144 Y149 L207 A211T144-N209 WeakPolarHBondContact CG2-OD1 3.43Å; Y149-N209 HydrophobicContact CE1-CB 4.15Å; Y149-N209 VanDerWaalsContact CE2-OD1 3.23Å; Y149-N209 WeakPolarHBondContact CE2-OD1 3.5Å; Y149-N209 PolarHBondContact OH-OD1 2.75Å; L207-N209 PolarHBondContact O-N 2.99Å; L207-N209 VanDerWaalsContact O-N 3.09Å; N209-A211 VanDerWaalsContact C-N 3.33Å
210F88.5Confident88.7Confident1 Ų137.3 Ų37.30%0.00419%0.186CC..G310 helixtrans-85.8-5.8177.5-67.8-19.6000113.3E200 F203 M204 L207 P208 E212 L302 F305E200-F210 HydrophobicContact CB-CB 3.83Å; E200-F210 HydrophobicContact CB-CD1 4.26Å; E200-F210 HydrophobicContact CB-CD2 4.34Å; E200-F210 HydrophobicContact CB-CG 3.94Å; E200-F210 HydrophobicContact CG-CB 4.3Å; E200-F210 HydrophobicContact CG-CD1 3.75Å; E200-F210 HydrophobicContact CG-CD2 4.35Å; E200-F210 HydrophobicContact CG-CE1 4.06Å; E200-F210 HydrophobicContact CG-CG 3.91Å; E200-F210 HydrophobicContact CG-CZ 4.48Å; F203-F210 HydrophobicContact CB-CD2 3.99Å; F203-F210 HydrophobicContact CB-CE2 4.02Å; M204-F210 HydrophobicContact CB-CB 4.16Å; L207-F210 HydrophobicContact CB-CD2 3.75Å; L207-F210 HydrophobicContact CB-CE2 3.98Å; L207-F210 HydrophobicContact CB-CG 4.12Å; L207-F210 HydrophobicContact CD1-CD2 4.12Å; L207-F210 HydrophobicContact CD1-CE1 4.38Å; L207-F210 HydrophobicContact CD1-CE2 3.43Å; L207-F210 VanDerWaalsContact CD1-CE2 3.43Å; L207-F210 HydrophobicContact CD1-CZ 3.59Å; L207-F210 HydrophobicContact CG-CE2 4.28Å; L207-F210 WeakPolarHBondContact O-CB 3.2Å; L207-F210 PolarHBondContact O-N 3.46Å; P208-F210 PolarHBondContact O-N 3.34Å; P208-F210 VanDerWaalsContact O-N 3.12Å; F210-E212 PolarHBondContact O-N 3.23Å; F210-L302 HydrophobicContact CE2-CD1 3.78Å; F210-L302 HydrophobicContact CZ-CD1 3.95Å; F210-F305 HydrophobicContact CD1-CD1 4.48Å; F210-F305 HydrophobicContact CE1-CB 3.86Å; F210-F305 AromaticContact CE1-CD1 3.55Å; F210-F305 HydrophobicContact CE1-CD1 3.55Å; F210-F305 HydrophobicContact CE1-CD2 4.08Å; F210-F305 HydrophobicContact CE1-CE1 4.05Å; F210-F305 AromaticContact CE1-CG 3.55Å; F210-F305 HydrophobicContact CE1-CG 3.55Å; F210-F305 HydrophobicContact CZ-CB 3.67Å; F210-F305 HydrophobicContact CZ-CD1 4.26Å; F210-F305 HydrophobicContact CZ-CD2 4.24Å; F210-F305 AromaticContact CZ-CG 3.81Å; F210-F305 HydrophobicContact CZ-CG 3.81Å
211A87.4Confident88.6Confident26 Ų2637.6 Ų37.622%0.21519%0.188CC..  trans-81.993.7174.800000108.9Y149 A150 P208 N209Y149-A211 CarbonylContact C-O 3.49Å; Y149-A211 WeakPolarHBondContact CB-O 3.38Å; A150-A211 HydrophobicContact CB-CB 4.06Å; A150-A211 VanDerWaalsContact CB-O 3.32Å; A150-A211 WeakPolarHBondContact CB-O 3.34Å; A150-A211 PolarHBondContact N-O 3.38Å; P208-A211 WeakPolarHBondContact O-CB 3.1Å; P208-A211 PolarHBondContact O-N 2.67Å; N209-A211 VanDerWaalsContact C-N 3.33Å
212E85.4Confident88.5Confident55 Ų5534.8 Ų34.826%0.25717%0.173SC..  trans-112.6168.1177.7-66178.2176.900111.1F210 D216 Q217F210-E212 PolarHBondContact O-N 3.23Å; E212-D216 HydrophobicContact CB-CB 4.48Å; E212-Q217 HydrophobicContact CB-CG 3.77Å
213C88.7Confident88.5Confident4 Ų438 Ų383%0.02719%0.191CC..  trans-73.7146.3177.7-73.80000111.2C153 W215 D216 Q217C153-C213 WeakPolarHBondContact CA-SG 3.45Å; C153-C213 HydrophobicContact CB-CB 3.58Å; C153-C213 WeakPolarHBondContact CB-SG 3.35Å; C153-C213 WeakPolarHBondContact SG-CA 3.38Å; C153-C213 WeakPolarHBondContact SG-CB 3.41Å; C153-C213 CovalentContact SG-SG 2.05Å; C153-C213 PolarHBondContact SG-SG 2.83Å; C213-W215 HydrophobicContact CB-CG 4.44Å; C213-W215 PolarHBondContact O-N 2.87Å; C213-W215 VanDerWaalsContact O-N 3.1Å; C213-D216 HydrophobicContact CB-CB 4.2Å; C213-D216 WeakPolarHBondContact O-CA 3.49Å; C213-D216 WeakPolarHBondContact O-CB 3.24Å; C213-D216 PolarHBondContact O-N 3.4Å; C213-Q217 PolarHBondContact O-N 3.3Å
214W88.6Confident88.5Confident123 Ų12342.1 Ų42.147%0.46621%0.213SC..Hα-helixtrans-55.5-34.5-178.970-91.3000113.4C153 I156 L218 I219C153-W214 PolarHBondContact O-NE1 3.43Å; I156-W214 HydrophobicContact CD1-CZ2 4.02Å; W214-L218 HydrophobicContact CE3-CD1 4.39Å; W214-L218 VanDerWaalsContact O-CB 3.25Å; W214-L218 WeakPolarHBondContact O-CB 3.37Å; W214-L218 VanDerWaalsContact O-CG 3.31Å; W214-L218 WeakPolarHBondContact O-CG 3.46Å; W214-L218 PolarHBondContact O-N 3.26Å; W214-I219 HydrophobicContact CZ3-CD1 4.16Å
215W89Confident88.6Confident12 Ų1238 Ų385%0.04519%0.194CC..Hα-helixtrans-77.9-26.4179.263.9-96.6000111.9I156 R160 I161 H164 C213 I219 L220I156-W215 HydrophobicContact CD1-CB 4.22Å; I156-W215 HydrophobicContact CD1-CG 3.98Å; I156-W215 HydrophobicContact CG1-CG 4.3Å; R160-W215 HydrophobicContact CG-CZ2 4.29Å; I161-W215 HydrophobicContact CG1-CH2 4.44Å; I161-W215 HydrophobicContact CG1-CZ3 4.3Å; H164-W215 HydrophobicContact CB-CH2 4.19Å; H164-W215 AromaticContact CD2-CH2 3.81Å; H164-W215 AromaticContact CG-CH2 3.78Å; C213-W215 HydrophobicContact CB-CG 4.44Å; C213-W215 PolarHBondContact O-N 2.87Å; C213-W215 VanDerWaalsContact O-N 3.1Å; W215-I219 HydrophobicContact CB-CD1 4.21Å; W215-I219 WeakPolarHBondContact O-CA 3.3Å; W215-I219 WeakPolarHBondContact O-CB 3.43Å; W215-I219 PolarHBondContact O-N 3.43Å; W215-L220 PolarHBondContact O-N 3.26Å
216D87Confident89Confident13 Ų1335.1 Ų35.17%0.0718%0.18CC..Iπ-helixtrans-66.1-61.1173.5-149.610.2000108.1H164 E212 C213 L218 L220 D221H164-D216 IonicContact CE1-OD2 3.14Å; H164-D216 PolarHBondContact CE1-OD2 2.88Å; H164-D216 VanDerWaalsContact CE1-OD2 3.29Å; H164-D216 IonicContact ND1-OD1 2.76Å; H164-D216 IonicContact ND1-OD2 2.73Å; H164-D216 PolarHBondContact ND1-OD2 3.32Å; E212-D216 HydrophobicContact CB-CB 4.48Å; C213-D216 HydrophobicContact CB-CB 4.2Å; C213-D216 WeakPolarHBondContact O-CA 3.49Å; C213-D216 WeakPolarHBondContact O-CB 3.24Å; C213-D216 PolarHBondContact O-N 3.4Å; D216-L218 PolarHBondContact O-N 2.95Å; D216-L220 CarbonylContact O-C 3.48Å; D216-L220 WeakPolarHBondContact O-CA 3.18Å; D216-L220 WeakPolarHBondContact O-CB 3.28Å; D216-L220 PolarHBondContact O-N 3.3Å; D216-L220 WeakPolarHBondContact OD1-CD2 3.47Å; D216-D221 PolarHBondContact O-N 2.92Å
217Q87.2Confident89.3Confident14 Ų1435.1 Ų35.17%0.06518%0.182CC..Iπ-helixtrans-57.1-48.4-179.8-64.4-178.3-31.200113.5E212 C213 I222E212-Q217 HydrophobicContact CB-CG 3.77Å; C213-Q217 PolarHBondContact O-N 3.3Å; Q217-I222 WeakPolarHBondContact O-CG1 3.49Å; Q217-I222 PolarHBondContact O-N 3.4Å
218L88.8Confident89.6Confident91 Ų9136 Ų3648%0.47619%0.192SC..Iπ-helixtrans-82-43.6-174.3-65.6-179.6000112.9W214 D216 I222 L223W214-L218 HydrophobicContact CE3-CD1 4.39Å; W214-L218 VanDerWaalsContact O-CB 3.25Å; W214-L218 WeakPolarHBondContact O-CB 3.37Å; W214-L218 VanDerWaalsContact O-CG 3.31Å; W214-L218 WeakPolarHBondContact O-CG 3.46Å; W214-L218 PolarHBondContact O-N 3.26Å; D216-L218 PolarHBondContact O-N 2.95Å; L218-I222 HydrophobicContact CD2-CD1 4.03Å; L218-L223 VanDerWaalsContact O-CG 3.28Å; L218-L223 WeakPolarHBondContact O-CG 3.32Å; L218-L223 PolarHBondContact O-N 2.95Å
219I89.6Confident90.1Very high77 Ų7733.3 Ų33.340%0.39517%0.174SC..Iπ-helixtrans-95.6-54.2-171.3-50.9177.5000110W214 W215 L223 L224W214-I219 HydrophobicContact CZ3-CD1 4.16Å; W215-I219 HydrophobicContact CB-CD1 4.21Å; W215-I219 WeakPolarHBondContact O-CA 3.3Å; W215-I219 WeakPolarHBondContact O-CB 3.43Å; W215-I219 PolarHBondContact O-N 3.43Å; I219-L223 WeakPolarHBondContact O-CB 3.29Å; I219-L224 HydrophobicContact CG2-CD1 4.3Å; I219-L224 WeakPolarHBondContact O-CG 3.4Å; I219-L224 PolarHBondContact O-N 2.6Å
220L88.3Confident90.8Very high8 Ų832.7 Ų32.74%0.04217%0.171CC..Iπ-helixtrans-71-51.7-176.1-168.662000110.9H164 F165 W215 D216 L224 C225H164-L220 HydrophobicContact CB-CD2 3.91Å; F165-L220 HydrophobicContact CD2-CD1 4.33Å; F165-L220 HydrophobicContact CE1-CD1 3.96Å; F165-L220 HydrophobicContact CE2-CD1 3.68Å; F165-L220 HydrophobicContact CZ-CD1 3.47Å; F165-L220 VanDerWaalsContact CZ-CD1 3.47Å; W215-L220 PolarHBondContact O-N 3.26Å; D216-L220 CarbonylContact O-C 3.48Å; D216-L220 WeakPolarHBondContact O-CA 3.18Å; D216-L220 WeakPolarHBondContact O-CB 3.28Å; D216-L220 PolarHBondContact O-N 3.3Å; D216-L220 WeakPolarHBondContact OD1-CD2 3.47Å; L220-L224 HydrophobicContact CD1-CD1 4.28Å; L220-L224 WeakPolarHBondContact O-CB 3.41Å; L220-C225 VanDerWaalsContact O-CB 3.3Å; L220-C225 WeakPolarHBondContact O-CB 3.37Å; L220-C225 PolarHBondContact O-N 3.02Å; L220-C225 PolarHBondContact O-SG 3.26Å
221D89.8Confident91.1Very high8 Ų840.2 Ų40.24%0.04320%0.2CC..Iπ-helixtrans-76-70.6-177.1-65-51.5000112.1H172 D216 L223 N226H172-D221 IonicContact CE1-OD1 2.56Å; H172-D221 PolarHBondContact CE1-OD1 3.44Å; H172-D221 IonicContact CG-OD1 2.8Å; H172-D221 IonicContact ND1-OD1 3.29Å; H172-D221 PolarHBondContact ND1-OD1 3.32Å; D216-D221 PolarHBondContact O-N 2.92Å; D221-L223 PolarHBondContact O-N 2.95Å; D221-N226 VanDerWaalsContact C-CG 3.5Å; D221-N226 WeakPolarHBondContact O-CA 3.35Å; D221-N226 WeakPolarHBondContact O-CB 3.39Å; D221-N226 PolarHBondContact O-N 3.13Å; D221-N226 PolarHBondContact O-ND2 3.2Å; D221-N226 PolarHBondContact O-OD1 3.43Å
222I90.1Very high91.6Very high19 Ų1942 Ų4210%0.09721%0.205CC..Iπ-helixtrans-57.8-53.7-174.5-74.4167.4000112.2W190 I194 E197 Q217 L218 G227W190-I222 HydrophobicContact CE3-CG2 4.48Å; W190-I222 HydrophobicContact CZ3-CG2 3.81Å; W190-I222 WeakPolarHBondContact CZ3-O 3.41Å; I194-I222 HydrophobicContact CG1-CG2 4.47Å; E197-I222 HydrophobicContact CB-CD1 4Å; E197-I222 HydrophobicContact CB-CG1 4.44Å; E197-I222 HydrophobicContact CG-CD1 3.35Å; E197-I222 HydrophobicContact CG-CG1 3.31Å; Q217-I222 WeakPolarHBondContact O-CG1 3.49Å; Q217-I222 PolarHBondContact O-N 3.4Å; L218-I222 HydrophobicContact CD2-CD1 4.03Å; I222-G227 PolarHBondContact O-N 3.4Å
223L91.6Very high92Very high103 Ų10339.4 Ų39.454%0.53919%0.193SC..Iπ-helixtrans-83-48.8-168-68.8176000112.9L218 I219 D221 G227L218-L223 VanDerWaalsContact O-CG 3.28Å; L218-L223 WeakPolarHBondContact O-CG 3.32Å; L218-L223 PolarHBondContact O-N 2.95Å; I219-L223 WeakPolarHBondContact O-CB 3.29Å; D221-L223 PolarHBondContact O-N 2.95Å; L223-G227 WeakPolarHBondContact O-CA 3.42Å
224L92.2Very high92.2Very high97 Ų9740 Ų4051%0.50820%0.196SC..Iπ-helixtrans-86.8-61.7-172.4-65.4177.7000112.4I219 L220 G228I219-L224 HydrophobicContact CG2-CD1 4.3Å; I219-L224 WeakPolarHBondContact O-CG 3.4Å; I219-L224 PolarHBondContact O-N 2.6Å; L220-L224 HydrophobicContact CD1-CD1 4.28Å; L220-L224 WeakPolarHBondContact O-CB 3.41Å; L224-G228 VanDerWaalsContact O-CA 3.31Å; L224-G228 WeakPolarHBondContact O-CA 3.46Å; L224-G228 PolarHBondContact O-N 2.83Å
225C93.4Very high92.3Very high7 Ų736.7 Ų36.75%0.04719%0.19CC..Iπ-helixtrans-70.9-57.9-174.4-66.90000110.9H172 F173 L220 G229H172-C225 HydrophobicContact CB-CB 3.77Å; F173-C225 WeakPolarHBondContact CA-O 3.34Å; L220-C225 VanDerWaalsContact O-CB 3.3Å; L220-C225 WeakPolarHBondContact O-CB 3.37Å; L220-C225 PolarHBondContact O-N 3.02Å; L220-C225 PolarHBondContact O-SG 3.26Å; C225-G229 PolarHBondContact O-N 2.89Å
226N95.3Very high92.4Very high0 Ų038.5 Ų38.50%020%0.201CC..Iπ-helixtrans-67.4-51.3-177.5-55.5-9.5000110W176 S193 E197 D221 G228 G229 I230W176-N226 HydrophobicContact CD2-CB 4.02Å; W176-N226 HydrophobicContact CG-CB 3.82Å; W176-N226 PolarHBondContact NE1-ND2 3.08Å; W176-N226 PolarHBondContact NE1-OD1 2.77Å; S193-N226 VanDerWaalsContact OG-CB 3.24Å; S193-N226 WeakPolarHBondContact OG-CB 3.45Å; S193-N226 PolarHBondContact OG-ND2 2.96Å; E197-N226 PolarHBondContact OE1-ND2 3.36Å; D221-N226 VanDerWaalsContact C-CG 3.5Å; D221-N226 WeakPolarHBondContact O-CA 3.35Å; D221-N226 WeakPolarHBondContact O-CB 3.39Å; D221-N226 PolarHBondContact O-N 3.13Å; D221-N226 PolarHBondContact O-ND2 3.2Å; D221-N226 PolarHBondContact O-OD1 3.43Å; N226-G228 PolarHBondContact O-N 2.66Å; N226-G229 PolarHBondContact O-N 2.82Å; N226-I230 WeakPolarHBondContact O-CB 3.26Å; N226-I230 WeakPolarHBondContact O-CG1 3.36Å; N226-I230 PolarHBondContact O-N 2.76Å
227G95.4Very high92.5Very high9 Ų937.9 Ų37.99%0.09320%0.198CC..Hα-helixtrans-58.9-45.1177.700000113.5W190 I222 L223 I230 W231W190-G227 VanDerWaalsContact CH2-CA 3.48Å; I222-G227 PolarHBondContact O-N 3.4Å; L223-G227 WeakPolarHBondContact O-CA 3.42Å; G227-I230 PolarHBondContact O-N 3.02Å; G227-W231 WeakPolarHBondContact O-CB 3.49Å; G227-W231 PolarHBondContact O-N 3.44Å
228G96.1Very high92.4Very high20 Ų2043.8 Ų43.821%0.20622%0.22CC..Hα-helixtrans-64-42.9175.400000112.7F173 L224 N226 W231 L232F173-G228 VanDerWaalsContact CE2-C 3.43Å; L224-G228 VanDerWaalsContact O-CA 3.31Å; L224-G228 WeakPolarHBondContact O-CA 3.46Å; L224-G228 PolarHBondContact O-N 2.83Å; N226-G228 PolarHBondContact O-N 2.66Å; G228-W231 PolarHBondContact O-N 3.05Å; G228-L232 PolarHBondContact O-N 3.01Å
229G96.5Very high92.3Very high0 Ų044.7 Ų44.70%022%0.22CC..Hα-helixtrans-60.9-47.6174.700000111.8F173 A177 C225 N226 W231 L232 G233F173-G229 WeakPolarHBondContact O-CA 3.32Å; A177-G229 WeakPolarHBondContact CA-O 3.01Å; C225-G229 PolarHBondContact O-N 2.89Å; N226-G229 PolarHBondContact O-N 2.82Å; G229-W231 VanDerWaalsContact C-N 3.34Å; G229-W231 PolarHBondContact O-N 2.89Å; G229-L232 PolarHBondContact O-N 3.19Å; G229-G233 PolarHBondContact O-N 3.45Å
230I96.9Very high92Very high0 Ų041.9 Ų41.90%021%0.206CC..Hα-helixtrans-57.7-47.3176.1-68.3166000110.5W176 Y186 C189 W190 N226 G227 L232 G233 M234W176-I230 HydrophobicContact CB-CG1 4.41Å; W176-I230 HydrophobicContact CD2-CD1 4.5Å; W176-I230 HydrophobicContact CD2-CG1 4.4Å; W176-I230 HydrophobicContact CE3-CD1 3.81Å; W176-I230 HydrophobicContact CE3-CG1 3.7Å; W176-I230 HydrophobicContact CZ3-CD1 4.17Å; W176-I230 HydrophobicContact CZ3-CG1 4.42Å; Y186-I230 HydrophobicContact CD1-CG2 3.63Å; Y186-I230 HydrophobicContact CE1-CG2 3.88Å; C189-I230 HydrophobicContact CB-CD1 3.77Å; C189-I230 HydrophobicContact CB-CG1 3.84Å; C189-I230 HydrophobicContact CB-CG2 4.06Å; W190-I230 HydrophobicContact CD2-CD1 4.2Å; W190-I230 HydrophobicContact CG-CD1 4.31Å; N226-I230 WeakPolarHBondContact O-CB 3.26Å; N226-I230 WeakPolarHBondContact O-CG1 3.36Å; N226-I230 PolarHBondContact O-N 2.76Å; G227-I230 PolarHBondContact O-N 3.02Å; I230-L232 PolarHBondContact O-N 3.19Å; I230-G233 PolarHBondContact O-N 3Å; I230-M234 HydrophobicContact CG2-CG 4.25Å; I230-M234 WeakPolarHBondContact O-CB 3.36Å; I230-M234 VanDerWaalsContact O-CG 3.23Å; I230-M234 WeakPolarHBondContact O-CG 3.48Å; I230-M234 PolarHBondContact O-N 3.42Å
231W96.4Very high91.6Very high158 Ų15844.4 Ų44.460%0.59822%0.218SC*.Hα-helixtrans-59.3-45.7177.4172.187000112.2G227 G228 G229 T235G227-W231 WeakPolarHBondContact O-CB 3.49Å; G227-W231 PolarHBondContact O-N 3.44Å; G228-W231 PolarHBondContact O-N 3.05Å; G229-W231 VanDerWaalsContact C-N 3.34Å; G229-W231 PolarHBondContact O-N 2.89Å; W231-T235 WeakPolarHBondContact O-CB 3.28Å; W231-T235 PolarHBondContact O-N 3.32Å; W231-T235 PolarHBondContact O-OG1 3.35Å
232L96.6Very high90.3Very high63 Ų6351.4 Ų51.433%0.3325%0.252SS..Hα-helixtrans-61.6-50.8177.8176.863.8000111F173 A177 G228 G229 I230 M234 T235 V236F173-L232 HydrophobicContact CE1-CD2 3.67Å; F173-L232 HydrophobicContact CZ-CB 4.3Å; F173-L232 HydrophobicContact CZ-CD2 3.67Å; A177-L232 HydrophobicContact CB-CB 4.47Å; A177-L232 HydrophobicContact CB-CD2 4.12Å; A177-L232 HydrophobicContact CB-CG 4.43Å; G228-L232 PolarHBondContact O-N 3.01Å; G229-L232 PolarHBondContact O-N 3.19Å; I230-L232 PolarHBondContact O-N 3.19Å; L232-M234 VanDerWaalsContact C-N 3.35Å; L232-M234 PolarHBondContact O-N 3.46Å; L232-T235 WeakPolarHBondContact O-CB 3.43Å; L232-T235 PolarHBondContact O-N 3.46Å; L232-T235 VanDerWaalsContact O-N 3.15Å; L232-V236 HydrophobicContact CD1-CG2 4.49Å; L232-V236 WeakPolarHBondContact O-CG2 3.44Å; L232-V236 PolarHBondContact O-N 3.39Å
233G94.6Very high89.2Confident1 Ų155.8 Ų55.81%0.0127%0.267CS..Hα-helixtrans-60-43.2-179.300000112.5G229 I230 V236 C237G229-G233 PolarHBondContact O-N 3.45Å; I230-G233 PolarHBondContact O-N 3Å; G233-V236 PolarHBondContact O-N 3.48Å; G233-C237 PolarHBondContact O-N 2.79Å; G233-C237 PolarHBondContact O-SG 2.9Å
234M91.9Very high87.6Confident18 Ų1856.9 Ų56.99%0.08928%0.279CS..Hα-helixtrans-68.6-33.3176.2-68.1-57.1-60.900112.9A180 Y186 I230 L232 C237 R238A180-M234 HydrophobicContact CB-CG 4.37Å; A180-M234 HydrophobicContact CB-SD 4.49Å; Y186-M234 HydrophobicContact CD1-CG 4Å; Y186-M234 HydrophobicContact CD2-CB 4.37Å; Y186-M234 HydrophobicContact CD2-CE 3.79Å; Y186-M234 HydrophobicContact CD2-CG 3.95Å; Y186-M234 HydrophobicContact CE1-CB 3.91Å; Y186-M234 HydrophobicContact CE1-CG 3.71Å; Y186-M234 HydrophobicContact CE2-CB 3.57Å; Y186-M234 HydrophobicContact CE2-CE 3.87Å; Y186-M234 HydrophobicContact CE2-CG 3.65Å; Y186-M234 HydrophobicContact CG-CG 4.12Å; Y186-M234 VanDerWaalsContact OH-CB 3.25Å; Y186-M234 WeakPolarHBondContact OH-CB 3.47Å; I230-M234 HydrophobicContact CG2-CG 4.25Å; I230-M234 WeakPolarHBondContact O-CB 3.36Å; I230-M234 VanDerWaalsContact O-CG 3.23Å; I230-M234 WeakPolarHBondContact O-CG 3.48Å; I230-M234 PolarHBondContact O-N 3.42Å; L232-M234 VanDerWaalsContact C-N 3.35Å; L232-M234 PolarHBondContact O-N 3.46Å; M234-C237 WeakPolarHBondContact O-CB 3.47Å; M234-C237 PolarHBondContact O-N 3.22Å; M234-R238 WeakPolarHBondContact O-CG 3.38Å; M234-R238 PolarHBondContact O-N 3.38Å
235T92.4Very high86.1Confident53 Ų5354.8 Ų54.833%0.32526%0.264SS..Hα-helixtrans-64.7-43172.9-60.60000110.9W231 L232 C237 R238 F239W231-T235 WeakPolarHBondContact O-CB 3.28Å; W231-T235 PolarHBondContact O-N 3.32Å; W231-T235 PolarHBondContact O-OG1 3.35Å; L232-T235 WeakPolarHBondContact O-CB 3.43Å; L232-T235 PolarHBondContact O-N 3.46Å; L232-T235 VanDerWaalsContact O-N 3.15Å; T235-C237 VanDerWaalsContact C-N 3.35Å; T235-C237 PolarHBondContact O-N 2.9Å; T235-R238 PolarHBondContact O-N 2.95Å; T235-F239 WeakPolarHBondContact O-CB 3.4Å; T235-F239 PolarHBondContact O-N 2.92Å
236V90.2Very high84.3Confident49 Ų4962.9 Ų62.930%0.29730%0.301SS..Hα-helixtrans-61.5-42.9172.8174.10000110.8M181 L232 G233 R238 F239 L240M181-V236 HydrophobicContact CE-CG1 3.76Å; M181-V236 HydrophobicContact CG-CG1 4.47Å; M181-V236 HydrophobicContact SD-CB 4.35Å; M181-V236 HydrophobicContact SD-CG1 3.9Å; L232-V236 HydrophobicContact CD1-CG2 4.49Å; L232-V236 WeakPolarHBondContact O-CG2 3.44Å; L232-V236 PolarHBondContact O-N 3.39Å; G233-V236 PolarHBondContact O-N 3.48Å; V236-R238 PolarHBondContact O-N 3.41Å; V236-F239 PolarHBondContact O-N 2.6Å; V236-L240 HydrophobicContact CG1-CD1 3.94Å; V236-L240 HydrophobicContact CG1-CG 4.34Å; V236-L240 VanDerWaalsContact O-CG 3.31Å; V236-L240 WeakPolarHBondContact O-CG 3.33Å; V236-L240 PolarHBondContact O-N 2.9Å
237C88.4Confident82.7Confident1 Ų166 Ų661%0.00731%0.313CS..Hα-helixtrans-55.8-52.1174.5-690000111.7G233 M234 T235 F239 L240 E241 W272G233-C237 PolarHBondContact O-N 2.79Å; G233-C237 PolarHBondContact O-SG 2.9Å; M234-C237 WeakPolarHBondContact O-CB 3.47Å; M234-C237 PolarHBondContact O-N 3.22Å; T235-C237 VanDerWaalsContact C-N 3.35Å; T235-C237 PolarHBondContact O-N 2.9Å; C237-F239 VanDerWaalsContact C-N 3.31Å; C237-F239 PolarHBondContact O-N 3.38Å; C237-L240 CarbonylContact O-C 2.94Å; C237-L240 PolarHBondContact O-N 3.28Å; C237-E241 WeakPolarHBondContact O-CG 3.24Å; C237-E241 PolarHBondContact O-N 3.45Å; C237-W272 HydrophobicContact CB-CZ2 4.43Å; C237-W272 PolarHBondContact O-NE1 3.02Å
238R85.8Confident81Confident137 Ų13768 Ų6852%0.51733%0.329SS..Hα-helixtrans-59.2-42.1179-71.3176.2-179.3174.80.3112M234 T235 V236 L240 E241 M242M234-R238 WeakPolarHBondContact O-CG 3.38Å; M234-R238 PolarHBondContact O-N 3.38Å; T235-R238 PolarHBondContact O-N 2.95Å; V236-R238 PolarHBondContact O-N 3.41Å; R238-L240 VanDerWaalsContact C-N 3.29Å; R238-L240 PolarHBondContact O-N 3.47Å; R238-E241 PolarHBondContact O-N 3.14Å; R238-M242 WeakPolarHBondContact O-CE 3.43Å; R238-M242 WeakPolarHBondContact O-CG 3.08Å; R238-M242 PolarHBondContact O-N 3.44Å; R238-M242 VanDerWaalsContact O-N 3.08Å
239F85.9Confident79.4Confident111 Ų11168.2 Ų68.249%0.48733%0.327SS..Hα-helixtrans-60.3-39.3175.6175.7-98.4000112.4T235 V236 C237 R243T235-F239 WeakPolarHBondContact O-CB 3.4Å; T235-F239 PolarHBondContact O-N 2.92Å; V236-F239 PolarHBondContact O-N 2.6Å; C237-F239 VanDerWaalsContact C-N 3.31Å; C237-F239 PolarHBondContact O-N 3.38Å; F239-R243 WeakPolarHBondContact O-CG 3.12Å
240L84Confident78Confident17 Ų1770.5 Ų70.59%0.08934%0.339CS..Hα-helixtrans-76.8-28.4176.9-66.6175.5000113.3M181 V236 C237 R238 Y245 W272M181-L240 HydrophobicContact CE-CD1 4.47Å; V236-L240 HydrophobicContact CG1-CD1 3.94Å; V236-L240 HydrophobicContact CG1-CG 4.34Å; V236-L240 VanDerWaalsContact O-CG 3.31Å; V236-L240 WeakPolarHBondContact O-CG 3.33Å; V236-L240 PolarHBondContact O-N 2.9Å; C237-L240 CarbonylContact O-C 2.94Å; C237-L240 PolarHBondContact O-N 3.28Å; R238-L240 VanDerWaalsContact C-N 3.29Å; R238-L240 PolarHBondContact O-N 3.47Å; L240-Y245 PolarHBondContact O-OH 2.91Å; L240-W272 HydrophobicContact CB-CB 4.28Å; L240-W272 HydrophobicContact CB-CD2 3.91Å; L240-W272 HydrophobicContact CB-CG 3.75Å; L240-W272 HydrophobicContact CD1-CD2 4.04Å; L240-W272 HydrophobicContact CD1-CE3 4.14Å; L240-W272 HydrophobicContact CD1-CH2 3.93Å; L240-W272 HydrophobicContact CD1-CZ2 3.91Å; L240-W272 HydrophobicContact CD1-CZ3 4.06Å
241E80.5Confident76.6Confident62 Ų6278.1 Ų78.129%0.2937%0.372SS..Hα-helixtrans-69.9-42.4175.5-74.5174.5-179.700112C237 R238 R243C237-E241 WeakPolarHBondContact O-CG 3.24Å; C237-E241 PolarHBondContact O-N 3.45Å; R238-E241 PolarHBondContact O-N 3.14Å; E241-R243 PolarHBondContact O-N 3.4Å
242M61.4Low75.4Confident154 Ų15475.7 Ų75.776%0.75937%0.37SS*.SBendtrans-72.4-8.2-179.8-66.1-175.8-65.900113.5R238R238-M242 WeakPolarHBondContact O-CE 3.43Å; R238-M242 WeakPolarHBondContact O-CG 3.08Å; R238-M242 PolarHBondContact O-N 3.44Å; R238-M242 VanDerWaalsContact O-N 3.08Å
243R66.8Low74.5Confident111 Ų11174.3 Ų74.342%0.41936%0.363SS..  trans-81.5121-179.9-81.2-96.9-178.3-174.8-3.9110.6F239 E241 Y245F239-R243 WeakPolarHBondContact O-CG 3.12Å; E241-R243 PolarHBondContact O-N 3.4Å; R243-Y245 HydrophobicContact CB-CE1 4.31Å; R243-Y245 HydrophobicContact CB-CE2 4.27Å; R243-Y245 VanDerWaalsContact O-CD2 3.25Å; R243-Y245 WeakPolarHBondContact O-CD2 3.26Å; R243-Y245 VanDerWaalsContact O-CE2 3.3Å; R243-Y245 WeakPolarHBondContact O-CE2 3.34Å
244T58.1Low73.8Confident127 Ų12782.4 Ų82.478%0.77940%0.4SS*.  trans-77.4123.6163.452.50000109.8Q246T244-Q246 PolarHBondContact O-N 3.44Å
245Y62Low73.5Confident53 Ų5385.3 Ų85.321%0.20842%0.419CS..  trans-93.976.3-175.5-66.5-75.5000110.5L240 R243 W247 P269 W272L240-Y245 PolarHBondContact O-OH 2.91Å; R243-Y245 HydrophobicContact CB-CE1 4.31Å; R243-Y245 HydrophobicContact CB-CE2 4.27Å; R243-Y245 VanDerWaalsContact O-CD2 3.25Å; R243-Y245 WeakPolarHBondContact O-CD2 3.26Å; R243-Y245 VanDerWaalsContact O-CE2 3.3Å; R243-Y245 WeakPolarHBondContact O-CE2 3.34Å; Y245-W247 AromaticContact CD1-CE2 3.95Å; Y245-W247 AromaticContact CD1-CH2 3.91Å; Y245-W247 HydrophobicContact CD1-CH2 3.91Å; Y245-W247 AromaticContact CD1-CZ2 3.23Å; Y245-W247 HydrophobicContact CD1-CZ2 3.23Å; Y245-W247 HydrophobicContact CE1-CZ2 4.04Å; Y245-W247 AromaticContact CG-CZ2 3.96Å; Y245-W247 HydrophobicContact CG-CZ2 3.96Å; Y245-W247 PolarHBondContact O-N 2.98Å; Y245-P269 WeakPolarHBondContact CE1-O 3.3Å; Y245-W272 HydrophobicContact CE2-CB 3.91Å
246Q54.7Low73.1Confident176 Ų17688.3 Ų88.382%0.82244%0.438SS*.  trans-86.7105.4170.9-73-171.4-19.300110.2T244 A248T244-Q246 PolarHBondContact O-N 3.44Å; Q246-A248 PolarHBondContact O-N 3.01Å
247W62.1Low72.7Confident67 Ų6791 Ų9125%0.25445%0.454SS..  trans-9679.3-173.5-60.9117.3000112.2R95 Y245 R262 L265 P269 A270R95-W247 VanDerWaalsContact NH1-CD2 3.33Å; R95-W247 VanDerWaalsContact NH1-CE3 3.29Å; R95-W247 VanDerWaalsContact NH2-NE1 3.14Å; Y245-W247 AromaticContact CD1-CE2 3.95Å; Y245-W247 AromaticContact CD1-CH2 3.91Å; Y245-W247 HydrophobicContact CD1-CH2 3.91Å; Y245-W247 AromaticContact CD1-CZ2 3.23Å; Y245-W247 HydrophobicContact CD1-CZ2 3.23Å; Y245-W247 HydrophobicContact CE1-CZ2 4.04Å; Y245-W247 AromaticContact CG-CZ2 3.96Å; Y245-W247 HydrophobicContact CG-CZ2 3.96Å; Y245-W247 PolarHBondContact O-N 2.98Å; W247-R262 VanDerWaalsContact CZ3-NH1 3.35Å; W247-L265 HydrophobicContact CH2-CB 4.2Å; W247-L265 VanDerWaalsContact CH2-O 3.26Å; W247-L265 WeakPolarHBondContact CH2-O 3.26Å; W247-L265 HydrophobicContact CZ3-CB 3.81Å; W247-L265 WeakPolarHBondContact CZ3-O 3.23Å; W247-P269 WeakPolarHBondContact CZ2-O 3.24Å; W247-A270 PolarHBondContact NE1-O 3.38Å
248A59.3Low72.3Confident50 Ų5091.6 Ų91.641%0.41346%0.461SS..  trans-64.7151169.800000111.7Q246 R262Q246-A248 PolarHBondContact O-N 3.01Å; A248-R262 PolarHBondContact O-NE 3.15Å
249S63.5Low72Confident25 Ų2589.6 Ų89.618%0.17546%0.456CS..  trans-67.4145.9176.1-169.50000110.1K251 D252S249-K251 PolarHBondContact O-N 2.88Å; S249-K251 VanDerWaalsContact O-N 3.1Å; S249-K251 PolarHBondContact OG-N 3.35Å; S249-D252 WeakPolarHBondContact CB-OD2 3.4Å; S249-D252 PolarHBondContact N-OD2 2.85Å; S249-D252 VanDerWaalsContact N-OD2 3.09Å; S249-D252 WeakPolarHBondContact O-CB 3.3Å; S249-D252 PolarHBondContact O-N 2.99Å
250I66.5Low71.9Confident48 Ų4890 Ų9025%0.24646%0.463CS..G310 helixtrans-57.1-27.3172.2-67.3168.6000110.7I34 D252 I253 K259 R262I34-I250 HydrophobicContact CD1-CD1 4.38Å; I250-D252 VanDerWaalsContact C-N 3.28Å; I250-D252 PolarHBondContact O-N 3.5Å; I250-I253 PolarHBondContact O-N 2.91Å; I250-K259 HydrophobicContact CG2-CG 4.37Å; I250-R262 HydrophobicContact CD1-CG 4.44Å; I250-R262 HydrophobicContact CG1-CB 4.46Å; I250-R262 HydrophobicContact CG1-CG 3.64Å
251K66.9Low71.7Confident160 Ų16095.5 Ų95.570%0.69649%0.486SS*.G310 helixtrans-67.5-27.7176.3-63.1-177.1-179.4-177.90113.2S249 I253S249-K251 PolarHBondContact O-N 2.88Å; S249-K251 VanDerWaalsContact O-N 3.1Å; S249-K251 PolarHBondContact OG-N 3.35Å; K251-I253 VanDerWaalsContact C-N 3.27Å
252D71.4Confident71.6Confident106 Ų10693.4 Ų93.457%0.56748%0.475SS*.G310 helixtrans-85.8-4.6-177.9-48.5-30.2000111.6S249 I250S249-D252 WeakPolarHBondContact CB-OD2 3.4Å; S249-D252 PolarHBondContact N-OD2 2.85Å; S249-D252 VanDerWaalsContact N-OD2 3.09Å; S249-D252 WeakPolarHBondContact O-CB 3.3Å; S249-D252 PolarHBondContact O-N 2.99Å; I250-D252 VanDerWaalsContact C-N 3.28Å; I250-D252 PolarHBondContact O-N 3.5Å
253I77.4Confident72.4Confident35 Ų3589.5 Ų89.518%0.17946%0.46CS..  trans-105.3112.3-178.2-56171.6000109.7I250 K251 K259 R262I250-I253 PolarHBondContact O-N 2.91Å; K251-I253 VanDerWaalsContact C-N 3.27Å; I253-K259 HydrophobicContact CB-CG 4.44Å; I253-K259 HydrophobicContact CG2-CG 4.25Å; I253-K259 WeakPolarHBondContact O-CE 3.34Å; I253-R262 HydrophobicContact CD1-CB 3.72Å; I253-R262 HydrophobicContact CD1-CG 3.93Å
254H80.2Confident73.1Confident171 Ų17188.5 Ų88.579%0.79247%0.466SS*.  trans-84.6-25.2-176.2-65-73.9000114.1
255T86.4Confident74Confident79 Ų7984.5 Ų84.549%0.48544%0.44SS..SBendtrans-87.6144.6-17661.20000113.1G258 K259T255-G258 PolarHBondContact O-N 2.87Å; T255-G258 WeakPolarHBondContact OG1-CA 3.49Å; T255-G258 PolarHBondContact OG1-N 3.45Å; T255-K259 WeakPolarHBondContact O-CG 3.44Å; T255-K259 PolarHBondContact O-N 2.9Å
256T83Confident74.6Confident116 Ų11683.9 Ų83.971%0.71244%0.438SS*.Hα-helixtrans-65-40.3176.950.20000112.1G258 K259 L260T256-G258 VanDerWaalsContact C-N 3.34Å; T256-K259 PolarHBondContact O-N 3.39Å; T256-L260 PolarHBondContact O-N 3.4Å
257T81.8Confident75.7Confident104 Ų10482.5 Ų82.564%0.63843%0.43SS*.Hα-helixtrans-63-39.1173.451.80000111.9L260 K261T257-L260 PolarHBondContact O-N 2.9Å; T257-K261 VanDerWaalsContact O-CB 3.3Å; T257-K261 WeakPolarHBondContact O-CB 3.38Å; T257-K261 PolarHBondContact O-N 2.96Å
258G79.9Confident76.4Confident15 Ų1581 Ų8116%0.15543%0.428CS..Hα-helixtrans-66-41.6174.500000112.6T255 T256 K261 R262T255-G258 PolarHBondContact O-N 2.87Å; T255-G258 WeakPolarHBondContact OG1-CA 3.49Å; T255-G258 PolarHBondContact OG1-N 3.45Å; T256-G258 VanDerWaalsContact C-N 3.34Å; G258-K261 PolarHBondContact O-N 3.5Å; G258-R262 WeakPolarHBondContact O-CB 3.35Å; G258-R262 PolarHBondContact O-N 2.92Å
259K81.3Confident77.2Confident94 Ų9480.3 Ų80.341%0.40942%0.42SS..Hα-helixtrans-63.4-45.5174.9-71.9178.2-175.8178.50111.6I250 I253 T255 T256 R262 V263I250-K259 HydrophobicContact CG2-CG 4.37Å; I253-K259 HydrophobicContact CB-CG 4.44Å; I253-K259 HydrophobicContact CG2-CG 4.25Å; I253-K259 WeakPolarHBondContact O-CE 3.34Å; T255-K259 WeakPolarHBondContact O-CG 3.44Å; T255-K259 PolarHBondContact O-N 2.9Å; T256-K259 PolarHBondContact O-N 3.39Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 PolarHBondContact O-N 3.34Å; K259-R262 VanDerWaalsContact O-N 3.16Å; K259-V263 WeakPolarHBondContact O-CG2 3.3Å; K259-V263 PolarHBondContact O-N 3.49Å
260L82.1Confident77.6Confident120 Ų12080.5 Ų80.563%0.62842%0.423SS*.Hα-helixtrans-61.1-47.2176.1-177.763.6000111.3T256 T257 R262 V263 V264T256-L260 PolarHBondContact O-N 3.4Å; T257-L260 PolarHBondContact O-N 2.9Å; L260-R262 PolarHBondContact O-N 3Å; L260-V263 PolarHBondContact O-N 3.23Å; L260-V263 VanDerWaalsContact O-N 3.16Å; L260-V264 WeakPolarHBondContact O-CG2 3.46Å; L260-V264 PolarHBondContact O-N 2.84Å
261K81Confident77.9Confident133 Ų13381.4 Ų81.458%0.57843%0.433SS*.Hα-helixtrans-56.2-40.6174.3-177.6178.2177.5-177.60111.4T257 G258 V264 L265T257-K261 VanDerWaalsContact O-CB 3.3Å; T257-K261 WeakPolarHBondContact O-CB 3.38Å; T257-K261 PolarHBondContact O-N 2.96Å; G258-K261 PolarHBondContact O-N 3.5Å; K261-V264 PolarHBondContact O-N 3.5Å; K261-L265 HydrophobicContact CG-CD1 3.79Å; K261-L265 WeakPolarHBondContact O-CB 3.45Å; K261-L265 WeakPolarHBondContact O-CD1 3.42Å; K261-L265 VanDerWaalsContact O-CG 3.31Å; K261-L265 WeakPolarHBondContact O-CG 3.35Å; K261-L265 PolarHBondContact O-N 3Å
262R78.1Confident78.3Confident17 Ų1775.4 Ų75.46%0.06441%0.406CS..Hα-helixtrans-67.6-37.8178.4-17659.1-173.698.7-3.7113.1W247 A248 I250 I253 G258 K259 L260 Q266W247-R262 VanDerWaalsContact CZ3-NH1 3.35Å; A248-R262 PolarHBondContact O-NE 3.15Å; I250-R262 HydrophobicContact CD1-CG 4.44Å; I250-R262 HydrophobicContact CG1-CB 4.46Å; I250-R262 HydrophobicContact CG1-CG 3.64Å; I253-R262 HydrophobicContact CD1-CB 3.72Å; I253-R262 HydrophobicContact CD1-CG 3.93Å; G258-R262 WeakPolarHBondContact O-CB 3.35Å; G258-R262 PolarHBondContact O-N 2.92Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 PolarHBondContact O-N 3.34Å; K259-R262 VanDerWaalsContact O-N 3.16Å; L260-R262 PolarHBondContact O-N 3Å; R262-Q266 PolarHBondContact O-N 3.2Å; R262-Q266 VanDerWaalsContact O-N 3.1Å
263V79.1Confident78.2Confident73 Ų7373 Ų7344%0.44240%0.396SS..Hα-helixtrans-64.6-46.4174.3171.90000110.3K259 L260 L265 Q266 F267K259-V263 WeakPolarHBondContact O-CG2 3.3Å; K259-V263 PolarHBondContact O-N 3.49Å; L260-V263 PolarHBondContact O-N 3.23Å; L260-V263 VanDerWaalsContact O-N 3.16Å; V263-L265 PolarHBondContact O-N 3.14Å; V263-Q266 WeakPolarHBondContact O-CB 3.18Å; V263-Q266 PolarHBondContact O-N 3.01Å; V263-F267 HydrophobicContact CG1-CE2 4.5Å; V263-F267 WeakPolarHBondContact O-CD2 3.43Å
264V80.4Confident78Confident90 Ų9078.9 Ų78.955%0.54542%0.417SS..Hα-helixtrans-61.2-44.6176.5175.10000111.1L260 K261 Q266 F267L260-V264 WeakPolarHBondContact O-CG2 3.46Å; L260-V264 PolarHBondContact O-N 2.84Å; K261-V264 PolarHBondContact O-N 3.5Å; V264-Q266 PolarHBondContact O-N 3.39Å; V264-Q266 VanDerWaalsContact O-N 3.17Å; V264-F267 PolarHBondContact O-N 2.93Å; V264-F267 VanDerWaalsContact O-N 3.13Å
265L76.7Confident77.7Confident43 Ų4371.3 Ų71.323%0.22538%0.382CS..G310 helixtrans-66.8-11.5175.5-73.6159.2000113.7W247 K261 V263 F267 T268W247-L265 HydrophobicContact CH2-CB 4.2Å; W247-L265 VanDerWaalsContact CH2-O 3.26Å; W247-L265 WeakPolarHBondContact CH2-O 3.26Å; W247-L265 HydrophobicContact CZ3-CB 3.81Å; W247-L265 WeakPolarHBondContact CZ3-O 3.23Å; K261-L265 HydrophobicContact CG-CD1 3.79Å; K261-L265 WeakPolarHBondContact O-CB 3.45Å; K261-L265 WeakPolarHBondContact O-CD1 3.42Å; K261-L265 VanDerWaalsContact O-CG 3.31Å; K261-L265 WeakPolarHBondContact O-CG 3.35Å; K261-L265 PolarHBondContact O-N 3Å; V263-L265 PolarHBondContact O-N 3.14Å; L265-F267 PolarHBondContact O-N 3.27Å; L265-T268 HydrophobicContact CD2-CG2 4.4Å; L265-T268 PolarHBondContact O-N 3.2Å; L265-T268 PolarHBondContact O-OG1 3.4Å
266Q74.1Confident77.3Confident39 Ų3971.2 Ų71.218%0.18237%0.373CS..G310 helixtrans-69.7-26.5172.9-171.261.221.900111.9P96 R262 V263 V264 T268P96-Q266 PolarHBondContact O-NE2 3.37Å; P96-Q266 VanDerWaalsContact O-NE2 3.11Å; R262-Q266 PolarHBondContact O-N 3.2Å; R262-Q266 VanDerWaalsContact O-N 3.1Å; V263-Q266 WeakPolarHBondContact O-CB 3.18Å; V263-Q266 PolarHBondContact O-N 3.01Å; V264-Q266 PolarHBondContact O-N 3.39Å; V264-Q266 VanDerWaalsContact O-N 3.17Å; Q266-T268 VanDerWaalsContact C-N 3.29Å
267F77.9Confident77Confident148 Ų14866.1 Ų66.165%0.64934%0.341SS*.G310 helixtrans-82.4-9.1175.4-64.2-83.6000112.8P96 V263 V264 L265P96-F267 HydrophobicContact CB-CD1 3.95Å; P96-F267 HydrophobicContact CB-CE1 4.19Å; P96-F267 HydrophobicContact CG-CD1 4.19Å; P96-F267 HydrophobicContact CG-CE1 4.47Å; V263-F267 HydrophobicContact CG1-CE2 4.5Å; V263-F267 WeakPolarHBondContact O-CD2 3.43Å; V264-F267 PolarHBondContact O-N 2.93Å; V264-F267 VanDerWaalsContact O-N 3.13Å; L265-F267 PolarHBondContact O-N 3.27Å
268T78.6Confident76.5Confident34 Ų3461.5 Ų61.521%0.20931%0.312CS..SBendtrans-82.4150.1169.463.30000111R95 L265 Q266R95-T268 WeakPolarHBondContact CD-O 3.34Å; L265-T268 HydrophobicContact CD2-CG2 4.4Å; L265-T268 PolarHBondContact O-N 3.2Å; L265-T268 PolarHBondContact O-OG1 3.4Å; Q266-T268 VanDerWaalsContact C-N 3.29Å
269P75.3Confident75.8Confident37 Ų3763.4 Ų63.424%0.2432%0.319CS..  trans-50.3146.9177-26.734.4000113.1Y245 W247 S271 W272Y245-P269 WeakPolarHBondContact CE1-O 3.3Å; W247-P269 WeakPolarHBondContact CZ2-O 3.24Å; P269-S271 VanDerWaalsContact C-N 3.33Å; P269-S271 WeakPolarHBondContact CB-O 3.41Å; P269-W272 HydrophobicContact CB-CE3 3.62Å; P269-W272 HydrophobicContact CB-CZ3 4.13Å; P269-W272 HydrophobicContact CG-CD2 4.42Å; P269-W272 HydrophobicContact CG-CE3 3.27Å; P269-W272 HydrophobicContact CG-CZ3 3.36Å
270A71.4Confident74.8Confident28 Ų2861 Ų6123%0.23131%0.313CS..SBendtrans-67-38.9179.200000112.1R95 W247R95-A270 HydrophobicContact CG-CB 4.06Å; W247-A270 PolarHBondContact NE1-O 3.38Å
271S72.4Confident73.8Confident67 Ų6764.7 Ų64.747%0.46932%0.324SS..  trans-142.5156.3170.560.50000107.8P269P269-S271 VanDerWaalsContact C-N 3.33Å; P269-S271 WeakPolarHBondContact CB-O 3.41Å
272W75.5Confident73Confident34 Ų3459.9 Ų59.913%0.12931%0.307CS..  trans-131.3102.6177.6-164.9-92.8000109.3M181 R184 C237 L240 Y245 P269M181-W272 HydrophobicContact CE-CH2 4.23Å; R184-W272 VanDerWaalsContact NH2-CZ3 3.3Å; C237-W272 HydrophobicContact CB-CZ2 4.43Å; C237-W272 PolarHBondContact O-NE1 3.02Å; L240-W272 HydrophobicContact CB-CB 4.28Å; L240-W272 HydrophobicContact CB-CD2 3.91Å; L240-W272 HydrophobicContact CB-CG 3.75Å; L240-W272 HydrophobicContact CD1-CD2 4.04Å; L240-W272 HydrophobicContact CD1-CE3 4.14Å; L240-W272 HydrophobicContact CD1-CH2 3.93Å; L240-W272 HydrophobicContact CD1-CZ2 3.91Å; L240-W272 HydrophobicContact CD1-CZ3 4.06Å; Y245-W272 HydrophobicContact CE2-CB 3.91Å; P269-W272 HydrophobicContact CB-CE3 3.62Å; P269-W272 HydrophobicContact CB-CZ3 4.13Å; P269-W272 HydrophobicContact CG-CD2 4.42Å; P269-W272 HydrophobicContact CG-CE3 3.27Å; P269-W272 HydrophobicContact CG-CZ3 3.36Å
273T70.8Confident72.8Confident57 Ų5762.3 Ų62.335%0.3533%0.326SS..  trans-89133.4-175.7560000110.9R184R184-T273 PolarHBondContact NH1-O 2.87Å
274Y71.7Confident72.8Confident158 Ų15867.1 Ų67.162%0.6234%0.342SS*.  trans-59.8136.5165.5-178.4-105.3000110R276Y274-R276 HydrophobicContact CE1-CB 4.08Å
275V75.4Confident72.7Confident12 Ų1269.2 Ų69.27%0.07335%0.346CS..  trans-113.9114.9-175.1176.50000108.5R184 W277 Y339R184-V275 HydrophobicContact CB-CB 4.12Å; R184-V275 HydrophobicContact CB-CG2 4.35Å; R184-V275 HydrophobicContact CG-CG2 4.49Å; V275-W277 HydrophobicContact CG1-CD2 4.33Å; V275-W277 HydrophobicContact CG1-CG 4.33Å; V275-W277 HydrophobicContact CG1-CZ2 4.22Å; V275-W277 VanDerWaalsContact CG1-NE1 3.29Å; V275-Y339 HydrophobicContact CB-CE2 4.34Å; V275-Y339 HydrophobicContact CG1-CD2 3.47Å; V275-Y339 VanDerWaalsContact CG1-CD2 3.47Å; V275-Y339 HydrophobicContact CG1-CE1 4.39Å; V275-Y339 HydrophobicContact CG1-CE2 3.25Å; V275-Y339 HydrophobicContact CG1-CG 4.12Å
276R76.3Confident72.9Confident76 Ų7668.6 Ų68.629%0.28734%0.34SS..  trans-107.7102.4176.9-173.4175.1-173.3-175.33.9108.4Y274 L278 D279 R286 Y339 E406Y274-R276 HydrophobicContact CE1-CB 4.08Å; R276-L278 VanDerWaalsContact CG-O 3.22Å; R276-L278 WeakPolarHBondContact CG-O 3.5Å; R276-L278 PolarHBondContact NE-O 2.72Å; R276-D279 IonicContact NH1-OD2 3.15Å; R276-R286 PolarHBondContact O-NH2 3.3Å; R276-Y339 PolarHBondContact N-OH 3.34Å; R276-Y339 VanDerWaalsContact N-OH 3.08Å; R276-Y339 WeakPolarHBondContact O-CE2 3.24Å; R276-Y339 PolarHBondContact O-OH 3.03Å; R276-E406 IonicContact CZ-OE1 3.85Å; R276-E406 IonicContact CZ-OE2 2.97Å; R276-E406 IonicContact NE-OE1 3.6Å; R276-E406 PolarHBondContact NE-OE1 2.99Å; R276-E406 IonicContact NE-OE2 3.78Å; R276-E406 IonicContact NH2-OE1 2.72Å; R276-E406 PolarHBondContact NH2-OE1 2.93Å; R276-E406 IonicContact NH2-OE2 3.77Å; R276-E406 PolarHBondContact NH2-OE2 3.4Å
277W77Confident73.3Confident9 Ų968.4 Ų68.43%0.03434%0.342CS..  trans-72.8-27.5-175.9-75.192.9000114.1I183 L188 V275 R286 F293 V335 Y338 Y339I183-W277 HydrophobicContact CG2-CZ2 4.46Å; I183-W277 PolarHBondContact O-NE1 2.91Å; L188-W277 HydrophobicContact CD1-CB 3.71Å; L188-W277 HydrophobicContact CD1-CD2 3.5Å; L188-W277 VanDerWaalsContact CD1-CD2 3.5Å; L188-W277 HydrophobicContact CD1-CE3 4.15Å; L188-W277 HydrophobicContact CD1-CG 3.27Å; L188-W277 HydrophobicContact CG-CG 4.41Å; V275-W277 HydrophobicContact CG1-CD2 4.33Å; V275-W277 HydrophobicContact CG1-CG 4.33Å; V275-W277 HydrophobicContact CG1-CZ2 4.22Å; V275-W277 VanDerWaalsContact CG1-NE1 3.29Å; W277-R286 PolarHBondContact O-NE 2.72Å; W277-R286 PolarHBondContact O-NH2 2.93Å; W277-F293 HydrophobicContact CH2-CE2 4.34Å; W277-F293 HydrophobicContact CH2-CZ 4.43Å; W277-V335 HydrophobicContact CH2-CG1 4.02Å; W277-V335 HydrophobicContact CZ2-CG1 3.95Å; W277-Y338 HydrophobicContact CZ3-CD1 4.48Å; W277-Y339 AromaticContact CD2-CD2 3.98Å; W277-Y339 HydrophobicContact CD2-CD2 3.98Å; W277-Y339 HydrophobicContact CD2-CE2 4.4Å; W277-Y339 AromaticContact CE3-CD2 3.9Å; W277-Y339 HydrophobicContact CE3-CD2 3.9Å; W277-Y339 HydrophobicContact CH2-CD2 4.11Å; W277-Y339 HydrophobicContact CZ2-CD2 4.17Å; W277-Y339 AromaticContact CZ3-CD2 3.97Å; W277-Y339 HydrophobicContact CZ3-CD2 3.97Å
278L71.3Confident73.7Confident8 Ų863.3 Ų63.34%0.04233%0.327CS..  trans-133.5135.6-179.8-157.182.7000109.5R276 V287 I290 L399 M402 V403R276-L278 VanDerWaalsContact CG-O 3.22Å; R276-L278 WeakPolarHBondContact CG-O 3.5Å; R276-L278 PolarHBondContact NE-O 2.72Å; L278-V287 HydrophobicContact CD1-CG2 4.29Å; L278-I290 HydrophobicContact CD1-CD1 3.74Å; L278-L399 HydrophobicContact CD1-CD2 4.1Å; L278-L399 HydrophobicContact CD2-CD2 4.45Å; L278-M402 HydrophobicContact CB-CE 4.32Å; L278-M402 HydrophobicContact CD2-CB 4.37Å; L278-M402 HydrophobicContact CD2-CE 4.4Å; L278-V403 HydrophobicContact CD2-CB 4.48Å; L278-V403 HydrophobicContact CD2-CG2 3.21Å; L278-V403 HydrophobicContact CG-CG2 4.41Å
279D65.4Low74.3Confident55 Ų5562 Ų6229%0.29432%0.32SS..  trans-113.6143.7169.4-172.8-58.9000108.4R276 K281 S282 R286R276-D279 IonicContact NH1-OD2 3.15Å; D279-K281 PolarHBondContact O-N 3Å; D279-K281 PolarHBondContact OD1-N 3.04Å; D279-S282 WeakPolarHBondContact CA-OG 3.28Å; D279-S282 PolarHBondContact N-OG 3.32Å; D279-S282 WeakPolarHBondContact O-CB 3.22Å; D279-S282 PolarHBondContact O-N 2.97Å; D279-S282 PolarHBondContact O-OG 2.78Å; D279-R286 VanDerWaalsContact CB-NH1 3.29Å
280P60.9Low74.9Confident44 Ų4460.2 Ų60.229%0.28631%0.309SS..THydrogen-bonded Turntrans-56.8-20.8178.6-26.636.4000113.9E406P280-E406 VanDerWaalsContact CD-OE2 3.24Å; P280-E406 WeakPolarHBondContact CD-OE2 3.36Å; P280-E406 HydrophobicContact CG-CB 4.21Å; P280-E406 WeakPolarHBondContact CG-OE2 3.35Å
281K60.5Low75.8Confident197 Ų19762.2 Ų62.286%0.85731%0.311SS*.THydrogen-bonded Turntrans-95.613.8174.3-59-175.9-177.3176.90113.9D279D279-K281 PolarHBondContact O-N 3Å; D279-K281 PolarHBondContact OD1-N 3.04Å
282S64.1Low76.7Confident31 Ų3162.3 Ų62.322%0.21731%0.309CS..  trans-65136.1-175-66.40000112.7D279 R286D279-S282 WeakPolarHBondContact CA-OG 3.28Å; D279-S282 PolarHBondContact N-OG 3.32Å; D279-S282 WeakPolarHBondContact O-CB 3.22Å; D279-S282 PolarHBondContact O-N 2.97Å; D279-S282 PolarHBondContact O-OG 2.78Å; S282-R286 WeakPolarHBondContact OG-CD 3.25Å; S282-R286 PolarHBondContact OG-NH1 3.03Å
283S74.2Confident77.6Confident68 Ų6861.4 Ų61.448%0.47631%0.305SS..  trans-67154.7174.163.80000111.7Q285 R286 V287S283-Q285 PolarHBondContact O-N 2.7Å; S283-Q285 VanDerWaalsContact O-N 3.13Å; S283-R286 WeakPolarHBondContact O-CB 3.47Å; S283-R286 PolarHBondContact O-N 3.41Å; S283-V287 PolarHBondContact O-N 2.83Å
284F78.8Confident78.6Confident174 Ų17458.7 Ų58.776%0.76329%0.289SS*.Hα-helixtrans-52.5-33.3172178.3-100.6000112.4R286 V287 A288F284-R286 VanDerWaalsContact C-N 3.28Å; F284-R286 PolarHBondContact O-N 3.13Å; F284-V287 PolarHBondContact O-N 3.42Å; F284-A288 PolarHBondContact O-N 3.25Å
285Q79.1Confident79.6Confident135 Ų13552.9 Ų52.963%0.63127%0.268SS*.Hα-helixtrans-58.1-37.4175.6-176.3178.4-7.800112.8S283 G289S283-Q285 PolarHBondContact O-N 2.7Å; S283-Q285 VanDerWaalsContact O-N 3.13Å; Q285-G289 PolarHBondContact O-N 3.43Å
286R81.1Confident80.5Confident29 Ų2954.6 Ų54.611%0.10928%0.276CS..Hα-helixtrans-71.7-37.3178-174.4168.3171.7-172.613.1112R276 W277 D279 S282 S283 F284 G289 I290R276-R286 PolarHBondContact O-NH2 3.3Å; W277-R286 PolarHBondContact O-NE 2.72Å; W277-R286 PolarHBondContact O-NH2 2.93Å; D279-R286 VanDerWaalsContact CB-NH1 3.29Å; S282-R286 WeakPolarHBondContact OG-CD 3.25Å; S282-R286 PolarHBondContact OG-NH1 3.03Å; S283-R286 WeakPolarHBondContact O-CB 3.47Å; S283-R286 PolarHBondContact O-N 3.41Å; F284-R286 VanDerWaalsContact C-N 3.28Å; F284-R286 PolarHBondContact O-N 3.13Å; R286-G289 PolarHBondContact O-N 2.56Å; R286-I290 WeakPolarHBondContact O-CG1 3.5Å; R286-I290 PolarHBondContact O-N 3.4Å
287V82.3Confident81.4Confident36 Ų3651.9 Ų51.922%0.21827%0.266CS..Hα-helixtrans-64.2-46.8173.9174.70000110.7L278 S283 F284 G289 I290 Y291 L396 L399L278-V287 HydrophobicContact CD1-CG2 4.29Å; S283-V287 PolarHBondContact O-N 2.83Å; F284-V287 PolarHBondContact O-N 3.42Å; V287-G289 VanDerWaalsContact C-N 3.28Å; V287-G289 PolarHBondContact O-N 2.82Å; V287-I290 PolarHBondContact O-N 2.8Å; V287-Y291 PolarHBondContact O-N 3.07Å; V287-L396 HydrophobicContact CG1-CD2 4.09Å; V287-L399 HydrophobicContact CB-CD1 4.3Å; V287-L399 HydrophobicContact CG1-CD1 3.51Å; V287-L399 HydrophobicContact CG2-CD1 4.44Å
288A86.6Confident82.2Confident40 Ų4051.5 Ų51.533%0.33127%0.265SS..Hα-helixtrans-60.2-39.517400000111.8F284 Y291 V292F284-A288 PolarHBondContact O-N 3.25Å; A288-Y291 PolarHBondContact O-N 3.2Å; A288-V292 WeakPolarHBondContact O-CG2 3.49Å; A288-V292 PolarHBondContact O-N 3.33Å
289G89.4Confident83.4Confident7 Ų752.9 Ų52.97%0.07227%0.272CS..Hα-helixtrans-59.4-47.5173.200000113Q285 R286 V287 Y291 V292 F293 Y338Q285-G289 PolarHBondContact O-N 3.43Å; R286-G289 PolarHBondContact O-N 2.56Å; V287-G289 VanDerWaalsContact C-N 3.28Å; V287-G289 PolarHBondContact O-N 2.82Å; G289-Y291 VanDerWaalsContact C-N 3.28Å; G289-Y291 PolarHBondContact O-N 3.29Å; G289-V292 PolarHBondContact O-N 2.92Å; G289-F293 PolarHBondContact O-N 3.47Å; G289-Y338 PolarHBondContact O-OH 3.49Å
290I89.8Confident84.8Confident0 Ų050.8 Ų50.80%026%0.261CS..Hα-helixtrans-62.1-38.9176.6-65.1165.1000110.8L188 L278 R286 V287 F293 M294 T395 L399L188-I290 HydrophobicContact CD2-CG2 3.96Å; L278-I290 HydrophobicContact CD1-CD1 3.74Å; R286-I290 WeakPolarHBondContact O-CG1 3.5Å; R286-I290 PolarHBondContact O-N 3.4Å; V287-I290 PolarHBondContact O-N 2.8Å; I290-F293 WeakPolarHBondContact O-CB 3.31Å; I290-F293 PolarHBondContact O-N 2.89Å; I290-M294 HydrophobicContact CG2-CE 4.01Å; I290-M294 WeakPolarHBondContact O-CG 3.45Å; I290-M294 PolarHBondContact O-N 3.07Å; I290-T395 HydrophobicContact CG2-CG2 4.39Å; I290-L399 HydrophobicContact CD1-CD2 3.8Å; I290-L399 HydrophobicContact CG2-CD2 3.99Å
291Y89.6Confident86.4Confident70 Ų7051 Ų5128%0.27526%0.259SS..Hα-helixtrans-63-44.8175178.6-116.8000112.5V287 A288 G289 F293 M294 I295 L388 V391 A392V287-Y291 PolarHBondContact O-N 3.07Å; A288-Y291 PolarHBondContact O-N 3.2Å; G289-Y291 VanDerWaalsContact C-N 3.28Å; G289-Y291 PolarHBondContact O-N 3.29Å; Y291-F293 VanDerWaalsContact C-N 3.29Å; Y291-F293 PolarHBondContact O-N 2.94Å; Y291-M294 WeakPolarHBondContact O-CB 3.42Å; Y291-M294 PolarHBondContact O-N 3.34Å; Y291-M294 VanDerWaalsContact O-N 3.16Å; Y291-I295 HydrophobicContact CD2-CG1 4.37Å; Y291-I295 HydrophobicContact CE1-CG1 4.17Å; Y291-I295 HydrophobicContact CE2-CD1 3.93Å; Y291-I295 HydrophobicContact CE2-CG1 3.82Å; Y291-I295 PolarHBondContact O-N 3.48Å; Y291-L388 PolarHBondContact OH-O 3.36Å; Y291-V391 HydrophobicContact CE2-CG1 4.22Å; Y291-A392 HydrophobicContact CD2-CB 4.25Å; Y291-A392 HydrophobicContact CE2-CB 3.51Å
292V92.1Very high87.9Confident69 Ų6942.2 Ų42.242%0.41822%0.221SC..Hα-helixtrans-59.9-40.8174.1169.70000111.2A288 G289 M294 I295 L296A288-V292 WeakPolarHBondContact O-CG2 3.49Å; A288-V292 PolarHBondContact O-N 3.33Å; G289-V292 PolarHBondContact O-N 2.92Å; V292-M294 VanDerWaalsContact C-N 3.35Å; V292-M294 PolarHBondContact O-N 2.86Å; V292-I295 PolarHBondContact O-N 2.93Å; V292-L296 HydrophobicContact CG1-CD1 3.78Å; V292-L296 HydrophobicContact CG1-CG 4.2Å; V292-L296 WeakPolarHBondContact O-CB 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.39Å; V292-L296 PolarHBondContact O-N 3Å
293F93.5Very high89.4Confident14 Ų1440.9 Ų40.96%0.06121%0.211CC..Hα-helixtrans-57.1-46.7173.9178.6-96.5000112I183 I192 W277 G289 I290 Y291 L296 W297 V335 Y338I183-F293 HydrophobicContact CG1-CE1 4.45Å; I183-F293 HydrophobicContact CG1-CZ 4.18Å; I192-F293 HydrophobicContact CD1-CE1 4.14Å; W277-F293 HydrophobicContact CH2-CE2 4.34Å; W277-F293 HydrophobicContact CH2-CZ 4.43Å; G289-F293 PolarHBondContact O-N 3.47Å; I290-F293 WeakPolarHBondContact O-CB 3.31Å; I290-F293 PolarHBondContact O-N 2.89Å; Y291-F293 VanDerWaalsContact C-N 3.29Å; Y291-F293 PolarHBondContact O-N 2.94Å; F293-L296 PolarHBondContact O-N 3.46Å; F293-W297 HydrophobicContact CE1-CE3 4.16Å; F293-W297 HydrophobicContact CE2-CE3 4.14Å; F293-W297 HydrophobicContact CE2-CZ3 4.43Å; F293-W297 AromaticContact CZ-CE3 3.6Å; F293-W297 HydrophobicContact CZ-CE3 3.6Å; F293-W297 AromaticContact CZ-CZ3 3.82Å; F293-W297 HydrophobicContact CZ-CZ3 3.82Å; F293-W297 VanDerWaalsContact O-CB 3.3Å; F293-W297 WeakPolarHBondContact O-CB 3.38Å; F293-W297 PolarHBondContact O-N 2.66Å; F293-V335 HydrophobicContact CE2-CG2 4.13Å; F293-V335 HydrophobicContact CZ-CG2 4.4Å; F293-Y338 HydrophobicContact CB-CD1 4.37Å; F293-Y338 HydrophobicContact CB-CE1 3.65Å; F293-Y338 AromaticContact CD2-CD1 3.69Å; F293-Y338 HydrophobicContact CD2-CD1 3.69Å; F293-Y338 AromaticContact CD2-CE1 3.86Å; F293-Y338 HydrophobicContact CD2-CE1 3.86Å; F293-Y338 HydrophobicContact CE2-CD1 4.48Å; F293-Y338 HydrophobicContact CG-CD1 4.4Å; F293-Y338 HydrophobicContact CG-CE1 4.16Å
294M92.5Very high90.3Very high1 Ų138.8 Ų38.81%0.00520%0.196CC..Hα-helixtrans-60.4-48177.4-64.9-52.5156.100111.7L188 I192 I290 Y291 V292 L296 W297 Q298 V391 T395L188-M294 HydrophobicContact CB-CE 3.87Å; L188-M294 HydrophobicContact CD1-CE 4.16Å; L188-M294 HydrophobicContact CD2-CE 3.53Å; L188-M294 HydrophobicContact CG-CE 4.03Å; I192-M294 HydrophobicContact CD1-CE 4.11Å; I192-M294 HydrophobicContact CD1-SD 3.69Å; I192-M294 HydrophobicContact CG1-CE 4.08Å; I192-M294 HydrophobicContact CG1-SD 3.23Å; I192-M294 WeakPolarHBondContact CG1-SD 3.47Å; I290-M294 HydrophobicContact CG2-CE 4.01Å; I290-M294 WeakPolarHBondContact O-CG 3.45Å; I290-M294 PolarHBondContact O-N 3.07Å; Y291-M294 WeakPolarHBondContact O-CB 3.42Å; Y291-M294 PolarHBondContact O-N 3.34Å; Y291-M294 VanDerWaalsContact O-N 3.16Å; V292-M294 VanDerWaalsContact C-N 3.35Å; V292-M294 PolarHBondContact O-N 2.86Å; M294-L296 PolarHBondContact O-N 3.25Å; M294-W297 WeakPolarHBondContact O-CB 3.38Å; M294-W297 PolarHBondContact O-N 2.97Å; M294-Q298 WeakPolarHBondContact O-CG 3.41Å; M294-Q298 PolarHBondContact O-N 2.91Å; M294-V391 HydrophobicContact CB-CG1 4.44Å; M294-T395 HydrophobicContact CG-CG2 4.03Å
295I92.4Very high91Very high35 Ų3532.7 Ų32.718%0.17917%0.169CC..Hα-helixtrans-63.1-44.8-180-64.9-61.6000111.8Y291 V292 W297 Q298 L299 L388 V391Y291-I295 HydrophobicContact CD2-CG1 4.37Å; Y291-I295 HydrophobicContact CE1-CG1 4.17Å; Y291-I295 HydrophobicContact CE2-CD1 3.93Å; Y291-I295 HydrophobicContact CE2-CG1 3.82Å; Y291-I295 PolarHBondContact O-N 3.48Å; V292-I295 PolarHBondContact O-N 2.93Å; I295-W297 VanDerWaalsContact C-N 3.29Å; I295-W297 PolarHBondContact O-N 2.74Å; I295-Q298 PolarHBondContact O-N 3.1Å; I295-L299 WeakPolarHBondContact O-CB 3.46Å; I295-L299 PolarHBondContact O-N 3.44Å; I295-L388 HydrophobicContact CD1-CD2 3.79Å; I295-V391 HydrophobicContact CD1-CB 4.17Å; I295-V391 HydrophobicContact CD1-CG1 3.73Å
296L94.3Very high91.7Very high48 Ų4826.5 Ų26.525%0.25114%0.14SC..Hα-helixtrans-64.5-36.4177.6-72.3176000111.8V292 F293 M294 L299 T300 F362V292-L296 HydrophobicContact CG1-CD1 3.78Å; V292-L296 HydrophobicContact CG1-CG 4.2Å; V292-L296 WeakPolarHBondContact O-CB 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.39Å; V292-L296 PolarHBondContact O-N 3Å; F293-L296 PolarHBondContact O-N 3.46Å; M294-L296 PolarHBondContact O-N 3.25Å; L296-L299 HydrophobicContact CD2-CD2 4.37Å; L296-L299 PolarHBondContact O-N 3.21Å; L296-T300 VanDerWaalsContact O-CG2 3.31Å; L296-T300 WeakPolarHBondContact O-CG2 3.3Å; L296-T300 PolarHBondContact O-N 2.81Å; L296-T300 PolarHBondContact O-OG1 3.03Å; L296-F362 HydrophobicContact CD2-CE2 4.01Å; L296-F362 HydrophobicContact CD2-CZ 3.87Å
297W94.6Very high92.3Very high20 Ų2025.5 Ų25.58%0.07614%0.137CC..Hα-helixtrans-62.4-51174.8-167.4-80.9000111.2K179 I183 I192 F293 M294 I295 L299 T300 E301 T331 V335K179-W297 HydrophobicContact CB-CH2 4.48Å; K179-W297 HydrophobicContact CB-CZ2 4.01Å; K179-W297 HydrophobicContact CD-CZ2 3.95Å; K179-W297 HydrophobicContact CG-CH2 4.34Å; K179-W297 HydrophobicContact CG-CZ2 3.67Å; I183-W297 HydrophobicContact CD1-CH2 3.68Å; I183-W297 HydrophobicContact CD1-CZ2 3.78Å; I183-W297 HydrophobicContact CD1-CZ3 4.16Å; I183-W297 HydrophobicContact CG1-CH2 3.98Å; I183-W297 HydrophobicContact CG1-CZ3 4.19Å; I192-W297 HydrophobicContact CD1-CD2 4.28Å; I192-W297 HydrophobicContact CD1-CG 4.24Å; I192-W297 HydrophobicContact CG2-CG 4.25Å; I192-W297 VanDerWaalsContact CG2-NE1 3.33Å; F293-W297 HydrophobicContact CE1-CE3 4.16Å; F293-W297 HydrophobicContact CE2-CE3 4.14Å; F293-W297 HydrophobicContact CE2-CZ3 4.43Å; F293-W297 AromaticContact CZ-CE3 3.6Å; F293-W297 HydrophobicContact CZ-CE3 3.6Å; F293-W297 AromaticContact CZ-CZ3 3.82Å; F293-W297 HydrophobicContact CZ-CZ3 3.82Å; F293-W297 VanDerWaalsContact O-CB 3.3Å; F293-W297 WeakPolarHBondContact O-CB 3.38Å; F293-W297 PolarHBondContact O-N 2.66Å; M294-W297 WeakPolarHBondContact O-CB 3.38Å; M294-W297 PolarHBondContact O-N 2.97Å; I295-W297 VanDerWaalsContact C-N 3.29Å; I295-W297 PolarHBondContact O-N 2.74Å; W297-L299 VanDerWaalsContact C-N 3.29Å; W297-L299 PolarHBondContact O-N 3.5Å; W297-T300 PolarHBondContact O-N 3.01Å; W297-T300 VanDerWaalsContact O-N 3.15Å; W297-T300 PolarHBondContact O-OG1 3.02Å; W297-E301 PolarHBondContact O-N 3.32Å; W297-E301 VanDerWaalsContact O-N 3.17Å; W297-T331 HydrophobicContact CH2-CG2 4.18Å; W297-T331 HydrophobicContact CZ3-CG2 3.84Å; W297-V335 HydrophobicContact CZ3-CG2 4.07Å
298Q94.6Very high92.7Very high1 Ų124.7 Ų24.71%0.00513%0.13CC..Hα-helixtrans-59.4-40.8176.5-63.1-55.48700111.8T195 W196 T199 M294 I295 T300 E301 L302 W387T195-Q298 VanDerWaalsContact C-NE2 3.28Å; T195-Q298 PolarHBondContact O-NE2 3.04Å; T195-Q298 VanDerWaalsContact O-NE2 3.13Å; W196-Q298 VanDerWaalsContact CA-NE2 3.28Å; T199-Q298 PolarHBondContact OG1-NE2 2.91Å; M294-Q298 WeakPolarHBondContact O-CG 3.41Å; M294-Q298 PolarHBondContact O-N 2.91Å; I295-Q298 PolarHBondContact O-N 3.1Å; Q298-T300 VanDerWaalsContact C-N 3.34Å; Q298-T300 PolarHBondContact O-N 3.18Å; Q298-E301 PolarHBondContact O-N 3.19Å; Q298-L302 WeakPolarHBondContact O-CB 3.33Å; Q298-L302 PolarHBondContact O-N 3.41Å; Q298-W387 HydrophobicContact CB-CZ2 3.91Å; Q298-W387 HydrophobicContact CG-CZ2 4.46Å
299L95.3Very high92.8Very high37 Ų3723.4 Ų23.419%0.19412%0.117CC..Hα-helixtrans-58.3-45.1176.7179.864.8000111.7I295 L296 W297 L302 N303 F362 A365I295-L299 WeakPolarHBondContact O-CB 3.46Å; I295-L299 PolarHBondContact O-N 3.44Å; L296-L299 HydrophobicContact CD2-CD2 4.37Å; L296-L299 PolarHBondContact O-N 3.21Å; W297-L299 VanDerWaalsContact C-N 3.29Å; W297-L299 PolarHBondContact O-N 3.5Å; L299-L302 PolarHBondContact O-N 2.87Å; L299-N303 WeakPolarHBondContact O-CB 3.45Å; L299-N303 PolarHBondContact O-N 3.26Å; L299-N303 PolarHBondContact O-OD1 2.78Å; L299-F362 HydrophobicContact CD2-CD1 4.33Å; L299-F362 HydrophobicContact CD2-CE1 4.21Å; L299-A365 HydrophobicContact CD1-CB 4Å
300T95.3Very high92.9Very high11 Ų1123.4 Ų23.47%0.06712%0.116CC..Hα-helixtrans-66.9-37.4-178.555.70000113.1L296 W297 Q298 T304 F357 A361L296-T300 VanDerWaalsContact O-CG2 3.31Å; L296-T300 WeakPolarHBondContact O-CG2 3.3Å; L296-T300 PolarHBondContact O-N 2.81Å; L296-T300 PolarHBondContact O-OG1 3.03Å; W297-T300 PolarHBondContact O-N 3.01Å; W297-T300 VanDerWaalsContact O-N 3.15Å; W297-T300 PolarHBondContact O-OG1 3.02Å; Q298-T300 VanDerWaalsContact C-N 3.34Å; Q298-T300 PolarHBondContact O-N 3.18Å; T300-T304 PolarHBondContact O-N 3.48Å; T300-T304 PolarHBondContact O-OG1 3.18Å; T300-T304 VanDerWaalsContact O-OG1 3.13Å; T300-F357 HydrophobicContact CG2-CE1 3.67Å; T300-F357 HydrophobicContact CG2-CZ 3.68Å; T300-A361 HydrophobicContact CG2-CB 3.6Å
301E93.5Very high93Very high48 Ų4824.4 Ų24.422%0.22412%0.12CC..Hα-helixtrans-68.3-48174.3-66.6-61.5144.200110.3K179 W196 W297 Q298 N303 T304 F305K179-E301 IonicContact NZ-OE1 3.77Å; K179-E301 PolarHBondContact NZ-OE1 3.39Å; K179-E301 IonicContact NZ-OE2 3.47Å; W196-E301 HydrophobicContact CE3-CB 3.65Å; W196-E301 HydrophobicContact CE3-CG 4.27Å; W196-E301 HydrophobicContact CH2-CB 3.52Å; W196-E301 HydrophobicContact CZ2-CB 4.39Å; W196-E301 HydrophobicContact CZ3-CB 3.1Å; W196-E301 HydrophobicContact CZ3-CG 4.17Å; W297-E301 PolarHBondContact O-N 3.32Å; W297-E301 VanDerWaalsContact O-N 3.17Å; Q298-E301 PolarHBondContact O-N 3.19Å; E301-N303 VanDerWaalsContact C-N 3.3Å; E301-N303 PolarHBondContact O-N 2.98Å; E301-T304 WeakPolarHBondContact O-CA 3.47Å; E301-T304 WeakPolarHBondContact O-CB 3.42Å; E301-T304 PolarHBondContact O-N 2.9Å; E301-T304 PolarHBondContact O-OG1 3.27Å; E301-F305 WeakPolarHBondContact O-CD2 3.34Å; E301-F305 PolarHBondContact O-N 2.88Å
302L93.9Very high92.9Very high12 Ų1222.9 Ų22.96%0.06312%0.118CC..Hα-helixtrans-59.9-39.9179.2-166.666.6000112T199 F203 F210 Q298 L299 T304 F305 F306T199-L302 HydrophobicContact CG2-CD1 4.12Å; F203-L302 HydrophobicContact CD2-CD1 4.17Å; F203-L302 HydrophobicContact CD2-CD2 4.22Å; F203-L302 HydrophobicContact CE2-CD2 4.03Å; F203-L302 HydrophobicContact CZ-CD2 4.44Å; F210-L302 HydrophobicContact CE2-CD1 3.78Å; F210-L302 HydrophobicContact CZ-CD1 3.95Å; Q298-L302 WeakPolarHBondContact O-CB 3.33Å; Q298-L302 PolarHBondContact O-N 3.41Å; L299-L302 PolarHBondContact O-N 2.87Å; L302-T304 PolarHBondContact O-N 2.9Å; L302-F305 PolarHBondContact O-N 3.41Å; L302-F306 HydrophobicContact CD1-CD2 4.2Å; L302-F306 HydrophobicContact CD1-CE2 3.75Å; L302-F306 HydrophobicContact CD2-CD2 4.34Å; L302-F306 HydrophobicContact CD2-CE2 3.78Å; L302-F306 HydrophobicContact CG-CD2 3.69Å; L302-F306 HydrophobicContact CG-CE2 3.47Å; L302-F306 VanDerWaalsContact CG-CE2 3.47Å; L302-F306 WeakPolarHBondContact O-CD2 3.45Å; L302-F306 PolarHBondContact O-N 3.2Å
303N95.7Very high92.7Very high4 Ų420.6 Ų20.62%0.02110%0.102CC..Hα-helixtrans-55.8-39.9171.8-76-12.2000111.8L299 E301 F305 F306 L307 A361 E364 A365L299-N303 WeakPolarHBondContact O-CB 3.45Å; L299-N303 PolarHBondContact O-N 3.26Å; L299-N303 PolarHBondContact O-OD1 2.78Å; E301-N303 VanDerWaalsContact C-N 3.3Å; E301-N303 PolarHBondContact O-N 2.98Å; N303-F305 VanDerWaalsContact C-N 3.32Å; N303-F305 PolarHBondContact O-N 3.48Å; N303-F306 PolarHBondContact O-N 3.29Å; N303-L307 VanDerWaalsContact O-CB 3.26Å; N303-L307 WeakPolarHBondContact O-CB 3.36Å; N303-L307 WeakPolarHBondContact O-CD1 3.43Å; N303-L307 WeakPolarHBondContact O-CG 3.38Å; N303-L307 PolarHBondContact O-N 2.95Å; N303-A361 PolarHBondContact ND2-O 3.25Å; N303-E364 HydrophobicContact CB-CB 4.2Å; N303-E364 VanDerWaalsContact ND2-CB 3.31Å; N303-E364 WeakPolarHBondContact ND2-CB 3.26Å; N303-E364 PolarHBondContact ND2-OE2 2.91Å; N303-A365 WeakPolarHBondContact OD1-CA 3.41Å
304T93.1Very high92.3Very high24 Ų2424.1 Ų24.115%0.14712%0.119CC..Hα-helixtrans-57.4-46.2178.5-540000111.5T300 E301 L302 K308 R323 I324T300-T304 PolarHBondContact O-N 3.48Å; T300-T304 PolarHBondContact O-OG1 3.18Å; T300-T304 VanDerWaalsContact O-OG1 3.13Å; E301-T304 WeakPolarHBondContact O-CA 3.47Å; E301-T304 WeakPolarHBondContact O-CB 3.42Å; E301-T304 PolarHBondContact O-N 2.9Å; E301-T304 PolarHBondContact O-OG1 3.27Å; L302-T304 PolarHBondContact O-N 2.9Å; T304-K308 PolarHBondContact O-N 3.01Å; T304-R323 PolarHBondContact OG1-NH1 2.69Å; T304-I324 HydrophobicContact CG2-CD1 4.14Å; T304-I324 HydrophobicContact CG2-CG1 4.02Å
305F91.7Very high91.8Very high46 Ų4624.7 Ų24.720%0.20212%0.124CC..Hα-helixtrans-72.8-40.8-179.7-71.8-90.4000112.7W196 L207 F210 E301 L302 N303 K308 H309W196-F305 AromaticContact CH2-CD2 3.68Å; W196-F305 HydrophobicContact CH2-CD2 3.68Å; W196-F305 AromaticContact CH2-CE2 3.69Å; W196-F305 HydrophobicContact CH2-CE2 3.69Å; W196-F305 AromaticContact CZ2-CD2 3.67Å; W196-F305 HydrophobicContact CZ2-CD2 3.67Å; W196-F305 AromaticContact CZ2-CE2 3.24Å; W196-F305 HydrophobicContact CZ2-CE2 3.24Å; W196-F305 AromaticContact CZ2-CZ 3.97Å; W196-F305 HydrophobicContact CZ2-CZ 3.97Å; L207-F305 HydrophobicContact CD1-CB 4.11Å; F210-F305 HydrophobicContact CD1-CD1 4.48Å; F210-F305 HydrophobicContact CE1-CB 3.86Å; F210-F305 AromaticContact CE1-CD1 3.55Å; F210-F305 HydrophobicContact CE1-CD1 3.55Å; F210-F305 HydrophobicContact CE1-CD2 4.08Å; F210-F305 HydrophobicContact CE1-CE1 4.05Å; F210-F305 AromaticContact CE1-CG 3.55Å; F210-F305 HydrophobicContact CE1-CG 3.55Å; F210-F305 HydrophobicContact CZ-CB 3.67Å; F210-F305 HydrophobicContact CZ-CD1 4.26Å; F210-F305 HydrophobicContact CZ-CD2 4.24Å; F210-F305 AromaticContact CZ-CG 3.81Å; F210-F305 HydrophobicContact CZ-CG 3.81Å; E301-F305 WeakPolarHBondContact O-CD2 3.34Å; E301-F305 PolarHBondContact O-N 2.88Å; L302-F305 PolarHBondContact O-N 3.41Å; N303-F305 VanDerWaalsContact C-N 3.32Å; N303-F305 PolarHBondContact O-N 3.48Å; F305-K308 WeakPolarHBondContact O-CG 3.35Å; F305-H309 WeakPolarHBondContact O-CB 3.46Å; F305-H309 PolarHBondContact O-N 3.38Å; F305-H309 VanDerWaalsContact O-N 3.16Å
306F93.8Very high91.4Very high5 Ų526.8 Ų26.82%0.02214%0.142CC..Hα-helixtrans-65.1-42.5176-83.7-62.5000112.5L206 L207 L302 N303 K308 H309 I310 C368 V375 F376L206-F306 HydrophobicContact CB-CE1 4.29Å; L206-F306 HydrophobicContact CB-CZ 4.34Å; L206-F306 HydrophobicContact CD1-CE1 4.43Å; L206-F306 HydrophobicContact CD1-CZ 3.99Å; L207-F306 HydrophobicContact CD1-CD1 3.81Å; L207-F306 HydrophobicContact CD1-CD2 4.34Å; L207-F306 HydrophobicContact CD1-CE1 3.66Å; L207-F306 HydrophobicContact CD1-CE2 4.22Å; L207-F306 HydrophobicContact CD1-CG 4.13Å; L207-F306 HydrophobicContact CD1-CZ 3.87Å; L207-F306 HydrophobicContact CD2-CD1 4.11Å; L207-F306 HydrophobicContact CD2-CE1 4.11Å; L207-F306 HydrophobicContact CG-CD1 4.14Å; L207-F306 HydrophobicContact CG-CE1 3.76Å; L207-F306 HydrophobicContact CG-CZ 4.25Å; L302-F306 HydrophobicContact CD1-CD2 4.2Å; L302-F306 HydrophobicContact CD1-CE2 3.75Å; L302-F306 HydrophobicContact CD2-CD2 4.34Å; L302-F306 HydrophobicContact CD2-CE2 3.78Å; L302-F306 HydrophobicContact CG-CD2 3.69Å; L302-F306 HydrophobicContact CG-CE2 3.47Å; L302-F306 VanDerWaalsContact CG-CE2 3.47Å; L302-F306 WeakPolarHBondContact O-CD2 3.45Å; L302-F306 PolarHBondContact O-N 3.2Å; N303-F306 PolarHBondContact O-N 3.29Å; F306-K308 PolarHBondContact O-N 3.47Å; F306-H309 PolarHBondContact O-N 2.83Å; F306-I310 HydrophobicContact CB-CD1 4.09Å; F306-I310 HydrophobicContact CD1-CD1 4.33Å; F306-I310 VanDerWaalsContact O-CB 3.3Å; F306-I310 WeakPolarHBondContact O-CB 3.36Å; F306-I310 WeakPolarHBondContact O-CD1 3.48Å; F306-I310 VanDerWaalsContact O-CG1 3.22Å; F306-I310 WeakPolarHBondContact O-CG1 3.38Å; F306-I310 PolarHBondContact O-N 3.15Å; F306-C368 HydrophobicContact CB-CB 4.15Å; F306-V375 HydrophobicContact CE1-CG1 4.08Å; F306-F376 HydrophobicContact CD1-CE2 4.28Å; F306-F376 AromaticContact CD1-CZ 3.98Å; F306-F376 HydrophobicContact CD1-CZ 3.98Å; F306-F376 HydrophobicContact CD2-CZ 4.2Å; F306-F376 HydrophobicContact CE1-CE1 4.35Å; F306-F376 HydrophobicContact CE1-CE2 4.44Å; F306-F376 AromaticContact CE1-CZ 3.94Å; F306-F376 HydrophobicContact CE1-CZ 3.94Å; F306-F376 HydrophobicContact CE2-CE1 4.39Å; F306-F376 HydrophobicContact CE2-CZ 4.14Å; F306-F376 HydrophobicContact CG-CZ 4.14Å; F306-F376 HydrophobicContact CZ-CE1 4.15Å; F306-F376 HydrophobicContact CZ-CZ 4.03Å
307L93.6Very high91.1Very high8 Ų826.3 Ų26.34%0.04214%0.138CC..Hα-helixtrans-59.9-47.1179.8-72167.8000111N303 H309 F311 R323 E364N303-L307 VanDerWaalsContact O-CB 3.26Å; N303-L307 WeakPolarHBondContact O-CB 3.36Å; N303-L307 WeakPolarHBondContact O-CD1 3.43Å; N303-L307 WeakPolarHBondContact O-CG 3.38Å; N303-L307 PolarHBondContact O-N 2.95Å; L307-H309 VanDerWaalsContact C-N 3.32Å; L307-H309 PolarHBondContact O-N 3.41Å; L307-F311 HydrophobicContact CB-CD2 4.36Å; L307-F311 HydrophobicContact CD2-CD2 3.9Å; L307-F311 HydrophobicContact CD2-CE2 3.45Å; L307-F311 VanDerWaalsContact CD2-CE2 3.45Å; L307-F311 VanDerWaalsContact O-CB 3.29Å; L307-F311 WeakPolarHBondContact O-CB 3.4Å; L307-F311 WeakPolarHBondContact O-CD2 3.41Å; L307-F311 PolarHBondContact O-N 3.32Å; L307-R323 VanDerWaalsContact CD1-NE 3.33Å; L307-E364 HydrophobicContact CD1-CB 4.35Å; L307-E364 HydrophobicContact CD1-CG 4.17Å
308K90.8Very high90.9Very high18 Ų1828.4 Ų28.48%0.07816%0.159CC..Hα-helixtrans-62.6-39.3177.471.5162-176.2163.70112.6E143 T304 F305 F306 V312 F313 A315E143-K308 IonicContact OE2-NZ 2.69Å; E143-K308 PolarHBondContact OE2-NZ 2.76Å; T304-K308 PolarHBondContact O-N 3.01Å; F305-K308 WeakPolarHBondContact O-CG 3.35Å; F306-K308 PolarHBondContact O-N 3.47Å; K308-V312 WeakPolarHBondContact O-CA 3.18Å; K308-V312 PolarHBondContact O-N 3.04Å; K308-F313 VanDerWaalsContact CA-CZ 3.48Å; K308-F313 HydrophobicContact CB-CD2 3.82Å; K308-F313 HydrophobicContact CB-CE2 3.43Å; K308-F313 VanDerWaalsContact CB-CE2 3.43Å; K308-F313 HydrophobicContact CB-CZ 3.89Å; K308-F313 PolarHBondContact O-N 3.28Å; K308-F313 VanDerWaalsContact O-N 3.14Å; K308-A315 HydrophobicContact CD-CB 4.39Å
309H90Very high90.7Very high13 Ų1331.4 Ų31.46%0.0618%0.175CC..Hα-helixtrans-71.4-44.5-177.9-179.590.2000112.3R142 L207 F305 F306 L307R142-H309 PolarHBondContact NE-O 3.39Å; L207-H309 HydrophobicContact CD2-CB 3.58Å; F305-H309 WeakPolarHBondContact O-CB 3.46Å; F305-H309 PolarHBondContact O-N 3.38Å; F305-H309 VanDerWaalsContact O-N 3.16Å; F306-H309 PolarHBondContact O-N 2.83Å; L307-H309 VanDerWaalsContact C-N 3.32Å; L307-H309 PolarHBondContact O-N 3.41Å
310I91.9Very high90.4Very high7 Ų730.1 Ų30.14%0.03617%0.169CC..Hα-helixtrans-71.5-49.2-177.7-67.8164.9000110W123 F306 V312 C368 F371 F376W123-I310 HydrophobicContact CH2-CG2 4.37Å; W123-I310 WeakPolarHBondContact CH2-O 3.23Å; W123-I310 HydrophobicContact CZ3-CG2 4.36Å; F306-I310 HydrophobicContact CB-CD1 4.09Å; F306-I310 HydrophobicContact CD1-CD1 4.33Å; F306-I310 VanDerWaalsContact O-CB 3.3Å; F306-I310 WeakPolarHBondContact O-CB 3.36Å; F306-I310 WeakPolarHBondContact O-CD1 3.48Å; F306-I310 VanDerWaalsContact O-CG1 3.22Å; F306-I310 WeakPolarHBondContact O-CG1 3.38Å; F306-I310 PolarHBondContact O-N 3.15Å; I310-V312 PolarHBondContact O-N 2.86Å; I310-C368 HydrophobicContact CD1-CB 3.85Å; I310-C368 WeakPolarHBondContact CD1-O 3.43Å; I310-F371 HydrophobicContact CG2-CB 3.77Å; I310-F376 HydrophobicContact CD1-CE2 4.09Å
311F91Very high90Very high22 Ų2235 Ų3510%0.09619%0.187CC..Hα-helixtrans-79.9-4-179.5-67.1-54000114L118 W123 V126 M130 L307 F313 F371L118-F311 HydrophobicContact CD2-CE2 4.42Å; L118-F311 HydrophobicContact CD2-CZ 3.99Å; W123-F311 AromaticContact CH2-CD1 3.87Å; W123-F311 HydrophobicContact CH2-CD1 3.87Å; W123-F311 HydrophobicContact CH2-CE1 4.41Å; W123-F311 AromaticContact CZ3-CD1 3.55Å; W123-F311 HydrophobicContact CZ3-CD1 3.55Å; W123-F311 AromaticContact CZ3-CE1 3.65Å; W123-F311 HydrophobicContact CZ3-CE1 3.65Å; V126-F311 HydrophobicContact CG1-CD1 3.92Å; V126-F311 HydrophobicContact CG1-CE1 3.58Å; M130-F311 HydrophobicContact CE-CB 3.86Å; M130-F311 WeakPolarHBondContact CE-O 3.46Å; M130-F311 HydrophobicContact SD-CB 3.81Å; M130-F311 HydrophobicContact SD-CD1 3.9Å; M130-F311 HydrophobicContact SD-CG 4.11Å; L307-F311 HydrophobicContact CB-CD2 4.36Å; L307-F311 HydrophobicContact CD2-CD2 3.9Å; L307-F311 HydrophobicContact CD2-CE2 3.45Å; L307-F311 VanDerWaalsContact CD2-CE2 3.45Å; L307-F311 VanDerWaalsContact O-CB 3.29Å; L307-F311 WeakPolarHBondContact O-CB 3.4Å; L307-F311 WeakPolarHBondContact O-CD2 3.41Å; L307-F311 PolarHBondContact O-N 3.32Å; F311-F313 HydrophobicContact CB-CD1 3.86Å; F311-F313 HydrophobicContact CB-CE1 3.66Å; F311-F371 HydrophobicContact CE1-CB 4.26Å; F311-F371 AromaticContact CE1-CD2 3.87Å; F311-F371 HydrophobicContact CE1-CD2 3.87Å; F311-F371 HydrophobicContact CE1-CE2 4.49Å; F311-F371 HydrophobicContact CE1-CG 4.13Å; F311-F371 AromaticContact CZ-CD2 3.68Å; F311-F371 HydrophobicContact CZ-CD2 3.68Å; F311-F371 HydrophobicContact CZ-CE2 4.26Å; F311-F371 HydrophobicContact CZ-CG 4.35Å
312V88.4Confident89.9Confident37 Ų3736.7 Ų36.722%0.22420%0.203CC..THydrogen-bonded Turntrans58.567.6172.9-165.40000112R142 K308 I310R142-V312 HydrophobicContact CB-CG1 4.24Å; K308-V312 WeakPolarHBondContact O-CA 3.18Å; K308-V312 PolarHBondContact O-N 3.04Å; I310-V312 PolarHBondContact O-N 2.86Å
313F87.5Confident89.9Confident21 Ų2137.3 Ų37.39%0.09220%0.204CC..  trans-136.5152166.456.1-98.3000110.8M130 L137 K308 F311 H317 L319 S320M130-F313 HydrophobicContact CE-CD1 4.09Å; L137-F313 HydrophobicContact CD2-CB 3.79Å; K308-F313 VanDerWaalsContact CA-CZ 3.48Å; K308-F313 HydrophobicContact CB-CD2 3.82Å; K308-F313 HydrophobicContact CB-CE2 3.43Å; K308-F313 VanDerWaalsContact CB-CE2 3.43Å; K308-F313 HydrophobicContact CB-CZ 3.89Å; K308-F313 PolarHBondContact O-N 3.28Å; K308-F313 VanDerWaalsContact O-N 3.14Å; F311-F313 HydrophobicContact CB-CD1 3.86Å; F311-F313 HydrophobicContact CB-CE1 3.66Å; F313-H317 HydrophobicContact CB-CB 4.32Å; F313-H317 HydrophobicContact CD2-CB 4.43Å; F313-L319 HydrophobicContact CD1-CD1 4.33Å; F313-L319 HydrophobicContact CD2-CB 4.42Å; F313-L319 HydrophobicContact CE2-CB 4.32Å; F313-L319 HydrophobicContact CZ-CB 4.44Å; F313-S320 VanDerWaalsContact CD2-OG 3.26Å; F313-S320 WeakPolarHBondContact CD2-OG 3.41Å; F313-S320 WeakPolarHBondContact CE2-OG 3.31Å
314Q84.8Confident89.7Confident89 Ų8941.1 Ų41.142%0.41622%0.224SC..  trans-72.8154.9-179.1-66.4-179.8-20.800111.7E143 S316 H317 S320E143-Q314 HydrophobicContact CG-CG 4.34Å; E143-Q314 WeakPolarHBondContact OE1-CA 3.08Å; Q314-S316 PolarHBondContact O-N 3.46Å; Q314-H317 WeakPolarHBondContact O-CB 3.31Å; Q314-H317 PolarHBondContact O-N 2.96Å; Q314-S320 PolarHBondContact O-OG 2.91Å
315A82.3Confident89.7Confident12 Ų1245.4 Ų45.410%0.09925%0.245CC..THydrogen-bonded Turntrans-62.2-31.5176.400000112.2E143 F168 K308 H317 S320 W321E143-A315 WeakPolarHBondContact OE1-CB 3.26Å; E143-A315 PolarHBondContact OE1-N 3.19Å; F168-A315 HydrophobicContact CE1-CB 3.59Å; F168-A315 HydrophobicContact CZ-CB 3.68Å; K308-A315 HydrophobicContact CD-CB 4.39Å; A315-H317 PolarHBondContact O-N 3.46Å; A315-S320 VanDerWaalsContact O-CB 3.24Å; A315-S320 WeakPolarHBondContact O-CB 3.44Å; A315-W321 PolarHBondContact O-NE1 2.73Å
316S82.8Confident89.8Confident80 Ų8045.1 Ų45.156%0.55925%0.246SC*.THydrogen-bonded Turntrans-72.4-13.3173.857.60000113.8Q314Q314-S316 PolarHBondContact O-N 3.46Å
317H88.8Confident89.9Confident38 Ų3845.5 Ų45.518%0.17625%0.248CC..SBendtrans-67.3146.7-176.4-168-99.1000112.1D134 F313 Q314 A315 L319 S320 W321D134-H317 IonicContact OD2-CE1 3.59Å; D134-H317 IonicContact OD2-NE2 3.2Å; D134-H317 PolarHBondContact OD2-NE2 3.29Å; D134-H317 VanDerWaalsContact OD2-NE2 3.15Å; F313-H317 HydrophobicContact CB-CB 4.32Å; F313-H317 HydrophobicContact CD2-CB 4.43Å; Q314-H317 WeakPolarHBondContact O-CB 3.31Å; Q314-H317 PolarHBondContact O-N 2.96Å; A315-H317 PolarHBondContact O-N 3.46Å; H317-L319 WeakPolarHBondContact ND1-CB 3.13Å; H317-L319 WeakPolarHBondContact ND1-CG 3.18Å; H317-L319 PolarHBondContact ND1-N 3.48Å; H317-L319 PolarHBondContact O-N 3.45Å; H317-L319 VanDerWaalsContact O-N 3.14Å; H317-S320 WeakPolarHBondContact O-CB 3.34Å; H317-S320 PolarHBondContact O-N 3.34Å; H317-W321 PolarHBondContact O-N 2.73Å
318A89.9Confident89.9Confident63 Ų6345.8 Ų45.852%0.52125%0.253SS..Hα-helixtrans-56.3-35.1-17800000113S320 W321 C322A318-S320 VanDerWaalsContact C-N 3.27Å; A318-S320 PolarHBondContact O-N 3.37Å; A318-W321 PolarHBondContact O-N 3.14Å; A318-C322 WeakPolarHBondContact O-CB 3.41Å; A318-C322 PolarHBondContact O-N 3.01Å; A318-C322 PolarHBondContact O-SG 2.84Å
319L90.3Very high90Very high64 Ų6448.1 Ų48.134%0.33527%0.266SS..Hα-helixtrans-57.9-38176.1-67.7172.8000112.8L137 F313 H317 R323L137-L319 HydrophobicContact CD1-CD1 3.95Å; F313-L319 HydrophobicContact CD1-CD1 4.33Å; F313-L319 HydrophobicContact CD2-CB 4.42Å; F313-L319 HydrophobicContact CE2-CB 4.32Å; F313-L319 HydrophobicContact CZ-CB 4.44Å; H317-L319 WeakPolarHBondContact ND1-CB 3.13Å; H317-L319 WeakPolarHBondContact ND1-CG 3.18Å; H317-L319 PolarHBondContact ND1-N 3.48Å; H317-L319 PolarHBondContact O-N 3.45Å; H317-L319 VanDerWaalsContact O-N 3.14Å; L319-R323 VanDerWaalsContact O-CB 3.24Å; L319-R323 WeakPolarHBondContact O-CB 3.13Å; L319-R323 PolarHBondContact O-N 2.85Å
320S89.1Confident90.2Very high11 Ų1147.5 Ų47.58%0.07726%0.263CS..Hα-helixtrans-66-57.1177.4-560000110.7F313 Q314 A315 H317 A318 R323 I324F313-S320 VanDerWaalsContact CD2-OG 3.26Å; F313-S320 WeakPolarHBondContact CD2-OG 3.41Å; F313-S320 WeakPolarHBondContact CE2-OG 3.31Å; Q314-S320 PolarHBondContact O-OG 2.91Å; A315-S320 VanDerWaalsContact O-CB 3.24Å; A315-S320 WeakPolarHBondContact O-CB 3.44Å; H317-S320 WeakPolarHBondContact O-CB 3.34Å; H317-S320 PolarHBondContact O-N 3.34Å; A318-S320 VanDerWaalsContact C-N 3.27Å; A318-S320 PolarHBondContact O-N 3.37Å; S320-R323 PolarHBondContact O-N 2.91Å; S320-I324 VanDerWaalsContact O-CG1 3.3Å; S320-I324 WeakPolarHBondContact O-CG1 3.39Å; S320-I324 PolarHBondContact O-N 3.16Å
321W87.6Confident90.4Very high113 Ų11347.9 Ų47.943%0.42827%0.266SS..Hα-helixtrans-68.2-40.5-175.7-67.390000112.8I167 A315 H317 A318 R323 I324 L325I167-W321 HydrophobicContact CD1-CH2 4.25Å; I167-W321 HydrophobicContact CD1-CZ2 3.77Å; I167-W321 HydrophobicContact CG1-CH2 4.14Å; I167-W321 HydrophobicContact CG1-CZ2 4Å; A315-W321 PolarHBondContact O-NE1 2.73Å; H317-W321 PolarHBondContact O-N 2.73Å; A318-W321 PolarHBondContact O-N 3.14Å; W321-R323 VanDerWaalsContact C-N 3.31Å; W321-R323 PolarHBondContact O-N 3.26Å; W321-I324 PolarHBondContact O-N 3.39Å; W321-L325 VanDerWaalsContact O-CB 3.28Å; W321-L325 WeakPolarHBondContact O-CB 3.43Å; W321-L325 PolarHBondContact O-N 3.21Å
322C91.9Very high90.4Very high84 Ų8447.6 Ų47.657%0.56827%0.267SS*.Hα-helixtrans-61-41.2175.5-720000111.5A318 L326A318-C322 WeakPolarHBondContact O-CB 3.41Å; A318-C322 PolarHBondContact O-N 3.01Å; A318-C322 PolarHBondContact O-SG 2.84Å; C322-L326 VanDerWaalsContact O-CB 3.27Å; C322-L326 WeakPolarHBondContact O-CB 3.36Å; C322-L326 PolarHBondContact O-N 3.23Å
323R93.3Very high90.6Very high25 Ų2546 Ų469%0.09426%0.258CS..Hα-helixtrans-67.5-46.6176.6-176.4-178.1161.9-79.82.8111.6Y111 T304 L307 L319 S320 W321 L325 L326 L327 E364Y111-R323 PolarHBondContact OH-NE 3.45Å; T304-R323 PolarHBondContact OG1-NH1 2.69Å; L307-R323 VanDerWaalsContact CD1-NE 3.33Å; L319-R323 VanDerWaalsContact O-CB 3.24Å; L319-R323 WeakPolarHBondContact O-CB 3.13Å; L319-R323 PolarHBondContact O-N 2.85Å; S320-R323 PolarHBondContact O-N 2.91Å; W321-R323 VanDerWaalsContact C-N 3.31Å; W321-R323 PolarHBondContact O-N 3.26Å; R323-L325 VanDerWaalsContact C-N 3.31Å; R323-L325 PolarHBondContact O-N 3.43Å; R323-L326 PolarHBondContact O-N 3.32Å; R323-L327 HydrophobicContact CG-CD1 4.35Å; R323-L327 HydrophobicContact CG-CG 4.42Å; R323-L327 VanDerWaalsContact CZ-CD1 3.45Å; R323-L327 VanDerWaalsContact NH2-CD1 3.33Å; R323-L327 PolarHBondContact O-N 3.39Å; R323-E364 IonicContact CZ-OE1 3.38Å; R323-E364 IonicContact CZ-OE2 3.74Å; R323-E364 IonicContact NE-OE1 2.83Å; R323-E364 PolarHBondContact NE-OE1 3.04Å; R323-E364 IonicContact NH2-OE1 2.84Å; R323-E364 PolarHBondContact NH2-OE1 3.33Å; R323-E364 IonicContact NH2-OE2 2.73Å; R323-E364 PolarHBondContact NH2-OE2 2.92Å
324I91.6Very high91Very high83 Ų8345.5 Ų45.543%0.42626%0.256SS..Hα-helixtrans-59.1-44.4177.9-69.7166.1000110.4T304 S320 W321 G328T304-I324 HydrophobicContact CG2-CD1 4.14Å; T304-I324 HydrophobicContact CG2-CG1 4.02Å; S320-I324 VanDerWaalsContact O-CG1 3.3Å; S320-I324 WeakPolarHBondContact O-CG1 3.39Å; S320-I324 PolarHBondContact O-N 3.16Å; W321-I324 PolarHBondContact O-N 3.39Å; I324-G328 PolarHBondContact O-N 2.97Å
325L92.6Very high91.4Very high115 Ų11541.7 Ų41.760%0.60224%0.239SC*.Hα-helixtrans-63-45.5176.8-178.363.6000111.7W321 R323 G328 I329W321-L325 VanDerWaalsContact O-CB 3.28Å; W321-L325 WeakPolarHBondContact O-CB 3.43Å; W321-L325 PolarHBondContact O-N 3.21Å; R323-L325 VanDerWaalsContact C-N 3.31Å; R323-L325 PolarHBondContact O-N 3.43Å; L325-G328 PolarHBondContact O-N 3.31Å; L325-I329 HydrophobicContact CD1-CD1 4.01Å; L325-I329 HydrophobicContact CD1-CG1 4.41Å; L325-I329 HydrophobicContact CG-CD1 4.06Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.5Å; L325-I329 PolarHBondContact O-N 2.87Å
326L94.5Very high91.8Very high39 Ų3944.4 Ų44.420%0.20425%0.247CC..Hα-helixtrans-59.3-52.8178176.462.3000111.2L107 Y111 C322 R323 I329 I330L107-L326 HydrophobicContact CB-CD1 3.77Å; L107-L326 HydrophobicContact CD1-CD1 4.19Å; Y111-L326 HydrophobicContact CD1-CD2 4.39Å; Y111-L326 HydrophobicContact CG-CD2 4.17Å; C322-L326 VanDerWaalsContact O-CB 3.27Å; C322-L326 WeakPolarHBondContact O-CB 3.36Å; C322-L326 PolarHBondContact O-N 3.23Å; R323-L326 PolarHBondContact O-N 3.32Å; L326-I329 PolarHBondContact O-N 2.9Å; L326-I330 HydrophobicContact CD1-CD1 3.71Å; L326-I330 HydrophobicContact CD1-CG1 4.37Å; L326-I330 HydrophobicContact CG-CD1 3.79Å; L326-I330 WeakPolarHBondContact O-CD1 3.49Å; L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.48Å; L326-I330 PolarHBondContact O-N 3.39Å; L326-I330 VanDerWaalsContact O-N 3.08Å
327L94.9Very high92.2Very high13 Ų1340.8 Ų40.87%0.06822%0.221CC..Hα-helixtrans-64.2-41.4178.7-68.2-172.3000111.2Y111 R323 I329 I330 T331 F357 I360Y111-L327 HydrophobicContact CE1-CD2 4.39Å; R323-L327 HydrophobicContact CG-CD1 4.35Å; R323-L327 HydrophobicContact CG-CG 4.42Å; R323-L327 VanDerWaalsContact CZ-CD1 3.45Å; R323-L327 VanDerWaalsContact NH2-CD1 3.33Å; R323-L327 PolarHBondContact O-N 3.39Å; L327-I329 VanDerWaalsContact C-N 3.3Å; L327-I329 PolarHBondContact O-N 3.39Å; L327-I330 PolarHBondContact O-N 2.87Å; L327-I330 VanDerWaalsContact O-N 3.13Å; L327-T331 WeakPolarHBondContact O-CB 3.17Å; L327-T331 PolarHBondContact O-N 3.37Å; L327-T331 PolarHBondContact O-OG1 3.17Å; L327-F357 HydrophobicContact CB-CE2 4.49Å; L327-F357 HydrophobicContact CD2-CD2 4.47Å; L327-F357 HydrophobicContact CD2-CE2 4.08Å; L327-I360 HydrophobicContact CD2-CG2 4.23Å
328G93.1Very high92.4Very high15 Ų1540 Ų4016%0.15522%0.216CC..Hα-helixtrans-56-41.9176.600000113.1M178 I324 L325M178-G328 WeakPolarHBondContact CE-O 3.23Å; I324-G328 PolarHBondContact O-N 2.97Å; L325-G328 PolarHBondContact O-N 3.31Å
329I93.3Very high92.4Very high67 Ų6738.3 Ų38.334%0.34420%0.197SC..Hα-helixtrans-71-39.8176.9-64.4166.6000111.5W101 V104 L325 L326 L327 T331 P333W101-I329 HydrophobicContact CZ3-CG2 4.33Å; V104-I329 HydrophobicContact CB-CG2 4.4Å; V104-I329 HydrophobicContact CG1-CG2 3.86Å; V104-I329 HydrophobicContact CG2-CG2 3.54Å; L325-I329 HydrophobicContact CD1-CD1 4.01Å; L325-I329 HydrophobicContact CD1-CG1 4.41Å; L325-I329 HydrophobicContact CG-CD1 4.06Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.5Å; L325-I329 PolarHBondContact O-N 2.87Å; L326-I329 PolarHBondContact O-N 2.9Å; L327-I329 VanDerWaalsContact C-N 3.3Å; L327-I329 PolarHBondContact O-N 3.39Å; I329-T331 VanDerWaalsContact C-N 3.33Å; I329-P333 VanDerWaalsContact O-CD 3.24Å; I329-P333 WeakPolarHBondContact O-CD 3.21Å
330I95.3Very high92.2Very high0 Ų035.5 Ų35.50%018%0.182CC..Hα-helixtrans-69.4-30.5178.1-64.2163.6000111.7V104 L326 L327 A332 P333 T334 F357V104-I330 HydrophobicContact CG1-CG1 3.88Å; L326-I330 HydrophobicContact CD1-CD1 3.71Å; L326-I330 HydrophobicContact CD1-CG1 4.37Å; L326-I330 HydrophobicContact CG-CD1 3.79Å; L326-I330 WeakPolarHBondContact O-CD1 3.49Å; L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.48Å; L326-I330 PolarHBondContact O-N 3.39Å; L326-I330 VanDerWaalsContact O-N 3.08Å; L327-I330 PolarHBondContact O-N 2.87Å; L327-I330 VanDerWaalsContact O-N 3.13Å; I330-A332 VanDerWaalsContact C-N 3.26Å; I330-A332 PolarHBondContact O-N 3.42Å; I330-P333 WeakPolarHBondContact O-CD 3.46Å; I330-P333 WeakPolarHBondContact O-CG 3.4Å; I330-T334 WeakPolarHBondContact O-CB 3.19Å; I330-T334 PolarHBondContact O-N 3.41Å; I330-T334 PolarHBondContact O-OG1 3.1Å; I330-F357 HydrophobicContact CB-CD2 4.42Å; I330-F357 HydrophobicContact CG2-CB 4.26Å; I330-F357 HydrophobicContact CG2-CD2 3.74Å; I330-F357 HydrophobicContact CG2-CG 4.45Å
331T94.7Very high92.2Very high15 Ų1538.3 Ų38.39%0.09219%0.192CC..Hα-helixtrans-63.4-33.1179.6-63.30000111.5L182 W297 L327 I329 T334 V335 F357L182-T331 HydrophobicContact CD1-CG2 3.77Å; W297-T331 HydrophobicContact CH2-CG2 4.18Å; W297-T331 HydrophobicContact CZ3-CG2 3.84Å; L327-T331 WeakPolarHBondContact O-CB 3.17Å; L327-T331 PolarHBondContact O-N 3.37Å; L327-T331 PolarHBondContact O-OG1 3.17Å; I329-T331 VanDerWaalsContact C-N 3.33Å; T331-T334 WeakPolarHBondContact O-CB 3.39Å; T331-T334 PolarHBondContact O-N 2.79Å; T331-V335 HydrophobicContact CG2-CG2 3.59Å; T331-V335 VanDerWaalsContact O-CG2 3.29Å; T331-V335 WeakPolarHBondContact O-CG2 3.36Å; T331-V335 PolarHBondContact O-N 3.08Å; T331-F357 WeakPolarHBondContact OG1-CE2 3.5Å
332A92.1Very high92.1Very high16 Ų1634.1 Ų34.113%0.13218%0.178CC..Hα-helixtrans-58.7-56.3-17900000114.1F93 L182 I330 T334 R336F93-A332 VanDerWaalsContact CE2-C 3.4Å; F93-A332 HydrophobicContact CE2-CB 3.72Å; F93-A332 HydrophobicContact CZ-CB 4.31Å; F93-A332 WeakPolarHBondContact CZ-O 3.36Å; L182-A332 HydrophobicContact CD2-CB 3.55Å; I330-A332 VanDerWaalsContact C-N 3.26Å; I330-A332 PolarHBondContact O-N 3.42Å; A332-T334 VanDerWaalsContact C-N 3.27Å; A332-T334 PolarHBondContact O-N 3.05Å; A332-R336 PolarHBondContact O-N 3.15Å
333P93.3Very high91.7Very high4 Ų432.2 Ų32.23%0.02616%0.163CC..Hα-helixtrans-67.6-30.2175.525.9-34.3000111.9P92 F93 I329 I330 R336 Q337 Q353P92-P333 HydrophobicContact CG-CB 3.64Å; F93-P333 HydrophobicContact CD2-CB 4.1Å; F93-P333 HydrophobicContact CE2-CB 3.97Å; F93-P333 HydrophobicContact CE2-CG 4.49Å; F93-P333 VanDerWaalsContact CE2-N 3.28Å; I329-P333 VanDerWaalsContact O-CD 3.24Å; I329-P333 WeakPolarHBondContact O-CD 3.21Å; I330-P333 WeakPolarHBondContact O-CD 3.46Å; I330-P333 WeakPolarHBondContact O-CG 3.4Å; P333-R336 PolarHBondContact O-N 3.42Å; P333-Q337 WeakPolarHBondContact O-CB 3.24Å; P333-Q337 WeakPolarHBondContact O-CG 3.47Å; P333-Q337 PolarHBondContact O-N 3.34Å; P333-Q353 HydrophobicContact CB-CB 4.43Å; P333-Q353 HydrophobicContact CB-CG 4.36Å; P333-Q353 HydrophobicContact CG-CG 4.31Å
334T95.1Very high91.1Very high10 Ų1033 Ų336%0.06117%0.17CC..Hα-helixtrans-62-53.4177.6-66.70000112.2I330 T331 A332 R336 Q337 Y338 C354 F357I330-T334 WeakPolarHBondContact O-CB 3.19Å; I330-T334 PolarHBondContact O-N 3.41Å; I330-T334 PolarHBondContact O-OG1 3.1Å; T331-T334 WeakPolarHBondContact O-CB 3.39Å; T331-T334 PolarHBondContact O-N 2.79Å; A332-T334 VanDerWaalsContact C-N 3.27Å; A332-T334 PolarHBondContact O-N 3.05Å; T334-R336 VanDerWaalsContact C-N 3.27Å; T334-R336 PolarHBondContact O-N 2.96Å; T334-Q337 PolarHBondContact O-N 2.9Å; T334-Y338 WeakPolarHBondContact O-CB 3.36Å; T334-Y338 PolarHBondContact O-N 3.26Å; T334-C354 HydrophobicContact CG2-CB 4.13Å; T334-F357 HydrophobicContact CG2-CB 3.91Å; T334-F357 HydrophobicContact CG2-CD1 3.78Å; T334-F357 HydrophobicContact CG2-CG 3.92Å; T334-F357 WeakPolarHBondContact OG1-CB 3.32Å
335V93.4Very high90.4Very high8 Ų834.9 Ų34.95%0.04819%0.185CC..Hα-helixtrans-61.1-39.4179.1174.20000110.3W277 F293 W297 T331 Y338 Y339W277-V335 HydrophobicContact CH2-CG1 4.02Å; W277-V335 HydrophobicContact CZ2-CG1 3.95Å; F293-V335 HydrophobicContact CE2-CG2 4.13Å; F293-V335 HydrophobicContact CZ-CG2 4.4Å; W297-V335 HydrophobicContact CZ3-CG2 4.07Å; T331-V335 HydrophobicContact CG2-CG2 3.59Å; T331-V335 VanDerWaalsContact O-CG2 3.29Å; T331-V335 WeakPolarHBondContact O-CG2 3.36Å; T331-V335 PolarHBondContact O-N 3.08Å; V335-Y338 PolarHBondContact O-N 2.91Å; V335-Y339 VanDerWaalsContact O-CB 3.26Å; V335-Y339 WeakPolarHBondContact O-CB 3.28Å; V335-Y339 PolarHBondContact O-N 3.44Å
336R90.4Very high89.6Confident70 Ų7032.8 Ų32.826%0.26417%0.172SC..Hα-helixtrans-62.6-46176.5178.457.3-178142.92.7112.4P92 F93 A332 P333 T334 A340P92-R336 HydrophobicContact CB-CG 3.97Å; P92-R336 HydrophobicContact CG-CG 4.42Å; F93-R336 HydrophobicContact CE1-CB 4.23Å; F93-R336 HydrophobicContact CE1-CG 4.17Å; F93-R336 HydrophobicContact CZ-CB 4.06Å; A332-R336 PolarHBondContact O-N 3.15Å; P333-R336 PolarHBondContact O-N 3.42Å; T334-R336 VanDerWaalsContact C-N 3.27Å; T334-R336 PolarHBondContact O-N 2.96Å; R336-A340 PolarHBondContact O-N 2.92Å; R336-A340 VanDerWaalsContact O-N 3.09Å
337Q91.8Very high88.9Confident3 Ų331.3 Ų31.31%0.01417%0.165CC..Hα-helixtrans-66.6-40.6177.6-74.7-177.1-16.700111.9N25 P92 P333 T334 A340 Y341 Q353 C354N25-Q337 WeakPolarHBondContact OD1-CG 3.18Å; N25-Q337 PolarHBondContact OD1-NE2 3.45Å; N25-Q337 VanDerWaalsContact OD1-NE2 3.12Å; P92-Q337 HydrophobicContact CG-CG 4.14Å; P333-Q337 WeakPolarHBondContact O-CB 3.24Å; P333-Q337 WeakPolarHBondContact O-CG 3.47Å; P333-Q337 PolarHBondContact O-N 3.34Å; T334-Q337 PolarHBondContact O-N 2.9Å; Q337-A340 PolarHBondContact O-N 3.36Å; Q337-Y341 WeakPolarHBondContact O-CB 3.32Å; Q337-Y341 PolarHBondContact O-N 2.97Å; Q337-Q353 VanDerWaalsContact OE1-CB 3.24Å; Q337-C354 HydrophobicContact CB-CB 4.01Å
338Y92.7Very high88.2Confident22 Ų2237.9 Ų37.99%0.08619%0.193CC..Hα-helixtrans-65.7-44.3178.2-169.7-100.2000111.9W277 G289 F293 T334 V335 A340 Y341 L342W277-Y338 HydrophobicContact CZ3-CD1 4.48Å; G289-Y338 PolarHBondContact O-OH 3.49Å; F293-Y338 HydrophobicContact CB-CD1 4.37Å; F293-Y338 HydrophobicContact CB-CE1 3.65Å; F293-Y338 AromaticContact CD2-CD1 3.69Å; F293-Y338 HydrophobicContact CD2-CD1 3.69Å; F293-Y338 AromaticContact CD2-CE1 3.86Å; F293-Y338 HydrophobicContact CD2-CE1 3.86Å; F293-Y338 HydrophobicContact CE2-CD1 4.48Å; F293-Y338 HydrophobicContact CG-CD1 4.4Å; F293-Y338 HydrophobicContact CG-CE1 4.16Å; T334-Y338 WeakPolarHBondContact O-CB 3.36Å; T334-Y338 PolarHBondContact O-N 3.26Å; V335-Y338 PolarHBondContact O-N 2.91Å; Y338-A340 VanDerWaalsContact C-N 3.35Å; Y338-A340 PolarHBondContact O-N 3.47Å; Y338-Y341 WeakPolarHBondContact O-CB 3.42Å; Y338-Y341 PolarHBondContact O-N 3.4Å; Y338-L342 HydrophobicContact CD1-CD1 3.94Å; Y338-L342 HydrophobicContact CD1-CG 4.25Å; Y338-L342 HydrophobicContact CE1-CD1 3.25Å; Y338-L342 HydrophobicContact CE1-CD2 4.45Å; Y338-L342 HydrophobicContact CE1-CG 3.78Å; Y338-L342 PolarHBondContact O-N 2.87Å
339Y89.5Confident87.8Confident28 Ų2845.2 Ų45.211%0.1122%0.216CC..Hα-helixtrans-56.4-49.8173.3174.4-95.3000111.1V275 R276 W277 V335 Y341 L342 T343V275-Y339 HydrophobicContact CB-CE2 4.34Å; V275-Y339 HydrophobicContact CG1-CD2 3.47Å; V275-Y339 VanDerWaalsContact CG1-CD2 3.47Å; V275-Y339 HydrophobicContact CG1-CE1 4.39Å; V275-Y339 HydrophobicContact CG1-CE2 3.25Å; V275-Y339 HydrophobicContact CG1-CG 4.12Å; R276-Y339 PolarHBondContact N-OH 3.34Å; R276-Y339 VanDerWaalsContact N-OH 3.08Å; R276-Y339 WeakPolarHBondContact O-CE2 3.24Å; R276-Y339 PolarHBondContact O-OH 3.03Å; W277-Y339 AromaticContact CD2-CD2 3.98Å; W277-Y339 HydrophobicContact CD2-CD2 3.98Å; W277-Y339 HydrophobicContact CD2-CE2 4.4Å; W277-Y339 AromaticContact CE3-CD2 3.9Å; W277-Y339 HydrophobicContact CE3-CD2 3.9Å; W277-Y339 HydrophobicContact CH2-CD2 4.11Å; W277-Y339 HydrophobicContact CZ2-CD2 4.17Å; W277-Y339 AromaticContact CZ3-CD2 3.97Å; W277-Y339 HydrophobicContact CZ3-CD2 3.97Å; V335-Y339 VanDerWaalsContact O-CB 3.26Å; V335-Y339 WeakPolarHBondContact O-CB 3.28Å; V335-Y339 PolarHBondContact O-N 3.44Å; Y339-Y341 VanDerWaalsContact C-N 3.32Å; Y339-Y341 PolarHBondContact O-N 3.28Å; Y339-L342 PolarHBondContact O-N 2.91Å; Y339-L342 VanDerWaalsContact O-N 3.07Å; Y339-T343 HydrophobicContact CD2-CG2 3.87Å; Y339-T343 HydrophobicContact CE1-CG2 4.18Å; Y339-T343 WeakPolarHBondContact CE1-OG1 3.44Å; Y339-T343 HydrophobicContact CE2-CG2 3.45Å; Y339-T343 VanDerWaalsContact CE2-CG2 3.45Å; Y339-T343 HydrophobicContact CG-CG2 4.4Å; Y339-T343 PolarHBondContact O-N 3.21Å; Y339-T343 PolarHBondContact O-OG1 3.23Å
340A86.9Confident87.6Confident4 Ų444.1 Ų44.13%0.03321%0.212CC..Hα-helixtrans-60.1-41.5179.100000112.1I24 R336 Q337 Y338 L342 T343 D344I24-A340 HydrophobicContact CG2-CB 3.57Å; R336-A340 PolarHBondContact O-N 2.92Å; R336-A340 VanDerWaalsContact O-N 3.09Å; Q337-A340 PolarHBondContact O-N 3.36Å; Y338-A340 VanDerWaalsContact C-N 3.35Å; Y338-A340 PolarHBondContact O-N 3.47Å; A340-L342 VanDerWaalsContact C-N 3.29Å; A340-L342 PolarHBondContact O-N 3.16Å; A340-T343 PolarHBondContact O-N 2.93Å; A340-D344 WeakPolarHBondContact O-CB 3.31Å; A340-D344 PolarHBondContact O-N 2.99Å
341Y88Confident87.3Confident71 Ų7144.1 Ų44.128%0.27821%0.213SC..Hα-helixtrans-61-34.1174.5174.6-105.4000113.5Q337 Y338 Y339 C347 R349 V350Q337-Y341 WeakPolarHBondContact O-CB 3.32Å; Q337-Y341 PolarHBondContact O-N 2.97Å; Y338-Y341 WeakPolarHBondContact O-CB 3.42Å; Y338-Y341 PolarHBondContact O-N 3.4Å; Y339-Y341 VanDerWaalsContact C-N 3.32Å; Y339-Y341 PolarHBondContact O-N 3.28Å; Y341-C347 WeakPolarHBondContact CD2-O 3.02Å; Y341-R349 VanDerWaalsContact CD2-C 3.46Å; Y341-R349 WeakPolarHBondContact CD2-O 3.3Å; Y341-V350 HydrophobicContact CD1-CG2 4Å; Y341-V350 HydrophobicContact CD2-CG2 4.08Å; Y341-V350 HydrophobicContact CE1-CG2 3.91Å; Y341-V350 HydrophobicContact CE2-CG2 3.98Å; Y341-V350 HydrophobicContact CG-CG2 4.08Å
342L86.6Confident87.1Confident25 Ų2546.2 Ų46.213%0.13123%0.226CC..Hα-helixtrans-83.3-31.9179.5-72-169.6000114.3Y338 Y339 A340Y338-L342 HydrophobicContact CD1-CD1 3.94Å; Y338-L342 HydrophobicContact CD1-CG 4.25Å; Y338-L342 HydrophobicContact CE1-CD1 3.25Å; Y338-L342 HydrophobicContact CE1-CD2 4.45Å; Y338-L342 HydrophobicContact CE1-CG 3.78Å; Y338-L342 PolarHBondContact O-N 2.87Å; Y339-L342 PolarHBondContact O-N 2.91Å; Y339-L342 VanDerWaalsContact O-N 3.07Å; A340-L342 VanDerWaalsContact C-N 3.29Å; A340-L342 PolarHBondContact O-N 3.16Å
343T82.4Confident87.2Confident43 Ų4345.9 Ų45.926%0.26422%0.221SC..Hα-helixtrans-101.3-27.8-172.261.70000114Y339 A340Y339-T343 HydrophobicContact CD2-CG2 3.87Å; Y339-T343 HydrophobicContact CE1-CG2 4.18Å; Y339-T343 WeakPolarHBondContact CE1-OG1 3.44Å; Y339-T343 HydrophobicContact CE2-CG2 3.45Å; Y339-T343 VanDerWaalsContact CE2-CG2 3.45Å; Y339-T343 HydrophobicContact CG-CG2 4.4Å; Y339-T343 PolarHBondContact O-N 3.21Å; Y339-T343 PolarHBondContact O-OG1 3.23Å; A340-T343 PolarHBondContact O-N 2.93Å
344D80.5Confident87.3Confident42 Ų4246.4 Ų46.423%0.22523%0.225CC..  trans-92.8116.8-177.7-166.7-27.9000110.3H20 I24 A340 Q346 C347H20-D344 IonicContact CE1-OD2 2.81Å; H20-D344 PolarHBondContact CE1-OD2 3.1Å; H20-D344 VanDerWaalsContact CE1-OD2 3.22Å; H20-D344 IonicContact NE2-OD2 3.22Å; I24-D344 VanDerWaalsContact CD1-OD2 3.24Å; I24-D344 WeakPolarHBondContact CD1-OD2 3.42Å; A340-D344 WeakPolarHBondContact O-CB 3.31Å; A340-D344 PolarHBondContact O-N 2.99Å; D344-Q346 PolarHBondContact O-N 3.37Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.04Å; D344-Q346 PolarHBondContact OD1-N 3.28Å; D344-C347 HydrophobicContact CB-CB 3.91Å; D344-C347 PolarHBondContact O-N 2.95Å; D344-C347 VanDerWaalsContact O-N 3.13Å
345T78Confident87.3Confident123 Ų12353.4 Ų53.476%0.75525%0.25SS*.THydrogen-bonded Turntrans-69-19.1-178.656.80000113.3
346Q75.3Confident87.5Confident71 Ų7153.8 Ų53.833%0.33225%0.252SS..THydrogen-bonded Turntrans-83-18.8175.4-55-65.8-65.300111.6D17 D344 K348D17-Q346 PolarHBondContact OD1-OE1 3.4Å; D344-Q346 PolarHBondContact O-N 3.37Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.04Å; D344-Q346 PolarHBondContact OD1-N 3.28Å; Q346-K348 PolarHBondContact O-N 2.89Å
347C79Confident87.8Confident8 Ų851.7 Ų51.75%0.05425%0.245CC..  trans-87.686.3-177.5-166.40000111.6I24 Y341 D344 R349I24-C347 HydrophobicContact CD1-CB 4.37Å; Y341-C347 WeakPolarHBondContact CD2-O 3.02Å; D344-C347 HydrophobicContact CB-CB 3.91Å; D344-C347 PolarHBondContact O-N 2.95Å; D344-C347 VanDerWaalsContact O-N 3.13Å; C347-R349 PolarHBondContact SG-O 3.33Å
348K80.6Confident88Confident150 Ų15052.2 Ų52.265%0.65225%0.251SS*.  trans-83.7-5.7-179-63.7173.6-175.4154.60114.8D17 Q346D17-K348 IonicContact OD2-NZ 3.62Å; D17-K348 PolarHBondContact OD2-NZ 3.48Å; Q346-K348 PolarHBondContact O-N 2.89Å
349R85.5Confident88.2Confident170 Ų17052 Ų5264%0.64225%0.254SS*.SBendtrans-125.4142.8-173.9-176.8179178.61772.1111.1F21 Y341 C347F21-R349 HydrophobicContact CD2-CB 4.09Å; F21-R349 HydrophobicContact CE2-CB 3.66Å; F21-R349 HydrophobicContact CE2-CG 3.99Å; F21-R349 WeakPolarHBondContact CE2-O 3.31Å; F21-R349 HydrophobicContact CZ-CB 4.25Å; F21-R349 HydrophobicContact CZ-CG 4.1Å; Y341-R349 VanDerWaalsContact CD2-C 3.46Å; Y341-R349 WeakPolarHBondContact CD2-O 3.3Å; C347-R349 PolarHBondContact SG-O 3.33Å
350V88Confident88.6Confident43 Ų4350.8 Ų50.826%0.26125%0.249SC..  trans-71.2135.1172.5-179.90000109.9Y341 C354 W355Y341-V350 HydrophobicContact CD1-CG2 4Å; Y341-V350 HydrophobicContact CD2-CG2 4.08Å; Y341-V350 HydrophobicContact CE1-CG2 3.91Å; Y341-V350 HydrophobicContact CE2-CG2 3.98Å; Y341-V350 HydrophobicContact CG-CG2 4.08Å; V350-C354 HydrophobicContact CG1-CB 3.69Å; V350-C354 VanDerWaalsContact CG1-SG 3.6Å; V350-W355 HydrophobicContact CG1-CB 4.42Å
351G88.9Confident89.1Confident1 Ų150.7 Ų50.71%0.0125%0.249CC..  trans-60.9153.8176.700000113N25 Q353 C354 W355N25-G351 WeakPolarHBondContact OD1-CA 3.46Å; G351-Q353 PolarHBondContact O-N 3.13Å; G351-C354 PolarHBondContact O-N 3.03Å; G351-W355 PolarHBondContact O-N 3.28Å
352T91.9Very high89.6Confident59 Ų5953.3 Ų53.336%0.36226%0.262SS..Hα-helixtrans-62-40-172.948.40000113.7M356T352-M356 WeakPolarHBondContact O-CB 3.49Å; T352-M356 PolarHBondContact O-N 2.91Å
353Q93.6Very high90.1Very high8 Ų853.5 Ų53.54%0.03726%0.263CS..Hα-helixtrans-68.8-44.2176.8-88.3-75.123.700111.1F105 S108 P333 Q337 G351 W355 M356 F357F105-Q353 VanDerWaalsContact CB-NE2 3.27Å; F105-Q353 HydrophobicContact CD2-CG 3.72Å; F105-Q353 HydrophobicContact CE2-CG 4.32Å; F105-Q353 HydrophobicContact CG-CG 4.37Å; S108-Q353 PolarHBondContact OG-OE1 2.97Å; P333-Q353 HydrophobicContact CB-CB 4.43Å; P333-Q353 HydrophobicContact CB-CG 4.36Å; P333-Q353 HydrophobicContact CG-CG 4.31Å; Q337-Q353 VanDerWaalsContact OE1-CB 3.24Å; G351-Q353 PolarHBondContact O-N 3.13Å; Q353-W355 VanDerWaalsContact C-N 3.31Å; Q353-W355 PolarHBondContact O-N 3.17Å; Q353-M356 PolarHBondContact O-N 3.13Å; Q353-F357 WeakPolarHBondContact O-CB 3.49Å; Q353-F357 PolarHBondContact O-N 2.86Å
354C95.1Very high90.8Very high16 Ų1651.5 Ų51.511%0.10825%0.251CS..Hα-helixtrans-61.3-40.7176.9-178.50000112.3T334 Q337 V350 G351 G358T334-C354 HydrophobicContact CG2-CB 4.13Å; Q337-C354 HydrophobicContact CB-CB 4.01Å; V350-C354 HydrophobicContact CG1-CB 3.69Å; V350-C354 VanDerWaalsContact CG1-SG 3.6Å; G351-C354 PolarHBondContact O-N 3.03Å; C354-G358 PolarHBondContact O-N 3.12Å
355W95.4Very high91.6Very high156 Ų15650.5 Ų50.559%0.59125%0.248SC*.Hα-helixtrans-63.7-46.2174.5-17691.4000111.6V350 G351 Q353 F357 G358 A359V350-W355 HydrophobicContact CG1-CB 4.42Å; G351-W355 PolarHBondContact O-N 3.28Å; Q353-W355 VanDerWaalsContact C-N 3.31Å; Q353-W355 PolarHBondContact O-N 3.17Å; W355-F357 PolarHBondContact O-N 2.87Å; W355-G358 PolarHBondContact O-N 3.02Å; W355-A359 HydrophobicContact CH2-CB 4.45Å; W355-A359 HydrophobicContact CZ3-CB 4.31Å; W355-A359 PolarHBondContact O-N 3.43Å
356M96.4Very high92.5Very high17 Ų1748.9 Ų48.98%0.08423%0.234CC..Hα-helixtrans-60.8-45.9178.8-176.659.360.900111.8F105 S108 V109 F112 T352 Q353 G358 A359 I360F105-M356 HydrophobicContact CE2-CB 4.07Å; F105-M356 HydrophobicContact CE2-CE 4.48Å; F105-M356 HydrophobicContact CE2-CG 4.29Å; S108-M356 WeakPolarHBondContact OG-CG 3.44Å; V109-M356 HydrophobicContact CG2-CE 3.81Å; V109-M356 HydrophobicContact CG2-SD 4.49Å; F112-M356 HydrophobicContact CB-SD 3.61Å; F112-M356 HydrophobicContact CD1-SD 4.32Å; F112-M356 HydrophobicContact CD2-SD 4.07Å; F112-M356 HydrophobicContact CG-SD 3.74Å; T352-M356 WeakPolarHBondContact O-CB 3.49Å; T352-M356 PolarHBondContact O-N 2.91Å; Q353-M356 PolarHBondContact O-N 3.13Å; M356-G358 PolarHBondContact O-N 2.63Å; M356-A359 WeakPolarHBondContact O-CB 3.5Å; M356-A359 PolarHBondContact O-N 3.3Å; M356-I360 HydrophobicContact CG-CD1 4.1Å; M356-I360 WeakPolarHBondContact O-CG1 3.16Å; M356-I360 PolarHBondContact O-N 3.24Å
357F96.9Very high93.5Very high25 Ų2545.5 Ų45.511%0.1122%0.219CC..Hα-helixtrans-61.7-42.6176.7-177.3-94000112.1T300 L327 I330 T331 T334 Q353 W355 A359 I360 A361T300-F357 HydrophobicContact CG2-CE1 3.67Å; T300-F357 HydrophobicContact CG2-CZ 3.68Å; L327-F357 HydrophobicContact CB-CE2 4.49Å; L327-F357 HydrophobicContact CD2-CD2 4.47Å; L327-F357 HydrophobicContact CD2-CE2 4.08Å; I330-F357 HydrophobicContact CB-CD2 4.42Å; I330-F357 HydrophobicContact CG2-CB 4.26Å; I330-F357 HydrophobicContact CG2-CD2 3.74Å; I330-F357 HydrophobicContact CG2-CG 4.45Å; T331-F357 WeakPolarHBondContact OG1-CE2 3.5Å; T334-F357 HydrophobicContact CG2-CB 3.91Å; T334-F357 HydrophobicContact CG2-CD1 3.78Å; T334-F357 HydrophobicContact CG2-CG 3.92Å; T334-F357 WeakPolarHBondContact OG1-CB 3.32Å; Q353-F357 WeakPolarHBondContact O-CB 3.49Å; Q353-F357 PolarHBondContact O-N 2.86Å; W355-F357 PolarHBondContact O-N 2.87Å; F357-A359 VanDerWaalsContact C-N 3.33Å; F357-A359 PolarHBondContact O-N 3.19Å; F357-I360 PolarHBondContact O-N 2.69Å; F357-A361 PolarHBondContact O-N 3.49Å
358G96.9Very high94.3Very high15 Ų1545.2 Ų45.216%0.15522%0.216CC..Hα-helixtrans-58.2-45.6172.800000112C354 W355 M356 I360 A361 F362C354-G358 PolarHBondContact O-N 3.12Å; W355-G358 PolarHBondContact O-N 3.02Å; M356-G358 PolarHBondContact O-N 2.63Å; G358-I360 PolarHBondContact O-N 2.68Å; G358-A361 PolarHBondContact O-N 3.23Å; G358-F362 WeakPolarHBondContact O-CD2 3.41Å; G358-F362 PolarHBondContact O-N 2.9Å
359A97.4Very high95Very high18 Ų1841.6 Ų41.615%0.14921%0.207CC..Hα-helixtrans-62.4-40.8177.600000112.4F112 W355 M356 F357 F362 L363F112-A359 HydrophobicContact CD2-CB 3.94Å; F112-A359 HydrophobicContact CE2-CB 3.71Å; W355-A359 HydrophobicContact CH2-CB 4.45Å; W355-A359 HydrophobicContact CZ3-CB 4.31Å; W355-A359 PolarHBondContact O-N 3.43Å; M356-A359 WeakPolarHBondContact O-CB 3.5Å; M356-A359 PolarHBondContact O-N 3.3Å; F357-A359 VanDerWaalsContact C-N 3.33Å; F357-A359 PolarHBondContact O-N 3.19Å; A359-F362 PolarHBondContact O-N 3.45Å; A359-L363 WeakPolarHBondContact O-CB 3.48Å; A359-L363 WeakPolarHBondContact O-CG 3.28Å; A359-L363 PolarHBondContact O-N 3.06Å
360I98.1Very high95.5Very high1 Ų136.9 Ų36.91%0.00519%0.191CC..Hα-helixtrans-59.8-50.7172.9-70.6163.6000110.5S108 Y111 F112 L115 L327 M356 F357 G358 F362 L363 E364S108-I360 WeakPolarHBondContact O-CD1 3.42Å; Y111-I360 HydrophobicContact CD1-CD1 4.23Å; Y111-I360 HydrophobicContact CD1-CG1 4.35Å; Y111-I360 HydrophobicContact CD1-CG2 3.63Å; Y111-I360 HydrophobicContact CE1-CG2 3.52Å; F112-I360 HydrophobicContact CB-CD1 4.47Å; F112-I360 HydrophobicContact CB-CG1 3.93Å; F112-I360 HydrophobicContact CD2-CG1 4.44Å; L115-I360 HydrophobicContact CD1-CG2 3.96Å; L327-I360 HydrophobicContact CD2-CG2 4.23Å; M356-I360 HydrophobicContact CG-CD1 4.1Å; M356-I360 WeakPolarHBondContact O-CG1 3.16Å; M356-I360 PolarHBondContact O-N 3.24Å; F357-I360 PolarHBondContact O-N 2.69Å; G358-I360 PolarHBondContact O-N 2.68Å; I360-F362 VanDerWaalsContact C-N 3.3Å; I360-F362 PolarHBondContact O-N 3.01Å; I360-L363 PolarHBondContact O-N 2.94Å; I360-L363 VanDerWaalsContact O-N 3.15Å; I360-E364 HydrophobicContact CG2-CG 4.32Å; I360-E364 WeakPolarHBondContact O-CG 3.42Å; I360-E364 PolarHBondContact O-N 3.2Å
361A97.5Very high95.9Very high3 Ų336 Ų363%0.02518%0.184CC..Hα-helixtrans-58.1-41.7-178.800000112.4T300 N303 F357 G358 A365T300-A361 HydrophobicContact CG2-CB 3.6Å; N303-A361 PolarHBondContact ND2-O 3.25Å; F357-A361 PolarHBondContact O-N 3.49Å; G358-A361 PolarHBondContact O-N 3.23Å; A361-A365 WeakPolarHBondContact O-CB 3.29Å; A361-A365 PolarHBondContact O-N 2.91Å; A361-A365 VanDerWaalsContact O-N 3.08Å
362F97.4Very high96.1Very high126 Ų12636.1 Ų36.155%0.55319%0.185SC*.Hα-helixtrans-71.1-38.3175.9-76.6-66.2000113.2L296 L299 G358 A359 I360 A365 L366L296-F362 HydrophobicContact CD2-CE2 4.01Å; L296-F362 HydrophobicContact CD2-CZ 3.87Å; L299-F362 HydrophobicContact CD2-CD1 4.33Å; L299-F362 HydrophobicContact CD2-CE1 4.21Å; G358-F362 WeakPolarHBondContact O-CD2 3.41Å; G358-F362 PolarHBondContact O-N 2.9Å; A359-F362 PolarHBondContact O-N 3.45Å; I360-F362 VanDerWaalsContact C-N 3.3Å; I360-F362 PolarHBondContact O-N 3.01Å; F362-A365 PolarHBondContact O-N 3.28Å; F362-L366 WeakPolarHBondContact O-CB 3.43Å; F362-L366 PolarHBondContact O-N 3.05Å
363L97.7Very high96.1Very high29 Ų2939.7 Ų39.715%0.15220%0.197CC..Hα-helixtrans-66.8-38.8176-76.3177.6000112.2F112 L115 V116 I119 A359 I360 L366 A367F112-L363 HydrophobicContact CD2-CD1 3.38Å; F112-L363 HydrophobicContact CE2-CD1 3.27Å; F112-L363 HydrophobicContact CE2-CG 4.3Å; F112-L363 HydrophobicContact CG-CD1 4.27Å; F112-L363 HydrophobicContact CZ-CD1 4.09Å; L115-L363 HydrophobicContact CB-CB 4.07Å; L115-L363 HydrophobicContact CB-CD1 4.12Å; L115-L363 HydrophobicContact CD1-CB 4.12Å; V116-L363 HydrophobicContact CG2-CD1 3.63Å; V116-L363 HydrophobicContact CG2-CD2 4.44Å; I119-L363 HydrophobicContact CD1-CB 4.16Å; I119-L363 HydrophobicContact CD1-CD2 3.62Å; I119-L363 HydrophobicContact CD1-CG 4.46Å; I119-L363 WeakPolarHBondContact CD1-O 3.38Å; A359-L363 WeakPolarHBondContact O-CB 3.48Å; A359-L363 WeakPolarHBondContact O-CG 3.28Å; A359-L363 PolarHBondContact O-N 3.06Å; I360-L363 PolarHBondContact O-N 2.94Å; I360-L363 VanDerWaalsContact O-N 3.15Å; L363-L366 PolarHBondContact O-N 3.15Å; L363-A367 WeakPolarHBondContact O-CB 3.45Å; L363-A367 PolarHBondContact O-N 3.46Å
364E97.4Very high95.9Very high1 Ų145.8 Ų45.81%0.00523%0.23CC..Hα-helixtrans-61.3-46.6172.4-74-178.1155.400111.3Y111 L115 N303 L307 R323 I360 L366 A367 C368Y111-E364 HydrophobicContact CE1-CG 4.5Å; Y111-E364 WeakPolarHBondContact CE1-OE1 3.44Å; Y111-E364 PolarHBondContact OH-OE1 3.15Å; L115-E364 HydrophobicContact CD1-CG 3.67Å; L115-E364 HydrophobicContact CD2-CG 4.25Å; N303-E364 HydrophobicContact CB-CB 4.2Å; N303-E364 VanDerWaalsContact ND2-CB 3.31Å; N303-E364 WeakPolarHBondContact ND2-CB 3.26Å; N303-E364 PolarHBondContact ND2-OE2 2.91Å; L307-E364 HydrophobicContact CD1-CB 4.35Å; L307-E364 HydrophobicContact CD1-CG 4.17Å; R323-E364 IonicContact CZ-OE1 3.38Å; R323-E364 IonicContact CZ-OE2 3.74Å; R323-E364 IonicContact NE-OE1 2.83Å; R323-E364 PolarHBondContact NE-OE1 3.04Å; R323-E364 IonicContact NH2-OE1 2.84Å; R323-E364 PolarHBondContact NH2-OE1 3.33Å; R323-E364 IonicContact NH2-OE2 2.73Å; R323-E364 PolarHBondContact NH2-OE2 2.92Å; I360-E364 HydrophobicContact CG2-CG 4.32Å; I360-E364 WeakPolarHBondContact O-CG 3.42Å; I360-E364 PolarHBondContact O-N 3.2Å; E364-L366 VanDerWaalsContact C-N 3.26Å; E364-L366 PolarHBondContact O-N 2.96Å; E364-A367 WeakPolarHBondContact O-CB 3.44Å; E364-A367 PolarHBondContact O-N 2.87Å; E364-A367 VanDerWaalsContact O-N 3.13Å; E364-C368 PolarHBondContact O-N 3.4Å; E364-C368 PolarHBondContact O-SG 3.41Å
365A96.5Very high95.6Very high20 Ų2045.9 Ų45.917%0.16523%0.23CC..Hα-helixtrans-59-41.617600000111.1L299 N303 A361 F362 C368 V369L299-A365 HydrophobicContact CD1-CB 4Å; N303-A365 WeakPolarHBondContact OD1-CA 3.41Å; A361-A365 WeakPolarHBondContact O-CB 3.29Å; A361-A365 PolarHBondContact O-N 2.91Å; A361-A365 VanDerWaalsContact O-N 3.08Å; F362-A365 PolarHBondContact O-N 3.28Å; A365-C368 WeakPolarHBondContact O-CB 3.33Å; A365-C368 PolarHBondContact O-N 2.88Å; A365-V369 WeakPolarHBondContact O-CG2 3.42Å; A365-V369 PolarHBondContact O-N 3.25Å
366L97.1Very high95.5Very high90 Ų9040.9 Ų40.947%0.47121%0.213SC..Hα-helixtrans-64.4-41175.4-177.759.4000112.1I119 F362 L363 E364 V369 K370I119-L366 HydrophobicContact CD1-CB 4.25Å; I119-L366 HydrophobicContact CD1-CD2 4.02Å; I119-L366 HydrophobicContact CD1-CG 4.16Å; I119-L366 HydrophobicContact CG2-CD2 4.29Å; F362-L366 WeakPolarHBondContact O-CB 3.43Å; F362-L366 PolarHBondContact O-N 3.05Å; L363-L366 PolarHBondContact O-N 3.15Å; E364-L366 VanDerWaalsContact C-N 3.26Å; E364-L366 PolarHBondContact O-N 2.96Å; L366-V369 PolarHBondContact O-N 3.3Å; L366-K370 VanDerWaalsContact O-CB 3.3Å; L366-K370 WeakPolarHBondContact O-CB 3.47Å; L366-K370 PolarHBondContact O-N 3.21Å
367A96.8Very high95.2Very high0 Ų044.6 Ų44.60%024%0.24CC..Hα-helixtrans-62.5-43.5174.500000111.1I119 L363 E364 K370 F371I119-A367 HydrophobicContact CD1-CB 4.45Å; I119-A367 HydrophobicContact CG1-CB 4.06Å; L363-A367 WeakPolarHBondContact O-CB 3.45Å; L363-A367 PolarHBondContact O-N 3.46Å; E364-A367 WeakPolarHBondContact O-CB 3.44Å; E364-A367 PolarHBondContact O-N 2.87Å; E364-A367 VanDerWaalsContact O-N 3.13Å; A367-K370 PolarHBondContact O-N 2.92Å; A367-F371 HydrophobicContact CB-CD2 4.3Å; A367-F371 HydrophobicContact CB-CE2 4.43Å; A367-F371 WeakPolarHBondContact O-CB 3.41Å; A367-F371 WeakPolarHBondContact O-CD2 3.45Å; A367-F371 PolarHBondContact O-N 3.18Å
368C96.1Very high94.9Very high1 Ų150.1 Ų50.11%0.00726%0.264CS..Hα-helixtrans-57.5-50.1173.7-68.40000111.2F306 I310 E364 A365 K370 G372 F376F306-C368 HydrophobicContact CB-CB 4.15Å; I310-C368 HydrophobicContact CD1-CB 3.85Å; I310-C368 WeakPolarHBondContact CD1-O 3.43Å; E364-C368 PolarHBondContact O-N 3.4Å; E364-C368 PolarHBondContact O-SG 3.41Å; A365-C368 WeakPolarHBondContact O-CB 3.33Å; A365-C368 PolarHBondContact O-N 2.88Å; C368-K370 PolarHBondContact O-N 2.05Å; C368-G372 VanDerWaalsContact O-CA 3.26Å; C368-G372 WeakPolarHBondContact O-CA 3.15Å; C368-G372 PolarHBondContact O-N 3.21Å; C368-F376 VanDerWaalsContact C-CE2 3.48Å; C368-F376 HydrophobicContact CB-CE2 3.98Å; C368-F376 HydrophobicContact CB-CZ 4.19Å; C368-F376 VanDerWaalsContact O-CE2 3.3Å; C368-F376 WeakPolarHBondContact O-CE2 3.3Å
369V94.8Very high94.6Very high75 Ų7551.7 Ų51.746%0.45527%0.271SS..Hα-helixtrans-63.7-42179.7172.70000111.6A365 L366 F376A365-V369 WeakPolarHBondContact O-CG2 3.42Å; A365-V369 PolarHBondContact O-N 3.25Å; L366-V369 PolarHBondContact O-N 3.3Å; V369-F376 HydrophobicContact CG2-CD1 4.5Å; V369-F376 HydrophobicContact CG2-CD2 4.41Å; V369-F376 HydrophobicContact CG2-CE1 4.37Å; V369-F376 HydrophobicContact CG2-CE2 4.3Å; V369-F376 HydrophobicContact CG2-CZ 4.27Å
370K95.6Very high94.3Very high70 Ų7056 Ų5630%0.30429%0.288SS..Hα-helixtrans-65.5-49.4-178.8-175.7-170.3176-166.10112.2I119 L121 L366 A367 C368 Q373I119-K370 HydrophobicContact CG2-CD 4.38Å; I119-K370 WeakPolarHBondContact O-CD 3.2Å; I119-K370 WeakPolarHBondContact O-CE 3.39Å; I119-K370 PolarHBondContact O-NZ 3.45Å; L121-K370 PolarHBondContact O-NZ 3.01Å; L366-K370 VanDerWaalsContact O-CB 3.3Å; L366-K370 WeakPolarHBondContact O-CB 3.47Å; L366-K370 PolarHBondContact O-N 3.21Å; A367-K370 PolarHBondContact O-N 2.92Å; C368-K370 PolarHBondContact O-N 2.05Å; K370-Q373 WeakPolarHBondContact O-CG 3.41Å
371F95.4Very high93.9Very high25 Ų2559.7 Ų59.711%0.1132%0.318CS..Hα-helixtrans-90.2-18.2-173.1-62.9-61000113L118 L121 W123 V126 I310 F311 A367L118-F371 HydrophobicContact CG-CE2 4.32Å; L118-F371 WeakPolarHBondContact O-CZ 3.48Å; L121-F371 VanDerWaalsContact O-CE1 3.31Å; L121-F371 WeakPolarHBondContact O-CE1 3.2Å; L121-F371 WeakPolarHBondContact O-CZ 3.29Å; W123-F371 HydrophobicContact CE3-CB 3.98Å; W123-F371 AromaticContact CE3-CD1 3.74Å; W123-F371 HydrophobicContact CE3-CD1 3.74Å; W123-F371 HydrophobicContact CE3-CG 4.09Å; W123-F371 HydrophobicContact CZ3-CB 3.87Å; W123-F371 HydrophobicContact CZ3-CD1 4.34Å; W123-F371 HydrophobicContact CZ3-CG 4.24Å; V126-F371 HydrophobicContact CG2-CE1 3.74Å; V126-F371 HydrophobicContact CG2-CE2 4.29Å; V126-F371 HydrophobicContact CG2-CZ 3.62Å; I310-F371 HydrophobicContact CG2-CB 3.77Å; F311-F371 HydrophobicContact CE1-CB 4.26Å; F311-F371 AromaticContact CE1-CD2 3.87Å; F311-F371 HydrophobicContact CE1-CD2 3.87Å; F311-F371 HydrophobicContact CE1-CE2 4.49Å; F311-F371 HydrophobicContact CE1-CG 4.13Å; F311-F371 AromaticContact CZ-CD2 3.68Å; F311-F371 HydrophobicContact CZ-CD2 3.68Å; F311-F371 HydrophobicContact CZ-CE2 4.26Å; F311-F371 HydrophobicContact CZ-CG 4.35Å; A367-F371 HydrophobicContact CB-CD2 4.3Å; A367-F371 HydrophobicContact CB-CE2 4.43Å; A367-F371 WeakPolarHBondContact O-CB 3.41Å; A367-F371 WeakPolarHBondContact O-CD2 3.45Å; A367-F371 PolarHBondContact O-N 3.18Å
372G93.3Very high93.5Very high3 Ų369.5 Ų69.53%0.03136%0.355CS..  trans-100.627.6178.500000114.4C368 D374 V375 F376C368-G372 VanDerWaalsContact O-CA 3.26Å; C368-G372 WeakPolarHBondContact O-CA 3.15Å; C368-G372 PolarHBondContact O-N 3.21Å; G372-D374 PolarHBondContact O-N 2.91Å; G372-D374 VanDerWaalsContact O-N 3.13Å; G372-V375 WeakPolarHBondContact O-CA 3.38Å; G372-V375 WeakPolarHBondContact O-CB 3.44Å; G372-V375 PolarHBondContact O-N 3.45Å; G372-F376 WeakPolarHBondContact O-CD2 3.34Å; G372-F376 PolarHBondContact O-N 2.88Å
373Q91.8Very high93.2Very high135 Ų13564.1 Ų64.163%0.63133%0.333SS*.Hα-helixtrans-50.9-39.4-177.1-74.5-178.9-5.300113K370 V375 F376 S377K370-Q373 WeakPolarHBondContact O-CG 3.41Å; Q373-V375 VanDerWaalsContact C-N 3.3Å; Q373-V375 PolarHBondContact O-N 3.14Å; Q373-F376 PolarHBondContact O-N 3.43Å; Q373-S377 VanDerWaalsContact O-CB 3.25Å; Q373-S377 WeakPolarHBondContact O-CB 3.4Å; Q373-S377 PolarHBondContact O-N 3.47Å
374D89.7Confident92.9Very high136 Ų13664.8 Ų64.873%0.72734%0.338SS*.Hα-helixtrans-62.5-37177.7-62.4-33.9000112.6G372 S377G372-D374 PolarHBondContact O-N 2.91Å; G372-D374 VanDerWaalsContact O-N 3.13Å; D374-S377 PolarHBondContact O-OG 2.95Å
375V90.2Very high92.6Very high18 Ų1870.8 Ų70.811%0.10936%0.364CS..Hα-helixtrans-74.4-52.8176.8-179.10000109.5L206 F306 G372 Q373 S377 K378L206-V375 HydrophobicContact CB-CG1 4.08Å; L206-V375 HydrophobicContact CD2-CG1 4.32Å; L206-V375 WeakPolarHBondContact CD2-O 3.21Å; F306-V375 HydrophobicContact CE1-CG1 4.08Å; G372-V375 WeakPolarHBondContact O-CA 3.38Å; G372-V375 WeakPolarHBondContact O-CB 3.44Å; G372-V375 PolarHBondContact O-N 3.45Å; Q373-V375 VanDerWaalsContact C-N 3.3Å; Q373-V375 PolarHBondContact O-N 3.14Å; V375-S377 PolarHBondContact O-N 3.28Å; V375-K378 WeakPolarHBondContact O-CB 3.44Å; V375-K378 PolarHBondContact O-N 3.26Å
376F91.7Very high92.5Very high51 Ų5174.7 Ų74.722%0.22438%0.379CS..Hα-helixtrans-68.1-20.1-176.5-75-76.6000113.6F306 I310 C368 V369 G372 Q373 K378 T379F306-F376 HydrophobicContact CD1-CE2 4.28Å; F306-F376 AromaticContact CD1-CZ 3.98Å; F306-F376 HydrophobicContact CD1-CZ 3.98Å; F306-F376 HydrophobicContact CD2-CZ 4.2Å; F306-F376 HydrophobicContact CE1-CE1 4.35Å; F306-F376 HydrophobicContact CE1-CE2 4.44Å; F306-F376 AromaticContact CE1-CZ 3.94Å; F306-F376 HydrophobicContact CE1-CZ 3.94Å; F306-F376 HydrophobicContact CE2-CE1 4.39Å; F306-F376 HydrophobicContact CE2-CZ 4.14Å; F306-F376 HydrophobicContact CG-CZ 4.14Å; F306-F376 HydrophobicContact CZ-CE1 4.15Å; F306-F376 HydrophobicContact CZ-CZ 4.03Å; I310-F376 HydrophobicContact CD1-CE2 4.09Å; C368-F376 VanDerWaalsContact C-CE2 3.48Å; C368-F376 HydrophobicContact CB-CE2 3.98Å; C368-F376 HydrophobicContact CB-CZ 4.19Å; C368-F376 VanDerWaalsContact O-CE2 3.3Å; C368-F376 WeakPolarHBondContact O-CE2 3.3Å; V369-F376 HydrophobicContact CG2-CD1 4.5Å; V369-F376 HydrophobicContact CG2-CD2 4.41Å; V369-F376 HydrophobicContact CG2-CE1 4.37Å; V369-F376 HydrophobicContact CG2-CE2 4.3Å; V369-F376 HydrophobicContact CG2-CZ 4.27Å; G372-F376 WeakPolarHBondContact O-CD2 3.34Å; G372-F376 PolarHBondContact O-N 2.88Å; Q373-F376 PolarHBondContact O-N 3.43Å; F376-K378 PolarHBondContact O-N 3.24Å; F376-T379 WeakPolarHBondContact CA-OG1 3.38Å; F376-T379 WeakPolarHBondContact O-CB 3.35Å; F376-T379 PolarHBondContact O-N 3.04Å; F376-T379 PolarHBondContact O-OG1 3.29Å
377S91.1Very high92.3Very high94 Ų9471.3 Ų71.366%0.65736%0.36SS*.THydrogen-bonded Turntrans-60.9-24171.372.50000113.2Q373 D374 V375 T379Q373-S377 VanDerWaalsContact O-CB 3.25Å; Q373-S377 WeakPolarHBondContact O-CB 3.4Å; Q373-S377 PolarHBondContact O-N 3.47Å; D374-S377 PolarHBondContact O-OG 2.95Å; V375-S377 PolarHBondContact O-N 3.28Å; S377-T379 VanDerWaalsContact C-N 3.33Å
378K90.8Very high92.1Very high142 Ų14274.1 Ų74.162%0.61738%0.375SS*.THydrogen-bonded Turntrans-89.51.7177.8-56.6174-174174.50112.8L206 V375 F376 Q380L206-K378 HydrophobicContact CD2-CB 3.98Å; V375-K378 WeakPolarHBondContact O-CB 3.44Å; V375-K378 PolarHBondContact O-N 3.26Å; F376-K378 PolarHBondContact O-N 3.24Å; K378-Q380 PolarHBondContact O-N 2.87Å
379T90.4Very high92Very high47 Ų4778.6 Ų78.629%0.28840%0.398SS..  trans-63.8123-176.2-55.10000110.8L206 F376 S377 A381 V384L206-T379 HydrophobicContact CD1-CG2 4.5Å; F376-T379 WeakPolarHBondContact CA-OG1 3.38Å; F376-T379 WeakPolarHBondContact O-CB 3.35Å; F376-T379 PolarHBondContact O-N 3.04Å; F376-T379 PolarHBondContact O-OG1 3.29Å; S377-T379 VanDerWaalsContact C-N 3.33Å; T379-A381 PolarHBondContact O-N 3.08Å; T379-V384 HydrophobicContact CG2-CG2 3.67Å
380Q90.4Very high91.9Very high108 Ų10877.1 Ų77.151%0.50539%0.391SS..  trans-85.8104173.6-63.8179-4.400109.4H205 K378 R382 S383 V384H205-Q380 PolarHBondContact NE2-N 3.37Å; K378-Q380 PolarHBondContact O-N 2.87Å; Q380-R382 PolarHBondContact O-N 3.02Å; Q380-R382 VanDerWaalsContact O-N 3.11Å; Q380-S383 WeakPolarHBondContact CB-OG 3.47Å; Q380-S383 WeakPolarHBondContact O-CB 3.23Å; Q380-S383 PolarHBondContact O-N 3.29Å; Q380-S383 PolarHBondContact OE1-OG 3.36Å; Q380-S383 VanDerWaalsContact OE1-OG 3.08Å; Q380-V384 PolarHBondContact O-N 2.99Å
381A89.6Confident91.6Very high79 Ų7973.8 Ų73.865%0.65338%0.376SS*.Hα-helixtrans-55.6-32-179.700000113.1T379 V384 F385T379-A381 PolarHBondContact O-N 3.08Å; A381-V384 PolarHBondContact O-N 2.82Å; A381-F385 PolarHBondContact O-N 3.5Å
382R90.7Very high91.4Very high209 Ų20973.5 Ų73.579%0.78938%0.379SS*.Hα-helixtrans-61-45.4173.6-68.4-177.1-178.2167.10.8111.8Q380 V384 F385 Q386Q380-R382 PolarHBondContact O-N 3.02Å; Q380-R382 VanDerWaalsContact O-N 3.11Å; R382-V384 PolarHBondContact O-N 3.3Å; R382-F385 PolarHBondContact O-N 3.39Å; R382-Q386 WeakPolarHBondContact O-CB 3.42Å; R382-Q386 VanDerWaalsContact O-CG 3.29Å; R382-Q386 WeakPolarHBondContact O-CG 3.17Å; R382-Q386 PolarHBondContact O-N 2.96Å
383S90Very high91.3Very high13 Ų1379.8 Ų79.89%0.09141%0.405CS..Hα-helixtrans-64.7-39.4179-50.10000111.4Q380 Q386 W387Q380-S383 WeakPolarHBondContact CB-OG 3.47Å; Q380-S383 WeakPolarHBondContact O-CB 3.23Å; Q380-S383 PolarHBondContact O-N 3.29Å; Q380-S383 PolarHBondContact OE1-OG 3.36Å; Q380-S383 VanDerWaalsContact OE1-OG 3.08Å; S383-Q386 PolarHBondContact O-N 2.8Å; S383-W387 WeakPolarHBondContact O-CB 3.35Å; S383-W387 PolarHBondContact O-N 3.42Å
384V91Very high91.3Very high43 Ų4375.2 Ų75.226%0.26139%0.385SS..Hα-helixtrans-63.1-45.4174.9-179.50000111.5F203 T379 Q380 A381 R382 W387 L388F203-V384 HydrophobicContact CE1-CG2 4.02Å; F203-V384 HydrophobicContact CZ-CG2 4.36Å; T379-V384 HydrophobicContact CG2-CG2 3.67Å; Q380-V384 PolarHBondContact O-N 2.99Å; A381-V384 PolarHBondContact O-N 2.82Å; R382-V384 PolarHBondContact O-N 3.3Å; V384-W387 PolarHBondContact O-N 2.96Å; V384-L388 HydrophobicContact CG1-CD1 4.49Å; V384-L388 WeakPolarHBondContact O-CG 3.31Å; V384-L388 PolarHBondContact O-N 3.37Å
385F92.8Very high91.3Very high127 Ų12768.9 Ų68.956%0.55735%0.351SS*.Hα-helixtrans-65.7-43.7178.7-177.7-101.8000111.9A381 R382 W387 L388 L389A381-F385 PolarHBondContact O-N 3.5Å; R382-F385 PolarHBondContact O-N 3.39Å; F385-W387 VanDerWaalsContact C-N 3.35Å; F385-L388 PolarHBondContact O-N 3.08Å; F385-L389 HydrophobicContact CD1-CD1 3.84Å; F385-L389 HydrophobicContact CD1-CG 4.35Å; F385-L389 HydrophobicContact CE1-CD1 3.26Å; F385-L389 HydrophobicContact CE1-CG 3.99Å; F385-L389 HydrophobicContact CZ-CD1 3.7Å; F385-L389 HydrophobicContact CZ-CD2 4.33Å; F385-L389 HydrophobicContact CZ-CG 4.09Å; F385-L389 WeakPolarHBondContact O-CG 3.35Å; F385-L389 PolarHBondContact O-N 3.38Å
386Q92.9Very high91.2Very high103 Ų10372.7 Ų72.748%0.48137%0.37SS..Hα-helixtrans-61.9-42.8175.2-74174.2-30.800111.6F202 R382 S383 L389 C390F202-Q386 HydrophobicContact CE1-CB 3.61Å; F202-Q386 HydrophobicContact CZ-CB 4.03Å; R382-Q386 WeakPolarHBondContact O-CB 3.42Å; R382-Q386 VanDerWaalsContact O-CG 3.29Å; R382-Q386 WeakPolarHBondContact O-CG 3.17Å; R382-Q386 PolarHBondContact O-N 2.96Å; S383-Q386 PolarHBondContact O-N 2.8Å; Q386-L389 PolarHBondContact O-N 2.84Å; Q386-C390 WeakPolarHBondContact O-CB 3.45Å; Q386-C390 PolarHBondContact O-N 2.96Å; Q386-C390 PolarHBondContact O-SG 3.22Å; Q386-C390 VanDerWaalsContact O-SG 3.35Å
387W93.9Very high91.1Very high18 Ų1875.1 Ų75.17%0.06839%0.385CS..Hα-helixtrans-57.1-50.6174.7169.571.2000111.8T199 F202 F203 Q298 S383 V384 F385 L389 C390 V391T199-W387 HydrophobicContact CG2-CZ2 4.31Å; T199-W387 PolarHBondContact OG1-NE1 3.01Å; F202-W387 HydrophobicContact CB-CB 4.1Å; F202-W387 HydrophobicContact CB-CG 4.42Å; F202-W387 HydrophobicContact CD1-CB 4.13Å; F202-W387 HydrophobicContact CD2-CB 3.78Å; F202-W387 AromaticContact CD2-CD1 3.75Å; F202-W387 HydrophobicContact CD2-CG 4.18Å; F202-W387 HydrophobicContact CE2-CB 4.21Å; F202-W387 HydrophobicContact CG-CB 3.75Å; F202-W387 HydrophobicContact CG-CG 4.37Å; F203-W387 AromaticContact CE2-CD2 3.76Å; F203-W387 HydrophobicContact CE2-CD2 3.76Å; F203-W387 AromaticContact CE2-CE2 3.91Å; F203-W387 HydrophobicContact CE2-CE3 4.11Å; F203-W387 AromaticContact CE2-CG 3.99Å; F203-W387 HydrophobicContact CE2-CG 3.99Å; F203-W387 HydrophobicContact CE2-CZ2 4.4Å; F203-W387 HydrophobicContact CZ-CD2 4.1Å; F203-W387 HydrophobicContact CZ-CE3 4.02Å; F203-W387 HydrophobicContact CZ-CG 4.42Å; F203-W387 HydrophobicContact CZ-CZ3 4.5Å; Q298-W387 HydrophobicContact CB-CZ2 3.91Å; Q298-W387 HydrophobicContact CG-CZ2 4.46Å; S383-W387 WeakPolarHBondContact O-CB 3.35Å; S383-W387 PolarHBondContact O-N 3.42Å; V384-W387 PolarHBondContact O-N 2.96Å; F385-W387 VanDerWaalsContact C-N 3.35Å; W387-L389 VanDerWaalsContact C-N 3.34Å; W387-L389 PolarHBondContact O-N 3.43Å; W387-C390 PolarHBondContact O-N 3.27Å; W387-V391 WeakPolarHBondContact O-CG2 3.46Å; W387-V391 PolarHBondContact O-N 2.85Å
388L92.4Very high91Very high59 Ų5971.7 Ų71.731%0.30936%0.361SS..Hα-helixtrans-58.1-45177-72.4173.3000112Y291 I295 V384 F385 V391 A392Y291-L388 PolarHBondContact OH-O 3.36Å; I295-L388 HydrophobicContact CD1-CD2 3.79Å; V384-L388 HydrophobicContact CG1-CD1 4.49Å; V384-L388 WeakPolarHBondContact O-CG 3.31Å; V384-L388 PolarHBondContact O-N 3.37Å; F385-L388 PolarHBondContact O-N 3.08Å; L388-V391 PolarHBondContact O-N 2.85Å; L388-A392 WeakPolarHBondContact O-CB 3.37Å; L388-A392 PolarHBondContact O-N 2.89Å
389L92.8Very high90.6Very high95 Ų9565.3 Ų65.350%0.49733%0.334SS..Hα-helixtrans-64.5-41.4177.3-72.6-175.9000112.5F385 Q386 W387 A392 F393F385-L389 HydrophobicContact CD1-CD1 3.84Å; F385-L389 HydrophobicContact CD1-CG 4.35Å; F385-L389 HydrophobicContact CE1-CD1 3.26Å; F385-L389 HydrophobicContact CE1-CG 3.99Å; F385-L389 HydrophobicContact CZ-CD1 3.7Å; F385-L389 HydrophobicContact CZ-CD2 4.33Å; F385-L389 HydrophobicContact CZ-CG 4.09Å; F385-L389 WeakPolarHBondContact O-CG 3.35Å; F385-L389 PolarHBondContact O-N 3.38Å; Q386-L389 PolarHBondContact O-N 2.84Å; W387-L389 VanDerWaalsContact C-N 3.34Å; W387-L389 PolarHBondContact O-N 3.43Å; L389-A392 PolarHBondContact O-N 3.23Å; L389-F393 VanDerWaalsContact O-CB 3.31Å; L389-F393 WeakPolarHBondContact O-CB 3.28Å; L389-F393 PolarHBondContact O-N 2.98Å
390C93Very high90.3Very high44 Ų4469.1 Ų69.130%0.29734%0.343SS..Hα-helixtrans-64.5-45.8177.6-77.70000111.6L198 F202 Q386 W387 A392 F393 I394L198-C390 HydrophobicContact CD2-CB 3.75Å; F202-C390 HydrophobicContact CE2-CB 4.07Å; F202-C390 HydrophobicContact CZ-CB 4.36Å; Q386-C390 WeakPolarHBondContact O-CB 3.45Å; Q386-C390 PolarHBondContact O-N 2.96Å; Q386-C390 PolarHBondContact O-SG 3.22Å; Q386-C390 VanDerWaalsContact O-SG 3.35Å; W387-C390 PolarHBondContact O-N 3.27Å; C390-A392 VanDerWaalsContact C-N 3.31Å; C390-A392 PolarHBondContact O-N 3.09Å; C390-F393 PolarHBondContact O-N 2.81Å; C390-I394 VanDerWaalsContact O-CG1 3.28Å; C390-I394 WeakPolarHBondContact O-CG1 3.48Å; C390-I394 PolarHBondContact O-N 3.49Å
391V90.4Very high90Very high0 Ų065.7 Ų65.70%034%0.337CS..Hα-helixtrans-61.1-42.7175.6176.40000110.4T195 Y291 M294 I295 W387 L388 T395T195-V391 HydrophobicContact CG2-CG2 4.39Å; Y291-V391 HydrophobicContact CE2-CG1 4.22Å; M294-V391 HydrophobicContact CB-CG1 4.44Å; I295-V391 HydrophobicContact CD1-CB 4.17Å; I295-V391 HydrophobicContact CD1-CG1 3.73Å; W387-V391 WeakPolarHBondContact O-CG2 3.46Å; W387-V391 PolarHBondContact O-N 2.85Å; L388-V391 PolarHBondContact O-N 2.85Å; V391-T395 VanDerWaalsContact O-CB 3.24Å; V391-T395 WeakPolarHBondContact O-CB 3.43Å; V391-T395 PolarHBondContact O-N 2.89Å; V391-T395 PolarHBondContact O-OG1 3.5Å
392A90Very high89.6Confident20 Ų2063.3 Ų63.317%0.16531%0.313CS..Hα-helixtrans-60.3-48.6175.600000111.9Y291 L388 L389 C390 T395 L396Y291-A392 HydrophobicContact CD2-CB 4.25Å; Y291-A392 HydrophobicContact CE2-CB 3.51Å; L388-A392 WeakPolarHBondContact O-CB 3.37Å; L388-A392 PolarHBondContact O-N 2.89Å; L389-A392 PolarHBondContact O-N 3.23Å; C390-A392 VanDerWaalsContact C-N 3.31Å; C390-A392 PolarHBondContact O-N 3.09Å; A392-T395 PolarHBondContact O-N 3.21Å; A392-L396 WeakPolarHBondContact O-CB 3.31Å; A392-L396 VanDerWaalsContact O-CG 3.24Å; A392-L396 WeakPolarHBondContact O-CG 3.36Å; A392-L396 PolarHBondContact O-N 3.47Å
393F92.4Very high89.2Confident134 Ų13455.1 Ų55.159%0.58829%0.286SS*.Hα-helixtrans-62.2-49-178.9177.9-100.8000112.3L389 C390 T395 L396 L397L389-F393 VanDerWaalsContact O-CB 3.31Å; L389-F393 WeakPolarHBondContact O-CB 3.28Å; L389-F393 PolarHBondContact O-N 2.98Å; C390-F393 PolarHBondContact O-N 2.81Å; F393-T395 VanDerWaalsContact C-N 3.33Å; F393-T395 PolarHBondContact O-N 3.39Å; F393-L396 PolarHBondContact O-N 3.14Å; F393-L397 HydrophobicContact CE1-CD1 4.29Å; F393-L397 HydrophobicContact CZ-CD1 4.27Å; F393-L397 WeakPolarHBondContact O-CB 3.16Å; F393-L397 PolarHBondContact O-N 3.01Å
394I92.1Very high88.7Confident39 Ų3960.9 Ų60.920%0.231%0.306CS..Hα-helixtrans-63.7-41.9179.3-63.8167.6000110.2T191 T195 L198 C390 L397 C398T191-I394 HydrophobicContact CG2-CG2 4.21Å; T195-I394 HydrophobicContact CG2-CB 4.09Å; T195-I394 HydrophobicContact CG2-CD1 4.02Å; T195-I394 HydrophobicContact CG2-CG2 3.93Å; L198-I394 HydrophobicContact CD2-CD1 3.64Å; C390-I394 VanDerWaalsContact O-CG1 3.28Å; C390-I394 WeakPolarHBondContact O-CG1 3.48Å; C390-I394 PolarHBondContact O-N 3.49Å; I394-L397 PolarHBondContact O-N 3.36Å; I394-C398 WeakPolarHBondContact O-CB 3.4Å; I394-C398 PolarHBondContact O-N 3.26Å
395T87.8Confident88.3Confident3 Ų365.9 Ų65.92%0.01832%0.321CS..Hα-helixtrans-60.4-48.7175.9-56.80000110.6I290 M294 V391 A392 F393 L397 C398 L399I290-T395 HydrophobicContact CG2-CG2 4.39Å; M294-T395 HydrophobicContact CG-CG2 4.03Å; V391-T395 VanDerWaalsContact O-CB 3.24Å; V391-T395 WeakPolarHBondContact O-CB 3.43Å; V391-T395 PolarHBondContact O-N 2.89Å; V391-T395 PolarHBondContact O-OG1 3.5Å; A392-T395 PolarHBondContact O-N 3.21Å; F393-T395 VanDerWaalsContact C-N 3.33Å; F393-T395 PolarHBondContact O-N 3.39Å; T395-L397 VanDerWaalsContact C-N 3.34Å; T395-L397 PolarHBondContact O-N 3.19Å; T395-C398 WeakPolarHBondContact O-CB 3.2Å; T395-C398 PolarHBondContact O-N 2.95Å; T395-L399 HydrophobicContact CG2-CD1 4.18Å; T395-L399 HydrophobicContact CG2-CG 4.3Å; T395-L399 WeakPolarHBondContact O-CB 3.19Å; T395-L399 VanDerWaalsContact O-CG 3.25Å; T395-L399 WeakPolarHBondContact O-CG 3.5Å; T395-L399 PolarHBondContact O-N 2.85Å
396L88.6Confident87.5Confident98 Ų9861.8 Ų61.851%0.51330%0.304SS..Hα-helixtrans-60.9-41.2178.3-73171.4000112.3V287 A392 F393 L399 Y400V287-L396 HydrophobicContact CG1-CD2 4.09Å; A392-L396 WeakPolarHBondContact O-CB 3.31Å; A392-L396 VanDerWaalsContact O-CG 3.24Å; A392-L396 WeakPolarHBondContact O-CG 3.36Å; A392-L396 PolarHBondContact O-N 3.47Å; F393-L396 PolarHBondContact O-N 3.14Å; L396-L399 PolarHBondContact O-N 3.44Å; L396-Y400 VanDerWaalsContact O-CB 3.31Å; L396-Y400 WeakPolarHBondContact O-CB 3.41Å; L396-Y400 PolarHBondContact O-N 2.99Å
397L90.1Very high86.7Confident103 Ų10361.8 Ų61.854%0.53930%0.304SS..Hα-helixtrans-63.3-44.2176.6-173.9146.3000111.4F393 I394 T395 Y400 G401F393-L397 HydrophobicContact CE1-CD1 4.29Å; F393-L397 HydrophobicContact CZ-CD1 4.27Å; F393-L397 WeakPolarHBondContact O-CB 3.16Å; F393-L397 PolarHBondContact O-N 3.01Å; I394-L397 PolarHBondContact O-N 3.36Å; T395-L397 VanDerWaalsContact C-N 3.34Å; T395-L397 PolarHBondContact O-N 3.19Å; L397-Y400 PolarHBondContact O-N 3.49Å; L397-G401 PolarHBondContact O-N 3.16Å
398C87.9Confident86Confident21 Ų2167.9 Ų67.914%0.14233%0.331CS..Hα-helixtrans-61.1-47174.2178.40000111.5A187 T191 I394 T395 Y400 G401 M402A187-C398 PolarHBondContact O-SG 3.43Å; T191-C398 HydrophobicContact CG2-CB 4.45Å; T191-C398 VanDerWaalsContact OG1-CB 3.22Å; T191-C398 WeakPolarHBondContact OG1-CB 3.46Å; T191-C398 PolarHBondContact OG1-SG 3.28Å; I394-C398 WeakPolarHBondContact O-CB 3.4Å; I394-C398 PolarHBondContact O-N 3.26Å; T395-C398 WeakPolarHBondContact O-CB 3.2Å; T395-C398 PolarHBondContact O-N 2.95Å; C398-Y400 VanDerWaalsContact C-N 3.34Å; C398-Y400 PolarHBondContact O-N 3.35Å; C398-G401 PolarHBondContact O-N 3.35Å; C398-M402 WeakPolarHBondContact O-CG 3.22Å; C398-M402 PolarHBondContact O-N 2.83Å
399L82.9Confident84.9Confident8 Ų869.7 Ų69.74%0.04233%0.334CS..Hα-helixtrans-60.2-46.1179-70-178.6000111L278 V287 I290 T395 L396 G401 M402 V403L278-L399 HydrophobicContact CD1-CD2 4.1Å; L278-L399 HydrophobicContact CD2-CD2 4.45Å; V287-L399 HydrophobicContact CB-CD1 4.3Å; V287-L399 HydrophobicContact CG1-CD1 3.51Å; V287-L399 HydrophobicContact CG2-CD1 4.44Å; I290-L399 HydrophobicContact CD1-CD2 3.8Å; I290-L399 HydrophobicContact CG2-CD2 3.99Å; T395-L399 HydrophobicContact CG2-CD1 4.18Å; T395-L399 HydrophobicContact CG2-CG 4.3Å; T395-L399 WeakPolarHBondContact O-CB 3.19Å; T395-L399 VanDerWaalsContact O-CG 3.25Å; T395-L399 WeakPolarHBondContact O-CG 3.5Å; T395-L399 PolarHBondContact O-N 2.85Å; L396-L399 PolarHBondContact O-N 3.44Å; L399-G401 VanDerWaalsContact C-N 3.34Å; L399-G401 PolarHBondContact O-N 3.37Å; L399-M402 HydrophobicContact CD2-CE 3.26Å; L399-M402 HydrophobicContact CG-CE 4.36Å; L399-M402 WeakPolarHBondContact O-CB 3.26Å; L399-M402 PolarHBondContact O-N 3.36Å; L399-V403 WeakPolarHBondContact O-CG2 3.46Å; L399-V403 PolarHBondContact O-N 3.29Å
400Y84.4Confident83.6Confident127 Ų12768.8 Ų68.850%0.49833%0.327SS..Hα-helixtrans-60.1-43175.7171.8-101.5000112.3L396 L397 C398 M402 V403 R404L396-Y400 VanDerWaalsContact O-CB 3.31Å; L396-Y400 WeakPolarHBondContact O-CB 3.41Å; L396-Y400 PolarHBondContact O-N 2.99Å; L397-Y400 PolarHBondContact O-N 3.49Å; C398-Y400 VanDerWaalsContact C-N 3.34Å; C398-Y400 PolarHBondContact O-N 3.35Å; Y400-M402 VanDerWaalsContact C-N 3.34Å; Y400-M402 PolarHBondContact O-N 3.48Å; Y400-V403 PolarHBondContact O-N 2.96Å; Y400-R404 HydrophobicContact CD1-CG 4.42Å; Y400-R404 HydrophobicContact CD2-CG 4.43Å; Y400-R404 HydrophobicContact CE1-CG 4.23Å; Y400-R404 HydrophobicContact CE2-CG 4.22Å; Y400-R404 WeakPolarHBondContact O-CB 3.3Å; Y400-R404 WeakPolarHBondContact O-CG 3.4Å; Y400-R404 PolarHBondContact O-N 2.84Å; Y400-R404 PolarHBondContact OH-NH1 3.03Å; Y400-R404 PolarHBondContact OH-NH2 3.18Å
401G84.1Confident82Confident36 Ų3670.5 Ų70.537%0.37134%0.338SS..Hα-helixtrans-58.4-44.2173.800000112.4L397 C398 L399 R404 Y405L397-G401 PolarHBondContact O-N 3.16Å; C398-G401 PolarHBondContact O-N 3.35Å; L399-G401 VanDerWaalsContact C-N 3.34Å; L399-G401 PolarHBondContact O-N 3.37Å; G401-R404 PolarHBondContact O-N 3.27Å; G401-Y405 VanDerWaalsContact O-CB 3.31Å; G401-Y405 WeakPolarHBondContact O-CB 3.37Å; G401-Y405 PolarHBondContact O-N 3.36Å
402M81.8Confident80.5Confident30 Ų3075.7 Ų75.715%0.14836%0.362CS..Hα-helixtrans-62.2-46.7175.9-71.5-167.8-66.100112.5A187 L188 L278 C398 L399 Y400 R404 Y405 E406A187-M402 HydrophobicContact CB-CG 3.59Å; A187-M402 HydrophobicContact CB-SD 3.37Å; A187-M402 WeakPolarHBondContact CB-SD 3.49Å; L188-M402 HydrophobicContact CD2-CE 4Å; L278-M402 HydrophobicContact CB-CE 4.32Å; L278-M402 HydrophobicContact CD2-CB 4.37Å; L278-M402 HydrophobicContact CD2-CE 4.4Å; C398-M402 WeakPolarHBondContact O-CG 3.22Å; C398-M402 PolarHBondContact O-N 2.83Å; L399-M402 HydrophobicContact CD2-CE 3.26Å; L399-M402 HydrophobicContact CG-CE 4.36Å; L399-M402 WeakPolarHBondContact O-CB 3.26Å; L399-M402 PolarHBondContact O-N 3.36Å; Y400-M402 VanDerWaalsContact C-N 3.34Å; Y400-M402 PolarHBondContact O-N 3.48Å; M402-R404 VanDerWaalsContact C-N 3.34Å; M402-R404 PolarHBondContact O-N 2.68Å; M402-Y405 PolarHBondContact O-N 2.61Å; M402-E406 PolarHBondContact O-N 3.36Å
403V81Confident79Confident37 Ų3781.3 Ų81.322%0.22439%0.389CS..Hα-helixtrans-59.4-47.2177.1177.50000110.7L278 L399 Y400 Y405 E406 Q407L278-V403 HydrophobicContact CD2-CB 4.48Å; L278-V403 HydrophobicContact CD2-CG2 3.21Å; L278-V403 HydrophobicContact CG-CG2 4.41Å; L399-V403 WeakPolarHBondContact O-CG2 3.46Å; L399-V403 PolarHBondContact O-N 3.29Å; Y400-V403 PolarHBondContact O-N 2.96Å; V403-Y405 VanDerWaalsContact C-N 3.33Å; V403-Y405 PolarHBondContact O-N 2.94Å; V403-E406 PolarHBondContact O-N 2.87Å; V403-Q407 HydrophobicContact CG1-CG 4.24Å; V403-Q407 WeakPolarHBondContact O-CB 3.34Å; V403-Q407 VanDerWaalsContact O-CG 3.29Å; V403-Q407 WeakPolarHBondContact O-CG 3.3Å; V403-Q407 PolarHBondContact O-N 3.11Å
404R80.9Confident77.2Confident133 Ų13380.1 Ų80.150%0.50238%0.383SS..Hα-helixtrans-61.5-41.6179.7-81.5-80.1177.982.41.1112.2Y400 G401 M402 K408Y400-R404 HydrophobicContact CD1-CG 4.42Å; Y400-R404 HydrophobicContact CD2-CG 4.43Å; Y400-R404 HydrophobicContact CE1-CG 4.23Å; Y400-R404 HydrophobicContact CE2-CG 4.22Å; Y400-R404 WeakPolarHBondContact O-CB 3.3Å; Y400-R404 WeakPolarHBondContact O-CG 3.4Å; Y400-R404 PolarHBondContact O-N 2.84Å; Y400-R404 PolarHBondContact OH-NH1 3.03Å; Y400-R404 PolarHBondContact OH-NH2 3.18Å; G401-R404 PolarHBondContact O-N 3.27Å; M402-R404 VanDerWaalsContact C-N 3.34Å; M402-R404 PolarHBondContact O-N 2.68Å; R404-K408 WeakPolarHBondContact O-CB 3.49Å; R404-K408 PolarHBondContact O-N 3.06Å; R404-K408 VanDerWaalsContact O-N 3.17Å
405Y81.2Confident75.4Confident149 Ų14981.2 Ų81.258%0.58439%0.394SS*.Hα-helixtrans-63.2-50.9176.8-176-89.6000110.6G401 M402 V403 Q407 K408 Y409G401-Y405 VanDerWaalsContact O-CB 3.31Å; G401-Y405 WeakPolarHBondContact O-CB 3.37Å; G401-Y405 PolarHBondContact O-N 3.36Å; M402-Y405 PolarHBondContact O-N 2.61Å; V403-Y405 VanDerWaalsContact C-N 3.33Å; V403-Y405 PolarHBondContact O-N 2.94Å; Y405-Q407 PolarHBondContact O-N 3.13Å; Y405-K408 PolarHBondContact O-N 2.81Å; Y405-Y409 HydrophobicContact CD1-CD2 4.12Å; Y405-Y409 AromaticContact CD2-CD2 3.67Å; Y405-Y409 HydrophobicContact CD2-CD2 3.67Å; Y405-Y409 AromaticContact CD2-CE2 3.56Å; Y405-Y409 HydrophobicContact CD2-CE2 3.56Å; Y405-Y409 AromaticContact CE1-CD2 3.95Å; Y405-Y409 HydrophobicContact CE1-CD2 3.95Å; Y405-Y409 AromaticContact CE2-CD2 3.51Å; Y405-Y409 HydrophobicContact CE2-CD2 3.51Å; Y405-Y409 AromaticContact CE2-CE2 3.29Å; Y405-Y409 HydrophobicContact CE2-CE2 3.29Å; Y405-Y409 AromaticContact CG-CD2 3.98Å; Y405-Y409 HydrophobicContact CG-CD2 3.98Å; Y405-Y409 HydrophobicContact CG-CE2 4.31Å; Y405-Y409 AromaticContact CZ-CD2 3.64Å; Y405-Y409 AromaticContact CZ-CE2 3.85Å; Y405-Y409 VanDerWaalsContact O-CD2 3.3Å; Y405-Y409 WeakPolarHBondContact O-CD2 3.46Å; Y405-Y409 PolarHBondContact O-N 3.45Å; Y405-Y409 VanDerWaalsContact O-N 3.09Å
406E75.7Confident73.8Confident41 Ų4184.9 Ų84.919%0.19242%0.416CS..Hα-helixtrans-61.2-43.9179-71.6-171154.800112.2R276 P280 M402 V403 K408 Y409 E410R276-E406 IonicContact CZ-OE1 3.85Å; R276-E406 IonicContact CZ-OE2 2.97Å; R276-E406 IonicContact NE-OE1 3.6Å; R276-E406 PolarHBondContact NE-OE1 2.99Å; R276-E406 IonicContact NE-OE2 3.78Å; R276-E406 IonicContact NH2-OE1 2.72Å; R276-E406 PolarHBondContact NH2-OE1 2.93Å; R276-E406 IonicContact NH2-OE2 3.77Å; R276-E406 PolarHBondContact NH2-OE2 3.4Å; P280-E406 VanDerWaalsContact CD-OE2 3.24Å; P280-E406 WeakPolarHBondContact CD-OE2 3.36Å; P280-E406 HydrophobicContact CG-CB 4.21Å; P280-E406 WeakPolarHBondContact CG-OE2 3.35Å; M402-E406 PolarHBondContact O-N 3.36Å; V403-E406 PolarHBondContact O-N 2.87Å; E406-K408 PolarHBondContact O-N 3.31Å; E406-Y409 PolarHBondContact O-N 3.36Å; E406-E410 WeakPolarHBondContact O-CB 3.2Å; E406-E410 PolarHBondContact O-N 2.87Å
407Q78.2Confident71.9Confident103 Ų10383 Ų8348%0.48141%0.412SS..Hα-helixtrans-60.2-32.3177-75.6176.1-1700113.5V403 Y405 P411V403-Q407 HydrophobicContact CG1-CG 4.24Å; V403-Q407 WeakPolarHBondContact O-CB 3.34Å; V403-Q407 VanDerWaalsContact O-CG 3.29Å; V403-Q407 WeakPolarHBondContact O-CG 3.3Å; V403-Q407 PolarHBondContact O-N 3.11Å; Y405-Q407 PolarHBondContact O-N 3.13Å; Q407-P411 VanDerWaalsContact O-CD 3.26Å; Q407-P411 WeakPolarHBondContact O-CD 3.44Å; Q407-P411 WeakPolarHBondContact O-CG 3.42Å
408K78.6Confident70.1Confident146 Ų14685 Ų8564%0.63542%0.419SS*.Hα-helixtrans-80.1-38-178.6-170.9176.7179.5-174.50112.5R404 Y405 E406R404-K408 WeakPolarHBondContact O-CB 3.49Å; R404-K408 PolarHBondContact O-N 3.06Å; R404-K408 VanDerWaalsContact O-N 3.17Å; Y405-K408 PolarHBondContact O-N 2.81Å; E406-K408 PolarHBondContact O-N 3.31Å
409Y68.6Low68.2Low96 Ų9686.9 Ų86.938%0.37643%0.431SS..Hα-helixtrans-100.5-18.7-172.4-71.3-77.7000114.5Y405 E406 P411 E412 L413Y405-Y409 HydrophobicContact CD1-CD2 4.12Å; Y405-Y409 AromaticContact CD2-CD2 3.67Å; Y405-Y409 HydrophobicContact CD2-CD2 3.67Å; Y405-Y409 AromaticContact CD2-CE2 3.56Å; Y405-Y409 HydrophobicContact CD2-CE2 3.56Å; Y405-Y409 AromaticContact CE1-CD2 3.95Å; Y405-Y409 HydrophobicContact CE1-CD2 3.95Å; Y405-Y409 AromaticContact CE2-CD2 3.51Å; Y405-Y409 HydrophobicContact CE2-CD2 3.51Å; Y405-Y409 AromaticContact CE2-CE2 3.29Å; Y405-Y409 HydrophobicContact CE2-CE2 3.29Å; Y405-Y409 AromaticContact CG-CD2 3.98Å; Y405-Y409 HydrophobicContact CG-CD2 3.98Å; Y405-Y409 HydrophobicContact CG-CE2 4.31Å; Y405-Y409 AromaticContact CZ-CD2 3.64Å; Y405-Y409 AromaticContact CZ-CE2 3.85Å; Y405-Y409 VanDerWaalsContact O-CD2 3.3Å; Y405-Y409 WeakPolarHBondContact O-CD2 3.46Å; Y405-Y409 PolarHBondContact O-N 3.45Å; Y405-Y409 VanDerWaalsContact O-N 3.09Å; E406-Y409 PolarHBondContact O-N 3.36Å; Y409-P411 VanDerWaalsContact C-CD 3.5Å; Y409-E412 WeakPolarHBondContact CD1-OE2 3.41Å; Y409-E412 PolarHBondContact O-N 3.37Å; Y409-L413 PolarHBondContact O-N 3.08Å
410E65.5Low66.6Low76 Ų7691.5 Ų91.536%0.35546%0.456SS..Hα-helixtrans-61.3-40.1174.1-167.8-172.5167.800113.6E406 E412 K414E406-E410 WeakPolarHBondContact O-CB 3.2Å; E406-E410 PolarHBondContact O-N 2.87Å; E410-E412 VanDerWaalsContact C-N 3.34Å; E410-K414 WeakPolarHBondContact O-CG 3.41Å; E410-K414 PolarHBondContact O-N 2.86Å; E410-K414 IonicContact OE1-NZ 2.72Å; E410-K414 PolarHBondContact OE1-NZ 3.5Å
411P60.5Low64.9Low80 Ų8090.8 Ų90.852%0.51946%0.461SS..Hα-helixtrans-65.1-38.3175.1-1830.9000112.5Q407 Y409 K414 S415Q407-P411 VanDerWaalsContact O-CD 3.26Å; Q407-P411 WeakPolarHBondContact O-CD 3.44Å; Q407-P411 WeakPolarHBondContact O-CG 3.42Å; Y409-P411 VanDerWaalsContact C-CD 3.5Å; P411-K414 PolarHBondContact O-N 3.18Å; P411-S415 PolarHBondContact O-N 2.83Å; P411-S415 PolarHBondContact O-OG 3.37Å
412E59.1Low63Low110 Ų11090.8 Ų90.851%0.51446%0.461SS..Hα-helixtrans-70.5-39.8-176.8-158.3171.5-163.600111.2Y409 E410 S415 V416Y409-E412 WeakPolarHBondContact CD1-OE2 3.41Å; Y409-E412 PolarHBondContact O-N 3.37Å; E410-E412 VanDerWaalsContact C-N 3.34Å; E412-S415 WeakPolarHBondContact CA-OG 3.47Å; E412-S415 PolarHBondContact O-N 3.47Å; E412-S415 PolarHBondContact O-OG 3.01Å; E412-V416 VanDerWaalsContact O-CG2 3.31Å; E412-V416 WeakPolarHBondContact O-CG2 3.47Å; E412-V416 PolarHBondContact O-N 3.02Å
413L56.8Low60.9Low137 Ų13794.1 Ų94.172%0.71748%0.479SS*.Hα-helixtrans-68.2-38.7175.7-149.380.7000112.3Y409 V416 S417Y409-L413 PolarHBondContact O-N 3.08Å; L413-V416 PolarHBondContact O-N 3.42Å; L413-S417 PolarHBondContact O-N 3.13Å; L413-S417 PolarHBondContact O-OG 3.05Å
414K56.4Low58.9Low110 Ų11098.5 Ų98.548%0.47850%0.501SS..Hα-helixtrans-65.6-41174.5-77.9177-179.5162.80111.9E410 P411 V416 S417 E418E410-K414 WeakPolarHBondContact O-CG 3.41Å; E410-K414 PolarHBondContact O-N 2.86Å; E410-K414 IonicContact OE1-NZ 2.72Å; E410-K414 PolarHBondContact OE1-NZ 3.5Å; P411-K414 PolarHBondContact O-N 3.18Å; K414-V416 VanDerWaalsContact C-N 3.34Å; K414-V416 PolarHBondContact O-N 3.42Å; K414-S417 WeakPolarHBondContact CA-OG 3.18Å; K414-S417 PolarHBondContact O-N 3.39Å; K414-S417 PolarHBondContact O-OG 2.9Å; K414-E418 WeakPolarHBondContact O-CB 3.33Å; K414-E418 WeakPolarHBondContact O-CG 3.25Å; K414-E418 PolarHBondContact O-N 2.81Å
415S53.5Low56.9Low62 Ų6298.3 Ų98.343%0.43451%0.508SS..Hα-helixtrans-65.7-35.4175.856.40000113P411 E412 S419P411-S415 PolarHBondContact O-N 2.83Å; P411-S415 PolarHBondContact O-OG 3.37Å; E412-S415 WeakPolarHBondContact CA-OG 3.47Å; E412-S415 PolarHBondContact O-N 3.47Å; E412-S415 PolarHBondContact O-OG 3.01Å; S415-S419 WeakPolarHBondContact O-CB 3.43Å; S415-S419 PolarHBondContact O-N 2.83Å; S415-S419 PolarHBondContact O-OG 3.23Å; S415-S419 VanDerWaalsContact O-OG 3.08Å
416V54.9Low54.7Low79 Ų7998.6 Ų98.648%0.47952%0.515SS..Hα-helixtrans-71.3-42.9177.1172.10000111.1E412 L413 K414 E418 S419 D420E412-V416 VanDerWaalsContact O-CG2 3.31Å; E412-V416 WeakPolarHBondContact O-CG2 3.47Å; E412-V416 PolarHBondContact O-N 3.02Å; L413-V416 PolarHBondContact O-N 3.42Å; K414-V416 VanDerWaalsContact C-N 3.34Å; K414-V416 PolarHBondContact O-N 3.42Å; V416-E418 PolarHBondContact O-N 3.41Å; V416-S419 VanDerWaalsContact CA-OG 3.31Å; V416-S419 WeakPolarHBondContact CA-OG 3.37Å; V416-S419 PolarHBondContact O-N 3.29Å; V416-S419 PolarHBondContact O-OG 2.9Å; V416-D420 PolarHBondContact O-N 3.49Å
417S48.4Very low52.6Low60 Ų60101.5 Ų101.542%0.4254%0.54SS..Hα-helixtrans-64.2-39175.155.20000112.9L413 K414 S419 D420 D421L413-S417 PolarHBondContact O-N 3.13Å; L413-S417 PolarHBondContact O-OG 3.05Å; K414-S417 WeakPolarHBondContact CA-OG 3.18Å; K414-S417 PolarHBondContact O-N 3.39Å; K414-S417 PolarHBondContact O-OG 2.9Å; S417-S419 VanDerWaalsContact C-N 3.33Å; S417-D420 PolarHBondContact O-N 2.66Å; S417-D421 PolarHBondContact O-N 3.03Å; S417-D421 VanDerWaalsContact O-N 3.08Å
418E52.6Low50.5Low145 Ų145101.8 Ų101.868%0.67855%0.552SS**Hα-helixtrans-69.3-31175.9-74.9176169.700112.1K414 V416 G422K414-E418 WeakPolarHBondContact O-CB 3.33Å; K414-E418 WeakPolarHBondContact O-CG 3.25Å; K414-E418 PolarHBondContact O-N 2.81Å; V416-E418 PolarHBondContact O-N 3.41Å; E418-G422 PolarHBondContact O-N 3.22Å
419S47Very low48.2Very low59 Ų59101.7 Ų101.741%0.41356%0.558SS.*Hα-helixtrans-75.6-32.8174.660.90000114.2S415 V416 S417 N423S415-S419 WeakPolarHBondContact O-CB 3.43Å; S415-S419 PolarHBondContact O-N 2.83Å; S415-S419 PolarHBondContact O-OG 3.23Å; S415-S419 VanDerWaalsContact O-OG 3.08Å; V416-S419 VanDerWaalsContact CA-OG 3.31Å; V416-S419 WeakPolarHBondContact CA-OG 3.37Å; V416-S419 PolarHBondContact O-N 3.29Å; V416-S419 PolarHBondContact O-OG 2.9Å; S417-S419 VanDerWaalsContact C-N 3.33Å; S419-N423 PolarHBondContact O-N 3.44Å; S419-N423 VanDerWaalsContact O-N 3.12Å; S419-N423 PolarHBondContact O-ND2 2.9Å
420D49.4Very low46.4Very low106 Ų106107.6 Ų107.657%0.56758%0.582SS**Hα-helixtrans-73.8-37.5174.9-102.2-3.9000111.9V416 S417 L424V416-D420 PolarHBondContact O-N 3.49Å; S417-D420 PolarHBondContact O-N 2.66Å; D420-L424 PolarHBondContact O-N 3.36Å
421D48.8Very low44.8Very low112 Ų112111.3 Ų111.360%0.59960%0.604SS**Hα-helixtrans-70.3-32.4172.1-80.7-24.6000111.9S417 L424 I425S417-D421 PolarHBondContact O-N 3.03Å; S417-D421 VanDerWaalsContact O-N 3.08Å; D421-L424 PolarHBondContact O-N 3.27Å; D421-I425 WeakPolarHBondContact O-CG1 3.29Å; D421-I425 PolarHBondContact O-N 3.08Å
422G44.2Very low43.4Very low35 Ų35115.5 Ų115.536%0.36162%0.62SS.*Hα-helixtrans-64.8-39.8173.400000113.4E418 L424 I425 E426E418-G422 PolarHBondContact O-N 3.22Å; G422-L424 VanDerWaalsContact C-N 3.34Å; G422-L424 PolarHBondContact O-N 3.05Å; G422-I425 PolarHBondContact O-N 2.93Å; G422-E426 PolarHBondContact O-N 3.04Å; G422-E426 VanDerWaalsContact O-N 3.16Å
423N38.5Very low41.9Very low100 Ų100117.5 Ų117.554%0.53564%0.64SS.*Hα-helixtrans-71-26177.5-76.7-31000113.4S419S419-N423 PolarHBondContact O-N 3.44Å; S419-N423 VanDerWaalsContact O-N 3.12Å; S419-N423 PolarHBondContact O-ND2 2.9Å
424L37.8Very low40.5Very low129 Ų129114.2 Ų114.268%0.67564%0.639SS**Hα-helixtrans-75.7-29.2174.2-115.9101000112.8D420 D421 G422D420-L424 PolarHBondContact O-N 3.36Å; D421-L424 PolarHBondContact O-N 3.27Å; G422-L424 VanDerWaalsContact C-N 3.34Å; G422-L424 PolarHBondContact O-N 3.05Å
425I39.8Very low39.1Very low129 Ų129118.5 Ų118.566%0.66266%0.661SS**Hα-helixtrans-80.2-34.8179.1-64.8171.7000110.8D421 G422 S427 C428D421-I425 WeakPolarHBondContact O-CG1 3.29Å; D421-I425 PolarHBondContact O-N 3.08Å; G422-I425 PolarHBondContact O-N 2.93Å; I425-S427 VanDerWaalsContact C-N 3.28Å; I425-S427 PolarHBondContact O-N 3.11Å; I425-C428 PolarHBondContact O-N 3.31Å
426E34.2Very low37.8Very low156 Ų156126.6 Ų126.673%0.72968%0.682SS**Hα-helixtrans-72.3-20179-139.1172.9-16300113.3G422 C428G422-E426 PolarHBondContact O-N 3.04Å; G422-E426 VanDerWaalsContact O-N 3.16Å; E426-C428 VanDerWaalsContact C-N 3.34Å
427S32.4Very low36.6Very low101 Ų101129.6 Ų129.671%0.70670%0.695SS**THydrogen-bonded Turntrans-78.6-11.3173.9178.40000114.3I425I425-S427 VanDerWaalsContact C-N 3.28Å; I425-S427 PolarHBondContact O-N 3.11Å
428C33.7Very low35.5Very low109 Ų109131.5 Ų131.574%0.73671%0.708SS**THydrogen-bonded Turntrans-106.63-173.8-72.70000114.9I425 E426I425-C428 PolarHBondContact O-N 3.31Å; E426-C428 VanDerWaalsContact C-N 3.34Å
429D29.4Very low34.3Very low145 Ų145136.2 Ų136.278%0.77572%0.72SS**  trans-110.821.2-170.6-144.525000115.6
430Y30.6Very low33.3Very low220 Ų220140.6 Ų140.686%0.86374%0.739SS**SBendtrans-113.184.1168-96.6-86.3000111
431D32.4Very low32.3Very low154 Ų154142.5 Ų142.582%0.82475%0.749SS**  trans163.170.5135.5-100-18.1000111.7
432I31Very low31.3Very low168 Ų168142.2 Ų142.286%0.86276%0.756SS**  trans-142.777.3153.7-50.6-179.9000109.7
433T28.5Very low30.5Very low151 Ų151144.7 Ų144.793%0.92677%0.773SS**  trans-137.294.4151.8440000110
434G26.3Very low30Very low68 Ų68145.7 Ų145.770%0.70179%0.787SS**  trans-165.4114.2171.700000110.7
435E27.3Very low30.5Very low200 Ų200145.3 Ų145.394%0.93579%0.793SS**  trans80.687.2166.5-61.1-173.5126.700119
436R27.4Very low29.8Very low233 Ų233144.3 Ų144.388%0.87980%0.797SS**  trans-67.8129.6135.8-93.9179.1179.8170.41108.8
437D28.1Very low29.6Very low142 Ų142146.2 Ų146.276%0.75980%0.803SS**  170.7147103.3-100.3-23000114.9
438S26.4Very low29.4Very low99 Ų99151 Ų15169%0.69281%0.814SS**  trans76.998.4146.3-62.40000121.1
439R26.3Very low29.1Very low245 Ų245149.5 Ų149.593%0.92582%0.817SS**  162.8128.9102.3-94.4171.6175.5176.1-0.6113.9
440N26.9Very low29.1Very low151 Ų151155 Ų15581%0.80783%0.827SS**  trans-61.5141.2161.7-75.5-26.1000112.3
441N28.1Very low28.9Very low146 Ų146148.5 Ų148.578%0.78183%0.828SS**  169.9128.5112.6-94.8-10.5000114.3
442S27.2Very low28.7Very low105 Ų105146.9 Ų146.973%0.73483%0.828SS**  trans22.8139.3138.250.60000124.2
443A28.5Very low28.6Very low87 Ų87143.1 Ų143.172%0.71982%0.822SS**  trans83.7106.3134.900000121.3
444S27.2Very low28.6Very low121 Ų121146.5 Ų146.585%0.84682%0.818SS**  71152.6124.8-560000121.7
445P47.8Very low28.7Very low121 Ų121148.8 Ų148.879%0.78682%0.818SS**  trans-106.6154.3-154.438.5-28.5000113.3
446S25.6Very low28.7Very low108 Ų108148.4 Ų148.476%0.75581%0.813SS**  trans-170149.3149.569.90000115.3
447K29.8Very low28.8Very low196 Ų196141.5 Ų141.585%0.85281%0.807SS**  trans92.9100.8144.5-78.6170.2-177.7-177.80121.6
448Q28.8Very low29Very low201 Ų201141.3 Ų141.394%0.93981%0.81SS**  -11141.1129.9-77.1174.7-22.600117.8
449G28Very low29.2Very low78 Ų78144.4 Ų144.480%0.80482%0.819SS**  trans-165.399.8157.800000112.4
450R28.4Very low29.4Very low261 Ų261136.1 Ų136.199%0.98581%0.81SS**  trans-63.8148.9164.3-92.4172.3161.8172.1-5.4110.5
451G27.6Very low29.4Very low84 Ų84138.1 Ų138.187%0.86681%0.814SS**  trans179.4115160.700000113.5
452S27.1Very low29.5Very low120 Ų120139.7 Ų139.784%0.83982%0.816SS**  trans-103.1161.7-176.81770000111.4
453A28.7Very low29.8Very low89 Ų89145.8 Ų145.874%0.73684%0.841SS**  trans82.6141164.800000115.5
454R28.8Very low29.8Very low222 Ų222148.8 Ų148.884%0.83885%0.847SS**  cis-173144.733.6-148.4-177.8175.8170.4-3.6110
455T29Very low30Very low115 Ų115150.2 Ų150.271%0.70685%0.847SS**  trans57150.7141.437.40000121.4
456K27.8Very low29Very low192 Ų192151.8 Ų151.884%0.83585%0.851SS**  cis-176162-13.8-147.2179.1-173.9-175.50105.9
457A29.6Very low29.2Very low89 Ų89154.4 Ų154.474%0.73686%0.856SS**  trans82.6109.1151.100000120.2
458V31.1Very low29.1Very low138 Ų138151.8 Ų151.884%0.83686%0.857SS**  trans-140.8115.1139177.20000108
459N31Very low29.2Very low164 Ų164148.5 Ų148.588%0.87785%0.851SS**  trans-109.5127.2151-91.1-5.6000104.5
460G29.6Very low29.3Very low71 Ų71153.6 Ų153.673%0.73285%0.854SS**  70.3134.697.900000111.4
461H28.2Very low29.3Very low192 Ų192145.3 Ų145.389%0.88984%0.844SS**  cis-170.6-169.89.6-151.114.7000106.1
462E29.1Very low29.5Very low179 Ų179150.4 Ų150.484%0.83684%0.843SS**  trans90.1115.8-175.6-56.6179.1164.300112.4
463D33.6Very low29.7Very low234 Ų234153.2 Ų153.2100%1.25184%0.843SS**  cis-132019.3-75.8-44.7000113.6

Retrieved 463 of 463 residues in 1185.1 ms (Link to these results)

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