A0A077ZBX2_TRITR Loading...

Rab5 GDP:GTP exchange factor

AlphaFold DB , UniProt , Accession A0A077ZBX2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 522 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
1M33.5Very low47.2Very low232 Ų232137.5 Ų137.5100%1.14369%0.687SS**  0107.60-68.8-170.6176.500105.8N3M1-N3 PolarHBondContact O-N 2.94Å
2D35.8Very low48.6Very low139 Ų139139.5 Ų139.574%0.74369%0.693SS**  trans-6794.7-179.4-91.9-39.6000109.2R4D2-R4 PolarHBondContact O-N 3.32Å
3N42.3Very low50Low139 Ų139136.9 Ų136.974%0.74368%0.683SS**  trans-74.746.7168-79.3-2000110.6M1 W5M1-N3 PolarHBondContact O-N 2.94Å; N3-W5 PolarHBondContact O-N 3.44Å
4R43.9Very low52Low179 Ų179132.5 Ų132.568%0.67566%0.662SS**  trans-82.6107176.9-157.6178.4-73.1175.4-0.4107.3D2 V6D2-R4 PolarHBondContact O-N 3.32Å; R4-V6 PolarHBondContact O-N 3.19Å
5W43.8Very low53.8Low148 Ų148128.2 Ų128.256%0.56164%0.642SS**  trans-65.6114.5-179.6-66.6102.2000110.4N3 K387N3-W5 PolarHBondContact O-N 3.44Å; W5-K387 HydrophobicContact CE3-CD 4.3Å; W5-K387 VanDerWaalsContact CE3-CE 3.47Å; W5-K387 HydrophobicContact CH2-CB 3.78Å; W5-K387 HydrophobicContact CH2-CD 3.15Å; W5-K387 HydrophobicContact CH2-CG 3.57Å; W5-K387 HydrophobicContact CZ2-CB 3.75Å; W5-K387 HydrophobicContact CZ2-CD 3.82Å; W5-K387 HydrophobicContact CZ2-CG 3.69Å; W5-K387 HydrophobicContact CZ3-CD 3.45Å; W5-K387 VanDerWaalsContact CZ3-CD 3.45Å; W5-K387 HydrophobicContact CZ3-CG 4.23Å
6V45.5Very low55.9Low116 Ų116120.4 Ų120.470%0.70360%0.603SS**  trans-111.7112.1168-179.90000106.3R4 Q8R4-V6 PolarHBondContact O-N 3.19Å; V6-Q8 PolarHBondContact O-N 3.43Å
7V50.2Low57.8Low115 Ų115121.8 Ų121.870%0.69761%0.605SS**  trans-78102.9173.9-170.80000107V9V7-V9 HydrophobicContact CB-CG2 4.44Å; V7-V9 HydrophobicContact CG1-CG2 3.43Å; V7-V9 VanDerWaalsContact CG1-CG2 3.43Å; V7-V9 PolarHBondContact O-N 3.28Å; V7-V9 VanDerWaalsContact O-N 3.13Å
8Q47.6Very low59.3Low187 Ų187118.1 Ų118.187%0.87460%0.597SS**  trans-77.394.5168.3-74.6-160.9-31.700108.6V6V6-Q8 PolarHBondContact O-N 3.43Å
9V56.9Low60.7Low73 Ų73115.5 Ų115.544%0.44260%0.603SS.*  trans-103124163.7-162.40000107.2V7 D13 L14V7-V9 HydrophobicContact CB-CG2 4.44Å; V7-V9 HydrophobicContact CG1-CG2 3.43Å; V7-V9 VanDerWaalsContact CG1-CG2 3.43Å; V7-V9 PolarHBondContact O-N 3.28Å; V7-V9 VanDerWaalsContact O-N 3.13Å; V9-D13 HydrophobicContact CG1-CB 4.02Å; V9-L14 HydrophobicContact CB-CD1 4.39Å; V9-L14 HydrophobicContact CB-CD2 4.47Å; V9-L14 HydrophobicContact CB-CG 4.32Å; V9-L14 HydrophobicContact CG1-CD1 4.18Å; V9-L14 HydrophobicContact CG1-CD2 3.73Å; V9-L14 HydrophobicContact CG1-CG 3.59Å
10S56.5Low62Low49 Ų49112.2 Ų112.234%0.34359%0.589SS.*  trans-72.6145.9173.8770000109.5E12 D13 L14S10-E12 PolarHBondContact O-N 3.38Å; S10-E12 VanDerWaalsContact O-N 3.14Å; S10-D13 PolarHBondContact O-N 3.07Å; S10-D13 PolarHBondContact OG-N 3.05Å; S10-D13 PolarHBondContact OG-OD2 3.04Å; S10-L14 PolarHBondContact O-N 3.18Å
11E62.8Low62.8Low135 Ų135109.8 Ų109.863%0.63159%0.591SS**Hα-helixtrans-56.9-31.3179.4-168.9177.5-176.700111.7D13 L14 L15E11-D13 PolarHBondContact O-N 3.04Å; E11-L14 PolarHBondContact O-N 3.15Å; E11-L15 WeakPolarHBondContact O-CG 3.34Å; E11-L15 PolarHBondContact O-N 2.93Å
12E64.2Low65.3Low162 Ų162105.5 Ų105.576%0.75757%0.567SS**Hα-helixtrans-63.5-36.8176.1-61164.3-156.700112.6S10 L14S10-E12 PolarHBondContact O-N 3.38Å; S10-E12 VanDerWaalsContact O-N 3.14Å; E12-L14 VanDerWaalsContact C-N 3.34Å
13D67.7Low67.7Low106 Ų106105.8 Ų105.857%0.56756%0.558SS**Hα-helixtrans-75.5-23.8179.2-68.3-45.2000112.9V9 S10 E11V9-D13 HydrophobicContact CG1-CB 4.02Å; S10-D13 PolarHBondContact O-N 3.07Å; S10-D13 PolarHBondContact OG-N 3.05Å; S10-D13 PolarHBondContact OG-OD2 3.04Å; E11-D13 PolarHBondContact O-N 3.04Å
14L77.6Confident69.5Low75 Ų7599.9 Ų99.939%0.39353%0.53SS..Hα-helixtrans-83.1-19.1177.9-68.5169.7000112.4V9 S10 E11 E12 Y23 G24V9-L14 HydrophobicContact CB-CD1 4.39Å; V9-L14 HydrophobicContact CB-CD2 4.47Å; V9-L14 HydrophobicContact CB-CG 4.32Å; V9-L14 HydrophobicContact CG1-CD1 4.18Å; V9-L14 HydrophobicContact CG1-CD2 3.73Å; V9-L14 HydrophobicContact CG1-CG 3.59Å; S10-L14 PolarHBondContact O-N 3.18Å; E11-L14 PolarHBondContact O-N 3.15Å; E12-L14 VanDerWaalsContact C-N 3.34Å; L14-Y23 HydrophobicContact CB-CD1 3.56Å; L14-Y23 HydrophobicContact CB-CE1 3.91Å; L14-Y23 CarbonylContact O-C 3.6Å; L14-Y23 WeakPolarHBondContact O-CA 3.46Å; L14-Y23 WeakPolarHBondContact O-CD1 3.24Å; L14-G24 PolarHBondContact O-N 3.37Å
15L78.9Confident71.1Confident68 Ų6893.6 Ų93.636%0.35651%0.51SS..BIsolated β-bridgetrans-73.5144.2-175.9-76.1164.2000112E11 K17E11-L15 WeakPolarHBondContact O-CG 3.34Å; E11-L15 PolarHBondContact O-N 2.93Å; L15-K17 PolarHBondContact O-N 3Å
16C87.3Confident72.8Confident4 Ų491.5 Ų91.53%0.02752%0.515CS..  trans-54.5128.4177.8173.70000109.9A18 G19 C20 F22 N30 C32C16-A18 PolarHBondContact O-N 3.46Å; C16-A18 PolarHBondContact SG-N 2.9Å; C16-A18 VanDerWaalsContact SG-N 3.43Å; C16-G19 PolarHBondContact O-N 3.19Å; C16-C20 VanDerWaalsContact CB-SG 3.57Å; C16-F22 WeakPolarHBondContact CA-O 3.49Å; C16-F22 WeakPolarHBondContact CB-O 3.48Å; C16-F22 PolarHBondContact N-O 2.97Å; C16-N30 CarbonylContact C-O 3.44Å; C16-N30 VanDerWaalsContact CA-O 3.3Å; C16-N30 WeakPolarHBondContact CA-O 3.36Å; C16-C32 HydrophobicContact CB-CB 3.92Å; C16-C32 PolarHBondContact SG-N 3.45Å
17K87.6Confident74.2Confident143 Ų14390.7 Ų90.762%0.62250%0.504SS*.THydrogen-bonded Turntrans-54.8-18.4178-167.6173.1-175.1173.90114.3L15 G19 K29 N30 Y31L15-K17 PolarHBondContact O-N 3Å; K17-G19 VanDerWaalsContact C-N 3.33Å; K17-K29 WeakPolarHBondContact CD-O 3.33Å; K17-N30 HydrophobicContact CB-CB 4.32Å; K17-N30 WeakPolarHBondContact CB-O 3.48Å; K17-N30 PolarHBondContact N-O 3.45Å; K17-Y31 HydrophobicContact CB-CD1 4.08Å; K17-Y31 HydrophobicContact CB-CE1 3.96Å; K17-Y31 HydrophobicContact CB-CG 4.47Å; K17-Y31 HydrophobicContact CD-CE2 4.21Å; K17-Y31 HydrophobicContact CG-CE1 4.35Å
18A85Confident75.8Confident56 Ų5688.8 Ų88.846%0.46348%0.484SS..THydrogen-bonded Turntrans-85.10.3173.800000114.2C16 C20 Y31 C35C16-A18 PolarHBondContact O-N 3.46Å; C16-A18 PolarHBondContact SG-N 2.9Å; C16-A18 VanDerWaalsContact SG-N 3.43Å; A18-C20 VanDerWaalsContact C-N 3.3Å; A18-C20 PolarHBondContact O-N 3.21Å; A18-Y31 HydrophobicContact CB-CD1 4.02Å; A18-Y31 HydrophobicContact CB-CE1 4.05Å; A18-C35 HydrophobicContact CB-CB 3.79Å; A18-C35 WeakPolarHBondContact CB-SG 3.34Å
19G85.3Confident77.5Confident69 Ų6986.4 Ų86.471%0.71147%0.471SS*.  trans67.225.3179.400000114.2C16 K17 G21C16-G19 PolarHBondContact O-N 3.19Å; K17-G19 VanDerWaalsContact C-N 3.33Å; G19-G21 VanDerWaalsContact C-N 3.28Å; G19-G21 PolarHBondContact O-N 2.68Å
20C86.9Confident78.8Confident49 Ų4986.1 Ų86.133%0.33147%0.467SS..SBendtrans-83.95-173.670.70000114.8C16 A18 F22 C35C16-C20 VanDerWaalsContact CB-SG 3.57Å; A18-C20 VanDerWaalsContact C-N 3.3Å; A18-C20 PolarHBondContact O-N 3.21Å; C20-F22 VanDerWaalsContact C-N 3.29Å; C20-F22 WeakPolarHBondContact O-CD2 3.48Å; C20-F22 PolarHBondContact O-N 3.16Å; C20-C35 VanDerWaalsContact SG-SG 3.64Å
21G80.3Confident80.2Confident62 Ų6285.8 Ų85.864%0.63946%0.459SS*.SBendtrans74.111.7-178.400000115.5G19G19-G21 VanDerWaalsContact C-N 3.28Å; G19-G21 PolarHBondContact O-N 2.68Å
22F84.9Confident81.3Confident142 Ų14279.7 Ų79.762%0.62343%0.431SS*.SBendtrans-111.8158.1172.7-71.2-87.6000109.8C16 C20 C32C16-F22 WeakPolarHBondContact CA-O 3.49Å; C16-F22 WeakPolarHBondContact CB-O 3.48Å; C16-F22 PolarHBondContact N-O 2.97Å; C20-F22 VanDerWaalsContact C-N 3.29Å; C20-F22 WeakPolarHBondContact O-CD2 3.48Å; C20-F22 PolarHBondContact O-N 3.16Å; F22-C32 HydrophobicContact CB-CB 4.03Å
23Y86.8Confident82Confident145 Ų14574 Ų7457%0.56941%0.409SS*.BIsolated β-bridgetrans-70.1139.1176-61.3-66.8000112.7L14 C32L14-Y23 HydrophobicContact CB-CD1 3.56Å; L14-Y23 HydrophobicContact CB-CE1 3.91Å; L14-Y23 CarbonylContact O-C 3.6Å; L14-Y23 WeakPolarHBondContact O-CA 3.46Å; L14-Y23 WeakPolarHBondContact O-CD1 3.24Å; Y23-C32 WeakPolarHBondContact O-CA 3.38Å; Y23-C32 WeakPolarHBondContact O-CB 3.48Å
24G78.9Confident82.5Confident15 Ų1575.9 Ų75.916%0.15541%0.412CS..  trans-92.9156.2174.700000111.8L14 N30L14-G24 PolarHBondContact O-N 3.37Å; G24-N30 WeakPolarHBondContact CA-O 3.36Å
25N77.7Confident82.9Confident47 Ų4773.2 Ų73.225%0.25140%0.399SS..BIsolated β-bridgetrans-114.8132.9175.9-178-24.8000109.9Q27 W28 K29 N30 Y31N25-Q27 VanDerWaalsContact C-N 3.27Å; N25-Q27 PolarHBondContact O-N 3.45Å; N25-Q27 WeakPolarHBondContact OD1-CB 3.26Å; N25-Q27 PolarHBondContact OD1-N 2.91Å; N25-W28 HydrophobicContact CB-CD2 4.22Å; N25-W28 HydrophobicContact CB-CE3 3.85Å; N25-W28 HydrophobicContact CB-CZ3 4.37Å; N25-W28 CarbonylContact O-C 3.51Å; N25-W28 VanDerWaalsContact O-C 3.31Å; N25-W28 WeakPolarHBondContact O-CA 3.41Å; N25-W28 PolarHBondContact O-N 3.47Å; N25-K29 PolarHBondContact O-N 3.38Å; N25-N30 VanDerWaalsContact O-CA 3.28Å; N25-N30 WeakPolarHBondContact O-CA 3.31Å; N25-N30 PolarHBondContact O-N 3.44Å; N25-Y31 PolarHBondContact N-O 2.71Å; N25-Y31 VanDerWaalsContact N-O 3.11Å
26P80.1Confident83.4Confident103 Ų10372.7 Ų72.767%0.66939%0.393SS*.G310 helixtrans-50.7-38.5172.4-28.134.5000114.9W28 K29 N30P26-W28 PolarHBondContact O-N 3.33Å; P26-K29 PolarHBondContact O-N 3.38Å; P26-N30 VanDerWaalsContact CA-OD1 3.31Å; P26-N30 WeakPolarHBondContact CA-OD1 3.4Å
27Q75.9Confident83Confident99 Ų9976.5 Ų76.546%0.46341%0.406SS..G310 helixtrans-61.1-27.3174.8-87.5168.6-65.900112.6N25N25-Q27 VanDerWaalsContact C-N 3.27Å; N25-Q27 PolarHBondContact O-N 3.45Å; N25-Q27 WeakPolarHBondContact OD1-CB 3.26Å; N25-Q27 PolarHBondContact OD1-N 2.91Å
28W83.4Confident82.7Confident75 Ų7574.3 Ų74.328%0.28440%0.401SS..G310 helixtrans-102.731.1175.3-58.8-23000111.8N25 P26 N30 Y31 S33 W36N25-W28 HydrophobicContact CB-CD2 4.22Å; N25-W28 HydrophobicContact CB-CE3 3.85Å; N25-W28 HydrophobicContact CB-CZ3 4.37Å; N25-W28 CarbonylContact O-C 3.51Å; N25-W28 VanDerWaalsContact O-C 3.31Å; N25-W28 WeakPolarHBondContact O-CA 3.41Å; N25-W28 PolarHBondContact O-N 3.47Å; P26-W28 PolarHBondContact O-N 3.33Å; W28-N30 PolarHBondContact O-N 2.9Å; W28-Y31 WeakPolarHBondContact CB-O 3.46Å; W28-Y31 VanDerWaalsContact O-CB 3.31Å; W28-Y31 WeakPolarHBondContact O-CB 3.38Å; W28-Y31 VanDerWaalsContact O-CD2 3.23Å; W28-Y31 WeakPolarHBondContact O-CD2 3.34Å; W28-Y31 PolarHBondContact O-N 3.47Å; W28-S33 VanDerWaalsContact CZ3-CB 3.41Å; W28-S33 VanDerWaalsContact CZ3-N 3.31Å; W28-W36 HydrophobicContact CB-CB 3.99Å; W28-W36 HydrophobicContact CB-CD2 3.71Å; W28-W36 HydrophobicContact CB-CE3 4.04Å; W28-W36 HydrophobicContact CB-CG 3.69Å; W28-W36 AromaticContact CD1-CD1 3.55Å; W28-W36 AromaticContact CD1-CE2 3.97Å; W28-W36 AromaticContact CD1-NE1 3.51Å; W28-W36 HydrophobicContact CD2-CB 4.42Å; W28-W36 HydrophobicContact CD2-CG 4.35Å; W28-W36 HydrophobicContact CG-CB 4.14Å; W28-W36 AromaticContact CG-CD1 3.67Å; W28-W36 HydrophobicContact CG-CD2 4.1Å; W28-W36 AromaticContact CG-CG 3.72Å; W28-W36 HydrophobicContact CG-CG 3.72Å; W28-W36 AromaticContact CG-NE1 4Å; W28-W36 AromaticContact NE1-CD1 3.98Å; W28-W36 VanDerWaalsContact O-CE3 3.26Å
29K83.5Confident82.7Confident138 Ų13875 Ų7560%0.639%0.394SS*.THydrogen-bonded Turntrans51.641.5-178.8-58.7-170.7176.1-174.30112.9K17 N25 P26 Y31 W36K17-K29 WeakPolarHBondContact CD-O 3.33Å; N25-K29 PolarHBondContact O-N 3.38Å; P26-K29 PolarHBondContact O-N 3.38Å; K29-Y31 HydrophobicContact CB-CD2 4.22Å; K29-Y31 HydrophobicContact CB-CE2 4.42Å; K29-Y31 PolarHBondContact O-N 2.9Å; K29-W36 HydrophobicContact CB-CZ3 4.1Å; K29-W36 HydrophobicContact CD-CH2 4.28Å; K29-W36 HydrophobicContact CD-CZ3 4.19Å; K29-W36 HydrophobicContact CG-CH2 4.15Å; K29-W36 HydrophobicContact CG-CZ3 4.02Å
30N84.1Confident82.6Confident66 Ų6674.3 Ų74.335%0.35337%0.374SS..THydrogen-bonded Turntrans61.519-174.2-63.4-10.1000114.6C16 K17 G24 N25 P26 W28C16-N30 CarbonylContact C-O 3.44Å; C16-N30 VanDerWaalsContact CA-O 3.3Å; C16-N30 WeakPolarHBondContact CA-O 3.36Å; K17-N30 HydrophobicContact CB-CB 4.32Å; K17-N30 WeakPolarHBondContact CB-O 3.48Å; K17-N30 PolarHBondContact N-O 3.45Å; G24-N30 WeakPolarHBondContact CA-O 3.36Å; N25-N30 VanDerWaalsContact O-CA 3.28Å; N25-N30 WeakPolarHBondContact O-CA 3.31Å; N25-N30 PolarHBondContact O-N 3.44Å; P26-N30 VanDerWaalsContact CA-OD1 3.31Å; P26-N30 WeakPolarHBondContact CA-OD1 3.4Å; W28-N30 PolarHBondContact O-N 2.9Å
31Y85.2Confident82.2Confident43 Ų4379.8 Ų79.817%0.16939%0.392CS..BIsolated β-bridgetrans-84.4149.1166.5-67.8-77000110.6K17 A18 N25 W28 K29 C35 W36 H39K17-Y31 HydrophobicContact CB-CD1 4.08Å; K17-Y31 HydrophobicContact CB-CE1 3.96Å; K17-Y31 HydrophobicContact CB-CG 4.47Å; K17-Y31 HydrophobicContact CD-CE2 4.21Å; K17-Y31 HydrophobicContact CG-CE1 4.35Å; A18-Y31 HydrophobicContact CB-CD1 4.02Å; A18-Y31 HydrophobicContact CB-CE1 4.05Å; N25-Y31 PolarHBondContact N-O 2.71Å; N25-Y31 VanDerWaalsContact N-O 3.11Å; W28-Y31 WeakPolarHBondContact CB-O 3.46Å; W28-Y31 VanDerWaalsContact O-CB 3.31Å; W28-Y31 WeakPolarHBondContact O-CB 3.38Å; W28-Y31 VanDerWaalsContact O-CD2 3.23Å; W28-Y31 WeakPolarHBondContact O-CD2 3.34Å; W28-Y31 PolarHBondContact O-N 3.47Å; K29-Y31 HydrophobicContact CB-CD2 4.22Å; K29-Y31 HydrophobicContact CB-CE2 4.42Å; K29-Y31 PolarHBondContact O-N 2.9Å; Y31-C35 HydrophobicContact CD1-CB 3.87Å; Y31-C35 HydrophobicContact CG-CB 4.47Å; Y31-W36 AromaticContact CD2-CE3 3.73Å; Y31-W36 HydrophobicContact CD2-CE3 3.73Å; Y31-W36 HydrophobicContact CD2-CZ3 4.08Å; Y31-W36 HydrophobicContact CG-CE3 4.33Å; Y31-H39 AromaticContact CE2-CD2 3.58Å; Y31-H39 AromaticContact CZ-CD2 3.7Å
32C85.6Confident82.1Confident7 Ų786 Ų865%0.04740%0.397CS..  trans-72.2165.1164.676.30000110.1C16 F22 Y23 K34 C35 W36C16-C32 HydrophobicContact CB-CB 3.92Å; C16-C32 PolarHBondContact SG-N 3.45Å; F22-C32 HydrophobicContact CB-CB 4.03Å; Y23-C32 WeakPolarHBondContact O-CA 3.38Å; Y23-C32 WeakPolarHBondContact O-CB 3.48Å; C32-K34 PolarHBondContact O-N 3.07Å; C32-K34 VanDerWaalsContact O-N 3.14Å; C32-C35 PolarHBondContact O-N 3.48Å; C32-C35 VanDerWaalsContact O-N 3.09Å; C32-C35 PolarHBondContact SG-N 2.81Å; C32-C35 VanDerWaalsContact SG-N 3.42Å; C32-W36 WeakPolarHBondContact O-CB 3.22Å; C32-W36 PolarHBondContact O-N 3.17Å
33S78.6Confident81.7Confident42 Ų4282.1 Ų82.129%0.29439%0.387SS..Hα-helixtrans-51.8-41.3-178.158.40000113.2W28 R37W28-S33 VanDerWaalsContact CZ3-CB 3.41Å; W28-S33 VanDerWaalsContact CZ3-N 3.31Å; S33-R37 WeakPolarHBondContact O-CG 3.44Å; S33-R37 PolarHBondContact O-N 3.15Å
34K79.3Confident80.8Confident146 Ų14683.9 Ų83.964%0.63539%0.392SS*.Hα-helixtrans-69.4-46.1179.1-170.5177.7-179-179.30112.3C32 R37 L38C32-K34 PolarHBondContact O-N 3.07Å; C32-K34 VanDerWaalsContact O-N 3.14Å; K34-R37 PolarHBondContact O-N 3.33Å; K34-L38 PolarHBondContact O-N 2.83Å
35C85.7Confident79.3Confident18 Ų1886 Ų8612%0.12241%0.414CS..Hα-helixtrans-71.9-32.7-178.9-69.40000112.3A18 C20 Y31 C32 L38 H39A18-C35 HydrophobicContact CB-CB 3.79Å; A18-C35 WeakPolarHBondContact CB-SG 3.34Å; C20-C35 VanDerWaalsContact SG-SG 3.64Å; Y31-C35 HydrophobicContact CD1-CB 3.87Å; Y31-C35 HydrophobicContact CG-CB 4.47Å; C32-C35 PolarHBondContact O-N 3.48Å; C32-C35 VanDerWaalsContact O-N 3.09Å; C32-C35 PolarHBondContact SG-N 2.81Å; C32-C35 VanDerWaalsContact SG-N 3.42Å; C35-L38 PolarHBondContact O-N 3.2Å; C35-H39 WeakPolarHBondContact O-CB 3.34Å; C35-H39 PolarHBondContact O-N 2.95Å
36W90.4Very high78.1Confident58 Ų5892.6 Ų92.622%0.2244%0.441CS..Hα-helixtrans-62.1-42.3173.8-175.7-121.6000111.8W28 K29 Y31 C32 L38 H39 L40W28-W36 HydrophobicContact CB-CB 3.99Å; W28-W36 HydrophobicContact CB-CD2 3.71Å; W28-W36 HydrophobicContact CB-CE3 4.04Å; W28-W36 HydrophobicContact CB-CG 3.69Å; W28-W36 AromaticContact CD1-CD1 3.55Å; W28-W36 AromaticContact CD1-CE2 3.97Å; W28-W36 AromaticContact CD1-NE1 3.51Å; W28-W36 HydrophobicContact CD2-CB 4.42Å; W28-W36 HydrophobicContact CD2-CG 4.35Å; W28-W36 HydrophobicContact CG-CB 4.14Å; W28-W36 AromaticContact CG-CD1 3.67Å; W28-W36 HydrophobicContact CG-CD2 4.1Å; W28-W36 AromaticContact CG-CG 3.72Å; W28-W36 HydrophobicContact CG-CG 3.72Å; W28-W36 AromaticContact CG-NE1 4Å; W28-W36 AromaticContact NE1-CD1 3.98Å; W28-W36 VanDerWaalsContact O-CE3 3.26Å; K29-W36 HydrophobicContact CB-CZ3 4.1Å; K29-W36 HydrophobicContact CD-CH2 4.28Å; K29-W36 HydrophobicContact CD-CZ3 4.19Å; K29-W36 HydrophobicContact CG-CH2 4.15Å; K29-W36 HydrophobicContact CG-CZ3 4.02Å; Y31-W36 AromaticContact CD2-CE3 3.73Å; Y31-W36 HydrophobicContact CD2-CE3 3.73Å; Y31-W36 HydrophobicContact CD2-CZ3 4.08Å; Y31-W36 HydrophobicContact CG-CE3 4.33Å; C32-W36 WeakPolarHBondContact O-CB 3.22Å; C32-W36 PolarHBondContact O-N 3.17Å; W36-L38 PolarHBondContact O-N 2.91Å; W36-H39 HydrophobicContact CE3-CB 4.47Å; W36-H39 CarbonylContact O-C 3.44Å; W36-H39 WeakPolarHBondContact O-CB 3.38Å; W36-H39 PolarHBondContact O-N 3.48Å; W36-L40 HydrophobicContact CD2-CD1 3.82Å; W36-L40 HydrophobicContact CG-CD1 4.1Å; W36-L40 HydrophobicContact CH2-CD1 4.47Å; W36-L40 HydrophobicContact CZ2-CD1 3.67Å; W36-L40 PolarHBondContact O-N 2.88Å
37R78.9Confident76.3Confident83 Ų8392.4 Ų92.431%0.31344%0.442SS..Hα-helixtrans-63.3-41.7174.6-71-178-145.1154.611.1112.8S33 K34 H39 L40 K41 S93S33-R37 WeakPolarHBondContact O-CG 3.44Å; S33-R37 PolarHBondContact O-N 3.15Å; K34-R37 PolarHBondContact O-N 3.33Å; R37-H39 VanDerWaalsContact C-N 3.29Å; R37-H39 PolarHBondContact O-N 3.22Å; R37-L40 PolarHBondContact O-N 3.28Å; R37-K41 PolarHBondContact O-N 3.16Å; R37-S93 PolarHBondContact NH1-OG 3.18Å
38L80.5Confident74.3Confident98 Ų9896 Ų9651%0.51346%0.458SS..Hα-helixtrans-61.5-40.5173.9-95.8149.4000111.3K34 C35 W36 R42K34-L38 PolarHBondContact O-N 2.83Å; C35-L38 PolarHBondContact O-N 3.2Å; W36-L38 PolarHBondContact O-N 2.91Å; L38-R42 PolarHBondContact O-N 3.27Å; L38-R42 VanDerWaalsContact O-N 3.1Å
39H84Confident71.9Confident70 Ų70100 Ų10032%0.32449%0.485SS..Hα-helixtrans-62.8-47.2174.2-173.6-64.4000111.4Y31 C35 W36 R37 R42 S43Y31-H39 AromaticContact CE2-CD2 3.58Å; Y31-H39 AromaticContact CZ-CD2 3.7Å; C35-H39 WeakPolarHBondContact O-CB 3.34Å; C35-H39 PolarHBondContact O-N 2.95Å; W36-H39 HydrophobicContact CE3-CB 4.47Å; W36-H39 CarbonylContact O-C 3.44Å; W36-H39 WeakPolarHBondContact O-CB 3.38Å; W36-H39 PolarHBondContact O-N 3.48Å; R37-H39 VanDerWaalsContact C-N 3.29Å; R37-H39 PolarHBondContact O-N 3.22Å; H39-R42 PolarHBondContact O-N 3.38Å; H39-S43 PolarHBondContact O-N 2.9Å; H39-S43 PolarHBondContact O-OG 3.38Å
40L83.5Confident69.2Low54 Ų5498.6 Ų98.628%0.28349%0.494SS..Hα-helixtrans-61.3-43.3176.8-105.6103.5000112.7W36 R37 R42 S43 R44W36-L40 HydrophobicContact CD2-CD1 3.82Å; W36-L40 HydrophobicContact CG-CD1 4.1Å; W36-L40 HydrophobicContact CH2-CD1 4.47Å; W36-L40 HydrophobicContact CZ2-CD1 3.67Å; W36-L40 PolarHBondContact O-N 2.88Å; R37-L40 PolarHBondContact O-N 3.28Å; L40-R42 VanDerWaalsContact C-N 3.33Å; L40-R42 PolarHBondContact O-N 3.42Å; L40-S43 VanDerWaalsContact CA-OG 3.27Å; L40-S43 WeakPolarHBondContact CA-OG 3.41Å; L40-S43 PolarHBondContact O-N 3.41Å; L40-S43 PolarHBondContact O-OG 2.93Å; L40-S43 VanDerWaalsContact O-OG 3.14Å; L40-R44 PolarHBondContact O-N 3.19Å
41K79.1Confident66.5Low164 Ų164101.3 Ų101.371%0.71352%0.515SS*.Hα-helixtrans-60-42.8175.9-100-178.1175.8175.50111.9R37 S43 G45R37-K41 PolarHBondContact O-N 3.16Å; K41-S43 VanDerWaalsContact C-N 3.35Å; K41-G45 PolarHBondContact O-N 2.94Å
42R78.8Confident63.8Low194 Ų194108.1 Ų108.173%0.73255%0.548SS*.Hα-helixtrans-68.2-31.5176.8-83.2-179.4173.3171.3-1.3113.5L38 H39 L40L38-R42 PolarHBondContact O-N 3.27Å; L38-R42 VanDerWaalsContact O-N 3.1Å; H39-R42 PolarHBondContact O-N 3.38Å; L40-R42 VanDerWaalsContact C-N 3.33Å; L40-R42 PolarHBondContact O-N 3.42Å
43S74.8Confident60.9Low59 Ų59115.1 Ų115.141%0.41359%0.585SS.*Hα-helixtrans-80-36.1179310000112.2H39 L40 K41H39-S43 PolarHBondContact O-N 2.9Å; H39-S43 PolarHBondContact O-OG 3.38Å; L40-S43 VanDerWaalsContact CA-OG 3.27Å; L40-S43 WeakPolarHBondContact CA-OG 3.41Å; L40-S43 PolarHBondContact O-N 3.41Å; L40-S43 PolarHBondContact O-OG 2.93Å; L40-S43 VanDerWaalsContact O-OG 3.14Å; K41-S43 VanDerWaalsContact C-N 3.35Å
44R67.9Low58.4Low182 Ų182121.7 Ų121.769%0.68761%0.609SS**Hα-helixtrans-67.4-40.1171.6-73.2-179.7171168.1-1.5112.5L40 K46 S47L40-R44 PolarHBondContact O-N 3.19Å; R44-K46 PolarHBondContact O-N 3.03Å; R44-K46 VanDerWaalsContact O-N 3.14Å; R44-S47 PolarHBondContact O-N 3.46Å; R44-S47 VanDerWaalsContact O-N 3.12Å
45G49.3Very low55.7Low60 Ų60119.5 Ų119.562%0.61961%0.612SS**THydrogen-bonded Turntrans-68.2-8.417900000115.8K41K41-G45 PolarHBondContact O-N 2.94Å
46K52.4Low53.1Low186 Ų186123.1 Ų123.181%0.80964%0.643SS**THydrogen-bonded Turntrans-93.1-6.7173.6-76.8-177.8175.7-175.10113.5R44R44-K46 PolarHBondContact O-N 3.03Å; R44-K46 VanDerWaalsContact O-N 3.14Å
47S41.7Very low50.1Low99 Ų99129.6 Ų129.669%0.69268%0.675SS**SBendtrans-94.3-8-174.1-175.50000114.8R44R44-S47 PolarHBondContact O-N 3.46Å; R44-S47 VanDerWaalsContact O-N 3.12Å
48E34.5Very low47.4Very low173 Ų173130.7 Ų130.781%0.80870%0.695SS**SBendtrans-101.69.3-172.4-77-177.116100115.1
49N31.3Very low44.9Very low159 Ų159133.5 Ų133.585%0.8571%0.709SS**SBendtrans-123.378172.4-83.4-13.6000111.2
50S27.6Very low42Very low110 Ų110138.6 Ų138.677%0.76973%0.733SS**  trans-164125147.3-161.50000110.7
51P28.4Very low39.4Very low123 Ų123139.5 Ų139.580%0.79976%0.756SS**  trans-80.6160.9172.532.2-29.3000112
52Q26.9Very low36.9Very low186 Ų186140.4 Ų140.487%0.86976%0.762SS**  trans-45.8140-176.4-64.7164-34.900115.3
53D26.2Very low34.4Very low153 Ų153139.2 Ų139.282%0.81877%0.769SS**  trans-168.1132.9134.9-104-27.5000114.9
54F24.8Very low31.9Very low181 Ų181143.4 Ų143.479%0.79479%0.786SS**  trans61.5113.7141.1-105.1-106.6000125.5
55S23.8Very low29.8Very low100 Ų100145 Ų14570%0.69979%0.793SS**  70.8117.6127.169.10000124
56A29.5Very low28.6Very low93 Ų93150.5 Ų150.577%0.76980%0.802SS**  177114.1114.500000108.5
57Q27.6Very low27.2Very low194 Ų194147 Ų14791%0.90780%0.801SS**  43.3136.488.5-79.5-179.75.100113.3
58C23.6Very low26.4Very low107 Ų107150.8 Ų150.872%0.72381%0.812SS**  cis-173.9151.43.9-158.90000102.2
59L26.7Very low26Very low157 Ų157147.2 Ų147.282%0.82281%0.806SS**  170.4152.772.7-138.6129.5000109.5
60Q24.6Very low25.8Very low176 Ų176145 Ų14582%0.82280%0.8SS**  trans-53.2153.3177.1-152.27811.100117
61G27.1Very low25.8Very low73 Ų73147 Ų14775%0.75381%0.807SS**  trans165.6106150.900000116.2
62Q26.6Very low25.6Very low183 Ų183146 Ų14686%0.85580%0.803SS**  trans-65.2151.3167.1-70.6166.2-68.900111.9
63I26.9Very low25.8Very low169 Ų169142.6 Ų142.687%0.86780%0.8SS**  175.9137.4125.8-85.6153.2000110.5
64D22Very low26.1Very low147 Ų147144.1 Ų144.179%0.78680%0.799SS**  trans-53.8142.8171.9-67-58000115.4
65R23.9Very low26.6Very low217 Ų217141.8 Ų141.882%0.81980%0.8SS**  159.6124.8115.7-90.1-174.8173.3-153.3-0.6112.1
66Q23.8Very low27.4Very low175 Ų175140.3 Ų140.382%0.81878%0.78SS**  trans42.798.8138.5-64.2176.2-11.800118.4
67S23.6Very low28.2Very low112 Ų112139.5 Ų139.578%0.78377%0.766SS**  trans-159118.9137.257.60000109.9S69S67-S69 PolarHBondContact O-N 2.93Å
68I24.1Very low29.4Very low178 Ų178132 Ų13291%0.91374%0.74SS**  trans-66.6116.6169.9-65.8162.2000107.3
69S26Very low31.1Very low99 Ų99127.6 Ų127.669%0.69271%0.709SS**  trans-124.5124.2163.456.10000108.2S67S67-S69 PolarHBondContact O-N 2.93Å
70P28.6Very low33.2Very low113 Ų113122.6 Ų122.673%0.73469%0.69SS**  trans-79.6164.4169.634.1-29.5000109.2
71V26.3Very low35.6Very low150 Ų150115.5 Ų115.591%0.90966%0.656SS**  trans86.871.9-178.9-163.10000114.3
72S25.9Very low37.3Very low103 Ų103117.7 Ų117.772%0.7265%0.651SS**SBendtrans-143.7133138.2-166.40000108.2K74S72-K74 PolarHBondContact O-N 3.35Å
73S29.9Very low39.3Very low115 Ų115117.8 Ų117.880%0.80464%0.643SS**  trans-30.893.7178.6-46.20000112.7T75S73-T75 VanDerWaalsContact C-N 3.34Å; S73-T75 PolarHBondContact O-N 3.21Å
74K32.3Very low41.4Very low184 Ų184110.3 Ų110.380%0.861%0.605SS**  trans-70.998.6167.2-71.5-175.7-178.6176.80106.3S72 W76S72-K74 PolarHBondContact O-N 3.35Å; K74-W76 VanDerWaalsContact C-N 3.33Å; K74-W76 PolarHBondContact O-N 2.94Å
75T36.3Very low43.3Very low132 Ų132105.4 Ų105.481%0.8158%0.577SS**  trans-52.4107.8151.447.80000105.9S73S73-T75 VanDerWaalsContact C-N 3.34Å; S73-T75 PolarHBondContact O-N 3.21Å
76W39.7Very low45.2Very low70 Ų7098.5 Ų98.527%0.26556%0.556SS.*  trans-58143172.2-7465.9000108K74 G78 S249 R253 Q379K74-W76 VanDerWaalsContact C-N 3.33Å; K74-W76 PolarHBondContact O-N 2.94Å; W76-G78 PolarHBondContact O-N 2.8Å; W76-S249 WeakPolarHBondContact CZ3-O 3.24Å; W76-S249 WeakPolarHBondContact CZ3-OG 3.37Å; W76-R253 HydrophobicContact CH2-CB 3.8Å; W76-R253 HydrophobicContact CH2-CG 3.93Å; W76-R253 HydrophobicContact CZ2-CG 4.34Å; W76-R253 HydrophobicContact CZ3-CB 4.26Å; W76-Q379 VanDerWaalsContact CB-NE2 3.26Å; W76-Q379 VanDerWaalsContact CD1-NE2 3.28Å; W76-Q379 HydrophobicContact CD2-CG 4.24Å; W76-Q379 HydrophobicContact CG-CG 4.29Å
77P46.8Very low46.7Very low76 Ų7691.6 Ų91.649%0.49453%0.527SS..THydrogen-bonded Turntrans-57.7127.8-179-17.629.2000110F79 V245P77-F79 PolarHBondContact O-N 2.97Å; P77-V245 HydrophobicContact CB-CG1 4.34Å
78G52.3Low48.1Very low35 Ų3586.6 Ų86.636%0.36149%0.491SS..THydrogen-bonded Turntrans81.9-7.3161.700000118.8W76 K348W76-G78 PolarHBondContact O-N 2.8Å; G78-K348 PolarHBondContact O-NZ 3.44Å
79F59.4Low49.1Very low15 Ų1580.8 Ų80.87%0.06646%0.457CS..  trans-130.6112.3-178.6-155.3-79.4000113.8P77 W81 L84 A246 L344 K348P77-F79 PolarHBondContact O-N 2.97Å; F79-W81 HydrophobicContact CD1-CD2 4.15Å; F79-W81 AromaticContact CD1-CE2 3.88Å; F79-W81 HydrophobicContact CD1-CG 4.36Å; F79-W81 HydrophobicContact CD1-CZ2 4.18Å; F79-W81 AromaticContact CD1-NE1 3.98Å; F79-W81 AromaticContact CE1-CD2 3.51Å; F79-W81 HydrophobicContact CE1-CD2 3.51Å; F79-W81 AromaticContact CE1-CE2 3.47Å; F79-W81 VanDerWaalsContact CE1-CE2 3.47Å; F79-W81 AromaticContact CE1-CE3 3.69Å; F79-W81 HydrophobicContact CE1-CE3 3.69Å; F79-W81 HydrophobicContact CE1-CG 4.09Å; F79-W81 AromaticContact CE1-CH2 3.72Å; F79-W81 HydrophobicContact CE1-CH2 3.72Å; F79-W81 AromaticContact CE1-CZ2 3.59Å; F79-W81 HydrophobicContact CE1-CZ2 3.59Å; F79-W81 AromaticContact CE1-CZ3 3.79Å; F79-W81 HydrophobicContact CE1-CZ3 3.79Å; F79-W81 HydrophobicContact CZ-CE3 4.34Å; F79-W81 AromaticContact CZ-CH2 3.97Å; F79-W81 HydrophobicContact CZ-CH2 3.97Å; F79-W81 HydrophobicContact CZ-CZ2 4.23Å; F79-W81 HydrophobicContact CZ-CZ3 4.06Å; F79-L84 HydrophobicContact CZ-CD1 3.98Å; F79-A246 HydrophobicContact CB-CB 4.02Å; F79-L344 HydrophobicContact CB-CD1 4.47Å; F79-L344 HydrophobicContact CD2-CB 3.83Å; F79-L344 HydrophobicContact CD2-CD1 3.98Å; F79-L344 HydrophobicContact CD2-CD2 4.45Å; F79-L344 HydrophobicContact CD2-CG 4.32Å; F79-L344 HydrophobicContact CE1-CD2 4.35Å; F79-L344 HydrophobicContact CE2-CB 3.59Å; F79-L344 HydrophobicContact CE2-CD1 4.41Å; F79-L344 HydrophobicContact CE2-CD2 4.12Å; F79-L344 HydrophobicContact CE2-CG 4.26Å; F79-L344 HydrophobicContact CG-CD1 4.15Å; F79-L344 HydrophobicContact CZ-CB 4.34Å; F79-L344 HydrophobicContact CZ-CD2 4.07Å; F79-K348 HydrophobicContact CD2-CD 3.85Å; F79-K348 HydrophobicContact CD2-CG 4.39Å; F79-K348 HydrophobicContact CE2-CD 3.46Å; F79-K348 VanDerWaalsContact CE2-CD 3.46Å; F79-K348 HydrophobicContact CE2-CG 3.53Å; F79-K348 HydrophobicContact CZ-CD 4.4Å; F79-K348 HydrophobicContact CZ-CG 4.05Å
80A72.2Confident50.2Low52 Ų5281 Ų8143%0.4345%0.451SS..  trans-116.2108.1175.500000110.5D82 R83 L84A80-D82 PolarHBondContact O-N 2.94Å; A80-R83 HydrophobicContact CB-CG 4.47Å; A80-R83 PolarHBondContact O-N 3.42Å; A80-R83 VanDerWaalsContact O-N 3.09Å; A80-L84 PolarHBondContact O-N 3.47Å
81W74Confident51.1Low27 Ų2776.7 Ų76.710%0.10242%0.423CS..G310 helixtrans-56.6-33177.2-69101000113F79 R83 L84 L344 V347 C372 L375 N376F79-W81 HydrophobicContact CD1-CD2 4.15Å; F79-W81 AromaticContact CD1-CE2 3.88Å; F79-W81 HydrophobicContact CD1-CG 4.36Å; F79-W81 HydrophobicContact CD1-CZ2 4.18Å; F79-W81 AromaticContact CD1-NE1 3.98Å; F79-W81 AromaticContact CE1-CD2 3.51Å; F79-W81 HydrophobicContact CE1-CD2 3.51Å; F79-W81 AromaticContact CE1-CE2 3.47Å; F79-W81 VanDerWaalsContact CE1-CE2 3.47Å; F79-W81 AromaticContact CE1-CE3 3.69Å; F79-W81 HydrophobicContact CE1-CE3 3.69Å; F79-W81 HydrophobicContact CE1-CG 4.09Å; F79-W81 AromaticContact CE1-CH2 3.72Å; F79-W81 HydrophobicContact CE1-CH2 3.72Å; F79-W81 AromaticContact CE1-CZ2 3.59Å; F79-W81 HydrophobicContact CE1-CZ2 3.59Å; F79-W81 AromaticContact CE1-CZ3 3.79Å; F79-W81 HydrophobicContact CE1-CZ3 3.79Å; F79-W81 HydrophobicContact CZ-CE3 4.34Å; F79-W81 AromaticContact CZ-CH2 3.97Å; F79-W81 HydrophobicContact CZ-CH2 3.97Å; F79-W81 HydrophobicContact CZ-CZ2 4.23Å; F79-W81 HydrophobicContact CZ-CZ3 4.06Å; W81-R83 PolarHBondContact O-N 3.47Å; W81-L84 HydrophobicContact CE3-CD2 3.87Å; W81-L84 HydrophobicContact CZ3-CD2 3.84Å; W81-L84 WeakPolarHBondContact O-CB 3.39Å; W81-L84 PolarHBondContact O-N 3.44Å; W81-L84 VanDerWaalsContact O-N 3.14Å; W81-L344 HydrophobicContact CH2-CD2 3.79Å; W81-L344 HydrophobicContact CZ2-CD2 3.65Å; W81-V347 HydrophobicContact CZ3-CG1 4.21Å; W81-C372 HydrophobicContact CE3-CB 4.31Å; W81-C372 HydrophobicContact CZ3-CB 3.89Å; W81-L375 HydrophobicContact CH2-CB 3.35Å; W81-L375 HydrophobicContact CH2-CD1 3.82Å; W81-L375 HydrophobicContact CH2-CG 4.24Å; W81-L375 HydrophobicContact CZ2-CB 3.53Å; W81-L375 HydrophobicContact CZ3-CB 4.37Å; W81-N376 HydrophobicContact CD2-CB 3.82Å; W81-N376 HydrophobicContact CE3-CB 4.45Å; W81-N376 HydrophobicContact CG-CB 3.96Å; W81-N376 HydrophobicContact CZ2-CB 4.41Å; W81-N376 PolarHBondContact NE1-OD1 3.25Å
82D61.8Low51.7Low119 Ų11973.7 Ų73.764%0.63640%0.401SS*.G310 helixtrans-60.9-28.8179.8-61.1-22.3000112.8A80A80-D82 PolarHBondContact O-N 2.94Å
83R70.5Confident52.3Low186 Ų18671.6 Ų71.670%0.70239%0.386SS*.G310 helixtrans-95.9-8.3-179.8-63.9-167.7-178.4179.31.7113.9A80 W81 F85 D86A80-R83 HydrophobicContact CB-CG 4.47Å; A80-R83 PolarHBondContact O-N 3.42Å; A80-R83 VanDerWaalsContact O-N 3.09Å; W81-R83 PolarHBondContact O-N 3.47Å; R83-F85 PolarHBondContact O-N 2.87Å; R83-F85 VanDerWaalsContact O-N 3.12Å; R83-D86 WeakPolarHBondContact O-CB 3.48Å; R83-D86 PolarHBondContact O-N 3.25Å
84L69.7Low52.6Low11 Ų1169.2 Ų69.26%0.05837%0.369CS..THydrogen-bonded Turntrans-55.2-38.3-174.2-17671.6000111.6F79 A80 W81 V347 K348 S351 C372F79-L84 HydrophobicContact CZ-CD1 3.98Å; A80-L84 PolarHBondContact O-N 3.47Å; W81-L84 HydrophobicContact CE3-CD2 3.87Å; W81-L84 HydrophobicContact CZ3-CD2 3.84Å; W81-L84 WeakPolarHBondContact O-CB 3.39Å; W81-L84 PolarHBondContact O-N 3.44Å; W81-L84 VanDerWaalsContact O-N 3.14Å; L84-V347 HydrophobicContact CD1-CG1 4.01Å; L84-V347 HydrophobicContact CD2-CG1 3.64Å; L84-V347 HydrophobicContact CG-CG1 4.43Å; L84-K348 HydrophobicContact CD1-CB 4.49Å; L84-K348 HydrophobicContact CD1-CG 3.75Å; L84-S351 PolarHBondContact O-OG 3.34Å; L84-C372 HydrophobicContact CD2-CB 4.35Å
85F62Low52.7Low44 Ų4467 Ų6719%0.19337%0.374CS..THydrogen-bonded Turntrans-98.51.4-178.3-56.9-75.3000114.8R83 M88 W89 F368 C372R83-F85 PolarHBondContact O-N 2.87Å; R83-F85 VanDerWaalsContact O-N 3.12Å; F85-M88 HydrophobicContact CB-CE 4.46Å; F85-M88 HydrophobicContact CD1-CE 3.62Å; F85-M88 HydrophobicContact CD1-SD 4.49Å; F85-M88 HydrophobicContact CE1-CE 4.29Å; F85-M88 HydrophobicContact CG-CE 4.44Å; F85-M88 PolarHBondContact O-N 3.44Å; F85-W89 VanDerWaalsContact CB-NE1 3.32Å; F85-W89 AromaticContact CG-NE1 3.91Å; F85-W89 PolarHBondContact O-N 2.98Å; F85-F368 HydrophobicContact CE1-CD1 4.39Å; F85-F368 AromaticContact CE1-CE1 3.96Å; F85-F368 HydrophobicContact CE1-CE1 3.96Å; F85-C372 HydrophobicContact CZ-CB 4.46Å
86D64.2Low52.5Low72 Ų7268.5 Ų68.539%0.38537%0.369SS..Hα-helixtrans-58.7-45.4179.8-78.7-20.2000112.5R83 M88 W89 N90R83-D86 WeakPolarHBondContact O-CB 3.48Å; R83-D86 PolarHBondContact O-N 3.25Å; D86-M88 VanDerWaalsContact C-N 3.34Å; D86-M88 PolarHBondContact O-N 3.5Å; D86-W89 PolarHBondContact O-N 3.45Å; D86-N90 VanDerWaalsContact O-CB 3.31Å; D86-N90 WeakPolarHBondContact O-CB 3.48Å; D86-N90 PolarHBondContact O-N 3.07Å; D86-N90 PolarHBondContact O-ND2 3.28Å
87P55.7Low52.1Low31 Ų3170.3 Ų70.320%0.20140%0.399CS..Hα-helixtrans-59.7-44.1177.9-22.333000112.2T91P87-T91 PolarHBondContact O-OG1 2.92Å
88M51.9Low51.3Low6 Ų671.1 Ų71.13%0.0341%0.406CS..Hα-helixtrans-66.6-38-177.8-173.2179.777.900112.9F85 D86 L359F85-M88 HydrophobicContact CB-CE 4.46Å; F85-M88 HydrophobicContact CD1-CE 3.62Å; F85-M88 HydrophobicContact CD1-SD 4.49Å; F85-M88 HydrophobicContact CE1-CE 4.29Å; F85-M88 HydrophobicContact CG-CE 4.44Å; F85-M88 PolarHBondContact O-N 3.44Å; D86-M88 VanDerWaalsContact C-N 3.34Å; D86-M88 PolarHBondContact O-N 3.5Å; M88-L359 HydrophobicContact SD-CB 3.61Å; M88-L359 HydrophobicContact SD-CD1 3.52Å; M88-L359 VanDerWaalsContact SD-CD1 3.52Å; M88-L359 HydrophobicContact SD-CG 4.23Å
89W45.5Very low50.3Low56 Ų5674.9 Ų74.921%0.21243%0.427CS..Hα-helixtrans-90.4-23.6-173.9-67.1124.1000114.4F85 D86 S93 M360F85-W89 VanDerWaalsContact CB-NE1 3.32Å; F85-W89 AromaticContact CG-NE1 3.91Å; F85-W89 PolarHBondContact O-N 2.98Å; D86-W89 PolarHBondContact O-N 3.45Å; W89-S93 PolarHBondContact O-N 3.42Å; W89-S93 PolarHBondContact O-OG 2.71Å; W89-M360 HydrophobicContact CE3-SD 4.32Å; W89-M360 HydrophobicContact CH2-CE 3.84Å; W89-M360 HydrophobicContact CH2-CG 3.82Å; W89-M360 HydrophobicContact CH2-SD 4.04Å; W89-M360 HydrophobicContact CZ3-CE 3.41Å; W89-M360 VanDerWaalsContact CZ3-CE 3.41Å; W89-M360 HydrophobicContact CZ3-CG 3.99Å; W89-M360 HydrophobicContact CZ3-SD 3.57Å; W89-M360 VanDerWaalsContact CZ3-SD 3.57Å
90N50Low49Very low104 Ų10478.3 Ų78.356%0.55645%0.446SS*.Hα-helixtrans-67.6-39176.8-75.1-25.7000111.5D86 L92 S93D86-N90 VanDerWaalsContact O-CB 3.31Å; D86-N90 WeakPolarHBondContact O-CB 3.48Å; D86-N90 PolarHBondContact O-N 3.07Å; D86-N90 PolarHBondContact O-ND2 3.28Å; N90-L92 VanDerWaalsContact C-N 3.33Å; N90-L92 PolarHBondContact O-N 3.42Å; N90-S93 PolarHBondContact O-N 2.93Å
91T46.6Very low47.4Very low23 Ų2386 Ų8614%0.14146%0.464CS..Hα-helixtrans-66.3-32.2178.5-0.80000112.9P87 Q190 N194P87-T91 PolarHBondContact O-OG1 2.92Å; T91-Q190 HydrophobicContact CG2-CB 3.86Å; T91-N194 VanDerWaalsContact CG2-ND2 3.31Å; T91-N194 WeakPolarHBondContact CG2-ND2 3.42Å
92L39.2Very low45.8Very low86 Ų8694 Ų9445%0.4550%0.5SS..Hα-helixtrans-78.3-19.5179.5-128.790.7000113.9N90 P356 M360N90-L92 VanDerWaalsContact C-N 3.33Å; N90-L92 PolarHBondContact O-N 3.42Å; L92-P356 HydrophobicContact CD1-CB 4.3Å; L92-M360 HydrophobicContact CD1-SD 3.82Å; L92-M360 HydrophobicContact CD2-CE 3.5Å; L92-M360 VanDerWaalsContact CD2-CE 3.5Å; L92-M360 HydrophobicContact CD2-SD 3.5Å; L92-M360 WeakPolarHBondContact CD2-SD 3.38Å; L92-M360 HydrophobicContact CG-SD 4.27Å
93S37.9Very low44.8Very low60 Ų6092.5 Ų92.542%0.4249%0.491SS..THydrogen-bonded Turntrans-100.30.3-168-56.80000114.1R37 W89 N90R37-S93 PolarHBondContact NH1-OG 3.18Å; W89-S93 PolarHBondContact O-N 3.42Å; W89-S93 PolarHBondContact O-OG 2.71Å; N90-S93 PolarHBondContact O-N 2.93Å
94S36Very low43Very low64 Ų6489.7 Ų89.745%0.44849%0.489SS..  trans-145.1110-173.1-166.90000113.4K96S94-K96 PolarHBondContact O-N 3.09Å; S94-K96 VanDerWaalsContact O-N 3.1Å; S94-K96 WeakPolarHBondContact OG-CB 3.45Å; S94-K96 PolarHBondContact OG-N 3.07Å
95P34.5Very low41.1Very low137 Ų13798 Ų9889%0.8953%0.525SS*.  trans-82.443.4163.735.4-32.8000110.5A97P95-A97 PolarHBondContact O-N 3.37Å
96K32.9Very low39.5Very low165 Ų16599.2 Ų99.272%0.71755%0.549SS*.  trans-96.388.3173.5-70.9-172178.4179.40109.2S94 S98S94-K96 PolarHBondContact O-N 3.09Å; S94-K96 VanDerWaalsContact O-N 3.1Å; S94-K96 WeakPolarHBondContact OG-CB 3.45Å; S94-K96 PolarHBondContact OG-N 3.07Å; K96-S98 PolarHBondContact O-N 3.39Å
97A30.2Very low37.9Very low107 Ų107101.7 Ų101.788%0.88457%0.567SS**  trans-61.879.9158.600000109.5P95P95-A97 PolarHBondContact O-N 3.37Å
98S31.5Very low36.6Very low93 Ų93106.1 Ų106.165%0.6560%0.596SS**  trans-165.981.8170.662.40000111.9K96K96-S98 PolarHBondContact O-N 3.39Å
99S30.9Very low35.5Very low114 Ų114110.8 Ų110.880%0.79763%0.629SS**SBendtrans-175.731138.4-120.90000117.5
100L31.9Very low34.6Very low88 Ų88117.3 Ų117.346%0.46166%0.664SS.*  trans-127.164.4170.4-69.4174.9000112.5F102 I103L100-F102 VanDerWaalsContact C-N 3.26Å; L100-I103 HydrophobicContact CD1-CD1 4.4Å; L100-I103 HydrophobicContact CD2-CD1 3.8Å; L100-I103 HydrophobicContact CD2-CG1 4.18Å
101R38.6Very low33.6Very low214 Ų214121 Ų12181%0.80868%0.678SS**SBendtrans-80.9-3.9160.7-80.3-173.1-177158.82113.3
102F39.2Very low32.6Very low195 Ų195128.4 Ų128.486%0.85572%0.716SS**SBendtrans-94.1-21.6-175.9-77-80.3000114.6L100L100-F102 VanDerWaalsContact C-N 3.26Å
103I41Very low32.1Very low87 Ų87127.4 Ų127.445%0.44673%0.727SS.*SBendtrans-95-11-176.6-60.9-179.3000113.1L100 N172L100-I103 HydrophobicContact CD1-CD1 4.4Å; L100-I103 HydrophobicContact CD2-CD1 3.8Å; L100-I103 HydrophobicContact CD2-CG1 4.18Å; I103-N172 WeakPolarHBondContact CG2-ND2 3.49Å
104L34.4Very low31.6Very low127 Ų127133.4 Ų133.467%0.66575%0.748SS**SBendtrans-110.35.5-175.7-88.8156.7000115.7G106 L168L104-G106 PolarHBondContact O-N 3.41Å; L104-L168 HydrophobicContact CD2-CD2 3.93Å
105K29Very low31.4Very low186 Ų186136.9 Ų136.981%0.80977%0.767SS**  trans-96.185.7173.2-78.9-174.4175.9-177.50110.4
106G29.1Very low31.1Very low68 Ų68137.5 Ų137.570%0.70177%0.768SS**  trans-162.643.1177.600000112.7L104L104-G106 PolarHBondContact O-N 3.41Å
107T29.8Very low31.1Very low125 Ų125133.3 Ų133.377%0.76777%0.772SS**  trans-105.2113.2163.652.30000108S109T107-S109 PolarHBondContact O-N 3.06Å
108P28.6Very low31.1Very low124 Ų124137.2 Ų137.281%0.80577%0.772SS**  trans-72.2114.7163.528.8-26.1000107M110P108-M110 PolarHBondContact O-N 3.36Å
109S27.9Very low31.2Very low104 Ų104140.9 Ų140.973%0.72778%0.784SS**  trans-56.7127.8164.4-81.70000108.7T107 E111T107-S109 PolarHBondContact O-N 3.06Å; S109-E111 VanDerWaalsContact C-N 3.35Å; S109-E111 PolarHBondContact O-N 2.97Å
110M28.1Very low31.2Very low193 Ų193140.3 Ų140.395%0.95179%0.786SS**  trans-63.598.5159-79.3-179.263.800107.9P108P108-M110 PolarHBondContact O-N 3.36Å
111E28.5Very low31.5Very low180 Ų180141.6 Ų141.684%0.84180%0.8SS**  trans-91.5114.9159.8-77.6-166.7156.200109S109 G113S109-E111 VanDerWaalsContact C-N 3.35Å; S109-E111 PolarHBondContact O-N 2.97Å; E111-G113 VanDerWaalsContact C-N 3.34Å; E111-G113 PolarHBondContact O-N 2.89Å; E111-G113 VanDerWaalsContact O-N 3.07Å
112L24.6Very low31.4Very low179 Ų179137.4 Ų137.494%0.93780%0.8SS**  trans-71.189.1167.7-172.574.2000108
113G29.5Very low31.1Very low66 Ų66136.8 Ų136.868%0.6880%0.804SS**  trans-113.294175.600000111.5E111 T115E111-G113 VanDerWaalsContact C-N 3.34Å; E111-G113 PolarHBondContact O-N 2.89Å; E111-G113 VanDerWaalsContact O-N 3.07Å; G113-T115 PolarHBondContact O-N 3.16Å
114Q27.9Very low30.9Very low185 Ų185135.4 Ų135.486%0.86481%0.811SS**  trans-67.3108.3161.3-74.3173.9-20.800108.7
115T30.8Very low30.8Very low138 Ų138135.2 Ų135.285%0.84782%0.821SS**  trans-146.6128.3149.452.20000110.7G113G113-T115 PolarHBondContact O-N 3.16Å
116T29Very low31Very low150 Ų150132.7 Ų132.792%0.9282%0.821SS**  trans-62.4131170.838.30000111.9
117G32.8Very low31.5Very low77 Ų77136.7 Ų136.779%0.79482%0.824SS**  trans-173.9100.8170.400000111.4
118Q30.4Very low31.6Very low189 Ų189135.8 Ų135.888%0.88382%0.821SS**  trans-60.8129.6173.6-66.7168.4-7.100110.2
119N33.3Very low31.9Very low169 Ų169141 Ų14190%0.90482%0.824SS**  trans-163.1114.4149.1-87.3-37.2000109.1
120A31.8Very low32Very low102 Ų102146.7 Ų146.784%0.84383%0.83SS**PPolyproline II helixtrans-81.2140.417500000110.7
121P36.5Very low32.3Very low115 Ų115145.9 Ų145.975%0.74782%0.823SS**PPolyproline II helixtrans-94.8155.7166.535-27.7000111.4
122P36.4Very low32.7Very low126 Ų126144.4 Ų144.482%0.81882%0.82SS**PPolyproline II helixtrans-80.4151.2-168.132.9-33.6000112.7G124P122-G124 PolarHBondContact O-N 3.33Å; P122-G124 VanDerWaalsContact O-N 3.1Å
123I34.6Very low33.4Very low183 Ų183143.7 Ų143.794%0.93881%0.811SS**  trans-63.4104.1175.2-64.6163.9000108.8
124G35.7Very low34.5Very low57 Ų57151.8 Ų151.859%0.58882%0.822SS**  trans-128.9118.3170.600000109.1P122 T126P122-G124 PolarHBondContact O-N 3.33Å; P122-G124 VanDerWaalsContact O-N 3.1Å; G124-T126 PolarHBondContact O-N 3.31Å
125S32.7Very low35.7Very low124 Ų124152 Ų15287%0.86782%0.823SS**  trans-59.499.6-177.553.80000112.6
126T34.1Very low37.3Very low132 Ų132149.1 Ų149.181%0.8180%0.802SS**  trans-99.6110.1164.744.70000109.8G124G124-T126 PolarHBondContact O-N 3.31Å
127I38Very low39.6Very low152 Ų152144.2 Ų144.278%0.77977%0.773SS**  trans-43.8129.3161.9-61.2164.6000108R129I127-R129 PolarHBondContact O-N 2.93Å
128P33.6Very low41.9Very low106 Ų106148.8 Ų148.869%0.68877%0.774SS**  trans-65.3106.2178.225.8-30.1000107.7R130P128-R130 PolarHBondContact O-N 2.87Å
129R33.1Very low44.2Very low235 Ų235144.2 Ų144.289%0.88775%0.752SS**  trans-57.796.7159.8-95.7-172.5174.5-171.4-0.6105.5I127 H131I127-R129 PolarHBondContact O-N 2.93Å; R129-H131 VanDerWaalsContact C-N 3.29Å; R129-H131 PolarHBondContact O-N 3.47Å
130R31.6Very low46.5Very low223 Ų223136.3 Ų136.384%0.84271%0.711SS**  trans-56.4102.8163.6-71.9-179.2178.6170.4-0.8105.2P128 I132P128-R130 PolarHBondContact O-N 2.87Å; R130-I132 PolarHBondContact O-N 3.22Å
131H33.3Very low49.1Very low175 Ų175136 Ų13681%0.8169%0.694SS**  trans-57.297.5159.5-109.2-93.7000104.8R129 E133R129-H131 VanDerWaalsContact C-N 3.29Å; R129-H131 PolarHBondContact O-N 3.47Å; H131-E133 PolarHBondContact O-N 3.02Å
132I37.4Very low51.5Low149 Ų149136.2 Ų136.276%0.76469%0.685SS**  trans-69.586.1163.2-59.5173000103.2R130 R134R130-I132 PolarHBondContact O-N 3.22Å; I132-R134 VanDerWaalsContact C-N 3.31Å; I132-R134 PolarHBondContact O-N 3.47Å
133E39.7Very low53.9Low164 Ų164130.6 Ų130.677%0.76665%0.649SS**  trans-54.5106.1160.3-92.9-177.8155.200105.2H131 Q135H131-E133 PolarHBondContact O-N 3.02Å; E133-Q135 PolarHBondContact O-N 3.39Å
134R52Low56.4Low237 Ų237126.1 Ų126.189%0.89462%0.623SS**  trans-52.4110.9170.8-97.5-178.9174.4168.2-2.4106I132 L136I132-R134 VanDerWaalsContact C-N 3.31Å; I132-R134 PolarHBondContact O-N 3.47Å; R134-L136 PolarHBondContact O-N 3.08Å
135Q53.7Low59.1Low189 Ų189127.2 Ų127.288%0.88362%0.618SS**PPolyproline II helixtrans-57.6130.7176.3-66.4-156.5-900107.8E133E133-Q135 PolarHBondContact O-N 3.39Å
136L63.9Low61.9Low78 Ų78125.6 Ų125.641%0.40860%0.597SS.*PPolyproline II helixtrans-55.3143.2176.5-68.3163.6000108.3R134R134-L136 PolarHBondContact O-N 3.08Å
137S76.3Confident64.6Low46 Ų46119.5 Ų119.532%0.32256%0.559SS.*PPolyproline II helixtrans-57.2150.117361.90000109.9E139 S140 L141S137-E139 PolarHBondContact O-N 3.4Å; S137-S140 CarbonylContact O-C 3.5Å; S137-S140 WeakPolarHBondContact O-CA 3.46Å; S137-S140 WeakPolarHBondContact O-CB 3.38Å; S137-S140 PolarHBondContact O-N 3.47Å; S137-S140 VanDerWaalsContact OG-CB 3.24Å; S137-S140 WeakPolarHBondContact OG-CB 3.33Å; S137-S140 PolarHBondContact OG-N 3.46Å; S137-L141 PolarHBondContact O-N 3.24Å
138E81.5Confident67.2Low173 Ų173115.5 Ų115.581%0.80854%0.542SS*.Hα-helixtrans-52.7-43.5179-173.4173.7-175.400111.6S140 L141 H142E138-S140 VanDerWaalsContact C-N 3.35Å; E138-S140 PolarHBondContact O-N 2.94Å; E138-L141 WeakPolarHBondContact O-CB 3.39Å; E138-L141 PolarHBondContact O-N 3.4Å; E138-L141 VanDerWaalsContact O-N 3.14Å; E138-H142 PolarHBondContact O-N 3.03Å
139E79.1Confident70.1Confident93 Ų93116.4 Ų116.444%0.43554%0.537SS..Hα-helixtrans-62.3-37.5174.4-66.2175.3162.500113.1S137 L141 H142 A143 F230 R294S137-E139 PolarHBondContact O-N 3.4Å; E139-L141 VanDerWaalsContact C-N 3.32Å; E139-H142 PolarHBondContact O-N 3.47Å; E139-A143 WeakPolarHBondContact O-CB 3.47Å; E139-A143 PolarHBondContact O-N 3.5Å; E139-F230 HydrophobicContact CB-CD1 4.36Å; E139-F230 HydrophobicContact CB-CE1 4.42Å; E139-R294 IonicContact OE2-CZ 3.6Å; E139-R294 IonicContact OE2-NE 2.75Å; E139-R294 PolarHBondContact OE2-NE 2.97Å; E139-R294 IonicContact OE2-NH2 3.54Å; E139-R294 PolarHBondContact OE2-NH2 3.44Å
140S82.2Confident72.9Confident4 Ų4106 Ų1063%0.02850%0.498CS..Hα-helixtrans-69.6-31.7175.7171.60000111.8S137 E138 K144 R231S137-S140 CarbonylContact O-C 3.5Å; S137-S140 WeakPolarHBondContact O-CA 3.46Å; S137-S140 WeakPolarHBondContact O-CB 3.38Å; S137-S140 PolarHBondContact O-N 3.47Å; S137-S140 VanDerWaalsContact OG-CB 3.24Å; S137-S140 WeakPolarHBondContact OG-CB 3.33Å; S137-S140 PolarHBondContact OG-N 3.46Å; E138-S140 VanDerWaalsContact C-N 3.35Å; E138-S140 PolarHBondContact O-N 2.94Å; S140-K144 PolarHBondContact O-N 2.92Å; S140-R231 WeakPolarHBondContact O-CD 3.47Å; S140-R231 WeakPolarHBondContact OG-CD 3.36Å; S140-R231 PolarHBondContact OG-NE 3.1Å
141L85.3Confident75.7Confident94 Ų9496.7 Ų96.749%0.49247%0.465SS..Hα-helixtrans-72.6-42.9175-172.467.3000110.2S137 E138 E139 K144 T145S137-L141 PolarHBondContact O-N 3.24Å; E138-L141 WeakPolarHBondContact O-CB 3.39Å; E138-L141 PolarHBondContact O-N 3.4Å; E138-L141 VanDerWaalsContact O-N 3.14Å; E139-L141 VanDerWaalsContact C-N 3.32Å; L141-K144 WeakPolarHBondContact O-CA 3.29Å; L141-K144 WeakPolarHBondContact O-CB 3.49Å; L141-K144 PolarHBondContact O-N 3.36Å; L141-K144 VanDerWaalsContact O-N 3.1Å; L141-T145 PolarHBondContact O-N 2.89Å; L141-T145 PolarHBondContact O-OG1 3.25Å
142H88.2Confident78.5Confident120 Ų12095.2 Ų95.256%0.55646%0.458SS*.Hα-helixtrans-59.5-47.9176-171.872.1000112E138 E139 K144 T145 E146E138-H142 PolarHBondContact O-N 3.03Å; E139-H142 PolarHBondContact O-N 3.47Å; H142-K144 PolarHBondContact O-N 3.25Å; H142-T145 WeakPolarHBondContact CA-OG1 3.31Å; H142-T145 PolarHBondContact O-N 2.87Å; H142-T145 VanDerWaalsContact O-N 3.1Å; H142-T145 PolarHBondContact O-OG1 2.95Å; H142-E146 WeakPolarHBondContact O-CB 3.3Å; H142-E146 PolarHBondContact O-N 3.31Å
143A86Confident81Confident8 Ų892.5 Ų92.57%0.06645%0.449CS..Hα-helixtrans-58.9-33.5175.400000112.1E139 F147 F230E139-A143 WeakPolarHBondContact O-CB 3.47Å; E139-A143 PolarHBondContact O-N 3.5Å; A143-F147 WeakPolarHBondContact O-CB 3.39Å; A143-F147 PolarHBondContact O-N 3.24Å; A143-F230 HydrophobicContact CB-CB 3.75Å; A143-F230 HydrophobicContact CB-CD1 4.33Å; A143-F230 HydrophobicContact CB-CG 4.17Å
144K87.8Confident83.2Confident90 Ų9085.4 Ų85.439%0.39142%0.416SS..Hα-helixtrans-70.2-43.5175-175.7-174.1176-172.40112.5S140 L141 H142 F147 V148 Y227S140-K144 PolarHBondContact O-N 2.92Å; L141-K144 WeakPolarHBondContact O-CA 3.29Å; L141-K144 WeakPolarHBondContact O-CB 3.49Å; L141-K144 PolarHBondContact O-N 3.36Å; L141-K144 VanDerWaalsContact O-N 3.1Å; H142-K144 PolarHBondContact O-N 3.25Å; K144-F147 PolarHBondContact O-N 2.98Å; K144-V148 VanDerWaalsContact O-CG2 3.28Å; K144-V148 WeakPolarHBondContact O-CG2 3.33Å; K144-V148 PolarHBondContact O-N 2.91Å; K144-Y227 HydrophobicContact CB-CE2 4.12Å; K144-Y227 HydrophobicContact CG-CE2 4.31Å
145T91Very high84.8Confident80 Ų8076.1 Ų76.149%0.49139%0.386SS..Hα-helixtrans-64.3-43.3177.346.40000111.6L141 H142 V148 H149L141-T145 PolarHBondContact O-N 2.89Å; L141-T145 PolarHBondContact O-OG1 3.25Å; H142-T145 WeakPolarHBondContact CA-OG1 3.31Å; H142-T145 PolarHBondContact O-N 2.87Å; H142-T145 VanDerWaalsContact O-N 3.1Å; H142-T145 PolarHBondContact O-OG1 2.95Å; T145-V148 PolarHBondContact O-N 3.04Å; T145-H149 PolarHBondContact O-N 3.41Å
146E91.4Very high86.4Confident90 Ų9076 Ų7642%0.42138%0.383SS..Hα-helixtrans-63.8-44.1177.9-170.7-179.5-17700111.2H142 V148 H149 F150H142-E146 WeakPolarHBondContact O-CB 3.3Å; H142-E146 PolarHBondContact O-N 3.31Å; E146-V148 PolarHBondContact O-N 3.31Å; E146-H149 PolarHBondContact O-N 3.43Å; E146-F150 WeakPolarHBondContact O-CB 3.39Å; E146-F150 PolarHBondContact O-N 3.35Å
147F92.5Very high87.4Confident4 Ų475.8 Ų75.82%0.01839%0.386CS..Hα-helixtrans-64.7-39.7177.7-174.8-112.3000112.7A143 K144 F150 L151 V162 V166 V224 Y227A143-F147 WeakPolarHBondContact O-CB 3.39Å; A143-F147 PolarHBondContact O-N 3.24Å; K144-F147 PolarHBondContact O-N 2.98Å; F147-F150 PolarHBondContact O-N 3.46Å; F147-L151 HydrophobicContact CD1-CD1 4.02Å; F147-L151 HydrophobicContact CD1-CG 4.39Å; F147-L151 HydrophobicContact CE1-CD1 3.62Å; F147-L151 HydrophobicContact CE1-CD2 4.43Å; F147-L151 HydrophobicContact CE1-CG 4.11Å; F147-L151 HydrophobicContact CE2-CD2 4.43Å; F147-L151 HydrophobicContact CZ-CD1 4.1Å; F147-L151 HydrophobicContact CZ-CD2 4.06Å; F147-L151 HydrophobicContact CZ-CG 4.18Å; F147-L151 WeakPolarHBondContact O-CG 3.37Å; F147-L151 PolarHBondContact O-N 2.9Å; F147-V162 HydrophobicContact CE2-CG1 4.48Å; F147-V162 HydrophobicContact CZ-CG1 4.05Å; F147-V166 HydrophobicContact CE1-CB 4.33Å; F147-V166 HydrophobicContact CE1-CG1 4.11Å; F147-V166 HydrophobicContact CZ-CB 4.07Å; F147-V166 HydrophobicContact CZ-CG1 3.95Å; F147-V166 HydrophobicContact CZ-CG2 4.05Å; F147-V224 HydrophobicContact CE2-CG2 4.38Å; F147-Y227 HydrophobicContact CB-CD2 3.42Å; F147-Y227 VanDerWaalsContact CB-CD2 3.42Å; F147-Y227 HydrophobicContact CB-CE2 3.95Å; F147-Y227 HydrophobicContact CB-CG 4.02Å; F147-Y227 HydrophobicContact CD1-CD1 4.16Å; F147-Y227 AromaticContact CD1-CD2 3.74Å; F147-Y227 HydrophobicContact CD1-CD2 3.74Å; F147-Y227 HydrophobicContact CD1-CE1 4.18Å; F147-Y227 AromaticContact CD1-CE2 3.79Å; F147-Y227 HydrophobicContact CD1-CE2 3.79Å; F147-Y227 AromaticContact CD1-CG 3.89Å; F147-Y227 HydrophobicContact CD1-CG 3.89Å; F147-Y227 AromaticContact CD1-CZ 3.96Å; F147-Y227 HydrophobicContact CD2-CD2 4.34Å; F147-Y227 HydrophobicContact CD2-CG 4.08Å; F147-Y227 HydrophobicContact CE1-CD1 4.23Å; F147-Y227 HydrophobicContact CE1-CE1 4.25Å; F147-Y227 HydrophobicContact CE1-CG 4.34Å; F147-Y227 HydrophobicContact CG-CD1 4.41Å; F147-Y227 AromaticContact CG-CD2 3.59Å; F147-Y227 HydrophobicContact CG-CD2 3.59Å; F147-Y227 HydrophobicContact CG-CE2 4.08Å; F147-Y227 AromaticContact CG-CG 3.73Å; F147-Y227 HydrophobicContact CG-CG 3.73Å
148V92.1Very high87.8Confident68 Ų6873.6 Ų73.641%0.41237%0.371SS..Hα-helixtrans-63.6-45.4175.3170.20000110.6K144 T145 E146 F150 L151 E152K144-V148 VanDerWaalsContact O-CG2 3.28Å; K144-V148 WeakPolarHBondContact O-CG2 3.33Å; K144-V148 PolarHBondContact O-N 2.91Å; T145-V148 PolarHBondContact O-N 3.04Å; E146-V148 PolarHBondContact O-N 3.31Å; V148-F150 VanDerWaalsContact C-N 3.3Å; V148-F150 PolarHBondContact O-N 3.46Å; V148-L151 PolarHBondContact O-N 2.96Å; V148-L151 VanDerWaalsContact O-N 3.14Å; V148-E152 WeakPolarHBondContact O-CG 3.27Å; V148-E152 PolarHBondContact O-N 2.81Å; V148-E152 VanDerWaalsContact O-N 3.12Å
149H93.4Very high88.2Confident125 Ų12566.1 Ų66.158%0.57934%0.338SS*.Hα-helixtrans-60.4-40.8175.4-178.6-91000111.6T145 E146 L151 E152 T153T145-H149 PolarHBondContact O-N 3.41Å; E146-H149 PolarHBondContact O-N 3.43Å; H149-L151 PolarHBondContact O-N 3.31Å; H149-E152 WeakPolarHBondContact O-CB 3.45Å; H149-E152 PolarHBondContact O-N 2.9Å; H149-T153 PolarHBondContact O-N 2.74Å
150F92.5Very high88.6Confident17 Ų1767.9 Ų67.98%0.07535%0.346CS..Hα-helixtrans-62.6-40.5173.7177.7-105.2000112.5E146 F147 V148 E152 T153 L154 E219 I220 Q223E146-F150 WeakPolarHBondContact O-CB 3.39Å; E146-F150 PolarHBondContact O-N 3.35Å; F147-F150 PolarHBondContact O-N 3.46Å; V148-F150 VanDerWaalsContact C-N 3.3Å; V148-F150 PolarHBondContact O-N 3.46Å; F150-E152 PolarHBondContact O-N 3.4Å; F150-T153 PolarHBondContact O-N 2.86Å; F150-T153 PolarHBondContact O-OG1 3.31Å; F150-L154 HydrophobicContact CD1-CD1 4.24Å; F150-L154 HydrophobicContact CE1-CD1 3.71Å; F150-L154 HydrophobicContact CE1-CG 4.38Å; F150-L154 HydrophobicContact CZ-CD1 4.12Å; F150-L154 HydrophobicContact CZ-CD2 4.3Å; F150-L154 HydrophobicContact CZ-CG 4.41Å; F150-E219 HydrophobicContact CE2-CG 4.17Å; F150-E219 HydrophobicContact CZ-CG 4.34Å; F150-I220 HydrophobicContact CE1-CG1 4.17Å; F150-I220 HydrophobicContact CZ-CB 4.48Å; F150-I220 HydrophobicContact CZ-CG1 3.91Å; F150-Q223 HydrophobicContact CD1-CB 3.77Å; F150-Q223 HydrophobicContact CD1-CG 3.87Å; F150-Q223 HydrophobicContact CD2-CG 3.94Å; F150-Q223 HydrophobicContact CE1-CB 3.65Å; F150-Q223 HydrophobicContact CE1-CG 3.77Å; F150-Q223 HydrophobicContact CE2-CG 3.85Å; F150-Q223 HydrophobicContact CG-CB 4.31Å; F150-Q223 HydrophobicContact CG-CG 3.95Å; F150-Q223 HydrophobicContact CZ-CB 4.12Å; F150-Q223 HydrophobicContact CZ-CG 3.77Å
151L90.9Very high88.9Confident26 Ų2668.6 Ų68.614%0.13635%0.35CS..Hα-helixtrans-64.1-28.3175.6-69.4178.5000112.7F147 V148 H149 T153 L154 A159 V162F147-L151 HydrophobicContact CD1-CD1 4.02Å; F147-L151 HydrophobicContact CD1-CG 4.39Å; F147-L151 HydrophobicContact CE1-CD1 3.62Å; F147-L151 HydrophobicContact CE1-CD2 4.43Å; F147-L151 HydrophobicContact CE1-CG 4.11Å; F147-L151 HydrophobicContact CE2-CD2 4.43Å; F147-L151 HydrophobicContact CZ-CD1 4.1Å; F147-L151 HydrophobicContact CZ-CD2 4.06Å; F147-L151 HydrophobicContact CZ-CG 4.18Å; F147-L151 WeakPolarHBondContact O-CG 3.37Å; F147-L151 PolarHBondContact O-N 2.9Å; V148-L151 PolarHBondContact O-N 2.96Å; V148-L151 VanDerWaalsContact O-N 3.14Å; H149-L151 PolarHBondContact O-N 3.31Å; L151-T153 VanDerWaalsContact C-N 3.32Å; L151-L154 HydrophobicContact CD2-CD1 4.32Å; L151-L154 PolarHBondContact O-N 3.48Å; L151-A159 HydrophobicContact CB-CB 4.4Å; L151-A159 WeakPolarHBondContact O-CB 3.5Å; L151-V162 HydrophobicContact CD2-CB 4.1Å; L151-V162 HydrophobicContact CD2-CG1 3.97Å
152E92.1Very high89.1Confident145 Ų14564.1 Ų64.168%0.67833%0.326SS*.Hα-helixtrans-71.2-25.2176.8-69.5173.5174.100113.1V148 H149 F150 L154V148-E152 WeakPolarHBondContact O-CG 3.27Å; V148-E152 PolarHBondContact O-N 2.81Å; V148-E152 VanDerWaalsContact O-N 3.12Å; H149-E152 WeakPolarHBondContact O-CB 3.45Å; H149-E152 PolarHBondContact O-N 2.9Å; F150-E152 PolarHBondContact O-N 3.4Å; E152-L154 VanDerWaalsContact C-N 3.32Å
153T89.4Confident89.3Confident92 Ų9258.8 Ų58.856%0.56430%0.303SS*.Hα-helixtrans-77.4-20.8175.972.10000112.5H149 F150 L151H149-T153 PolarHBondContact O-N 2.74Å; F150-T153 PolarHBondContact O-N 2.86Å; F150-T153 PolarHBondContact O-OG1 3.31Å; L151-T153 VanDerWaalsContact C-N 3.32Å
154L86.4Confident89.5Confident15 Ų1565.2 Ų65.28%0.07933%0.33CS..SBendtrans-84.8153.1-177-64.1177.3000112.5F150 L151 E152 K156 I158 A159 L216 I220F150-L154 HydrophobicContact CD1-CD1 4.24Å; F150-L154 HydrophobicContact CE1-CD1 3.71Å; F150-L154 HydrophobicContact CE1-CG 4.38Å; F150-L154 HydrophobicContact CZ-CD1 4.12Å; F150-L154 HydrophobicContact CZ-CD2 4.3Å; F150-L154 HydrophobicContact CZ-CG 4.41Å; L151-L154 HydrophobicContact CD2-CD1 4.32Å; L151-L154 PolarHBondContact O-N 3.48Å; E152-L154 VanDerWaalsContact C-N 3.32Å; L154-K156 PolarHBondContact O-N 3.42Å; L154-I158 HydrophobicContact CD1-CG2 4.26Å; L154-A159 HydrophobicContact CB-CB 4.18Å; L154-L216 HydrophobicContact CD2-CD1 4.28Å; L154-I220 HydrophobicContact CD1-CD1 4.19Å; L154-I220 HydrophobicContact CD1-CG1 4.03Å; L154-I220 HydrophobicContact CD2-CD1 4.08Å; L154-I220 HydrophobicContact CD2-CG1 4.12Å
155P85.9Confident89.7Confident42 Ų4263 Ų6327%0.27332%0.321SS..  trans-55.4132.3170.2-24.534.1000111.2P157 I158 A159P155-P157 VanDerWaalsContact C-N 3.34Å; P155-P157 HydrophobicContact CB-CG 4.42Å; P155-P157 WeakPolarHBondContact O-CD 3.21Å; P155-P157 VanDerWaalsContact O-N 3.07Å; P155-I158 HydrophobicContact CB-CD1 4.32Å; P155-I158 HydrophobicContact CG-CD1 4.19Å; P155-I158 WeakPolarHBondContact O-CA 3.42Å; P155-I158 WeakPolarHBondContact O-CB 3.2Å; P155-I158 PolarHBondContact O-N 2.79Å; P155-A159 PolarHBondContact O-N 3.05Å
156K86.7Confident89.7Confident186 Ų18659.2 Ų59.281%0.80930%0.298SS*.Hα-helixtrans-40.7-46.4-179-67.4-174.6179.4179.10115.8L154 I158 A159 H160L154-K156 PolarHBondContact O-N 3.42Å; K156-I158 VanDerWaalsContact C-N 3.31Å; K156-I158 PolarHBondContact O-N 3.33Å; K156-A159 PolarHBondContact O-N 3.47Å; K156-H160 WeakPolarHBondContact O-CB 3.29Å; K156-H160 PolarHBondContact O-N 3.21Å
157P84.7Confident89.7Confident73 Ų7358.6 Ų58.647%0.47430%0.297SS..Hα-helixtrans-63.9-35.7179.523.7-34.2000113P155 L161P155-P157 VanDerWaalsContact C-N 3.34Å; P155-P157 HydrophobicContact CB-CG 4.42Å; P155-P157 WeakPolarHBondContact O-CD 3.21Å; P155-P157 VanDerWaalsContact O-N 3.07Å; P157-L161 WeakPolarHBondContact O-CB 3.26Å; P157-L161 PolarHBondContact O-N 3.34Å
158I85.2Confident89.6Confident1 Ų162.2 Ų62.21%0.00532%0.317CS..Hα-helixtrans-75.9-47.1178.5-66.9167000109.8L154 P155 K156 H160 L161 V162 L200 L204 I211 I220L154-I158 HydrophobicContact CD1-CG2 4.26Å; P155-I158 HydrophobicContact CB-CD1 4.32Å; P155-I158 HydrophobicContact CG-CD1 4.19Å; P155-I158 WeakPolarHBondContact O-CA 3.42Å; P155-I158 WeakPolarHBondContact O-CB 3.2Å; P155-I158 PolarHBondContact O-N 2.79Å; K156-I158 VanDerWaalsContact C-N 3.31Å; K156-I158 PolarHBondContact O-N 3.33Å; I158-H160 VanDerWaalsContact C-N 3.27Å; I158-H160 PolarHBondContact O-N 2.78Å; I158-L161 WeakPolarHBondContact O-CB 3.46Å; I158-L161 PolarHBondContact O-N 3.09Å; I158-L161 VanDerWaalsContact O-N 3.12Å; I158-V162 HydrophobicContact CG2-CG2 4.14Å; I158-V162 WeakPolarHBondContact O-CG2 3.24Å; I158-V162 PolarHBondContact O-N 3.5Å; I158-L200 HydrophobicContact CG1-CD2 4.42Å; I158-L200 HydrophobicContact CG2-CD2 3.78Å; I158-L204 HydrophobicContact CG1-CD1 4.09Å; I158-I211 HydrophobicContact CD1-CD1 3.09Å; I158-I220 HydrophobicContact CG2-CD1 4.02Å
159A89Confident89.5Confident15 Ų1559.7 Ų59.712%0.12430%0.301CS..Hα-helixtrans-54.8-44.6176.900000111.7L151 L154 P155 K156 G163L151-A159 HydrophobicContact CB-CB 4.4Å; L151-A159 WeakPolarHBondContact O-CB 3.5Å; L154-A159 HydrophobicContact CB-CB 4.18Å; P155-A159 PolarHBondContact O-N 3.05Å; K156-A159 PolarHBondContact O-N 3.47Å; A159-G163 PolarHBondContact O-N 2.8Å
160H88.1Confident89.3Confident131 Ų13153.9 Ų53.961%0.60627%0.274SS*.Hα-helixtrans-66-41.7177.7-173.371.5000112.5K156 I158 K164K156-H160 WeakPolarHBondContact O-CB 3.29Å; K156-H160 PolarHBondContact O-N 3.21Å; I158-H160 VanDerWaalsContact C-N 3.27Å; I158-H160 PolarHBondContact O-N 2.78Å; H160-K164 WeakPolarHBondContact O-CB 3.44Å; H160-K164 PolarHBondContact O-N 3.37Å
161L87.9Confident89.1Confident19 Ų1955.7 Ų55.710%0.09929%0.292CS..Hα-helixtrans-61.7-52178.3-179.3161.2000111.4P157 I158 Q165 L204P157-L161 WeakPolarHBondContact O-CB 3.26Å; P157-L161 PolarHBondContact O-N 3.34Å; I158-L161 WeakPolarHBondContact O-CB 3.46Å; I158-L161 PolarHBondContact O-N 3.09Å; I158-L161 VanDerWaalsContact O-N 3.12Å; L161-Q165 PolarHBondContact O-N 3.05Å; L161-L204 HydrophobicContact CD1-CD1 3.89Å
162V90.5Very high89Confident0 Ų055.7 Ų55.70%029%0.292CS..Hα-helixtrans-64.8-54.9-179.4176.10000109.2F147 L151 I158 K164 Q165 V166 I220 V224F147-V162 HydrophobicContact CE2-CG1 4.48Å; F147-V162 HydrophobicContact CZ-CG1 4.05Å; L151-V162 HydrophobicContact CD2-CB 4.1Å; L151-V162 HydrophobicContact CD2-CG1 3.97Å; I158-V162 HydrophobicContact CG2-CG2 4.14Å; I158-V162 WeakPolarHBondContact O-CG2 3.24Å; I158-V162 PolarHBondContact O-N 3.5Å; V162-K164 VanDerWaalsContact C-N 3.3Å; V162-K164 PolarHBondContact O-N 3.41Å; V162-Q165 PolarHBondContact O-N 3.1Å; V162-V166 HydrophobicContact CG1-CG2 3.98Å; V162-V166 WeakPolarHBondContact O-CB 3.24Å; V162-V166 WeakPolarHBondContact O-CG2 3.09Å; V162-V166 PolarHBondContact O-N 2.89Å; V162-I220 HydrophobicContact CG1-CG2 4.27Å; V162-I220 HydrophobicContact CG2-CG2 3.86Å; V162-V224 HydrophobicContact CG1-CG2 3.71Å
163G91.7Very high88.7Confident7 Ų749.6 Ų49.67%0.07226%0.264CS..Hα-helixtrans-56.7-40.5-178.500000113.4A159 N167A159-G163 PolarHBondContact O-N 2.8Å; G163-N167 VanDerWaalsContact O-CB 3.24Å; G163-N167 WeakPolarHBondContact O-CB 3.47Å; G163-N167 VanDerWaalsContact O-CG 3.25Å; G163-N167 PolarHBondContact O-N 2.9Å; G163-N167 VanDerWaalsContact O-N 3.09Å; G163-N167 PolarHBondContact O-ND2 3.15Å
164K91.2Very high88.5Confident143 Ų14348.4 Ų48.462%0.62225%0.254SS*.Hα-helixtrans-66.5-47.5178-176.2177.7179.8177.50112.4H160 V162 L168H160-K164 WeakPolarHBondContact O-CB 3.44Å; H160-K164 PolarHBondContact O-N 3.37Å; V162-K164 VanDerWaalsContact C-N 3.3Å; V162-K164 PolarHBondContact O-N 3.41Å; K164-L168 WeakPolarHBondContact O-CB 3.48Å; K164-L168 PolarHBondContact O-N 2.81Å
165Q90.2Very high88.3Confident45 Ų4556 Ų5621%0.2128%0.281CS..Hα-helixtrans-68-45-177.9-76.9-170.5-44.700111.9L161 V162 L168 I169 M196 R199L161-Q165 PolarHBondContact O-N 3.05Å; V162-Q165 PolarHBondContact O-N 3.1Å; Q165-L168 PolarHBondContact O-N 3.02Å; Q165-I169 PolarHBondContact O-N 2.86Å; Q165-I169 VanDerWaalsContact O-N 3.1Å; Q165-M196 HydrophobicContact CB-CE 3.44Å; Q165-M196 VanDerWaalsContact CB-CE 3.44Å; Q165-M196 HydrophobicContact CG-CE 4.44Å; Q165-R199 VanDerWaalsContact CD-NH1 3.34Å; Q165-R199 VanDerWaalsContact NE2-NH1 3.12Å
166V92.3Very high87.9Confident0 Ų056.4 Ų56.40%028%0.281CS..Hα-helixtrans-64.5-47.3-179-179.70000111F147 V162 L168 I169 T170 M196 V224 Y227 I228F147-V166 HydrophobicContact CE1-CB 4.33Å; F147-V166 HydrophobicContact CE1-CG1 4.11Å; F147-V166 HydrophobicContact CZ-CB 4.07Å; F147-V166 HydrophobicContact CZ-CG1 3.95Å; F147-V166 HydrophobicContact CZ-CG2 4.05Å; V162-V166 HydrophobicContact CG1-CG2 3.98Å; V162-V166 WeakPolarHBondContact O-CB 3.24Å; V162-V166 WeakPolarHBondContact O-CG2 3.09Å; V162-V166 PolarHBondContact O-N 2.89Å; V166-L168 VanDerWaalsContact C-N 3.28Å; V166-L168 PolarHBondContact O-N 2.88Å; V166-I169 VanDerWaalsContact O-CG2 3.25Å; V166-I169 WeakPolarHBondContact O-CG2 3.17Å; V166-I169 PolarHBondContact O-N 3.35Å; V166-T170 WeakPolarHBondContact O-CB 3.11Å; V166-T170 PolarHBondContact O-N 2.7Å; V166-T170 PolarHBondContact O-OG1 3.15Å; V166-M196 HydrophobicContact CG2-CE 3.46Å; V166-M196 VanDerWaalsContact CG2-CE 3.46Å; V166-M196 HydrophobicContact CG2-SD 4.38Å; V166-V224 HydrophobicContact CG2-CB 4.33Å; V166-V224 HydrophobicContact CG2-CG1 3.64Å; V166-V224 HydrophobicContact CG2-CG2 3.82Å; V166-Y227 HydrophobicContact CG1-CD1 3.26Å; V166-Y227 HydrophobicContact CG1-CE1 3.46Å; V166-Y227 VanDerWaalsContact CG1-CE1 3.46Å; V166-Y227 HydrophobicContact CG1-CG 4.4Å; V166-I228 HydrophobicContact CG1-CD1 4.31Å; V166-I228 HydrophobicContact CG1-CG1 3.91Å
167N90.8Very high87Confident76 Ų7650.6 Ų50.641%0.40626%0.264SS..Hα-helixtrans-64.8-33.8179.4-73.3-39.8000112.5G163 A171 Y227G163-N167 VanDerWaalsContact O-CB 3.24Å; G163-N167 WeakPolarHBondContact O-CB 3.47Å; G163-N167 VanDerWaalsContact O-CG 3.25Å; G163-N167 PolarHBondContact O-N 2.9Å; G163-N167 VanDerWaalsContact O-N 3.09Å; G163-N167 PolarHBondContact O-ND2 3.15Å; N167-A171 VanDerWaalsContact O-CB 3.27Å; N167-A171 WeakPolarHBondContact O-CB 3.16Å; N167-A171 PolarHBondContact O-N 2.83Å; N167-Y227 PolarHBondContact OD1-OH 3.07Å
168L91.1Very high86.1Confident81 Ų8151.6 Ų51.642%0.42427%0.272SS..Hα-helixtrans-64.8-48.4176.1-176.866000111.6L104 K164 Q165 V166 A171 N172L104-L168 HydrophobicContact CD2-CD2 3.93Å; K164-L168 WeakPolarHBondContact O-CB 3.48Å; K164-L168 PolarHBondContact O-N 2.81Å; Q165-L168 PolarHBondContact O-N 3.02Å; V166-L168 VanDerWaalsContact C-N 3.28Å; V166-L168 PolarHBondContact O-N 2.88Å; L168-A171 PolarHBondContact O-N 3.35Å; L168-N172 VanDerWaalsContact O-CG 3.25Å; L168-N172 PolarHBondContact O-N 3.28Å; L168-N172 PolarHBondContact O-OD1 2.85Å
169I89.3Confident85.5Confident15 Ų1559.6 Ų59.68%0.07731%0.31CS..Hα-helixtrans-67.6-41.2179.6-167.4166.4000111.7Q165 V166 A171 N172 I173 A188 I189 I192 I228Q165-I169 PolarHBondContact O-N 2.86Å; Q165-I169 VanDerWaalsContact O-N 3.1Å; V166-I169 VanDerWaalsContact O-CG2 3.25Å; V166-I169 WeakPolarHBondContact O-CG2 3.17Å; V166-I169 PolarHBondContact O-N 3.35Å; I169-A171 VanDerWaalsContact C-N 3.29Å; I169-A171 PolarHBondContact O-N 3.45Å; I169-N172 PolarHBondContact O-N 3.11Å; I169-N172 VanDerWaalsContact O-N 3.15Å; I169-I173 HydrophobicContact CD1-CD1 4.31Å; I169-I173 HydrophobicContact CG1-CD1 3.79Å; I169-I173 HydrophobicContact CG1-CG1 4.12Å; I169-I173 VanDerWaalsContact O-CG1 3.31Å; I169-I173 WeakPolarHBondContact O-CG1 3.3Å; I169-I173 PolarHBondContact O-N 3.39Å; I169-A188 HydrophobicContact CD1-CB 4.35Å; I169-I189 HydrophobicContact CD1-CG1 3.79Å; I169-I192 HydrophobicContact CB-CD1 3.46Å; I169-I192 VanDerWaalsContact CB-CD1 3.46Å; I169-I192 HydrophobicContact CD1-CD1 3.32Å; I169-I192 HydrophobicContact CD1-CG1 4.07Å; I169-I192 HydrophobicContact CG1-CD1 3.89Å; I169-I192 HydrophobicContact CG2-CD1 3.63Å; I169-I228 HydrophobicContact CG2-CD1 3.94Å; I169-I228 HydrophobicContact CG2-CG1 4.46Å
170T90.2Very high84.9Confident3 Ų361.6 Ų61.62%0.01832%0.32CS..Hα-helixtrans-59.7-42.5176.6-59.20000110.8V166 L174 Y227 R231V166-T170 WeakPolarHBondContact O-CB 3.11Å; V166-T170 PolarHBondContact O-N 2.7Å; V166-T170 PolarHBondContact O-OG1 3.15Å; T170-L174 HydrophobicContact CG2-CD1 3.95Å; T170-L174 WeakPolarHBondContact O-CB 3.02Å; T170-L174 VanDerWaalsContact O-CG 3.25Å; T170-L174 WeakPolarHBondContact O-CG 3.5Å; T170-L174 PolarHBondContact O-N 2.93Å; T170-L174 VanDerWaalsContact O-N 3.09Å; T170-Y227 HydrophobicContact CG2-CE1 4.48Å; T170-R231 HydrophobicContact CG2-CB 3.77Å; T170-R231 HydrophobicContact CG2-CG 4.26Å
171A88.2Confident84.6Confident54 Ų5458.9 Ų58.945%0.44631%0.314SS..Hα-helixtrans-64.6-40.6176.100000112.2N167 L168 I169 R175N167-A171 VanDerWaalsContact O-CB 3.27Å; N167-A171 WeakPolarHBondContact O-CB 3.16Å; N167-A171 PolarHBondContact O-N 2.83Å; L168-A171 PolarHBondContact O-N 3.35Å; I169-A171 VanDerWaalsContact C-N 3.29Å; I169-A171 PolarHBondContact O-N 3.45Å; A171-R175 WeakPolarHBondContact O-CB 3.33Å; A171-R175 PolarHBondContact O-N 2.94Å; A171-R175 VanDerWaalsContact O-N 3.07Å
172N87.3Confident84.4Confident27 Ų2759 Ų5914%0.14432%0.315CS..Hα-helixtrans-65.6-47.1177.7-70.7-10.1000111.8I103 L168 I169 L174 R175 D176I103-N172 WeakPolarHBondContact CG2-ND2 3.49Å; L168-N172 VanDerWaalsContact O-CG 3.25Å; L168-N172 PolarHBondContact O-N 3.28Å; L168-N172 PolarHBondContact O-OD1 2.85Å; I169-N172 PolarHBondContact O-N 3.11Å; I169-N172 VanDerWaalsContact O-N 3.15Å; N172-L174 VanDerWaalsContact C-N 3.33Å; N172-L174 PolarHBondContact O-N 3.35Å; N172-R175 PolarHBondContact O-N 3.3Å; N172-D176 WeakPolarHBondContact O-CB 3.32Å; N172-D176 PolarHBondContact O-N 3Å
173I86.7Confident84.1Confident16 Ų1663.2 Ų63.28%0.08234%0.337CS..Hα-helixtrans-59-45.8178.3-66165.6000110.5I169 R175 S177 V185 I189 I228 C232 L236I169-I173 HydrophobicContact CD1-CD1 4.31Å; I169-I173 HydrophobicContact CG1-CD1 3.79Å; I169-I173 HydrophobicContact CG1-CG1 4.12Å; I169-I173 VanDerWaalsContact O-CG1 3.31Å; I169-I173 WeakPolarHBondContact O-CG1 3.3Å; I169-I173 PolarHBondContact O-N 3.39Å; I173-R175 VanDerWaalsContact C-N 3.3Å; I173-R175 PolarHBondContact O-N 2.97Å; I173-S177 WeakPolarHBondContact O-CA 3.32Å; I173-S177 WeakPolarHBondContact O-CB 3.49Å; I173-S177 PolarHBondContact O-N 3.44Å; I173-S177 VanDerWaalsContact O-N 3.15Å; I173-V185 HydrophobicContact CD1-CG1 4.24Å; I173-V185 HydrophobicContact CG1-CG1 4.05Å; I173-I189 HydrophobicContact CD1-CD1 3.83Å; I173-I189 HydrophobicContact CD1-CG1 4.04Å; I173-I228 HydrophobicContact CD1-CG2 4.26Å; I173-C232 HydrophobicContact CG2-CB 3.81Å; I173-L236 HydrophobicContact CG2-CD2 4.11Å
174L85.2Confident83.9Confident68 Ų6866.9 Ų66.936%0.35636%0.355SS..Hα-helixtrans-68.4-28.1-179.1-71.2171.8000113.2T170 N172T170-L174 HydrophobicContact CG2-CD1 3.95Å; T170-L174 WeakPolarHBondContact O-CB 3.02Å; T170-L174 VanDerWaalsContact O-CG 3.25Å; T170-L174 WeakPolarHBondContact O-CG 3.5Å; T170-L174 PolarHBondContact O-N 2.93Å; T170-L174 VanDerWaalsContact O-N 3.09Å; N172-L174 VanDerWaalsContact C-N 3.33Å; N172-L174 PolarHBondContact O-N 3.35Å
175R83.1Confident83.8Confident175 Ų17561.1 Ų61.166%0.6633%0.332SS*.Hα-helixtrans-80.6-40.3178.1-167.8-172.769.9-158.8-6.4112A171 N172 I173A171-R175 WeakPolarHBondContact O-CB 3.33Å; A171-R175 PolarHBondContact O-N 2.94Å; A171-R175 VanDerWaalsContact O-N 3.07Å; N172-R175 PolarHBondContact O-N 3.3Å; I173-R175 VanDerWaalsContact C-N 3.3Å; I173-R175 PolarHBondContact O-N 2.97Å
176D77.1Confident83.8Confident49 Ų4959 Ų5926%0.26232%0.322SS..Hα-helixtrans-101.49.8-168-57.5-18.8000112.5N172 S178 H179 V180N172-D176 WeakPolarHBondContact O-CB 3.32Å; N172-D176 PolarHBondContact O-N 3Å; D176-S178 PolarHBondContact O-N 3.15Å; D176-H179 PolarHBondContact O-N 3.39Å; D176-V180 HydrophobicContact CB-CG2 3.93Å
177S67Low83.7Confident64 Ų6464 Ų6445%0.44835%0.346SS..THydrogen-bonded Turntrans-58.2-15.3-168.166.70000116.4I173 S235I173-S177 WeakPolarHBondContact O-CA 3.32Å; I173-S177 WeakPolarHBondContact O-CB 3.49Å; I173-S177 PolarHBondContact O-N 3.44Å; I173-S177 VanDerWaalsContact O-N 3.15Å; S177-S235 WeakPolarHBondContact CB-OG 3.46Å
178S66.8Low83.7Confident94 Ų9461.4 Ų61.466%0.65733%0.334SS*.THydrogen-bonded Turntrans-100.4-10.718058.50000114.7D176D176-S178 PolarHBondContact O-N 3.15Å
179H71.7Confident83.7Confident170 Ų17057.6 Ų57.679%0.78731%0.314SS*.THydrogen-bonded Turntrans-120.8-11.8-169.3-72.7-63000115D176D176-H179 PolarHBondContact O-N 3.39Å
180V76.9Confident83.9Confident57 Ų5757 Ų5735%0.34531%0.311SS..SBendtrans-106.9127.8-176.2-174.20000109.4D176 D184 V185D176-V180 HydrophobicContact CB-CG2 3.93Å; V180-D184 HydrophobicContact CG1-CB 3.85Å; V180-V185 HydrophobicContact CB-CG2 4.11Å; V180-V185 HydrophobicContact CG1-CG2 3.73Å
181P81.7Confident83.9Confident74 Ų7460.1 Ų60.148%0.48133%0.328SS..  trans-64146.9176.528.9-34.6000110.2D183 D184 V185P181-D183 PolarHBondContact O-N 3.48Å; P181-D184 HydrophobicContact CG-CB 4.16Å; P181-D184 WeakPolarHBondContact CG-OD2 3.27Å; P181-D184 PolarHBondContact O-N 2.94Å; P181-D184 VanDerWaalsContact O-N 3.14Å; P181-V185 PolarHBondContact O-N 3.22Å
182L84.1Confident84Confident22 Ų2259 Ų5912%0.11531%0.314CS..Hα-helixtrans-64-28.8-171.4-123.277.8000114.7D184 V185 S186 L236 S239 F353L182-D184 VanDerWaalsContact C-N 3.29Å; L182-D184 PolarHBondContact O-N 3.47Å; L182-V185 PolarHBondContact O-N 2.98Å; L182-S186 WeakPolarHBondContact O-CB 3.35Å; L182-S186 PolarHBondContact O-N 2.72Å; L182-L236 WeakPolarHBondContact CD2-O 3.38Å; L182-S239 WeakPolarHBondContact CD1-OG 3.32Å; L182-S239 VanDerWaalsContact CD2-OG 3.23Å; L182-S239 WeakPolarHBondContact CD2-OG 3.42Å; L182-F353 HydrophobicContact CD2-CE2 4.2Å; L182-F353 HydrophobicContact CD2-CZ 3.89Å; L182-F353 HydrophobicContact CG-CZ 4.32Å
183D83.8Confident84.2Confident87 Ų8757.9 Ų57.947%0.46531%0.308SS..Hα-helixtrans-66.6-35.8-179.9-63.1-27.3000110.6P181 S186 E187 R352P181-D183 PolarHBondContact O-N 3.48Å; D183-S186 WeakPolarHBondContact O-CB 3.4Å; D183-S186 PolarHBondContact O-N 3.15Å; D183-E187 PolarHBondContact O-N 3.27Å; D183-R352 IonicContact OD1-CZ 3.19Å; D183-R352 IonicContact OD1-NE 2.7Å; D183-R352 PolarHBondContact OD1-NE 2.75Å; D183-R352 IonicContact OD1-NH2 2.73Å
184D86.3Confident84.4Confident85 Ų8559.4 Ų59.446%0.45532%0.316SS..Hα-helixtrans-68.7-37.8173.9-66.6-7.1000111.3V180 P181 L182 E187 A188V180-D184 HydrophobicContact CG1-CB 3.85Å; P181-D184 HydrophobicContact CG-CB 4.16Å; P181-D184 WeakPolarHBondContact CG-OD2 3.27Å; P181-D184 PolarHBondContact O-N 2.94Å; P181-D184 VanDerWaalsContact O-N 3.14Å; L182-D184 VanDerWaalsContact C-N 3.29Å; L182-D184 PolarHBondContact O-N 3.47Å; D184-E187 PolarHBondContact O-N 3.05Å; D184-A188 WeakPolarHBondContact O-CB 3.28Å; D184-A188 PolarHBondContact O-N 3.14Å
185V89.1Confident84.6Confident21 Ų2158.3 Ų58.313%0.12731%0.314CS..Hα-helixtrans-66.6-41.3175.2-178.70000110.7I173 V180 P181 L182 A188 I189 L236I173-V185 HydrophobicContact CD1-CG1 4.24Å; I173-V185 HydrophobicContact CG1-CG1 4.05Å; V180-V185 HydrophobicContact CB-CG2 4.11Å; V180-V185 HydrophobicContact CG1-CG2 3.73Å; P181-V185 PolarHBondContact O-N 3.22Å; L182-V185 PolarHBondContact O-N 2.98Å; V185-A188 PolarHBondContact O-N 2.95Å; V185-I189 HydrophobicContact CG1-CD1 4.06Å; V185-I189 WeakPolarHBondContact O-CG1 3.16Å; V185-I189 PolarHBondContact O-N 3.48Å; V185-L236 HydrophobicContact CG1-CD2 3.69Å
186S90.6Very high84.8Confident0 Ų050 Ų500%028%0.282CS..Hα-helixtrans-60.4-49.3174.5176.70000110.6L182 D183 A188 I189 Q190 R352L182-S186 WeakPolarHBondContact O-CB 3.35Å; L182-S186 PolarHBondContact O-N 2.72Å; D183-S186 WeakPolarHBondContact O-CB 3.4Å; D183-S186 PolarHBondContact O-N 3.15Å; S186-A188 VanDerWaalsContact C-N 3.34Å; S186-A188 PolarHBondContact O-N 2.71Å; S186-I189 PolarHBondContact O-N 3.21Å; S186-Q190 WeakPolarHBondContact O-CB 3.37Å; S186-Q190 VanDerWaalsContact O-CG 3.23Å; S186-Q190 WeakPolarHBondContact O-CG 3.25Å; S186-Q190 PolarHBondContact O-N 2.99Å; S186-R352 WeakPolarHBondContact OG-CA 3.49Å; S186-R352 WeakPolarHBondContact OG-CB 3.44Å; S186-R352 PolarHBondContact OG-O 3.18Å
187E90.3Very high85.3Confident107 Ų10749.4 Ų49.450%0.528%0.283SS..Hα-helixtrans-58.6-44.6177.2-169.6171.6-163.300111.5D183 D184 I189 Q190 D191D183-E187 PolarHBondContact O-N 3.27Å; D184-E187 PolarHBondContact O-N 3.05Å; E187-I189 PolarHBondContact O-N 3.42Å; E187-Q190 PolarHBondContact O-N 3.31Å; E187-D191 WeakPolarHBondContact O-CB 3.29Å; E187-D191 PolarHBondContact O-N 2.99Å
188A90.7Very high86.2Confident20 Ų2051.5 Ų51.517%0.16529%0.289CS..Hα-helixtrans-62-39.9177.400000113.4I169 D184 V185 S186 I192I169-A188 HydrophobicContact CD1-CB 4.35Å; D184-A188 WeakPolarHBondContact O-CB 3.28Å; D184-A188 PolarHBondContact O-N 3.14Å; V185-A188 PolarHBondContact O-N 2.95Å; S186-A188 VanDerWaalsContact C-N 3.34Å; S186-A188 PolarHBondContact O-N 2.71Å; A188-I192 PolarHBondContact O-N 2.85Å
189I92.3Very high87Confident1 Ų152.1 Ų52.11%0.00528%0.276CS..Hα-helixtrans-67.7-45.2176.2-71.1169.9000110.5I169 I173 V185 S186 E187 D191 I192 Y193 I228 L236 F353I169-I189 HydrophobicContact CD1-CG1 3.79Å; I173-I189 HydrophobicContact CD1-CD1 3.83Å; I173-I189 HydrophobicContact CD1-CG1 4.04Å; V185-I189 HydrophobicContact CG1-CD1 4.06Å; V185-I189 WeakPolarHBondContact O-CG1 3.16Å; V185-I189 PolarHBondContact O-N 3.48Å; S186-I189 PolarHBondContact O-N 3.21Å; E187-I189 PolarHBondContact O-N 3.42Å; I189-D191 VanDerWaalsContact C-N 3.31Å; I189-D191 PolarHBondContact O-N 2.87Å; I189-I192 WeakPolarHBondContact O-CB 3.31Å; I189-I192 PolarHBondContact O-N 2.92Å; I189-I192 VanDerWaalsContact O-N 3.09Å; I189-Y193 HydrophobicContact CG2-CD2 4.25Å; I189-Y193 HydrophobicContact CG2-CE1 4.12Å; I189-Y193 HydrophobicContact CG2-CE2 3.56Å; I189-Y193 VanDerWaalsContact CG2-CZ 3.47Å; I189-Y193 PolarHBondContact O-N 2.93Å; I189-Y193 VanDerWaalsContact O-N 3.08Å; I189-I228 HydrophobicContact CD1-CG2 4.08Å; I189-I228 HydrophobicContact CG1-CG2 4.46Å; I189-L236 HydrophobicContact CD1-CD1 4.3Å; I189-L236 HydrophobicContact CD1-CD2 4.27Å; I189-F353 HydrophobicContact CD1-CD1 3.63Å; I189-F353 HydrophobicContact CD1-CE1 3.77Å
190Q92.4Very high87.4Confident2 Ų244.4 Ų44.41%0.00924%0.241CC..Hα-helixtrans-63.5-37.5179.4-66.2-64.5-18.800111.9T91 S186 E187 I192 Y193 N194 R352 A354T91-Q190 HydrophobicContact CG2-CB 3.86Å; S186-Q190 WeakPolarHBondContact O-CB 3.37Å; S186-Q190 VanDerWaalsContact O-CG 3.23Å; S186-Q190 WeakPolarHBondContact O-CG 3.25Å; S186-Q190 PolarHBondContact O-N 2.99Å; E187-Q190 PolarHBondContact O-N 3.31Å; Q190-I192 VanDerWaalsContact C-N 3.3Å; Q190-I192 PolarHBondContact O-N 2.88Å; Q190-Y193 PolarHBondContact O-N 3.42Å; Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.22Å; Q190-R352 PolarHBondContact NE2-O 3Å; Q190-A354 PolarHBondContact NE2-O 3.27Å
191D90.6Very high87.5Confident70 Ų7044.4 Ų44.437%0.37424%0.244SC..Hα-helixtrans-62.3-36172.9-84.7-8.6000112.5E187 I189 S195E187-D191 WeakPolarHBondContact O-CB 3.29Å; E187-D191 PolarHBondContact O-N 2.99Å; I189-D191 VanDerWaalsContact C-N 3.31Å; I189-D191 PolarHBondContact O-N 2.87Å; D191-S195 WeakPolarHBondContact O-CB 3.36Å; D191-S195 PolarHBondContact O-N 3.46Å
192I90.8Very high86.9Confident29 Ų2944.3 Ų44.315%0.14925%0.245CC..Hα-helixtrans-67.8-43.6174.4-73-168.2000111.3I169 A188 I189 Q190 N194 S195 M196I169-I192 HydrophobicContact CB-CD1 3.46Å; I169-I192 VanDerWaalsContact CB-CD1 3.46Å; I169-I192 HydrophobicContact CD1-CD1 3.32Å; I169-I192 HydrophobicContact CD1-CG1 4.07Å; I169-I192 HydrophobicContact CG1-CD1 3.89Å; I169-I192 HydrophobicContact CG2-CD1 3.63Å; A188-I192 PolarHBondContact O-N 2.85Å; I189-I192 WeakPolarHBondContact O-CB 3.31Å; I189-I192 PolarHBondContact O-N 2.92Å; I189-I192 VanDerWaalsContact O-N 3.09Å; Q190-I192 VanDerWaalsContact C-N 3.3Å; Q190-I192 PolarHBondContact O-N 2.88Å; I192-N194 VanDerWaalsContact C-N 3.32Å; I192-N194 PolarHBondContact O-N 3.48Å; I192-S195 PolarHBondContact O-N 2.9Å; I192-M196 HydrophobicContact CG2-CE 3.42Å; I192-M196 VanDerWaalsContact CG2-CE 3.42Å; I192-M196 HydrophobicContact CG2-CG 4.2Å; I192-M196 HydrophobicContact CG2-SD 3.86Å; I192-M196 WeakPolarHBondContact O-CB 3.48Å; I192-M196 WeakPolarHBondContact O-CG 3.36Å; I192-M196 PolarHBondContact O-N 3.13Å
193Y92.1Very high85.4Confident4 Ų447.9 Ų47.92%0.01627%0.269CS..Hα-helixtrans-58-46.7175.3-61.4-31.1000111.2I189 Q190 M196 S197 V224 E225 F353 L355I189-Y193 HydrophobicContact CG2-CD2 4.25Å; I189-Y193 HydrophobicContact CG2-CE1 4.12Å; I189-Y193 HydrophobicContact CG2-CE2 3.56Å; I189-Y193 VanDerWaalsContact CG2-CZ 3.47Å; I189-Y193 PolarHBondContact O-N 2.93Å; I189-Y193 VanDerWaalsContact O-N 3.08Å; Q190-Y193 PolarHBondContact O-N 3.42Å; Y193-M196 PolarHBondContact O-N 2.85Å; Y193-S197 VanDerWaalsContact O-CB 3.24Å; Y193-S197 WeakPolarHBondContact O-CB 3.4Å; Y193-S197 PolarHBondContact O-N 3.03Å; Y193-V224 HydrophobicContact CD1-CG1 4.45Å; Y193-V224 HydrophobicContact CE1-CG1 4.1Å; Y193-E225 HydrophobicContact CE1-CB 4.31Å; Y193-E225 WeakPolarHBondContact OH-CA 3.5Å; Y193-F353 WeakPolarHBondContact CE2-O 3.39Å; Y193-F353 PolarHBondContact OH-O 2.98Å; Y193-L355 HydrophobicContact CD1-CD2 3.87Å; Y193-L355 HydrophobicContact CD2-CD2 3.73Å; Y193-L355 HydrophobicContact CE1-CD2 4.14Å; Y193-L355 HydrophobicContact CE2-CD2 3.99Å; Y193-L355 HydrophobicContact CG-CD2 3.67Å
194N90.3Very high84Confident49 Ų4945.6 Ų45.626%0.26226%0.257SS..Hα-helixtrans-64.5-44.9177.3-74.7-36.6000112.3T91 Q190 I192 M196 S197 N198T91-N194 VanDerWaalsContact CG2-ND2 3.31Å; T91-N194 WeakPolarHBondContact CG2-ND2 3.42Å; Q190-N194 PolarHBondContact O-N 3.25Å; Q190-N194 PolarHBondContact O-ND2 3.22Å; I192-N194 VanDerWaalsContact C-N 3.32Å; I192-N194 PolarHBondContact O-N 3.48Å; N194-M196 PolarHBondContact O-N 2.87Å; N194-S197 PolarHBondContact O-N 3.26Å; N194-N198 WeakPolarHBondContact O-CB 3.25Å; N194-N198 VanDerWaalsContact O-CG 3.26Å; N194-N198 PolarHBondContact O-N 3.38Å; N194-N198 PolarHBondContact O-ND2 3.3Å; N194-N198 VanDerWaalsContact O-ND2 3.08Å
195S88.8Confident82.4Confident44 Ų4445.9 Ų45.931%0.30825%0.254SS..Hα-helixtrans-61-43.7176.9173.20000111.5D191 I192 R199D191-S195 WeakPolarHBondContact O-CB 3.36Å; D191-S195 PolarHBondContact O-N 3.46Å; I192-S195 PolarHBondContact O-N 2.9Å; S195-R199 WeakPolarHBondContact O-CB 3.44Å; S195-R199 WeakPolarHBondContact O-CG 3.31Å; S195-R199 PolarHBondContact O-N 3.39Å; S195-R199 VanDerWaalsContact O-N 3.08Å
196M87.3Confident80.5Confident0 Ų050.3 Ų50.30%028%0.281CS..Hα-helixtrans-68.1-47.5178.8-75.8-177.8-174.800110.6Q165 V166 I192 Y193 N194 N198 R199 L200 L221 V224Q165-M196 HydrophobicContact CB-CE 3.44Å; Q165-M196 VanDerWaalsContact CB-CE 3.44Å; Q165-M196 HydrophobicContact CG-CE 4.44Å; V166-M196 HydrophobicContact CG2-CE 3.46Å; V166-M196 VanDerWaalsContact CG2-CE 3.46Å; V166-M196 HydrophobicContact CG2-SD 4.38Å; I192-M196 HydrophobicContact CG2-CE 3.42Å; I192-M196 VanDerWaalsContact CG2-CE 3.42Å; I192-M196 HydrophobicContact CG2-CG 4.2Å; I192-M196 HydrophobicContact CG2-SD 3.86Å; I192-M196 WeakPolarHBondContact O-CB 3.48Å; I192-M196 WeakPolarHBondContact O-CG 3.36Å; I192-M196 PolarHBondContact O-N 3.13Å; Y193-M196 PolarHBondContact O-N 2.85Å; N194-M196 PolarHBondContact O-N 2.87Å; M196-N198 VanDerWaalsContact C-N 3.32Å; M196-N198 PolarHBondContact O-N 3.28Å; M196-R199 PolarHBondContact O-N 3.03Å; M196-L200 HydrophobicContact CB-CD1 4.41Å; M196-L200 WeakPolarHBondContact O-CB 3.28Å; M196-L200 WeakPolarHBondContact O-CG 3.24Å; M196-L200 PolarHBondContact O-N 3.23Å; M196-L221 HydrophobicContact CB-CD2 3.81Å; M196-V224 HydrophobicContact SD-CG1 4.1Å; M196-V224 HydrophobicContact SD-CG2 4.01Å
197S87.9Confident78.6Confident38 Ų3857.2 Ų57.227%0.26632%0.318SS..Hα-helixtrans-53.8-48.5177.3-173.90000111.7Y193 N194 L200 S201Y193-S197 VanDerWaalsContact O-CB 3.24Å; Y193-S197 WeakPolarHBondContact O-CB 3.4Å; Y193-S197 PolarHBondContact O-N 3.03Å; N194-S197 PolarHBondContact O-N 3.26Å; S197-L200 PolarHBondContact O-N 2.66Å; S197-S201 WeakPolarHBondContact O-CB 3.48Å; S197-S201 PolarHBondContact O-N 3.17Å; S197-S201 PolarHBondContact O-OG 3.13Å
198N85.5Confident76.9Confident107 Ų10752.9 Ų52.957%0.57230%0.299SS*.Hα-helixtrans-64.7-42.4178.5-72-33.8000113N194 M196 S201 S202N194-N198 WeakPolarHBondContact O-CB 3.25Å; N194-N198 VanDerWaalsContact O-CG 3.26Å; N194-N198 PolarHBondContact O-N 3.38Å; N194-N198 PolarHBondContact O-ND2 3.3Å; N194-N198 VanDerWaalsContact O-ND2 3.08Å; M196-N198 VanDerWaalsContact C-N 3.32Å; M196-N198 PolarHBondContact O-N 3.28Å; N198-S201 PolarHBondContact O-N 3.02Å; N198-S202 WeakPolarHBondContact O-CB 3.36Å; N198-S202 PolarHBondContact O-N 3.44Å
199R83.2Confident75.1Confident107 Ų10759 Ų5940%0.40433%0.329SS..Hα-helixtrans-75.1-24.8-178.9-71.6177.572.9-1594.5113.8Q165 S195 M196 S202Q165-R199 VanDerWaalsContact CD-NH1 3.34Å; Q165-R199 VanDerWaalsContact NE2-NH1 3.12Å; S195-R199 WeakPolarHBondContact O-CB 3.44Å; S195-R199 WeakPolarHBondContact O-CG 3.31Å; S195-R199 PolarHBondContact O-N 3.39Å; S195-R199 VanDerWaalsContact O-N 3.08Å; M196-R199 PolarHBondContact O-N 3.03Å; R199-S202 CarbonylContact C-O 3.5Å
200L81.4Confident73.2Confident9 Ų966 Ų665%0.04737%0.366CS..Hα-helixtrans-83.9-31.1173.8-65.5170.1000110.7I158 M196 S197 L204 V217 I220I158-L200 HydrophobicContact CG1-CD2 4.42Å; I158-L200 HydrophobicContact CG2-CD2 3.78Å; M196-L200 HydrophobicContact CB-CD1 4.41Å; M196-L200 WeakPolarHBondContact O-CB 3.28Å; M196-L200 WeakPolarHBondContact O-CG 3.24Å; M196-L200 PolarHBondContact O-N 3.23Å; S197-L200 PolarHBondContact O-N 2.66Å; L200-L204 HydrophobicContact CD2-CD1 4.49Å; L200-V217 HydrophobicContact CB-CG1 4.09Å; L200-V217 HydrophobicContact CB-CG2 3.99Å; L200-V217 HydrophobicContact CD1-CG1 4.27Å; L200-I220 HydrophobicContact CD1-CB 4.3Å; L200-I220 HydrophobicContact CD1-CD1 4.16Å; L200-I220 HydrophobicContact CD1-CG2 3.88Å; L200-I220 HydrophobicContact CD2-CD1 4.38Å
201S78.4Confident71.4Confident57 Ų5766.5 Ų66.540%0.39937%0.368SS..Hα-helixtrans-79.5-24.5178.4-610000114.1S197 N198S197-S201 WeakPolarHBondContact O-CB 3.48Å; S197-S201 PolarHBondContact O-N 3.17Å; S197-S201 PolarHBondContact O-OG 3.13Å; N198-S201 PolarHBondContact O-N 3.02Å
202S69.5Low69.6Low72 Ų7270.3 Ų70.350%0.50339%0.389SS..THydrogen-bonded Turntrans-126.9175.1-179.4-169.90000109.5N198 R199 L204N198-S202 WeakPolarHBondContact O-CB 3.36Å; N198-S202 PolarHBondContact O-N 3.44Å; R199-S202 CarbonylContact C-O 3.5Å; S202-L204 PolarHBondContact O-N 3.23Å
203P53Low68.3Low97 Ų9771.1 Ų71.163%0.6340%0.397SS*.THydrogen-bonded Turn-36.8-2.5-113-9.929000122.1K205 V206P203-K205 PolarHBondContact O-N 3.47Å; P203-V206 PolarHBondContact O-N 3.48Å; P203-V206 VanDerWaalsContact O-N 3.1Å
204L53.5Low67.4Low38 Ų3875.5 Ų75.520%0.19943%0.426CS..G310 helixtrans-64.6-23.1179.9-77.9169000113.5I158 L161 L200 S202 V206 N207 C208I158-L204 HydrophobicContact CG1-CD1 4.09Å; L161-L204 HydrophobicContact CD1-CD1 3.89Å; L200-L204 HydrophobicContact CD2-CD1 4.49Å; S202-L204 PolarHBondContact O-N 3.23Å; L204-V206 PolarHBondContact O-N 2.88Å; L204-N207 PolarHBondContact O-N 3.31Å; L204-C208 PolarHBondContact O-N 3.38Å; L204-C208 PolarHBondContact O-SG 3.28Å; L204-C208 VanDerWaalsContact O-SG 3.36Å
205K52.5Low66.9Low92 Ų9276.5 Ų76.540%0.444%0.437SS..G310 helixtrans-55.7-28170.7-76.8-175.3172-176.50114P203P203-K205 PolarHBondContact O-N 3.47Å
206V49Very low66.6Low113 Ų11375.9 Ų75.969%0.68543%0.43SS*.G310 helixtrans-78.2-26.4-175.8-176.30000112P203 L204P203-V206 PolarHBondContact O-N 3.48Å; P203-V206 VanDerWaalsContact O-N 3.1Å; L204-V206 PolarHBondContact O-N 2.88Å
207N51.8Low66.6Low145 Ų14576.4 Ų76.478%0.77543%0.433SS*.THydrogen-bonded Turntrans-101.1-16.6-178.6-76-3.2000113.6L204L204-N207 PolarHBondContact O-N 3.31Å
208C54.4Low66.6Low17 Ų1779.9 Ų79.912%0.11545%0.445CS..  trans-118.689-177.6-450000108.2L204 L210 I211L204-C208 PolarHBondContact O-N 3.38Å; L204-C208 PolarHBondContact O-SG 3.28Å; L204-C208 VanDerWaalsContact O-SG 3.36Å; C208-L210 PolarHBondContact O-N 2.95Å; C208-I211 HydrophobicContact CB-CD1 4.42Å
209N52.1Low66.7Low148 Ų14879.2 Ų79.279%0.79144%0.438SS*.THydrogen-bonded Turntrans-64.433.9176.3-70-18.2000114
210L53Low67.1Low148 Ų14874.2 Ų74.278%0.77542%0.42SS*.THydrogen-bonded Turntrans-133.8-2.3-171.5-78160.6000113.2C208C208-L210 PolarHBondContact O-N 2.95Å
211I54Low67.6Low12 Ų1274.4 Ų74.46%0.06242%0.421CS..  trans-122.263.8-175.8-46.3175.6000109.9I158 C208 S213 L216I158-I211 HydrophobicContact CD1-CD1 3.09Å; C208-I211 HydrophobicContact CB-CD1 4.42Å; I211-S213 VanDerWaalsContact C-N 3.27Å; I211-L216 HydrophobicContact CB-CD2 4.23Å; I211-L216 HydrophobicContact CD1-CD2 3.82Å; I211-L216 HydrophobicContact CG1-CD2 3.66Å; I211-L216 HydrophobicContact CG2-CB 4.09Å; I211-L216 HydrophobicContact CG2-CD2 3.67Å; I211-L216 HydrophobicContact CG2-CG 4.4Å
212D53.7Low68.2Low150 Ų15074.1 Ų74.180%0.80241%0.413SS*.  trans-83.9-3170.7-80.9-29.6000112.8
213S62.7Low69.3Low47 Ų4772.7 Ų72.733%0.32940%0.398SS..  trans-105.7119.1-176.263.10000112.5I211 S215 L216I211-S213 VanDerWaalsContact C-N 3.27Å; S213-S215 WeakPolarHBondContact CB-OG 3.35Å; S213-S215 PolarHBondContact O-N 2.92Å; S213-S215 PolarHBondContact OG-OG 2.84Å; S213-S215 VanDerWaalsContact OG-OG 3.06Å; S213-L216 PolarHBondContact O-N 3.11Å; S213-L216 VanDerWaalsContact O-N 3.11Å
214P73Confident71.2Confident96 Ų9668 Ų6862%0.62337%0.368SS*.Hα-helixtrans-54.5-20.616619-28.7000112.6L216 V217 E218P214-L216 VanDerWaalsContact C-N 3.34Å; P214-L216 PolarHBondContact O-N 2.93Å; P214-V217 PolarHBondContact O-N 3.05Å; P214-E218 PolarHBondContact O-N 3.24Å
215S80.1Confident73.1Confident69 Ų6966.2 Ų66.248%0.48336%0.359SS..Hα-helixtrans-60.5-35.3174.471.60000113.9S213 V217 E218 E219S213-S215 WeakPolarHBondContact CB-OG 3.35Å; S213-S215 PolarHBondContact O-N 2.92Å; S213-S215 PolarHBondContact OG-OG 2.84Å; S213-S215 VanDerWaalsContact OG-OG 3.06Å; S215-V217 VanDerWaalsContact C-N 3.33Å; S215-V217 PolarHBondContact O-N 3.14Å; S215-E218 PolarHBondContact O-N 2.94Å; S215-E219 WeakPolarHBondContact O-CB 3.42Å; S215-E219 PolarHBondContact O-N 3.16Å
216L83.7Confident75Confident31 Ų3163 Ų6316%0.16235%0.347CS..Hα-helixtrans-70.7-33.7-179.2-174.966.3000111.4L154 I211 S213 P214 E218 E219 I220L154-L216 HydrophobicContact CD2-CD1 4.28Å; I211-L216 HydrophobicContact CB-CD2 4.23Å; I211-L216 HydrophobicContact CD1-CD2 3.82Å; I211-L216 HydrophobicContact CG1-CD2 3.66Å; I211-L216 HydrophobicContact CG2-CB 4.09Å; I211-L216 HydrophobicContact CG2-CD2 3.67Å; I211-L216 HydrophobicContact CG2-CG 4.4Å; S213-L216 PolarHBondContact O-N 3.11Å; S213-L216 VanDerWaalsContact O-N 3.11Å; P214-L216 VanDerWaalsContact C-N 3.34Å; P214-L216 PolarHBondContact O-N 2.93Å; L216-E218 VanDerWaalsContact C-N 3.34Å; L216-E219 PolarHBondContact O-N 3.1Å; L216-I220 HydrophobicContact CG-CD1 4.11Å; L216-I220 HydrophobicContact CG-CG1 4.48Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.36Å; L216-I220 PolarHBondContact O-N 3.31Å
217V87Confident77.2Confident11 Ų1158 Ų587%0.06732%0.316CS..Hα-helixtrans-64.8-44.1176.5-179.10000109.9L200 P214 S215 I220 L221L200-V217 HydrophobicContact CB-CG1 4.09Å; L200-V217 HydrophobicContact CB-CG2 3.99Å; L200-V217 HydrophobicContact CD1-CG1 4.27Å; P214-V217 PolarHBondContact O-N 3.05Å; S215-V217 VanDerWaalsContact C-N 3.33Å; S215-V217 PolarHBondContact O-N 3.14Å; V217-I220 PolarHBondContact O-N 3.1Å; V217-L221 HydrophobicContact CG1-CD1 4.1Å; V217-L221 VanDerWaalsContact O-CG 3.28Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 2.94Å
218E87Confident79.1Confident112 Ų11251 Ų5152%0.52328%0.279SS..Hα-helixtrans-59.8-50.8174-70-179.8172.300110.6P214 S215 L216 I220 L221 E222P214-E218 PolarHBondContact O-N 3.24Å; S215-E218 PolarHBondContact O-N 2.94Å; L216-E218 VanDerWaalsContact C-N 3.34Å; E218-I220 VanDerWaalsContact C-N 3.33Å; E218-I220 PolarHBondContact O-N 2.95Å; E218-L221 CarbonylContact O-C 3.47Å; E218-L221 PolarHBondContact O-N 2.64Å; E218-E222 VanDerWaalsContact O-CG 3.28Å; E218-E222 WeakPolarHBondContact O-CG 3.35Å; E218-E222 PolarHBondContact O-N 3.3Å
219E88.8Confident80.9Confident93 Ų9350.2 Ų50.244%0.43527%0.273SS..Hα-helixtrans-55-44.7178.5-173.4179.3-178.100112.8F150 S215 L216 E222 Q223F150-E219 HydrophobicContact CE2-CG 4.17Å; F150-E219 HydrophobicContact CZ-CG 4.34Å; S215-E219 WeakPolarHBondContact O-CB 3.42Å; S215-E219 PolarHBondContact O-N 3.16Å; L216-E219 PolarHBondContact O-N 3.1Å; E219-E222 PolarHBondContact O-N 3.26Å; E219-Q223 WeakPolarHBondContact O-CG 3Å; E219-Q223 PolarHBondContact O-N 3.03Å
220I91Very high82.8Confident2 Ų244.7 Ų44.71%0.0124%0.242CC..Hα-helixtrans-60.9-49175.3-68.4167.1000110.3F150 L154 I158 V162 L200 L216 V217 E218 E222 Q223 V224F150-I220 HydrophobicContact CE1-CG1 4.17Å; F150-I220 HydrophobicContact CZ-CB 4.48Å; F150-I220 HydrophobicContact CZ-CG1 3.91Å; L154-I220 HydrophobicContact CD1-CD1 4.19Å; L154-I220 HydrophobicContact CD1-CG1 4.03Å; L154-I220 HydrophobicContact CD2-CD1 4.08Å; L154-I220 HydrophobicContact CD2-CG1 4.12Å; I158-I220 HydrophobicContact CG2-CD1 4.02Å; V162-I220 HydrophobicContact CG1-CG2 4.27Å; V162-I220 HydrophobicContact CG2-CG2 3.86Å; L200-I220 HydrophobicContact CD1-CB 4.3Å; L200-I220 HydrophobicContact CD1-CD1 4.16Å; L200-I220 HydrophobicContact CD1-CG2 3.88Å; L200-I220 HydrophobicContact CD2-CD1 4.38Å; L216-I220 HydrophobicContact CG-CD1 4.11Å; L216-I220 HydrophobicContact CG-CG1 4.48Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.36Å; L216-I220 PolarHBondContact O-N 3.31Å; V217-I220 PolarHBondContact O-N 3.1Å; E218-I220 VanDerWaalsContact C-N 3.33Å; E218-I220 PolarHBondContact O-N 2.95Å; I220-E222 VanDerWaalsContact C-N 3.29Å; I220-E222 PolarHBondContact O-N 3.38Å; I220-Q223 PolarHBondContact O-N 3.45Å; I220-V224 HydrophobicContact CG2-CG2 4.28Å; I220-V224 WeakPolarHBondContact O-CG2 3.43Å; I220-V224 PolarHBondContact O-N 3.33Å
221L92.1Very high84.5Confident12 Ų1239.5 Ų39.56%0.06321%0.212CC..Hα-helixtrans-63.2-35.9-179.3-70.6173.6000112.1M196 V217 E218 V224 E225 L355M196-L221 HydrophobicContact CB-CD2 3.81Å; V217-L221 HydrophobicContact CG1-CD1 4.1Å; V217-L221 VanDerWaalsContact O-CG 3.28Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 2.94Å; E218-L221 CarbonylContact O-C 3.47Å; E218-L221 PolarHBondContact O-N 2.64Å; L221-V224 PolarHBondContact O-N 2.82Å; L221-E225 WeakPolarHBondContact O-CB 3.35Å; L221-E225 PolarHBondContact O-N 2.94Å; L221-L355 HydrophobicContact CB-CD1 4.05Å; L221-L355 HydrophobicContact CB-CD2 3.96Å
222E91.4Very high86.2Confident51 Ų5139 Ų3924%0.23821%0.209CC..Hα-helixtrans-64.5-41.4175.3-67-161.4151.500112.3E218 E219 I220 V224 E225 T226 K297 L355 R358E218-E222 VanDerWaalsContact O-CG 3.28Å; E218-E222 WeakPolarHBondContact O-CG 3.35Å; E218-E222 PolarHBondContact O-N 3.3Å; E219-E222 PolarHBondContact O-N 3.26Å; I220-E222 VanDerWaalsContact C-N 3.29Å; I220-E222 PolarHBondContact O-N 3.38Å; E222-V224 VanDerWaalsContact C-N 3.33Å; E222-E225 PolarHBondContact O-N 3.01Å; E222-T226 WeakPolarHBondContact O-CB 3.34Å; E222-T226 PolarHBondContact O-N 2.67Å; E222-T226 PolarHBondContact O-OG1 3.27Å; E222-K297 IonicContact OE2-NZ 2.68Å; E222-K297 PolarHBondContact OE2-NZ 2.84Å; E222-L355 HydrophobicContact CG-CD1 4.04Å; E222-R358 VanDerWaalsContact CG-NH2 3.3Å; E222-R358 IonicContact OE1-CZ 3.03Å; E222-R358 IonicContact OE1-NH2 3.98Å; E222-R358 PolarHBondContact OE1-NH2 3.39Å; E222-R358 IonicContact OE2-NH2 2.68Å
223Q91.9Very high87.9Confident42 Ų4232.7 Ų32.720%0.19618%0.175CC..Hα-helixtrans-67.8-37176-70.8-62.7-14.600111.6F150 E219 I220 Y227F150-Q223 HydrophobicContact CD1-CB 3.77Å; F150-Q223 HydrophobicContact CD1-CG 3.87Å; F150-Q223 HydrophobicContact CD2-CG 3.94Å; F150-Q223 HydrophobicContact CE1-CB 3.65Å; F150-Q223 HydrophobicContact CE1-CG 3.77Å; F150-Q223 HydrophobicContact CE2-CG 3.85Å; F150-Q223 HydrophobicContact CG-CB 4.31Å; F150-Q223 HydrophobicContact CG-CG 3.95Å; F150-Q223 HydrophobicContact CZ-CB 4.12Å; F150-Q223 HydrophobicContact CZ-CG 3.77Å; E219-Q223 WeakPolarHBondContact O-CG 3Å; E219-Q223 PolarHBondContact O-N 3.03Å; I220-Q223 PolarHBondContact O-N 3.45Å; Q223-Y227 VanDerWaalsContact O-CB 3.31Å; Q223-Y227 WeakPolarHBondContact O-CB 3.45Å; Q223-Y227 PolarHBondContact O-N 3.16Å
224V93.3Very high88.9Confident0 Ų035.5 Ų35.50%019%0.186CC..Hα-helixtrans-64.1-47.9173.8174.50000111.2F147 V162 V166 Y193 M196 I220 L221 E222 T226 Y227 I228F147-V224 HydrophobicContact CE2-CG2 4.38Å; V162-V224 HydrophobicContact CG1-CG2 3.71Å; V166-V224 HydrophobicContact CG2-CB 4.33Å; V166-V224 HydrophobicContact CG2-CG1 3.64Å; V166-V224 HydrophobicContact CG2-CG2 3.82Å; Y193-V224 HydrophobicContact CD1-CG1 4.45Å; Y193-V224 HydrophobicContact CE1-CG1 4.1Å; M196-V224 HydrophobicContact SD-CG1 4.1Å; M196-V224 HydrophobicContact SD-CG2 4.01Å; I220-V224 HydrophobicContact CG2-CG2 4.28Å; I220-V224 WeakPolarHBondContact O-CG2 3.43Å; I220-V224 PolarHBondContact O-N 3.33Å; L221-V224 PolarHBondContact O-N 2.82Å; E222-V224 VanDerWaalsContact C-N 3.33Å; V224-T226 VanDerWaalsContact C-N 3.35Å; V224-T226 PolarHBondContact O-N 2.89Å; V224-Y227 PolarHBondContact O-N 3.01Å; V224-I228 HydrophobicContact CG1-CD1 3.67Å; V224-I228 HydrophobicContact CG1-CG1 4.37Å; V224-I228 WeakPolarHBondContact O-CG1 3.49Å; V224-I228 PolarHBondContact O-N 2.97Å
225E93.8Very high89.5Confident0 Ų032.2 Ų32.20%017%0.165CC..Hα-helixtrans-55.6-51176.2176.9-164.666.300110.7Y193 L221 E222 I228 C229 P296 A354 L355 R358Y193-E225 HydrophobicContact CE1-CB 4.31Å; Y193-E225 WeakPolarHBondContact OH-CA 3.5Å; L221-E225 WeakPolarHBondContact O-CB 3.35Å; L221-E225 PolarHBondContact O-N 2.94Å; E222-E225 PolarHBondContact O-N 3.01Å; E225-I228 PolarHBondContact O-N 2.99Å; E225-C229 VanDerWaalsContact O-CB 3.28Å; E225-C229 WeakPolarHBondContact O-CB 3.44Å; E225-C229 PolarHBondContact O-N 3.19Å; E225-C229 PolarHBondContact O-SG 3.42Å; E225-P296 HydrophobicContact CG-CG 4.27Å; E225-A354 VanDerWaalsContact OE2-CA 3.27Å; E225-A354 WeakPolarHBondContact OE2-CA 3.48Å; E225-L355 HydrophobicContact CB-CD1 4.37Å; E225-L355 HydrophobicContact CB-CG 4.23Å; E225-L355 HydrophobicContact CG-CG 4.47Å; E225-L355 PolarHBondContact OE2-N 3.27Å; E225-R358 IonicContact OE1-CZ 2.75Å; E225-R358 IonicContact OE1-NH1 3.4Å; E225-R358 PolarHBondContact OE1-NH1 3.46Å; E225-R358 IonicContact OE1-NH2 2.77Å; E225-R358 IonicContact OE2-NH1 3.7Å; E225-R358 PolarHBondContact OE2-NH1 3.06Å
226T92.3Very high89.9Confident25 Ų2529.1 Ų29.115%0.15314%0.143CC..Hα-helixtrans-61-49.2-178.7-580000110.7E222 V224 C229 F230E222-T226 WeakPolarHBondContact O-CB 3.34Å; E222-T226 PolarHBondContact O-N 2.67Å; E222-T226 PolarHBondContact O-OG1 3.27Å; V224-T226 VanDerWaalsContact C-N 3.35Å; V224-T226 PolarHBondContact O-N 2.89Å; T226-C229 PolarHBondContact O-N 3.42Å; T226-F230 HydrophobicContact CG2-CD2 3.82Å; T226-F230 HydrophobicContact CG2-CE2 3.95Å; T226-F230 WeakPolarHBondContact O-CB 3.02Å; T226-F230 VanDerWaalsContact O-CD2 3.31Å; T226-F230 WeakPolarHBondContact O-CD2 3.23Å; T226-F230 PolarHBondContact O-N 3.4Å
227Y93.4Very high89.9Confident6 Ų628 Ų282%0.02414%0.137CC..Hα-helixtrans-60.9-49180175.7-97.3000112.6K144 F147 V166 N167 T170 Q223 V224 C229 F230 R231K144-Y227 HydrophobicContact CB-CE2 4.12Å; K144-Y227 HydrophobicContact CG-CE2 4.31Å; F147-Y227 HydrophobicContact CB-CD2 3.42Å; F147-Y227 VanDerWaalsContact CB-CD2 3.42Å; F147-Y227 HydrophobicContact CB-CE2 3.95Å; F147-Y227 HydrophobicContact CB-CG 4.02Å; F147-Y227 HydrophobicContact CD1-CD1 4.16Å; F147-Y227 AromaticContact CD1-CD2 3.74Å; F147-Y227 HydrophobicContact CD1-CD2 3.74Å; F147-Y227 HydrophobicContact CD1-CE1 4.18Å; F147-Y227 AromaticContact CD1-CE2 3.79Å; F147-Y227 HydrophobicContact CD1-CE2 3.79Å; F147-Y227 AromaticContact CD1-CG 3.89Å; F147-Y227 HydrophobicContact CD1-CG 3.89Å; F147-Y227 AromaticContact CD1-CZ 3.96Å; F147-Y227 HydrophobicContact CD2-CD2 4.34Å; F147-Y227 HydrophobicContact CD2-CG 4.08Å; F147-Y227 HydrophobicContact CE1-CD1 4.23Å; F147-Y227 HydrophobicContact CE1-CE1 4.25Å; F147-Y227 HydrophobicContact CE1-CG 4.34Å; F147-Y227 HydrophobicContact CG-CD1 4.41Å; F147-Y227 AromaticContact CG-CD2 3.59Å; F147-Y227 HydrophobicContact CG-CD2 3.59Å; F147-Y227 HydrophobicContact CG-CE2 4.08Å; F147-Y227 AromaticContact CG-CG 3.73Å; F147-Y227 HydrophobicContact CG-CG 3.73Å; V166-Y227 HydrophobicContact CG1-CD1 3.26Å; V166-Y227 HydrophobicContact CG1-CE1 3.46Å; V166-Y227 VanDerWaalsContact CG1-CE1 3.46Å; V166-Y227 HydrophobicContact CG1-CG 4.4Å; N167-Y227 PolarHBondContact OD1-OH 3.07Å; T170-Y227 HydrophobicContact CG2-CE1 4.48Å; Q223-Y227 VanDerWaalsContact O-CB 3.31Å; Q223-Y227 WeakPolarHBondContact O-CB 3.45Å; Q223-Y227 PolarHBondContact O-N 3.16Å; V224-Y227 PolarHBondContact O-N 3.01Å; Y227-C229 PolarHBondContact O-N 3.16Å; Y227-F230 PolarHBondContact O-N 2.89Å; Y227-R231 HydrophobicContact CD1-CG 4.29Å; Y227-R231 HydrophobicContact CD2-CG 3.94Å; Y227-R231 HydrophobicContact CE1-CG 4.1Å; Y227-R231 HydrophobicContact CE2-CG 3.69Å; Y227-R231 HydrophobicContact CG-CG 4.28Å; Y227-R231 VanDerWaalsContact O-CB 3.3Å; Y227-R231 WeakPolarHBondContact O-CB 3.12Å; Y227-R231 WeakPolarHBondContact O-CG 3.21Å; Y227-R231 PolarHBondContact O-N 3.2Å; Y227-R231 PolarHBondContact OH-NH1 3.47Å
228I92.8Very high89.1Confident0 Ų034.3 Ų34.30%016%0.16CC..Hα-helixtrans-61.7-48.2-178.8-67.3172.1000110.2V166 I169 I173 I189 V224 E225 F230 R231 C232V166-I228 HydrophobicContact CG1-CD1 4.31Å; V166-I228 HydrophobicContact CG1-CG1 3.91Å; I169-I228 HydrophobicContact CG2-CD1 3.94Å; I169-I228 HydrophobicContact CG2-CG1 4.46Å; I173-I228 HydrophobicContact CD1-CG2 4.26Å; I189-I228 HydrophobicContact CD1-CG2 4.08Å; I189-I228 HydrophobicContact CG1-CG2 4.46Å; V224-I228 HydrophobicContact CG1-CD1 3.67Å; V224-I228 HydrophobicContact CG1-CG1 4.37Å; V224-I228 WeakPolarHBondContact O-CG1 3.49Å; V224-I228 PolarHBondContact O-N 2.97Å; E225-I228 PolarHBondContact O-N 2.99Å; I228-F230 PolarHBondContact O-N 3.04Å; I228-R231 PolarHBondContact O-N 2.86Å; I228-C232 WeakPolarHBondContact O-CB 3.39Å; I228-C232 PolarHBondContact O-N 3.38Å
229C92.6Very high87.9Confident0 Ų031.4 Ų31.40%015%0.152CC..Hα-helixtrans-64.5-41.5-177.4-67.60000112E225 T226 Y227 Y233 P296 F349E225-C229 VanDerWaalsContact O-CB 3.28Å; E225-C229 WeakPolarHBondContact O-CB 3.44Å; E225-C229 PolarHBondContact O-N 3.19Å; E225-C229 PolarHBondContact O-SG 3.42Å; T226-C229 PolarHBondContact O-N 3.42Å; Y227-C229 PolarHBondContact O-N 3.16Å; C229-Y233 WeakPolarHBondContact O-CA 3.29Å; C229-Y233 WeakPolarHBondContact O-CB 3.36Å; C229-Y233 PolarHBondContact O-N 3.39Å; C229-P296 WeakPolarHBondContact SG-CD 3.46Å; C229-F349 HydrophobicContact CB-CZ 4.23Å
230F91.2Very high87.1Confident32 Ų3230.8 Ų30.814%0.1415%0.151CC..Hα-helixtrans-67-46176.8-93.1-102.2000112.3E139 A143 T226 Y227 I228 C232 R294E139-F230 HydrophobicContact CB-CD1 4.36Å; E139-F230 HydrophobicContact CB-CE1 4.42Å; A143-F230 HydrophobicContact CB-CB 3.75Å; A143-F230 HydrophobicContact CB-CD1 4.33Å; A143-F230 HydrophobicContact CB-CG 4.17Å; T226-F230 HydrophobicContact CG2-CD2 3.82Å; T226-F230 HydrophobicContact CG2-CE2 3.95Å; T226-F230 WeakPolarHBondContact O-CB 3.02Å; T226-F230 VanDerWaalsContact O-CD2 3.31Å; T226-F230 WeakPolarHBondContact O-CD2 3.23Å; T226-F230 PolarHBondContact O-N 3.4Å; Y227-F230 PolarHBondContact O-N 2.89Å; I228-F230 PolarHBondContact O-N 3.04Å; F230-C232 VanDerWaalsContact C-N 3.32Å; F230-C232 PolarHBondContact O-N 3.28Å; F230-R294 HydrophobicContact CD1-CB 4.21Å; F230-R294 HydrophobicContact CD2-CB 4.08Å; F230-R294 HydrophobicContact CE1-CB 4.06Å; F230-R294 HydrophobicContact CE1-CG 4.42Å; F230-R294 HydrophobicContact CE2-CB 3.95Å; F230-R294 HydrophobicContact CG-CB 4.22Å; F230-R294 HydrophobicContact CZ-CB 3.93Å
231R89.5Confident86.2Confident38 Ų3834.3 Ų34.314%0.14318%0.177CC..Hα-helixtrans-64.6-35.9-178.5-72-63.5-53-78.1-8.9112.8S140 T170 Y227 I228S140-R231 WeakPolarHBondContact O-CD 3.47Å; S140-R231 WeakPolarHBondContact OG-CD 3.36Å; S140-R231 PolarHBondContact OG-NE 3.1Å; T170-R231 HydrophobicContact CG2-CB 3.77Å; T170-R231 HydrophobicContact CG2-CG 4.26Å; Y227-R231 HydrophobicContact CD1-CG 4.29Å; Y227-R231 HydrophobicContact CD2-CG 3.94Å; Y227-R231 HydrophobicContact CE1-CG 4.1Å; Y227-R231 HydrophobicContact CE2-CG 3.69Å; Y227-R231 HydrophobicContact CG-CG 4.28Å; Y227-R231 VanDerWaalsContact O-CB 3.3Å; Y227-R231 WeakPolarHBondContact O-CB 3.12Å; Y227-R231 WeakPolarHBondContact O-CG 3.21Å; Y227-R231 PolarHBondContact O-N 3.2Å; Y227-R231 PolarHBondContact OH-NH1 3.47Å; I228-R231 PolarHBondContact O-N 2.86Å
232C88.8Confident85.8Confident1 Ų137.6 Ų37.61%0.00719%0.194CC..Hα-helixtrans-110.110.5-173.5-51.90000113.2I173 I228 F230 N234 S235 L236I173-C232 HydrophobicContact CG2-CB 3.81Å; I228-C232 WeakPolarHBondContact O-CB 3.39Å; I228-C232 PolarHBondContact O-N 3.38Å; F230-C232 VanDerWaalsContact C-N 3.32Å; F230-C232 PolarHBondContact O-N 3.28Å; C232-N234 VanDerWaalsContact C-N 3.31Å; C232-N234 PolarHBondContact O-N 2.72Å; C232-N234 VanDerWaalsContact O-N 3.16Å; C232-S235 WeakPolarHBondContact O-CA 3.49Å; C232-S235 WeakPolarHBondContact O-CB 3.46Å; C232-S235 PolarHBondContact O-N 3.05Å; C232-L236 HydrophobicContact CB-CD1 3.75Å; C232-L236 HydrophobicContact CB-CG 3.83Å; C232-L236 WeakPolarHBondContact O-CG 3.48Å; C232-L236 PolarHBondContact O-N 2.96Å
233Y89.5Confident85.5Confident18 Ų1835.8 Ų35.87%0.07119%0.186CC..Hα-helixtrans-51.8-46.7-169.9-170.5-107.1000113.4C229 S235 L236 F237 R294 F349C229-Y233 WeakPolarHBondContact O-CA 3.29Å; C229-Y233 WeakPolarHBondContact O-CB 3.36Å; C229-Y233 PolarHBondContact O-N 3.39Å; Y233-S235 PolarHBondContact O-N 3.37Å; Y233-L236 PolarHBondContact O-N 3.06Å; Y233-L236 VanDerWaalsContact O-N 3.13Å; Y233-F237 HydrophobicContact CD1-CB 4.48Å; Y233-F237 HydrophobicContact CE1-CB 4.15Å; Y233-F237 HydrophobicContact CE1-CG 4.2Å; Y233-F237 HydrophobicContact CE2-CB 4.15Å; Y233-F237 AromaticContact CE2-CD2 3.92Å; Y233-F237 HydrophobicContact CE2-CD2 3.92Å; Y233-F237 HydrophobicContact CE2-CG 4.24Å; Y233-F237 AromaticContact CZ-CD2 3.67Å; Y233-F237 AromaticContact CZ-CG 3.76Å; Y233-F237 WeakPolarHBondContact O-CB 3.32Å; Y233-F237 PolarHBondContact O-N 3.22Å; Y233-F237 WeakPolarHBondContact OH-CD2 3.38Å; Y233-F237 WeakPolarHBondContact OH-CE2 3.21Å; Y233-R294 HydrophobicContact CD1-CG 3.96Å; Y233-R294 HydrophobicContact CD2-CB 3.72Å; Y233-R294 HydrophobicContact CD2-CG 4.01Å; Y233-R294 WeakPolarHBondContact CD2-O 3.34Å; Y233-R294 HydrophobicContact CE1-CG 4.15Å; Y233-R294 HydrophobicContact CE2-CB 4.07Å; Y233-R294 HydrophobicContact CE2-CG 4.24Å; Y233-R294 HydrophobicContact CG-CB 4Å; Y233-R294 HydrophobicContact CG-CG 3.88Å; Y233-F349 HydrophobicContact CD2-CE2 4.07Å; Y233-F349 AromaticContact CD2-CZ 3.88Å; Y233-F349 HydrophobicContact CD2-CZ 3.88Å; Y233-F349 HydrophobicContact CE2-CE1 4.29Å; Y233-F349 HydrophobicContact CE2-CE2 4.03Å; Y233-F349 AromaticContact CE2-CZ 3.85Å; Y233-F349 HydrophobicContact CE2-CZ 3.85Å
234N84.6Confident85.2Confident107 Ų10738.5 Ų38.557%0.57220%0.198SC*.Hα-helixtrans-62.9-32.9-178.7-64.1-9.6000112.4C232C232-N234 VanDerWaalsContact C-N 3.31Å; C232-N234 PolarHBondContact O-N 2.72Å; C232-N234 VanDerWaalsContact O-N 3.16Å
235S85.3Confident85Confident26 Ų2641.9 Ų41.918%0.18222%0.219CC..Hα-helixtrans-80.4-29.9176.8-56.60000112.4S177 C232 Y233S177-S235 WeakPolarHBondContact CB-OG 3.46Å; C232-S235 WeakPolarHBondContact O-CA 3.49Å; C232-S235 WeakPolarHBondContact O-CB 3.46Å; C232-S235 PolarHBondContact O-N 3.05Å; Y233-S235 PolarHBondContact O-N 3.37Å
236L87.5Confident84.9Confident4 Ų442.1 Ų42.12%0.02122%0.221CC..Hα-helixtrans-90.7-20.4-175.6-63.3179.4000113.8I173 L182 V185 I189 C232 Y233 F349 F353I173-L236 HydrophobicContact CG2-CD2 4.11Å; L182-L236 WeakPolarHBondContact CD2-O 3.38Å; V185-L236 HydrophobicContact CG1-CD2 3.69Å; I189-L236 HydrophobicContact CD1-CD1 4.3Å; I189-L236 HydrophobicContact CD1-CD2 4.27Å; C232-L236 HydrophobicContact CB-CD1 3.75Å; C232-L236 HydrophobicContact CB-CG 3.83Å; C232-L236 WeakPolarHBondContact O-CG 3.48Å; C232-L236 PolarHBondContact O-N 2.96Å; Y233-L236 PolarHBondContact O-N 3.06Å; Y233-L236 VanDerWaalsContact O-N 3.13Å; L236-F349 HydrophobicContact CB-CE2 3.95Å; L236-F353 HydrophobicContact CB-CD2 4.49Å; L236-F353 HydrophobicContact CB-CE2 3.89Å; L236-F353 HydrophobicContact CB-CZ 4.03Å; L236-F353 HydrophobicContact CD1-CE1 4.48Å; L236-F353 HydrophobicContact CD2-CE1 3.84Å; L236-F353 HydrophobicContact CD2-CE2 4.42Å; L236-F353 HydrophobicContact CD2-CZ 3.71Å; L236-F353 HydrophobicContact CG-CZ 4.29Å
237F85.3Confident84.9Confident8 Ų841.2 Ų41.24%0.03522%0.215CC..Hα-helixtrans-100-35.8-176.5-165.5-91.1000113.7Y233 L342 F349Y233-F237 HydrophobicContact CD1-CB 4.48Å; Y233-F237 HydrophobicContact CE1-CB 4.15Å; Y233-F237 HydrophobicContact CE1-CG 4.2Å; Y233-F237 HydrophobicContact CE2-CB 4.15Å; Y233-F237 AromaticContact CE2-CD2 3.92Å; Y233-F237 HydrophobicContact CE2-CD2 3.92Å; Y233-F237 HydrophobicContact CE2-CG 4.24Å; Y233-F237 AromaticContact CZ-CD2 3.67Å; Y233-F237 AromaticContact CZ-CG 3.76Å; Y233-F237 WeakPolarHBondContact O-CB 3.32Å; Y233-F237 PolarHBondContact O-N 3.22Å; Y233-F237 WeakPolarHBondContact OH-CD2 3.38Å; Y233-F237 WeakPolarHBondContact OH-CE2 3.21Å; F237-L342 HydrophobicContact CE1-CD1 3.89Å; F237-L342 HydrophobicContact CZ-CB 4.24Å; F237-L342 HydrophobicContact CZ-CD1 4.28Å; F237-F349 HydrophobicContact CB-CD2 4.48Å; F237-F349 HydrophobicContact CD2-CB 4.19Å; F237-F349 AromaticContact CD2-CD2 3.9Å; F237-F349 HydrophobicContact CD2-CD2 3.9Å; F237-F349 HydrophobicContact CD2-CG 4.07Å; F237-F349 HydrophobicContact CE2-CB 4.38Å
238W69.3Low84.8Confident144 Ų14445 Ų4555%0.54524%0.235SC..SBendtrans-11155-169.6-66.2103.5000113.4L342W238-L342 HydrophobicContact CH2-CD1 3.54Å; W238-L342 HydrophobicContact CH2-CD2 4.49Å; W238-L342 HydrophobicContact CZ2-CD1 3.93Å; W238-L342 HydrophobicContact CZ3-CD1 4.44Å
239S62.3Low84.9Confident51 Ų5146.7 Ų46.736%0.35725%0.247SC..  trans-105.7-18.7-163.455.30000116.3L182L182-S239 WeakPolarHBondContact CD1-OG 3.32Å; L182-S239 VanDerWaalsContact CD2-OG 3.23Å; L182-S239 WeakPolarHBondContact CD2-OG 3.42Å
240D70.6Confident84.9Confident79 Ų7946.9 Ų46.942%0.42225%0.247SC..  trans-141.5134.4-177.9-165-10000111.3D242 E243D240-D242 PolarHBondContact O-N 2.75Å; D240-D242 PolarHBondContact OD1-N 3.31Å; D240-D242 VanDerWaalsContact OD1-N 3.13Å; D240-E243 HydrophobicContact CB-CG 4.28Å; D240-E243 PolarHBondContact O-N 2.97Å
241S73.8Confident85.1Confident77 Ų7748.1 Ų48.154%0.53825%0.254SS..Hα-helixtrans-60.8-29.2174.652.20000112E243 E244 V245S241-E243 VanDerWaalsContact C-N 3.28Å; S241-E243 PolarHBondContact O-N 3.48Å; S241-E244 PolarHBondContact O-N 3.05Å; S241-V245 VanDerWaalsContact O-CG2 3.3Å; S241-V245 WeakPolarHBondContact O-CG2 3.2Å; S241-V245 PolarHBondContact O-N 3.32Å
242D83.4Confident85.2Confident81 Ų8151 Ų5143%0.43327%0.269SS..Hα-helixtrans-66.9-30.4-178.8-74.8-2.3000112.3D240 A246D240-D242 PolarHBondContact O-N 2.75Å; D240-D242 PolarHBondContact OD1-N 3.31Å; D240-D242 VanDerWaalsContact OD1-N 3.13Å; D242-A246 WeakPolarHBondContact O-CB 3.46Å; D242-A246 PolarHBondContact O-N 2.73Å
243E83.9Confident85.4Confident12 Ų1253.3 Ų53.36%0.05628%0.277CS..Hα-helixtrans-73.4-42.4177.5-59.5-164.1166.300111.7D240 S241 V245 A246 D247 K348 R352D240-E243 HydrophobicContact CB-CG 4.28Å; D240-E243 PolarHBondContact O-N 2.97Å; S241-E243 VanDerWaalsContact C-N 3.28Å; S241-E243 PolarHBondContact O-N 3.48Å; E243-V245 VanDerWaalsContact C-N 3.34Å; E243-V245 PolarHBondContact O-N 2.91Å; E243-A246 PolarHBondContact O-N 2.91Å; E243-D247 PolarHBondContact O-N 2.98Å; E243-K348 HydrophobicContact CG-CD 4.32Å; E243-K348 WeakPolarHBondContact OE1-CD 3.48Å; E243-K348 IonicContact OE1-NZ 2.67Å; E243-K348 PolarHBondContact OE1-NZ 2.99Å; E243-R352 IonicContact OE1-CZ 3.76Å; E243-R352 IonicContact OE1-NH1 4Å; E243-R352 PolarHBondContact OE1-NH1 3.34Å; E243-R352 IonicContact OE1-NH2 3.65Å; E243-R352 PolarHBondContact OE1-NH2 3.44Å; E243-R352 IonicContact OE2-NH1 2.74Å; E243-R352 PolarHBondContact OE2-NH1 3.31Å
244E86.2Confident85.6Confident100 Ų10052.5 Ų52.547%0.46727%0.274SS..Hα-helixtrans-60.7-45.2174.6-176.9178.5-172.200111S241 A246 D247 I248S241-E244 PolarHBondContact O-N 3.05Å; E244-A246 VanDerWaalsContact C-N 3.32Å; E244-A246 PolarHBondContact O-N 3.15Å; E244-D247 PolarHBondContact O-N 3.33Å; E244-I248 HydrophobicContact CG-CD1 4.01Å; E244-I248 VanDerWaalsContact O-CG1 3.32Å; E244-I248 WeakPolarHBondContact O-CG1 3.27Å; E244-I248 PolarHBondContact O-N 3.35Å
245V90Very high85.9Confident70 Ų7052.9 Ų52.942%0.42427%0.268SS..Hα-helixtrans-61.1-42.7176.11720000111.1P77 S241 E243 I248 S249P77-V245 HydrophobicContact CB-CG1 4.34Å; S241-V245 VanDerWaalsContact O-CG2 3.3Å; S241-V245 WeakPolarHBondContact O-CG2 3.2Å; S241-V245 PolarHBondContact O-N 3.32Å; E243-V245 VanDerWaalsContact C-N 3.34Å; E243-V245 PolarHBondContact O-N 2.91Å; V245-I248 PolarHBondContact O-N 2.94Å; V245-S249 VanDerWaalsContact O-CB 3.25Å; V245-S249 WeakPolarHBondContact O-CB 3.23Å; V245-S249 PolarHBondContact O-N 3.13Å
246A90.8Very high86.2Confident5 Ų553.5 Ų53.54%0.04127%0.272CS..Hα-helixtrans-62.4-43.5177.400000111.9F79 D242 E243 E244 S249 F250 L344F79-A246 HydrophobicContact CB-CB 4.02Å; D242-A246 WeakPolarHBondContact O-CB 3.46Å; D242-A246 PolarHBondContact O-N 2.73Å; E243-A246 PolarHBondContact O-N 2.91Å; E244-A246 VanDerWaalsContact C-N 3.32Å; E244-A246 PolarHBondContact O-N 3.15Å; A246-S249 PolarHBondContact O-N 3.47Å; A246-F250 VanDerWaalsContact O-CB 3.29Å; A246-F250 WeakPolarHBondContact O-CB 3.18Å; A246-F250 PolarHBondContact O-N 3.31Å; A246-L344 HydrophobicContact CB-CD1 4.19Å
247D92.7Very high86.3Confident6 Ų653.3 Ų53.33%0.03227%0.271CS..Hα-helixtrans-64.6-44.4177.8-96-44.6000112.5E243 E244 S249 F250 Q251 L342 I343 L344 S345E243-D247 PolarHBondContact O-N 2.98Å; E244-D247 PolarHBondContact O-N 3.33Å; D247-S249 VanDerWaalsContact C-N 3.33Å; D247-S249 PolarHBondContact O-N 3.13Å; D247-F250 PolarHBondContact O-N 3.07Å; D247-Q251 WeakPolarHBondContact O-CB 3.3Å; D247-Q251 PolarHBondContact O-N 3.2Å; D247-L342 HydrophobicContact CB-CD2 4.08Å; D247-L342 VanDerWaalsContact CG-CA 3.42Å; D247-L342 WeakPolarHBondContact OD1-CA 3.33Å; D247-L342 WeakPolarHBondContact OD2-CA 3.22Å; D247-I343 PolarHBondContact OD1-N 2.93Å; D247-I343 VanDerWaalsContact OD1-N 3.13Å; D247-L344 WeakPolarHBondContact OD1-CA 3.02Å; D247-L344 WeakPolarHBondContact OD1-CB 3.21Å; D247-L344 PolarHBondContact OD1-N 2.99Å; D247-S345 WeakPolarHBondContact OD2-CB 3.48Å; D247-S345 PolarHBondContact OD2-N 3.4Å; D247-S345 PolarHBondContact OD2-OG 3.02Å
248I91.8Very high86.3Confident86 Ų8658.4 Ų58.444%0.44129%0.291SS..Hα-helixtrans-60.1-47.5175.3-67.4166.9000110E244 V245 F250 Q251 E252E244-I248 HydrophobicContact CG-CD1 4.01Å; E244-I248 VanDerWaalsContact O-CG1 3.32Å; E244-I248 WeakPolarHBondContact O-CG1 3.27Å; E244-I248 PolarHBondContact O-N 3.35Å; V245-I248 PolarHBondContact O-N 2.94Å; I248-F250 VanDerWaalsContact C-N 3.29Å; I248-F250 PolarHBondContact O-N 3.41Å; I248-Q251 WeakPolarHBondContact O-CB 3.28Å; I248-Q251 PolarHBondContact O-N 2.8Å; I248-E252 PolarHBondContact O-N 3.34Å
249S93.3Very high87.1Confident36 Ų3652.2 Ų52.225%0.25227%0.267SS..Hα-helixtrans-61-40.4180-156.50000111.6W76 V245 A246 D247 R253W76-S249 WeakPolarHBondContact CZ3-O 3.24Å; W76-S249 WeakPolarHBondContact CZ3-OG 3.37Å; V245-S249 VanDerWaalsContact O-CB 3.25Å; V245-S249 WeakPolarHBondContact O-CB 3.23Å; V245-S249 PolarHBondContact O-N 3.13Å; A246-S249 PolarHBondContact O-N 3.47Å; D247-S249 VanDerWaalsContact C-N 3.33Å; D247-S249 PolarHBondContact O-N 3.13Å; S249-R253 WeakPolarHBondContact O-CB 3.35Å; S249-R253 PolarHBondContact O-N 3.13Å
250F94Very high88.2Confident3 Ų349.8 Ų49.81%0.01325%0.25CS..Hα-helixtrans-70.7-36.3177-169.4-103.5000112.7A246 D247 I248 R253 I254 I343 L344 L375 I378 Q379A246-F250 VanDerWaalsContact O-CB 3.29Å; A246-F250 WeakPolarHBondContact O-CB 3.18Å; A246-F250 PolarHBondContact O-N 3.31Å; D247-F250 PolarHBondContact O-N 3.07Å; I248-F250 VanDerWaalsContact C-N 3.29Å; I248-F250 PolarHBondContact O-N 3.41Å; F250-R253 VanDerWaalsContact O-CB 3.31Å; F250-R253 WeakPolarHBondContact O-CB 3.49Å; F250-R253 PolarHBondContact O-N 2.94Å; F250-I254 HydrophobicContact CD1-CD1 3.87Å; F250-I254 HydrophobicContact CD1-CG1 4.42Å; F250-I254 HydrophobicContact CE1-CD1 3.44Å; F250-I254 VanDerWaalsContact CE1-CD1 3.44Å; F250-I254 HydrophobicContact CE1-CG1 4.07Å; F250-I254 HydrophobicContact CZ-CD1 4.16Å; F250-I254 HydrophobicContact CZ-CG1 4.39Å; F250-I254 PolarHBondContact O-N 2.88Å; F250-I343 HydrophobicContact CD1-CG2 3.64Å; F250-I343 HydrophobicContact CE1-CG2 3.63Å; F250-L344 HydrophobicContact CB-CD1 3.61Å; F250-L344 HydrophobicContact CB-CG 4.15Å; F250-L344 HydrophobicContact CD1-CD1 4.45Å; F250-L344 HydrophobicContact CD1-CD2 4.33Å; F250-L344 HydrophobicContact CD1-CG 4.14Å; F250-L344 HydrophobicContact CD2-CD1 4.26Å; F250-L344 HydrophobicContact CG-CD1 3.86Å; F250-L344 HydrophobicContact CG-CD2 4.32Å; F250-L344 HydrophobicContact CG-CG 4.05Å; F250-L375 HydrophobicContact CE1-CD2 3.47Å; F250-L375 VanDerWaalsContact CE1-CD2 3.47Å; F250-L375 WeakPolarHBondContact CE2-O 3.48Å; F250-L375 HydrophobicContact CZ-CB 4.06Å; F250-L375 HydrophobicContact CZ-CD2 3.52Å; F250-L375 HydrophobicContact CZ-CG 4.4Å; F250-I378 HydrophobicContact CE2-CB 4.33Å; F250-I378 HydrophobicContact CE2-CG2 4.02Å; F250-I378 HydrophobicContact CZ-CB 4.14Å; F250-I378 HydrophobicContact CZ-CG2 3.89Å; F250-Q379 HydrophobicContact CD2-CB 4.44Å; F250-Q379 HydrophobicContact CE2-CB 4.06Å
251Q94.8Very high88.4Confident58 Ų5846.2 Ų46.227%0.27123%0.232SC..Hα-helixtrans-62.9-44.6174.5-164.3-17351.400111.5D247 I248 R253 I254 R255 N339D247-Q251 WeakPolarHBondContact O-CB 3.3Å; D247-Q251 PolarHBondContact O-N 3.2Å; I248-Q251 WeakPolarHBondContact O-CB 3.28Å; I248-Q251 PolarHBondContact O-N 2.8Å; Q251-R253 VanDerWaalsContact C-N 3.29Å; Q251-R253 PolarHBondContact O-N 2.65Å; Q251-I254 PolarHBondContact O-N 2.93Å; Q251-R255 VanDerWaalsContact CD-NH1 3.27Å; Q251-R255 WeakPolarHBondContact O-CG 3.44Å; Q251-R255 PolarHBondContact O-N 3.43Å; Q251-R255 VanDerWaalsContact OE1-NH2 3.12Å; Q251-N339 WeakPolarHBondContact CG-OD1 3.45Å
252E91.7Very high88.2Confident100 Ų10043.7 Ų43.747%0.46721%0.213SC..Hα-helixtrans-62.9-37.8173.7-71.8-52.6132.900111.8I248 R255 S256I248-E252 PolarHBondContact O-N 3.34Å; E252-R255 PolarHBondContact O-N 2.88Å; E252-R255 IonicContact OE1-CZ 3.65Å; E252-R255 IonicContact OE1-NH1 3.93Å; E252-R255 PolarHBondContact OE1-NH1 2.88Å; E252-S256 PolarHBondContact O-N 3.27Å
253R92.6Very high87.5Confident48 Ų4840.6 Ų40.618%0.18120%0.201CC..Hα-helixtrans-59.9-48.7173.8-177.355.5162.2174.1-3.3111.7W76 S249 F250 Q251 R255 S256 L257 Q379 L381W76-R253 HydrophobicContact CH2-CB 3.8Å; W76-R253 HydrophobicContact CH2-CG 3.93Å; W76-R253 HydrophobicContact CZ2-CG 4.34Å; W76-R253 HydrophobicContact CZ3-CB 4.26Å; S249-R253 WeakPolarHBondContact O-CB 3.35Å; S249-R253 PolarHBondContact O-N 3.13Å; F250-R253 VanDerWaalsContact O-CB 3.31Å; F250-R253 WeakPolarHBondContact O-CB 3.49Å; F250-R253 PolarHBondContact O-N 2.94Å; Q251-R253 VanDerWaalsContact C-N 3.29Å; Q251-R253 PolarHBondContact O-N 2.65Å; R253-R255 VanDerWaalsContact C-N 3.31Å; R253-R255 PolarHBondContact O-N 2.93Å; R253-S256 PolarHBondContact O-N 3.47Å; R253-S256 PolarHBondContact O-OG 3.38Å; R253-L257 HydrophobicContact CG-CD1 4.2Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.93Å; R253-L257 VanDerWaalsContact O-N 3.14Å; R253-Q379 PolarHBondContact NE-O 3.35Å; R253-Q379 PolarHBondContact NH2-O 2.76Å; R253-L381 PolarHBondContact NH2-O 3.43Å
254I93.7Very high86.7Confident1 Ų142.7 Ų42.71%0.00522%0.216CC..Hα-helixtrans-58.5-44.4176.1-70.7171.3000110.7F250 Q251 S256 L257 Y258 V335 L336 N339 I378F250-I254 HydrophobicContact CD1-CD1 3.87Å; F250-I254 HydrophobicContact CD1-CG1 4.42Å; F250-I254 HydrophobicContact CE1-CD1 3.44Å; F250-I254 VanDerWaalsContact CE1-CD1 3.44Å; F250-I254 HydrophobicContact CE1-CG1 4.07Å; F250-I254 HydrophobicContact CZ-CD1 4.16Å; F250-I254 HydrophobicContact CZ-CG1 4.39Å; F250-I254 PolarHBondContact O-N 2.88Å; Q251-I254 PolarHBondContact O-N 2.93Å; I254-S256 PolarHBondContact O-N 2.98Å; I254-L257 CarbonylContact O-C 3.51Å; I254-L257 PolarHBondContact O-N 3.47Å; I254-L257 VanDerWaalsContact O-N 3.11Å; I254-Y258 PolarHBondContact O-N 3.36Å; I254-V335 HydrophobicContact CD1-CG1 4.28Å; I254-L336 HydrophobicContact CG2-CD2 4.26Å; I254-L336 WeakPolarHBondContact CG2-O 3.41Å; I254-N339 WeakPolarHBondContact CD1-OD1 3.38Å; I254-N339 HydrophobicContact CG2-CB 3.72Å; I254-I378 HydrophobicContact CG1-CG2 3.97Å
255R91.3Very high85.9Confident115 Ų11539 Ų3943%0.43420%0.199SC..Hα-helixtrans-57.6-46.5177.1-72-178.6179.5109.99.2112Q251 E252 R253 L257 Y258Q251-R255 VanDerWaalsContact CD-NH1 3.27Å; Q251-R255 WeakPolarHBondContact O-CG 3.44Å; Q251-R255 PolarHBondContact O-N 3.43Å; Q251-R255 VanDerWaalsContact OE1-NH2 3.12Å; E252-R255 PolarHBondContact O-N 2.88Å; E252-R255 IonicContact OE1-CZ 3.65Å; E252-R255 IonicContact OE1-NH1 3.93Å; E252-R255 PolarHBondContact OE1-NH1 2.88Å; R253-R255 VanDerWaalsContact C-N 3.31Å; R253-R255 PolarHBondContact O-N 2.93Å; R255-L257 PolarHBondContact O-N 3.17Å; R255-Y258 WeakPolarHBondContact O-CB 3.46Å; R255-Y258 PolarHBondContact O-N 3.48Å
256S90.4Very high85.1Confident39 Ų3939 Ų3927%0.27320%0.197SC..Hα-helixtrans-63.5-25.9178.374.10000113.6E252 R253 I254 W259E252-S256 PolarHBondContact O-N 3.27Å; R253-S256 PolarHBondContact O-N 3.47Å; R253-S256 PolarHBondContact O-OG 3.38Å; I254-S256 PolarHBondContact O-N 2.98Å; S256-W259 PolarHBondContact O-NE1 3.24Å; S256-W259 VanDerWaalsContact O-NE1 3.15Å
257L90Very high84.3Confident0 Ų039.1 Ų39.10%020%0.197CC..THydrogen-bonded Turntrans-99.84.1-179-64179.6000113.1R253 I254 R255 W259 V260 L336 I378 L381 F393R253-L257 HydrophobicContact CG-CD1 4.2Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.93Å; R253-L257 VanDerWaalsContact O-N 3.14Å; I254-L257 CarbonylContact O-C 3.51Å; I254-L257 PolarHBondContact O-N 3.47Å; I254-L257 VanDerWaalsContact O-N 3.11Å; R255-L257 PolarHBondContact O-N 3.17Å; L257-W259 PolarHBondContact O-N 2.93Å; L257-W259 VanDerWaalsContact O-N 3.1Å; L257-V260 HydrophobicContact CB-CG2 4.29Å; L257-V260 HydrophobicContact CD2-CG2 4.38Å; L257-V260 VanDerWaalsContact O-CB 3.24Å; L257-V260 WeakPolarHBondContact O-CB 3.38Å; L257-V260 VanDerWaalsContact O-CG2 3.28Å; L257-V260 WeakPolarHBondContact O-CG2 3.48Å; L257-V260 PolarHBondContact O-N 3.47Å; L257-L336 HydrophobicContact CB-CD2 4.04Å; L257-I378 HydrophobicContact CD1-CG2 4.24Å; L257-L381 HydrophobicContact CD1-CB 3.98Å; L257-L381 HydrophobicContact CD1-CD1 4.4Å; L257-L381 HydrophobicContact CD1-CD2 4.34Å; L257-L381 HydrophobicContact CD1-CG 4.48Å; L257-L381 HydrophobicContact CD2-CD2 4.04Å; L257-F393 HydrophobicContact CD2-CE2 4.25Å; L257-F393 HydrophobicContact CD2-CZ 3.69Å
258Y86.3Confident83.5Confident116 Ų11639.2 Ų39.246%0.45520%0.199SC..G310 helixtrans-56.6-33.4-177.1-176-99.8000112.1I254 R255 V260 T261 K337I254-Y258 PolarHBondContact O-N 3.36Å; R255-Y258 WeakPolarHBondContact O-CB 3.46Å; R255-Y258 PolarHBondContact O-N 3.48Å; Y258-V260 PolarHBondContact O-N 2.75Å; Y258-V260 VanDerWaalsContact O-N 3.16Å; Y258-T261 WeakPolarHBondContact O-CB 3.49Å; Y258-T261 PolarHBondContact O-N 3.08Å; Y258-T261 VanDerWaalsContact O-N 3.1Å; Y258-T261 PolarHBondContact O-OG1 3.16Å; Y258-K337 HydrophobicContact CE2-CD 3.62Å; Y258-K337 PolarHBondContact OH-NZ 3.36Å
259W85.5Confident83Confident13 Ų1335.6 Ų35.65%0.04918%0.181CC..G310 helixtrans-58.6-26.2176.766.6-99.4000114S256 L257 T261 C262 L386 M388 F393 Y396 S397 P403S256-W259 PolarHBondContact O-NE1 3.24Å; S256-W259 VanDerWaalsContact O-NE1 3.15Å; L257-W259 PolarHBondContact O-N 2.93Å; L257-W259 VanDerWaalsContact O-N 3.1Å; W259-T261 PolarHBondContact O-N 3.24Å; W259-C262 WeakPolarHBondContact O-CB 3.36Å; W259-C262 PolarHBondContact O-N 2.75Å; W259-L386 HydrophobicContact CH2-CD1 3.54Å; W259-L386 HydrophobicContact CZ2-CD1 4.29Å; W259-L386 HydrophobicContact CZ3-CD1 4.14Å; W259-M388 HydrophobicContact CH2-CE 3.94Å; W259-M388 HydrophobicContact CH2-SD 3.5Å; W259-M388 WeakPolarHBondContact CH2-SD 3.49Å; W259-M388 HydrophobicContact CZ3-CE 4.23Å; W259-M388 HydrophobicContact CZ3-SD 4.07Å; W259-F393 AromaticContact CH2-CD2 3.63Å; W259-F393 HydrophobicContact CH2-CD2 3.63Å; W259-F393 AromaticContact CH2-CE2 3.97Å; W259-F393 HydrophobicContact CH2-CE2 3.97Å; W259-F393 HydrophobicContact CH2-CG 4.48Å; W259-F393 AromaticContact CZ2-CD2 3.45Å; W259-F393 HydrophobicContact CZ2-CD2 3.45Å; W259-F393 VanDerWaalsContact CZ2-CD2 3.45Å; W259-F393 AromaticContact CZ2-CE2 3.53Å; W259-F393 HydrophobicContact CZ2-CE2 3.53Å; W259-F393 HydrophobicContact CZ2-CG 4.13Å; W259-F393 HydrophobicContact CZ2-CZ 4.28Å; W259-Y396 HydrophobicContact CD2-CG 4.19Å; W259-Y396 HydrophobicContact CE3-CD2 4.2Å; W259-Y396 HydrophobicContact CE3-CG 4.09Å; W259-Y396 HydrophobicContact CH2-CD2 4.38Å; W259-Y396 HydrophobicContact CZ3-CD2 4.06Å; W259-Y396 HydrophobicContact CZ3-CG 4.39Å; W259-S397 PolarHBondContact NE1-OG 3.42Å; W259-S397 VanDerWaalsContact NE1-OG 3.14Å; W259-P403 HydrophobicContact CB-CB 3.76Å; W259-P403 HydrophobicContact CB-CG 3.39Å
260V85Confident82.4Confident0 Ų037.1 Ų37.10%019%0.186CC..G310 helixtrans-61.3-31.5178.7179.20000110.9L257 Y258 C262 G263 P264 L265 L336 L381 L386L257-V260 HydrophobicContact CB-CG2 4.29Å; L257-V260 HydrophobicContact CD2-CG2 4.38Å; L257-V260 VanDerWaalsContact O-CB 3.24Å; L257-V260 WeakPolarHBondContact O-CB 3.38Å; L257-V260 VanDerWaalsContact O-CG2 3.28Å; L257-V260 WeakPolarHBondContact O-CG2 3.48Å; L257-V260 PolarHBondContact O-N 3.47Å; Y258-V260 PolarHBondContact O-N 2.75Å; Y258-V260 VanDerWaalsContact O-N 3.16Å; V260-C262 PolarHBondContact O-N 3.42Å; V260-G263 PolarHBondContact O-N 3.14Å; V260-P264 HydrophobicContact CG1-CG 4.38Å; V260-L265 HydrophobicContact CG1-CB 4.11Å; V260-L265 HydrophobicContact CG1-CD1 3.78Å; V260-L336 HydrophobicContact CB-CD1 4.48Å; V260-L336 HydrophobicContact CG1-CD1 4.48Å; V260-L381 HydrophobicContact CG2-CD2 4.49Å; V260-L386 HydrophobicContact CG1-CD1 4.15Å; V260-L386 HydrophobicContact CG1-CD2 4.07Å; V260-L386 HydrophobicContact CG2-CD1 3.88Å
261T76Confident81.6Confident5 Ų538.1 Ų38.13%0.03119%0.191CC..G310 helixtrans-70.1-15.5176.369.40000113.3Y258 W259 Y333 L336 K337Y258-T261 WeakPolarHBondContact O-CB 3.49Å; Y258-T261 PolarHBondContact O-N 3.08Å; Y258-T261 VanDerWaalsContact O-N 3.1Å; Y258-T261 PolarHBondContact O-OG1 3.16Å; W259-T261 PolarHBondContact O-N 3.24Å; T261-Y333 HydrophobicContact CG2-CD2 4.15Å; T261-Y333 HydrophobicContact CG2-CE2 4.15Å; T261-Y333 WeakPolarHBondContact O-CE2 3.18Å; T261-L336 HydrophobicContact CG2-CB 3.53Å; T261-L336 HydrophobicContact CG2-CD1 4.08Å; T261-L336 HydrophobicContact CG2-CG 4.45Å; T261-K337 HydrophobicContact CG2-CD 4Å; T261-K337 HydrophobicContact CG2-CG 4.07Å; T261-K337 VanDerWaalsContact OG1-CE 3.25Å; T261-K337 WeakPolarHBondContact OG1-CE 3.38Å; T261-K337 PolarHBondContact OG1-NZ 3.22Å
262C68.9Low80.8Confident23 Ų2338 Ų3816%0.15520%0.2CC..G310 helixtrans-90-21.7177.2-590000112.4W259 V260 P403 P404 R406W259-C262 WeakPolarHBondContact O-CB 3.36Å; W259-C262 PolarHBondContact O-N 2.75Å; V260-C262 PolarHBondContact O-N 3.42Å; C262-P403 HydrophobicContact CB-CB 4.03Å; C262-P404 CarbonylContact C-O 3.59Å; C262-R406 VanDerWaalsContact O-CB 3.31Å; C262-R406 WeakPolarHBondContact O-CB 3.35Å; C262-R406 PolarHBondContact O-N 3.44Å
263G68.7Low80.3Confident17 Ų1735.9 Ų35.918%0.17519%0.192CC..THydrogen-bonded Turntrans-116.7-103.9-170.100000114.2V260 L265V260-G263 PolarHBondContact O-N 3.14Å; G263-L265 PolarHBondContact O-N 2.81Å
264P66.1Low80Confident56 Ų5637.9 Ų37.936%0.36421%0.209SC..THydrogen-bonded Turntrans-76.7-22.6-161.128.8-35.3000114.7V260 D266 L386V260-P264 HydrophobicContact CG1-CG 4.38Å; P264-D266 PolarHBondContact O-N 3.36Å; P264-D266 VanDerWaalsContact O-N 3.13Å; P264-L386 HydrophobicContact CG-CD1 4.2Å; P264-L386 HydrophobicContact CG-CD2 3.95Å
265L70.8Confident79.7Confident21 Ų2140 Ų4011%0.1123%0.227CC..  trans-8297.2-179.8-129.8112.7000108.8V260 G263 P267 P329 I332 Y333 L386V260-L265 HydrophobicContact CG1-CB 4.11Å; V260-L265 HydrophobicContact CG1-CD1 3.78Å; G263-L265 PolarHBondContact O-N 2.81Å; L265-P267 VanDerWaalsContact O-CD 3.23Å; L265-P267 WeakPolarHBondContact O-CD 3.33Å; L265-P329 WeakPolarHBondContact CD2-O 3.46Å; L265-I332 HydrophobicContact CD2-CB 4.33Å; L265-I332 HydrophobicContact CD2-CG2 4.02Å; L265-Y333 HydrophobicContact CD2-CD2 4.41Å; L265-L386 HydrophobicContact CD1-CD2 4.44Å
266D72Confident79.6Confident72 Ų7234.5 Ų34.539%0.38521%0.206SC..  trans-92.9104.2171-171.17.8000110.2P264 G268 R406P264-D266 PolarHBondContact O-N 3.36Å; P264-D266 VanDerWaalsContact O-N 3.13Å; D266-G268 PolarHBondContact O-N 2.77Å; D266-G268 WeakPolarHBondContact OD1-CA 3.44Å; D266-G268 PolarHBondContact OD1-N 2.68Å; D266-R406 VanDerWaalsContact CB-NH2 3.32Å; D266-R406 VanDerWaalsContact CG-CZ 3.43Å; D266-R406 IonicContact OD1-CZ 3.32Å; D266-R406 IonicContact OD1-NH1 3.33Å; D266-R406 PolarHBondContact OD1-NH1 3.25Å; D266-R406 IonicContact OD1-NH2 2.75Å; D266-R406 PolarHBondContact OD1-NH2 3.33Å; D266-R406 IonicContact OD2-CZ 3.93Å; D266-R406 IonicContact OD2-NH1 2.73Å; D266-R406 IonicContact OD2-NH2 3.2Å; D266-R406 PolarHBondContact OD2-NH2 3.35Å
267P74Confident79.4Confident7 Ų733 Ų335%0.04520%0.195CC..  trans-69-9.9173.531.9-36.8000111.8L265 F269 H314 A330 Y333L265-P267 VanDerWaalsContact O-CD 3.23Å; L265-P267 WeakPolarHBondContact O-CD 3.33Å; P267-F269 VanDerWaalsContact C-N 3.29Å; P267-F269 HydrophobicContact CB-CD1 4.46Å; P267-F269 HydrophobicContact CB-CD2 3.52Å; P267-F269 HydrophobicContact CB-CE1 4.48Å; P267-F269 HydrophobicContact CB-CE2 3.55Å; P267-F269 HydrophobicContact CB-CG 4.01Å; P267-F269 HydrophobicContact CB-CZ 4.07Å; P267-F269 HydrophobicContact CG-CB 4.24Å; P267-F269 HydrophobicContact CG-CD2 3.36Å; P267-F269 HydrophobicContact CG-CE2 3.88Å; P267-F269 HydrophobicContact CG-CG 3.9Å; P267-H314 PolarHBondContact O-CE1 3.26Å; P267-A330 HydrophobicContact CB-CB 4.15Å; P267-Y333 HydrophobicContact CB-CD1 4.24Å; P267-Y333 HydrophobicContact CB-CG 4.05Å; P267-Y333 HydrophobicContact CG-CD1 3.84Å; P267-Y333 HydrophobicContact CG-CD2 3.99Å; P267-Y333 HydrophobicContact CG-CE1 4.07Å; P267-Y333 HydrophobicContact CG-CE2 4.2Å; P267-Y333 HydrophobicContact CG-CG 3.81Å
268G77.6Confident79.4Confident8 Ų838.2 Ų38.28%0.08222%0.22CC..  trans77.815.8-177.100000114D266 R318D266-G268 PolarHBondContact O-N 2.77Å; D266-G268 WeakPolarHBondContact OD1-CA 3.44Å; D266-G268 PolarHBondContact OD1-N 2.68Å; G268-R318 VanDerWaalsContact CA-NH2 3.26Å; G268-R318 PolarHBondContact O-NE 2.65Å
269F80.8Confident79.6Confident10 Ų1033 Ų334%0.04420%0.2CC..  trans-79.7131.4173.9-58.6-34.8000110.7P267 L271 V276 F280 I310 C313 H314 A330 Y333P267-F269 VanDerWaalsContact C-N 3.29Å; P267-F269 HydrophobicContact CB-CD1 4.46Å; P267-F269 HydrophobicContact CB-CD2 3.52Å; P267-F269 HydrophobicContact CB-CE1 4.48Å; P267-F269 HydrophobicContact CB-CE2 3.55Å; P267-F269 HydrophobicContact CB-CG 4.01Å; P267-F269 HydrophobicContact CB-CZ 4.07Å; P267-F269 HydrophobicContact CG-CB 4.24Å; P267-F269 HydrophobicContact CG-CD2 3.36Å; P267-F269 HydrophobicContact CG-CE2 3.88Å; P267-F269 HydrophobicContact CG-CG 3.9Å; F269-L271 VanDerWaalsContact C-N 3.28Å; F269-L271 HydrophobicContact CB-CD2 4.01Å; F269-L271 HydrophobicContact CB-CG 4.11Å; F269-L271 PolarHBondContact O-N 2.86Å; F269-V276 HydrophobicContact CB-CG1 4.07Å; F269-F280 HydrophobicContact CD2-CD2 4.02Å; F269-F280 HydrophobicContact CD2-CE2 4.28Å; F269-F280 AromaticContact CE2-CD2 3.78Å; F269-F280 HydrophobicContact CE2-CD2 3.78Å; F269-F280 AromaticContact CE2-CE2 3.94Å; F269-F280 HydrophobicContact CE2-CE2 3.94Å; F269-I310 HydrophobicContact CZ-CG2 4.17Å; F269-C313 HydrophobicContact CD1-CB 3.73Å; F269-C313 HydrophobicContact CE1-CB 3.53Å; F269-C313 HydrophobicContact CG-CB 4.49Å; F269-C313 HydrophobicContact CZ-CB 4.13Å; F269-H314 AromaticContact CE1-CD2 3.71Å; F269-H314 AromaticContact CE1-NE2 3.7Å; F269-A330 HydrophobicContact CE1-CB 4.18Å; F269-A330 HydrophobicContact CE2-CB 4.38Å; F269-A330 HydrophobicContact CZ-CB 3.67Å; F269-Y333 HydrophobicContact CD2-CD1 4.45Å; F269-Y333 HydrophobicContact CE2-CD1 4.26Å
270D81.1Confident79.9Confident67 Ų6733 Ų3336%0.35820%0.2SC..  trans-79.980.5168.5-175.714.6000109.7A272 N273 V276 S317D270-A272 PolarHBondContact O-N 3.03Å; D270-A272 VanDerWaalsContact O-N 3.07Å; D270-A272 WeakPolarHBondContact OD1-CB 3.43Å; D270-A272 PolarHBondContact OD1-N 2.86Å; D270-N273 WeakPolarHBondContact O-CB 3.38Å; D270-N273 PolarHBondContact O-N 2.86Å; D270-V276 WeakPolarHBondContact O-CB 3.49Å; D270-S317 PolarHBondContact N-OG 3.41Å
271L76Confident80.2Confident25 Ų2537.2 Ų37.213%0.13122%0.22CC..THydrogen-bonded Turntrans-68.70.9179.8-63175000113.6F269 V277 N408 L410F269-L271 VanDerWaalsContact C-N 3.28Å; F269-L271 HydrophobicContact CB-CD2 4.01Å; F269-L271 HydrophobicContact CB-CG 4.11Å; F269-L271 PolarHBondContact O-N 2.86Å; L271-V277 WeakPolarHBondContact O-CG2 3.23Å; L271-N408 WeakPolarHBondContact CB-O 3.36Å; L271-L410 VanDerWaalsContact O-CB 3.3Å; L271-L410 WeakPolarHBondContact O-CB 3.4Å
272A77.5Confident81.2Confident56 Ų5642.5 Ų42.546%0.46324%0.243SC..THydrogen-bonded Turntrans-81.2-22.3167.200000112.1D270D270-A272 PolarHBondContact O-N 3.03Å; D270-A272 VanDerWaalsContact O-N 3.07Å; D270-A272 WeakPolarHBondContact OD1-CB 3.43Å; D270-A272 PolarHBondContact OD1-N 2.86Å
273N83Confident82.4Confident55 Ų5541.4 Ų41.429%0.29424%0.235SC..SBendtrans-83.4120.6177.7-175.6-14.9000110.7D270 A275 V276 V277D270-N273 WeakPolarHBondContact O-CB 3.38Å; D270-N273 PolarHBondContact O-N 2.86Å; N273-A275 VanDerWaalsContact C-N 3.26Å; N273-A275 PolarHBondContact O-N 2.94Å; N273-A275 WeakPolarHBondContact OD1-CB 3.2Å; N273-A275 PolarHBondContact OD1-N 3.42Å; N273-V276 HydrophobicContact CB-CB 4.17Å; N273-V276 HydrophobicContact CB-CG2 3.82Å; N273-V276 WeakPolarHBondContact O-CB 3.49Å; N273-V276 PolarHBondContact O-N 3.42Å; N273-V276 VanDerWaalsContact O-N 3.1Å; N273-V277 WeakPolarHBondContact O-CG2 3.37Å; N273-V277 PolarHBondContact O-N 3.47Å; N273-V277 VanDerWaalsContact O-N 3.09Å
274V85.4Confident83.7Confident90 Ų9041.5 Ų41.555%0.54523%0.232SC..Hα-helixtrans-56.3-39.7179.4-179.80000111.9V276 V277 E278V274-V276 VanDerWaalsContact C-N 3.33Å; V274-V276 PolarHBondContact O-N 3.48Å; V274-V277 PolarHBondContact O-N 3.15Å; V274-E278 HydrophobicContact CG1-CG 4.41Å; V274-E278 WeakPolarHBondContact O-CG 3.5Å; V274-E278 PolarHBondContact O-N 3.1Å
275A87.7Confident85.1Confident45 Ų4542.2 Ų42.237%0.37224%0.238SC..Hα-helixtrans-65.1-37.9179.600000112.2N273 C279N273-A275 VanDerWaalsContact C-N 3.26Å; N273-A275 PolarHBondContact O-N 2.94Å; N273-A275 WeakPolarHBondContact OD1-CB 3.2Å; N273-A275 PolarHBondContact OD1-N 3.42Å; A275-C279 VanDerWaalsContact O-CB 3.27Å; A275-C279 WeakPolarHBondContact O-CB 3.34Å; A275-C279 PolarHBondContact O-N 3.43Å
276V88Confident86.4Confident0 Ų043.9 Ų43.90%025%0.245CC..Hα-helixtrans-66.4-41.8176.3175.50000110.1F269 D270 N273 V274 C279 F280 C313 E316 S317F269-V276 HydrophobicContact CB-CG1 4.07Å; D270-V276 WeakPolarHBondContact O-CB 3.49Å; N273-V276 HydrophobicContact CB-CB 4.17Å; N273-V276 HydrophobicContact CB-CG2 3.82Å; N273-V276 WeakPolarHBondContact O-CB 3.49Å; N273-V276 PolarHBondContact O-N 3.42Å; N273-V276 VanDerWaalsContact O-N 3.1Å; V274-V276 VanDerWaalsContact C-N 3.33Å; V274-V276 PolarHBondContact O-N 3.48Å; V276-C279 PolarHBondContact O-N 2.97Å; V276-F280 WeakPolarHBondContact O-CB 3.38Å; V276-F280 PolarHBondContact O-N 3.07Å; V276-C313 HydrophobicContact CG1-CB 4.36Å; V276-E316 HydrophobicContact CG2-CB 3.68Å; V276-S317 WeakPolarHBondContact CG1-OG 3.46Å; V276-S317 WeakPolarHBondContact CG2-OG 3.3Å
277V86.9Confident87.5Confident7 Ų740.5 Ų40.54%0.04223%0.227CC..Hα-helixtrans-63.5-50.3176.6175.80000110.7L271 N273 V274 C279 F280 E281 H411L271-V277 WeakPolarHBondContact O-CG2 3.23Å; N273-V277 WeakPolarHBondContact O-CG2 3.37Å; N273-V277 PolarHBondContact O-N 3.47Å; N273-V277 VanDerWaalsContact O-N 3.09Å; V274-V277 PolarHBondContact O-N 3.15Å; V277-C279 PolarHBondContact O-N 2.83Å; V277-F280 CarbonylContact O-C 3.59Å; V277-F280 WeakPolarHBondContact O-CA 3.36Å; V277-F280 WeakPolarHBondContact O-CB 3.42Å; V277-F280 PolarHBondContact O-N 3.41Å; V277-E281 HydrophobicContact CG1-CG 4.15Å; V277-E281 WeakPolarHBondContact O-CG 3.25Å; V277-E281 PolarHBondContact O-N 2.89Å; V277-H411 WeakPolarHBondContact CG1-CE1 3.22Å
278E89.6Confident88.6Confident110 Ų11043.5 Ų43.551%0.51424%0.242SC..Hα-helixtrans-57.9-40.2178.6-73.9-175.8179.800111.9V274 F280 K282V274-E278 HydrophobicContact CG1-CG 4.41Å; V274-E278 WeakPolarHBondContact O-CG 3.5Å; V274-E278 PolarHBondContact O-N 3.1Å; E278-F280 VanDerWaalsContact C-N 3.35Å; E278-K282 VanDerWaalsContact O-CG 3.25Å; E278-K282 WeakPolarHBondContact O-CG 3.35Å; E278-K282 PolarHBondContact O-N 3.14Å; E278-K282 VanDerWaalsContact O-N 3.08Å
279C91.4Very high89.5Confident7 Ų744.5 Ų44.55%0.04725%0.25CC..Hα-helixtrans-65.2-40.1175.6-167.60000111.7A275 V276 V277 K282 A283 L309 C313A275-C279 VanDerWaalsContact O-CB 3.27Å; A275-C279 WeakPolarHBondContact O-CB 3.34Å; A275-C279 PolarHBondContact O-N 3.43Å; V276-C279 PolarHBondContact O-N 2.97Å; V277-C279 PolarHBondContact O-N 2.83Å; C279-K282 PolarHBondContact O-N 3.28Å; C279-A283 PolarHBondContact O-N 2.94Å; C279-L309 PolarHBondContact SG-O 3.03Å; C279-C313 VanDerWaalsContact CB-SG 3.56Å; C279-C313 PolarHBondContact SG-SG 3.49Å
280F91.5Very high90.1Very high11 Ų1144.2 Ų44.25%0.04825%0.249CC..Hα-helixtrans-67-44.3178.1176.2-102.1000112.4F269 V276 V277 E278 K282 A283 I284 C313 Y333 V334 K337F269-F280 HydrophobicContact CD2-CD2 4.02Å; F269-F280 HydrophobicContact CD2-CE2 4.28Å; F269-F280 AromaticContact CE2-CD2 3.78Å; F269-F280 HydrophobicContact CE2-CD2 3.78Å; F269-F280 AromaticContact CE2-CE2 3.94Å; F269-F280 HydrophobicContact CE2-CE2 3.94Å; V276-F280 WeakPolarHBondContact O-CB 3.38Å; V276-F280 PolarHBondContact O-N 3.07Å; V277-F280 CarbonylContact O-C 3.59Å; V277-F280 WeakPolarHBondContact O-CA 3.36Å; V277-F280 WeakPolarHBondContact O-CB 3.42Å; V277-F280 PolarHBondContact O-N 3.41Å; E278-F280 VanDerWaalsContact C-N 3.35Å; F280-K282 VanDerWaalsContact C-N 3.3Å; F280-K282 PolarHBondContact O-N 2.9Å; F280-A283 WeakPolarHBondContact O-CB 3.31Å; F280-A283 PolarHBondContact O-N 3.24Å; F280-A283 VanDerWaalsContact O-N 3.1Å; F280-I284 HydrophobicContact CD1-CD1 3.9Å; F280-I284 HydrophobicContact CE1-CD1 3.27Å; F280-I284 HydrophobicContact CE1-CG1 4.21Å; F280-I284 HydrophobicContact CE2-CD1 4.44Å; F280-I284 HydrophobicContact CZ-CD1 3.57Å; F280-I284 HydrophobicContact CZ-CG1 4.16Å; F280-I284 PolarHBondContact O-N 3.08Å; F280-C313 PolarHBondContact N-SG 3.27Å; F280-C313 VanDerWaalsContact N-SG 3.39Å; F280-Y333 HydrophobicContact CE1-CE1 4.4Å; F280-Y333 AromaticContact CE2-CD1 3.69Å; F280-Y333 HydrophobicContact CE2-CD1 3.69Å; F280-Y333 AromaticContact CE2-CE1 3.65Å; F280-Y333 HydrophobicContact CE2-CE1 3.65Å; F280-Y333 AromaticContact CZ-CD1 3.87Å; F280-Y333 HydrophobicContact CZ-CD1 3.87Å; F280-Y333 AromaticContact CZ-CE1 3.47Å; F280-Y333 HydrophobicContact CZ-CE1 3.47Å; F280-Y333 VanDerWaalsContact CZ-CE1 3.47Å; F280-V334 HydrophobicContact CD2-CG2 4.1Å; F280-V334 HydrophobicContact CE2-CG2 3.6Å; F280-K337 HydrophobicContact CZ-CB 4.05Å; F280-K337 HydrophobicContact CZ-CG 3.94Å
281E92.3Very high90.7Very high89 Ų8943 Ų4342%0.41624%0.243SC..Hα-helixtrans-64-35.6175.5-67.9-62.4151.700111.8V277 I284 S285V277-E281 HydrophobicContact CG1-CG 4.15Å; V277-E281 WeakPolarHBondContact O-CG 3.25Å; V277-E281 PolarHBondContact O-N 2.89Å; E281-I284 PolarHBondContact O-N 2.89Å; E281-S285 WeakPolarHBondContact O-CB 3.3Å; E281-S285 PolarHBondContact O-N 3.43Å; E281-S285 PolarHBondContact O-OG 3.49Å
282K95.4Very high91.5Very high116 Ų11646 Ų4650%0.50427%0.265SS..Hα-helixtrans-63.8-41.7170.6-72.9168.8-175.4168.30111.5E278 C279 F280 I284 S285 E286 L309E278-K282 VanDerWaalsContact O-CG 3.25Å; E278-K282 WeakPolarHBondContact O-CG 3.35Å; E278-K282 PolarHBondContact O-N 3.14Å; E278-K282 VanDerWaalsContact O-N 3.08Å; C279-K282 PolarHBondContact O-N 3.28Å; F280-K282 VanDerWaalsContact C-N 3.3Å; F280-K282 PolarHBondContact O-N 2.9Å; K282-I284 VanDerWaalsContact C-N 3.34Å; K282-I284 PolarHBondContact O-N 3.27Å; K282-S285 WeakPolarHBondContact O-CB 3.43Å; K282-S285 PolarHBondContact O-N 3.09Å; K282-S285 VanDerWaalsContact O-N 3.15Å; K282-E286 WeakPolarHBondContact O-CG 3.28Å; K282-E286 PolarHBondContact O-N 2.94Å; K282-L309 HydrophobicContact CB-CD1 3.79Å; K282-L309 HydrophobicContact CB-CD2 4.25Å
283A95.6Very high92.3Very high0 Ų045.8 Ų45.80%025%0.254CS..Hα-helixtrans-62.5-4217700000111.6C279 F280 S285 E286 I287 C306 L309 I310C279-A283 PolarHBondContact O-N 2.94Å; F280-A283 WeakPolarHBondContact O-CB 3.31Å; F280-A283 PolarHBondContact O-N 3.24Å; F280-A283 VanDerWaalsContact O-N 3.1Å; A283-S285 VanDerWaalsContact C-N 3.33Å; A283-S285 PolarHBondContact O-N 3.21Å; A283-E286 PolarHBondContact O-N 2.91Å; A283-I287 PolarHBondContact O-N 3.4Å; A283-I287 VanDerWaalsContact O-N 3.11Å; A283-C306 PolarHBondContact O-SG 3.48Å; A283-C306 VanDerWaalsContact O-SG 3.33Å; A283-L309 HydrophobicContact CB-CB 3.8Å; A283-L309 HydrophobicContact CB-CD1 4.38Å; A283-I310 HydrophobicContact CB-CG1 4.35Å
284I94.8Very high92.7Very high19 Ų1945.5 Ų45.510%0.09725%0.249CC..Hα-helixtrans-58.6-45.8172.1-72.2173.6000110.9F280 E281 K282 E286 I287 I288 V334 K337 A338F280-I284 HydrophobicContact CD1-CD1 3.9Å; F280-I284 HydrophobicContact CE1-CD1 3.27Å; F280-I284 HydrophobicContact CE1-CG1 4.21Å; F280-I284 HydrophobicContact CE2-CD1 4.44Å; F280-I284 HydrophobicContact CZ-CD1 3.57Å; F280-I284 HydrophobicContact CZ-CG1 4.16Å; F280-I284 PolarHBondContact O-N 3.08Å; E281-I284 PolarHBondContact O-N 2.89Å; K282-I284 VanDerWaalsContact C-N 3.34Å; K282-I284 PolarHBondContact O-N 3.27Å; I284-E286 VanDerWaalsContact C-N 3.33Å; I284-E286 PolarHBondContact O-N 3.24Å; I284-I287 VanDerWaalsContact O-CG2 3.27Å; I284-I287 WeakPolarHBondContact O-CG2 3.39Å; I284-I287 PolarHBondContact O-N 3.35Å; I284-I288 HydrophobicContact CG2-CD1 3.71Å; I284-I288 VanDerWaalsContact O-CG1 3.28Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 3.19Å; I284-I288 VanDerWaalsContact O-N 3.14Å; I284-V334 HydrophobicContact CG1-CG1 4.36Å; I284-K337 HydrophobicContact CD1-CB 4.05Å; I284-A338 HydrophobicContact CB-CB 4.35Å; I284-A338 HydrophobicContact CG1-CB 4.25Å; I284-A338 HydrophobicContact CG2-CB 3.83Å
285S96.1Very high93Very high72 Ų7241.3 Ų41.350%0.50322%0.224SC..Hα-helixtrans-62.2-40.4-179.5-59.70000112E281 K282 A283 I288 A289E281-S285 WeakPolarHBondContact O-CB 3.3Å; E281-S285 PolarHBondContact O-N 3.43Å; E281-S285 PolarHBondContact O-OG 3.49Å; K282-S285 WeakPolarHBondContact O-CB 3.43Å; K282-S285 PolarHBondContact O-N 3.09Å; K282-S285 VanDerWaalsContact O-N 3.15Å; A283-S285 VanDerWaalsContact C-N 3.33Å; A283-S285 PolarHBondContact O-N 3.21Å; S285-I288 PolarHBondContact O-N 3.4Å; S285-A289 VanDerWaalsContact O-CB 3.3Å; S285-A289 WeakPolarHBondContact O-CB 3.38Å; S285-A289 PolarHBondContact O-N 2.81Å
286E96.9Very high93.3Very high56 Ų5639.1 Ų39.126%0.26221%0.206SC..Hα-helixtrans-65-48.2177.1-73.5-70.1174.800112.4K282 A283 I284 I288 A289 T290 S302 S305 C306 L309K282-E286 WeakPolarHBondContact O-CG 3.28Å; K282-E286 PolarHBondContact O-N 2.94Å; A283-E286 PolarHBondContact O-N 2.91Å; I284-E286 VanDerWaalsContact C-N 3.33Å; I284-E286 PolarHBondContact O-N 3.24Å; E286-I288 PolarHBondContact O-N 3.25Å; E286-A289 WeakPolarHBondContact O-CB 3.45Å; E286-A289 PolarHBondContact O-N 2.88Å; E286-T290 PolarHBondContact O-N 3.45Å; E286-T290 VanDerWaalsContact O-N 3.11Å; E286-T290 PolarHBondContact O-OG1 3.48Å; E286-S302 PolarHBondContact O-OG 2.92Å; E286-S302 PolarHBondContact OE2-OG 3.4Å; E286-S305 VanDerWaalsContact CD-OG 3.25Å; E286-S305 PolarHBondContact OE1-OG 3.42Å; E286-S305 VanDerWaalsContact OE1-OG 3.08Å; E286-C306 HydrophobicContact CB-CB 3.77Å; E286-L309 HydrophobicContact CG-CD1 3.84Å
287I96.5Very high93.5Very high1 Ų143 Ų431%0.00522%0.223CC..Hα-helixtrans-64.2-31.1179.6-164.765.1000112A283 I284 T290 L303 V334 A338 P340 L371A283-I287 PolarHBondContact O-N 3.4Å; A283-I287 VanDerWaalsContact O-N 3.11Å; I284-I287 VanDerWaalsContact O-CG2 3.27Å; I284-I287 WeakPolarHBondContact O-CG2 3.39Å; I284-I287 PolarHBondContact O-N 3.35Å; I287-T290 WeakPolarHBondContact O-CB 3.33Å; I287-T290 PolarHBondContact O-OG1 3.14Å; I287-L303 HydrophobicContact CD1-CD1 3.85Å; I287-V334 HydrophobicContact CG2-CG1 4.23Å; I287-A338 HydrophobicContact CG2-CB 3.44Å; I287-A338 VanDerWaalsContact CG2-CB 3.44Å; I287-P340 HydrophobicContact CG1-CB 4.26Å; I287-P340 HydrophobicContact CG1-CG 4.15Å; I287-L371 HydrophobicContact CD1-CD1 4.33Å
288I96.6Very high93.8Very high69 Ų6946.4 Ų46.435%0.35424%0.238SC..Hα-helixtrans-70.4-41.8172.2-66.8169.6000110.8I284 S285 E286 T290 N291 A338I284-I288 HydrophobicContact CG2-CD1 3.71Å; I284-I288 VanDerWaalsContact O-CG1 3.28Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 3.19Å; I284-I288 VanDerWaalsContact O-N 3.14Å; S285-I288 PolarHBondContact O-N 3.4Å; E286-I288 PolarHBondContact O-N 3.25Å; I288-T290 PolarHBondContact O-N 3.5Å; I288-T290 VanDerWaalsContact O-N 3.16Å; I288-N291 PolarHBondContact O-N 2.81Å; I288-A338 HydrophobicContact CD1-CB 4.39Å; I288-A338 HydrophobicContact CG1-CB 4.24Å
289A95.4Very high94.1Very high29 Ų2941.1 Ų41.124%0.2421%0.214CC..Hα-helixtrans-61.2-22.7178.800000113.1S285 E286 N291 S292 H293S285-A289 VanDerWaalsContact O-CB 3.3Å; S285-A289 WeakPolarHBondContact O-CB 3.38Å; S285-A289 PolarHBondContact O-N 2.81Å; E286-A289 WeakPolarHBondContact O-CB 3.45Å; E286-A289 PolarHBondContact O-N 2.88Å; A289-N291 PolarHBondContact O-N 3.36Å; A289-N291 VanDerWaalsContact O-N 3.08Å; A289-S292 WeakPolarHBondContact O-CB 3.27Å; A289-S292 PolarHBondContact O-N 3.21Å; A289-S292 PolarHBondContact O-OG 3.46Å; A289-H293 PolarHBondContact O-CD2 3.27Å
290T94.9Very high94.3Very high4 Ų440.9 Ų40.93%0.02521%0.212CC..G310 helixtrans-49.5-37.9174-630000112.5E286 I287 I288 S292 K299 N346E286-T290 PolarHBondContact O-N 3.45Å; E286-T290 VanDerWaalsContact O-N 3.11Å; E286-T290 PolarHBondContact O-OG1 3.48Å; I287-T290 WeakPolarHBondContact O-CB 3.33Å; I287-T290 PolarHBondContact O-OG1 3.14Å; I288-T290 PolarHBondContact O-N 3.5Å; I288-T290 VanDerWaalsContact O-N 3.16Å; T290-S292 VanDerWaalsContact C-N 3.33Å; T290-S292 PolarHBondContact O-N 2.99Å; T290-K299 HydrophobicContact CG2-CB 4.09Å; T290-K299 HydrophobicContact CG2-CG 4.34Å; T290-K299 WeakPolarHBondContact O-CG 3.42Å; T290-K299 PolarHBondContact O-NZ 3.15Å; T290-N346 HydrophobicContact CG2-CB 4.49Å
291N93.5Very high94.5Very high43 Ų4343 Ų4323%0.2323%0.232CC..G310 helixtrans-71-26.6178.7-169.354.2000113.4I288 A289 H293 P341 N346I288-N291 PolarHBondContact O-N 2.81Å; A289-N291 PolarHBondContact O-N 3.36Å; A289-N291 VanDerWaalsContact O-N 3.08Å; N291-H293 VanDerWaalsContact C-N 3.3Å; N291-H293 PolarHBondContact O-N 2.9Å; N291-P341 HydrophobicContact CB-CG 3.96Å; N291-N346 PolarHBondContact OD1-ND2 3.39Å
292S92.8Very high94.6Very high87 Ų8739 Ų3961%0.60821%0.213SC*.G310 helixtrans-71.9-23-178.774.50000113.6A289 T290A289-S292 WeakPolarHBondContact O-CB 3.27Å; A289-S292 PolarHBondContact O-N 3.21Å; A289-S292 PolarHBondContact O-OG 3.46Å; T290-S292 VanDerWaalsContact C-N 3.33Å; T290-S292 PolarHBondContact O-N 2.99Å
293H93.3Very high94.7Very high51 Ų5133.6 Ų33.624%0.23619%0.19CC..  trans-81.9149.3-177.1-61.4-44.4000112.5A289 N291 Q298 K299A289-H293 PolarHBondContact O-CD2 3.27Å; N291-H293 VanDerWaalsContact C-N 3.3Å; N291-H293 PolarHBondContact O-N 2.9Å; H293-Q298 HydrophobicContact CB-CB 3.64Å; H293-Q298 PolarHBondContact CD2-O 2.91Å; H293-K299 HydrophobicContact CB-CG 3.84Å; H293-K299 WeakPolarHBondContact O-CE 3.45Å; H293-K299 PolarHBondContact O-NZ 3.43Å
294R91.4Very high94.7Very high50 Ų5034.3 Ų34.319%0.18919%0.194CC..  trans-104.8-26.3178.7-62.4-167.8-168.6-132.52.8114.5E139 F230 Y233 F349E139-R294 IonicContact OE2-CZ 3.6Å; E139-R294 IonicContact OE2-NE 2.75Å; E139-R294 PolarHBondContact OE2-NE 2.97Å; E139-R294 IonicContact OE2-NH2 3.54Å; E139-R294 PolarHBondContact OE2-NH2 3.44Å; F230-R294 HydrophobicContact CD1-CB 4.21Å; F230-R294 HydrophobicContact CD2-CB 4.08Å; F230-R294 HydrophobicContact CE1-CB 4.06Å; F230-R294 HydrophobicContact CE1-CG 4.42Å; F230-R294 HydrophobicContact CE2-CB 3.95Å; F230-R294 HydrophobicContact CG-CB 4.22Å; F230-R294 HydrophobicContact CZ-CB 3.93Å; Y233-R294 HydrophobicContact CD1-CG 3.96Å; Y233-R294 HydrophobicContact CD2-CB 3.72Å; Y233-R294 HydrophobicContact CD2-CG 4.01Å; Y233-R294 WeakPolarHBondContact CD2-O 3.34Å; Y233-R294 HydrophobicContact CE1-CG 4.15Å; Y233-R294 HydrophobicContact CE2-CB 4.07Å; Y233-R294 HydrophobicContact CE2-CG 4.24Å; Y233-R294 HydrophobicContact CG-CB 4Å; Y233-R294 HydrophobicContact CG-CG 3.88Å; R294-F349 WeakPolarHBondContact O-CZ 3.47Å
295S91.8Very high94.8Very high1 Ų135.3 Ų35.31%0.00720%0.203CC..SBendtrans-91143.7175.766.30000111.7K297 Q298 K299S295-K297 PolarHBondContact O-N 3.17Å; S295-Q298 PolarHBondContact O-N 3.3Å; S295-Q298 WeakPolarHBondContact OG-CB 3.41Å; S295-Q298 VanDerWaalsContact OG-CG 3.29Å; S295-Q298 WeakPolarHBondContact OG-CG 3.3Å; S295-Q298 PolarHBondContact OG-N 2.89Å; S295-Q298 PolarHBondContact OG-OE1 3.34Å; S295-K299 WeakPolarHBondContact O-CG 2.99Å; S295-K299 PolarHBondContact O-N 3.46Å
296P93.6Very high94.8Very high0 Ų031.9 Ų31.90%018%0.179CC..Hα-helixtrans-55.9-35.5171.6-23.732.2000112.5E225 C229 K299 L300 F349 F353 A354E225-P296 HydrophobicContact CG-CG 4.27Å; C229-P296 WeakPolarHBondContact SG-CD 3.46Å; P296-K299 PolarHBondContact O-N 2.9Å; P296-L300 WeakPolarHBondContact O-CB 3.44Å; P296-L300 WeakPolarHBondContact O-CG 3.38Å; P296-L300 PolarHBondContact O-N 3.41Å; P296-F349 HydrophobicContact CG-CD1 4.38Å; P296-F349 HydrophobicContact CG-CE1 3.77Å; P296-F349 HydrophobicContact CG-CZ 4.49Å; P296-F353 HydrophobicContact CG-CB 4.21Å; P296-A354 HydrophobicContact CB-CB 3.69Å; P296-A354 HydrophobicContact CG-CB 4.42Å
297K92.9Very high94.7Very high81 Ų8129.2 Ų29.235%0.35217%0.167SC..Hα-helixtrans-54.3-53173.2-174.6175.1176.2171.80112.4E222 S295 L300 A301 R358E222-K297 IonicContact OE2-NZ 2.68Å; E222-K297 PolarHBondContact OE2-NZ 2.84Å; S295-K297 PolarHBondContact O-N 3.17Å; K297-L300 PolarHBondContact O-N 3.09Å; K297-A301 WeakPolarHBondContact O-CB 3.17Å; K297-A301 PolarHBondContact O-N 2.98Å; K297-R358 VanDerWaalsContact CA-NH1 3.35Å; K297-R358 VanDerWaalsContact CB-NH1 3.32Å
298Q94.4Very high94.7Very high78 Ų7832.4 Ų32.436%0.36418%0.184SC..Hα-helixtrans-67.8-39.5-178.6-74.7173.1-24.600111.6H293 S295 L300 A301 S302H293-Q298 HydrophobicContact CB-CB 3.64Å; H293-Q298 PolarHBondContact CD2-O 2.91Å; S295-Q298 PolarHBondContact O-N 3.3Å; S295-Q298 WeakPolarHBondContact OG-CB 3.41Å; S295-Q298 VanDerWaalsContact OG-CG 3.29Å; S295-Q298 WeakPolarHBondContact OG-CG 3.3Å; S295-Q298 PolarHBondContact OG-N 2.89Å; S295-Q298 PolarHBondContact OG-OE1 3.34Å; Q298-L300 PolarHBondContact O-N 2.87Å; Q298-A301 PolarHBondContact O-N 3.27Å; Q298-S302 PolarHBondContact O-N 3.39Å
299K95.1Very high94.6Very high0 Ų030.1 Ų30.10%017%0.172CC..Hα-helixtrans-59-46.5174.4-67.4-174.1-179.4-67.40111.9T290 H293 S295 P296 S302 L303 N346 F349 I350T290-K299 HydrophobicContact CG2-CB 4.09Å; T290-K299 HydrophobicContact CG2-CG 4.34Å; T290-K299 WeakPolarHBondContact O-CG 3.42Å; T290-K299 PolarHBondContact O-NZ 3.15Å; H293-K299 HydrophobicContact CB-CG 3.84Å; H293-K299 WeakPolarHBondContact O-CE 3.45Å; H293-K299 PolarHBondContact O-NZ 3.43Å; S295-K299 WeakPolarHBondContact O-CG 2.99Å; S295-K299 PolarHBondContact O-N 3.46Å; P296-K299 PolarHBondContact O-N 2.9Å; K299-S302 PolarHBondContact O-N 2.97Å; K299-L303 PolarHBondContact O-N 3.01Å; K299-N346 WeakPolarHBondContact CE-OD1 3.41Å; K299-N346 PolarHBondContact NZ-OD1 3.1Å; K299-F349 HydrophobicContact CD-CD1 3.93Å; K299-F349 HydrophobicContact CD-CE1 4.28Å; K299-I350 HydrophobicContact CB-CD1 3.84Å; K299-I350 HydrophobicContact CB-CG1 4.08Å; K299-I350 HydrophobicContact CD-CD1 4.39Å; K299-I350 HydrophobicContact CD-CG1 4.12Å
300L95Very high94.5Very high2 Ų228.8 Ų28.81%0.0116%0.161CC..Hα-helixtrans-66.8-36.5176.1-74.7170.6000112.3P296 K297 Q298 L303 T304 I350 R358 L359 F368P296-L300 WeakPolarHBondContact O-CB 3.44Å; P296-L300 WeakPolarHBondContact O-CG 3.38Å; P296-L300 PolarHBondContact O-N 3.41Å; K297-L300 PolarHBondContact O-N 3.09Å; Q298-L300 PolarHBondContact O-N 2.87Å; L300-L303 HydrophobicContact CD2-CD2 4.48Å; L300-L303 PolarHBondContact O-N 2.87Å; L300-T304 WeakPolarHBondContact O-CB 3.39Å; L300-T304 PolarHBondContact O-N 2.85Å; L300-T304 PolarHBondContact O-OG1 3.16Å; L300-T304 VanDerWaalsContact O-OG1 3.11Å; L300-I350 HydrophobicContact CD1-CG2 4.16Å; L300-I350 HydrophobicContact CD2-CD1 4.46Å; L300-I350 HydrophobicContact CD2-CG2 3.93Å; L300-I350 HydrophobicContact CG-CG2 4.03Å; L300-R358 HydrophobicContact CD1-CG 4.1Å; L300-L359 HydrophobicContact CD1-CD2 3.91Å; L300-L359 HydrophobicContact CD2-CD2 4.08Å; L300-F368 HydrophobicContact CD2-CB 3.95Å; L300-F368 HydrophobicContact CD2-CD2 3.98Å; L300-F368 HydrophobicContact CD2-CG 4.16Å
301A95.1Very high94.4Very high56 Ų5630.4 Ų30.446%0.46317%0.167SC..Hα-helixtrans-63.5-42.7176.700000111.9K297 Q298 T304 S305K297-A301 WeakPolarHBondContact O-CB 3.17Å; K297-A301 PolarHBondContact O-N 2.98Å; Q298-A301 PolarHBondContact O-N 3.27Å; A301-T304 PolarHBondContact O-N 3.19Å; A301-S305 WeakPolarHBondContact O-CB 3.17Å; A301-S305 PolarHBondContact O-N 2.95Å
302S96.2Very high94.4Very high4 Ų432.8 Ų32.83%0.02818%0.177CC..Hα-helixtrans-66-39.2175.1-173.60000111.8E286 Q298 K299 T304 S305 C306E286-S302 PolarHBondContact O-OG 2.92Å; E286-S302 PolarHBondContact OE2-OG 3.4Å; Q298-S302 PolarHBondContact O-N 3.39Å; K299-S302 PolarHBondContact O-N 2.97Å; S302-T304 PolarHBondContact O-N 2.93Å; S302-S305 WeakPolarHBondContact O-CB 3.42Å; S302-S305 PolarHBondContact O-N 3.4Å; S302-C306 PolarHBondContact O-N 3.32Å
303L96.3Very high94.3Very high2 Ų228.7 Ų28.71%0.0115%0.148CC..Hα-helixtrans-60-45.9170.9178.359.7000112.2I287 K299 L300 S305 C306 C307 F368 L371I287-L303 HydrophobicContact CD1-CD1 3.85Å; K299-L303 PolarHBondContact O-N 3.01Å; L300-L303 HydrophobicContact CD2-CD2 4.48Å; L300-L303 PolarHBondContact O-N 2.87Å; L303-S305 VanDerWaalsContact C-N 3.33Å; L303-S305 PolarHBondContact O-N 3.4Å; L303-C306 WeakPolarHBondContact O-CB 3.44Å; L303-C306 PolarHBondContact O-N 3.19Å; L303-C307 PolarHBondContact O-N 2.64Å; L303-C307 PolarHBondContact O-SG 3.11Å; L303-F368 HydrophobicContact CD2-CB 4.18Å; L303-F368 HydrophobicContact CD2-CD2 4.27Å; L303-L371 HydrophobicContact CD1-CB 4.33Å; L303-L371 HydrophobicContact CD1-CD2 3.9Å; L303-L371 HydrophobicContact CD2-CB 4.26Å; L303-L371 HydrophobicContact CD2-CD2 3.85Å
304T95.7Very high94.1Very high15 Ų1526.3 Ų26.39%0.09214%0.138CC..Hα-helixtrans-61.5-42176.1-65.80000111.5L300 A301 S302 C307 N308 E363 Y367L300-T304 WeakPolarHBondContact O-CB 3.39Å; L300-T304 PolarHBondContact O-N 2.85Å; L300-T304 PolarHBondContact O-OG1 3.16Å; L300-T304 VanDerWaalsContact O-OG1 3.11Å; A301-T304 PolarHBondContact O-N 3.19Å; S302-T304 PolarHBondContact O-N 2.93Å; T304-C307 PolarHBondContact O-N 2.84Å; T304-N308 WeakPolarHBondContact CG2-ND2 3.31Å; T304-N308 WeakPolarHBondContact O-CB 3.41Å; T304-N308 VanDerWaalsContact O-CG 3.24Å; T304-N308 PolarHBondContact O-N 3.33Å; T304-N308 PolarHBondContact O-ND2 2.99Å; T304-E363 HydrophobicContact CG2-CG 4.27Å; T304-Y367 HydrophobicContact CG2-CD2 4.1Å; T304-Y367 HydrophobicContact CG2-CE2 3.92Å
305S96.5Very high94Very high41 Ų4129.5 Ų29.529%0.28715%0.153SC..Hα-helixtrans-57.5-49.7173.7-169.40000111E286 A301 S302 L303 C307 N308 L309E286-S305 VanDerWaalsContact CD-OG 3.25Å; E286-S305 PolarHBondContact OE1-OG 3.42Å; E286-S305 VanDerWaalsContact OE1-OG 3.08Å; A301-S305 WeakPolarHBondContact O-CB 3.17Å; A301-S305 PolarHBondContact O-N 2.95Å; S302-S305 WeakPolarHBondContact O-CB 3.42Å; S302-S305 PolarHBondContact O-N 3.4Å; L303-S305 VanDerWaalsContact C-N 3.33Å; L303-S305 PolarHBondContact O-N 3.4Å; S305-C307 PolarHBondContact O-N 3.45Å; S305-N308 PolarHBondContact O-N 3.11Å; S305-L309 VanDerWaalsContact O-CG 3.32Å; S305-L309 WeakPolarHBondContact O-CG 3.4Å; S305-L309 PolarHBondContact O-N 3.42Å
306C96.9Very high93.8Very high0 Ų033.7 Ų33.70%017%0.172CC..Hα-helixtrans-55.3-50.2174.71770000112.1A283 E286 S302 L303 N308 L309 I310A283-C306 PolarHBondContact O-SG 3.48Å; A283-C306 VanDerWaalsContact O-SG 3.33Å; E286-C306 HydrophobicContact CB-CB 3.77Å; S302-C306 PolarHBondContact O-N 3.32Å; L303-C306 WeakPolarHBondContact O-CB 3.44Å; L303-C306 PolarHBondContact O-N 3.19Å; C306-N308 VanDerWaalsContact C-N 3.35Å; C306-N308 PolarHBondContact O-N 2.99Å; C306-L309 PolarHBondContact O-N 3.49Å; C306-I310 WeakPolarHBondContact O-CG1 3.5Å; C306-I310 PolarHBondContact O-N 2.95Å
307C95.5Very high93.4Very high0 Ų035 Ų350%018%0.181CC..Hα-helixtrans-65.8-37.2-178.3-65.40000112.4L303 T304 S305 I310 F311 F327 Y367L303-C307 PolarHBondContact O-N 2.64Å; L303-C307 PolarHBondContact O-SG 3.11Å; T304-C307 PolarHBondContact O-N 2.84Å; S305-C307 PolarHBondContact O-N 3.45Å; C307-I310 WeakPolarHBondContact O-CB 3.47Å; C307-I310 PolarHBondContact O-N 3.42Å; C307-F311 WeakPolarHBondContact O-CD2 3.22Å; C307-F311 PolarHBondContact O-N 3.36Å; C307-F311 VanDerWaalsContact O-N 3.1Å; C307-F327 HydrophobicContact CB-CE2 3.99Å; C307-F327 HydrophobicContact CB-CZ 3.9Å; C307-Y367 HydrophobicContact CB-CD1 3.58Å; C307-Y367 HydrophobicContact CB-CD2 3.85Å; C307-Y367 HydrophobicContact CB-CE1 3.8Å; C307-Y367 HydrophobicContact CB-CE2 4Å; C307-Y367 HydrophobicContact CB-CG 3.63Å
308N95Very high92.9Very high67 Ų6736.3 Ų36.336%0.35818%0.184SC..Hα-helixtrans-65.9-38.5174.8-72.2-25.2000112.1T304 S305 C306 I310 F311 Q312 Y367T304-N308 WeakPolarHBondContact CG2-ND2 3.31Å; T304-N308 WeakPolarHBondContact O-CB 3.41Å; T304-N308 VanDerWaalsContact O-CG 3.24Å; T304-N308 PolarHBondContact O-N 3.33Å; T304-N308 PolarHBondContact O-ND2 2.99Å; S305-N308 PolarHBondContact O-N 3.11Å; C306-N308 VanDerWaalsContact C-N 3.35Å; C306-N308 PolarHBondContact O-N 2.99Å; N308-I310 VanDerWaalsContact C-N 3.3Å; N308-I310 PolarHBondContact O-N 3.4Å; N308-F311 PolarHBondContact O-N 2.95Å; N308-Q312 PolarHBondContact O-N 3.43Å; N308-Y367 PolarHBondContact OD1-OH 3.43Å
309L95.3Very high92.3Very high22 Ų2235.6 Ų35.612%0.11520%0.198CC..Hα-helixtrans-63.9-35.1172.8-70.4164.6000111.9C279 K282 A283 E286 S305 C306 Q312 C313C279-L309 PolarHBondContact SG-O 3.03Å; K282-L309 HydrophobicContact CB-CD1 3.79Å; K282-L309 HydrophobicContact CB-CD2 4.25Å; A283-L309 HydrophobicContact CB-CB 3.8Å; A283-L309 HydrophobicContact CB-CD1 4.38Å; E286-L309 HydrophobicContact CG-CD1 3.84Å; S305-L309 VanDerWaalsContact O-CG 3.32Å; S305-L309 WeakPolarHBondContact O-CG 3.4Å; S305-L309 PolarHBondContact O-N 3.42Å; C306-L309 PolarHBondContact O-N 3.49Å; L309-Q312 WeakPolarHBondContact O-CB 3.39Å; L309-Q312 PolarHBondContact O-N 2.82Å; L309-C313 PolarHBondContact O-N 3.24Å; L309-C313 PolarHBondContact O-SG 2.86Å
310I93.7Very high91.7Very high0 Ų039.6 Ų39.60%022%0.222CC..Hα-helixtrans-62.3-45.7172.5-69167.8000111.2F269 A283 C306 C307 N308 Q312 C313 H314 F327 A330 L331 V334F269-I310 HydrophobicContact CZ-CG2 4.17Å; A283-I310 HydrophobicContact CB-CG1 4.35Å; C306-I310 WeakPolarHBondContact O-CG1 3.5Å; C306-I310 PolarHBondContact O-N 2.95Å; C307-I310 WeakPolarHBondContact O-CB 3.47Å; C307-I310 PolarHBondContact O-N 3.42Å; N308-I310 VanDerWaalsContact C-N 3.3Å; N308-I310 PolarHBondContact O-N 3.4Å; I310-Q312 VanDerWaalsContact C-N 3.27Å; I310-Q312 PolarHBondContact O-N 3.46Å; I310-C313 WeakPolarHBondContact O-CB 3.42Å; I310-C313 PolarHBondContact O-N 2.79Å; I310-H314 PolarHBondContact O-CD2 2.99Å; I310-H314 PolarHBondContact O-N 2.77Å; I310-H314 VanDerWaalsContact O-N 3.08Å; I310-F327 HydrophobicContact CB-CE2 4.33Å; I310-F327 HydrophobicContact CD1-CE2 4.42Å; I310-F327 HydrophobicContact CG2-CD2 3.87Å; I310-F327 HydrophobicContact CG2-CE2 4.04Å; I310-A330 HydrophobicContact CG2-CB 3.8Å; I310-L331 HydrophobicContact CD1-CB 4.33Å; I310-L331 HydrophobicContact CD1-CD1 3.77Å; I310-V334 HydrophobicContact CD1-CB 4.26Å; I310-V334 HydrophobicContact CD1-CG2 3.85Å; I310-V334 HydrophobicContact CG1-CG2 3.9Å
311F93Very high91Very high38 Ų3845.8 Ų45.817%0.16726%0.255CS..Hα-helixtrans-62.8-36.6174.8-73.1-67.3000112.3C307 N308 H314 K315 A322 F327 Y367C307-F311 WeakPolarHBondContact O-CD2 3.22Å; C307-F311 PolarHBondContact O-N 3.36Å; C307-F311 VanDerWaalsContact O-N 3.1Å; N308-F311 PolarHBondContact O-N 2.95Å; F311-H314 PolarHBondContact O-N 3.02Å; F311-K315 WeakPolarHBondContact O-CB 3.45Å; F311-K315 PolarHBondContact O-N 3Å; F311-A322 HydrophobicContact CD1-CB 3.83Å; F311-A322 HydrophobicContact CE1-CB 3.99Å; F311-F327 HydrophobicContact CD2-CD2 4.46Å; F311-F327 HydrophobicContact CD2-CE2 4.44Å; F311-F327 HydrophobicContact CE1-CB 4.14Å; F311-F327 AromaticContact CE1-CD2 3.9Å; F311-F327 HydrophobicContact CE1-CD2 3.9Å; F311-F327 HydrophobicContact CE1-CG 4.19Å; F311-F327 AromaticContact CE2-CD2 3.79Å; F311-F327 HydrophobicContact CE2-CD2 3.79Å; F311-F327 AromaticContact CE2-CE2 3.78Å; F311-F327 HydrophobicContact CE2-CE2 3.78Å; F311-F327 HydrophobicContact CE2-CG 4.46Å; F311-F327 HydrophobicContact CE2-CZ 4.44Å; F311-F327 HydrophobicContact CZ-CB 4.18Å; F311-F327 HydrophobicContact CZ-CD1 4.45Å; F311-F327 AromaticContact CZ-CD2 3.47Å; F311-F327 HydrophobicContact CZ-CD2 3.47Å; F311-F327 VanDerWaalsContact CZ-CD2 3.47Å; F311-F327 AromaticContact CZ-CE2 3.92Å; F311-F327 HydrophobicContact CZ-CE2 3.92Å; F311-F327 AromaticContact CZ-CG 3.77Å; F311-F327 HydrophobicContact CZ-CG 3.77Å; F311-Y367 AromaticContact CE2-CE1 3.7Å; F311-Y367 HydrophobicContact CE2-CE1 3.7Å; F311-Y367 AromaticContact CE2-CZ 3.99Å; F311-Y367 HydrophobicContact CZ-CE1 4.42Å
312Q92Very high90.3Very high94 Ų9443.9 Ų43.944%0.43924%0.238SC..Hα-helixtrans-64.5-43.1174-175.5174.21.900111.4N308 L309 I310 H314 K315 E316N308-Q312 PolarHBondContact O-N 3.43Å; L309-Q312 WeakPolarHBondContact O-CB 3.39Å; L309-Q312 PolarHBondContact O-N 2.82Å; I310-Q312 VanDerWaalsContact C-N 3.27Å; I310-Q312 PolarHBondContact O-N 3.46Å; Q312-H314 VanDerWaalsContact C-N 3.29Å; Q312-H314 PolarHBondContact O-N 3.42Å; Q312-K315 PolarHBondContact O-N 3.41Å; Q312-K315 VanDerWaalsContact O-N 3.13Å; Q312-E316 HydrophobicContact CG-CG 4.39Å; Q312-E316 WeakPolarHBondContact O-CG 3.44Å; Q312-E316 PolarHBondContact O-N 3.39Å
313C91.3Very high89.8Confident0 Ų046.1 Ų46.10%025%0.254CS..Hα-helixtrans-55.8-43.7173.6-70.50000111.8F269 V276 C279 F280 L309 I310 S317F269-C313 HydrophobicContact CD1-CB 3.73Å; F269-C313 HydrophobicContact CE1-CB 3.53Å; F269-C313 HydrophobicContact CG-CB 4.49Å; F269-C313 HydrophobicContact CZ-CB 4.13Å; V276-C313 HydrophobicContact CG1-CB 4.36Å; C279-C313 VanDerWaalsContact CB-SG 3.56Å; C279-C313 PolarHBondContact SG-SG 3.49Å; F280-C313 PolarHBondContact N-SG 3.27Å; F280-C313 VanDerWaalsContact N-SG 3.39Å; L309-C313 PolarHBondContact O-N 3.24Å; L309-C313 PolarHBondContact O-SG 2.86Å; I310-C313 WeakPolarHBondContact O-CB 3.42Å; I310-C313 PolarHBondContact O-N 2.79Å; C313-S317 WeakPolarHBondContact O-CB 3.39Å; C313-S317 PolarHBondContact O-N 3.44Å; C313-S317 PolarHBondContact O-OG 3.34Å
314H89.2Confident89.2Confident2 Ų248.6 Ų48.61%0.00928%0.275CS..Hα-helixtrans-64-44.5175.7-83.5-74.1000112.7P267 F269 I310 F311 Q312 E316 S317 R318 A322 A330P267-H314 PolarHBondContact O-CE1 3.26Å; F269-H314 AromaticContact CE1-CD2 3.71Å; F269-H314 AromaticContact CE1-NE2 3.7Å; I310-H314 PolarHBondContact O-CD2 2.99Å; I310-H314 PolarHBondContact O-N 2.77Å; I310-H314 VanDerWaalsContact O-N 3.08Å; F311-H314 PolarHBondContact O-N 3.02Å; Q312-H314 VanDerWaalsContact C-N 3.29Å; Q312-H314 PolarHBondContact O-N 3.42Å; H314-E316 VanDerWaalsContact C-N 3.33Å; H314-E316 PolarHBondContact O-N 2.94Å; H314-S317 PolarHBondContact O-N 3.1Å; H314-R318 PolarHBondContact O-N 2.96Å; H314-A322 HydrophobicContact CB-CB 3.8Å; H314-A322 VanDerWaalsContact CD2-CB 3.48Å; H314-A322 WeakPolarHBondContact CD2-CB 3.49Å; H314-A330 WeakPolarHBondContact NE2-CB 3.4Å
315K89.8Confident88.6Confident117 Ų11754.3 Ų54.351%0.50931%0.305SS..Hα-helixtrans-60.2-43.8178.9-174-177.2175.8-172.70111.5F311 Q312 S317 G319 T320F311-K315 WeakPolarHBondContact O-CB 3.45Å; F311-K315 PolarHBondContact O-N 3Å; Q312-K315 PolarHBondContact O-N 3.41Å; Q312-K315 VanDerWaalsContact O-N 3.13Å; K315-S317 VanDerWaalsContact C-N 3.34Å; K315-G319 WeakPolarHBondContact O-CA 3.35Å; K315-G319 PolarHBondContact O-N 2.94Å; K315-T320 WeakPolarHBondContact CA-O 3.5Å
316E87.6Confident88.2Confident89 Ų8955.1 Ų55.142%0.41630%0.304SS..Hα-helixtrans-70.7-29.4177.5-64.5-57.6151.900112.6V276 Q312 H314V276-E316 HydrophobicContact CG2-CB 3.68Å; Q312-E316 HydrophobicContact CG-CG 4.39Å; Q312-E316 WeakPolarHBondContact O-CG 3.44Å; Q312-E316 PolarHBondContact O-N 3.39Å; H314-E316 VanDerWaalsContact C-N 3.33Å; H314-E316 PolarHBondContact O-N 2.94Å
317S85.6Confident87.9Confident26 Ų2655.1 Ų55.118%0.18230%0.304CS..Hα-helixtrans-80.9-37.3-179.5-58.10000113.6D270 V276 C313 H314 K315D270-S317 PolarHBondContact N-OG 3.41Å; V276-S317 WeakPolarHBondContact CG1-OG 3.46Å; V276-S317 WeakPolarHBondContact CG2-OG 3.3Å; C313-S317 WeakPolarHBondContact O-CB 3.39Å; C313-S317 PolarHBondContact O-N 3.44Å; C313-S317 PolarHBondContact O-OG 3.34Å; H314-S317 PolarHBondContact O-N 3.1Å; K315-S317 VanDerWaalsContact C-N 3.34Å
318R82.4Confident87.7Confident110 Ų11057.7 Ų57.742%0.41532%0.318SS..Hα-helixtrans-123.3-8.7-170.7-62.2-175.3-179.4-172.6-2.6114.4G268 H314 T320 E326G268-R318 VanDerWaalsContact CA-NH2 3.26Å; G268-R318 PolarHBondContact O-NE 2.65Å; H314-R318 PolarHBondContact O-N 2.96Å; R318-T320 PolarHBondContact O-N 3.03Å; R318-E326 IonicContact CZ-OE1 3.6Å; R318-E326 IonicContact NH1-OE1 3.47Å; R318-E326 PolarHBondContact NH1-OE1 3.31Å
319G81.2Confident87.5Confident63 Ų6356.7 Ų56.765%0.64932%0.315SS*.SBendtrans76.5-3.1-174.300000114.7K315K315-G319 WeakPolarHBondContact O-CA 3.35Å; K315-G319 PolarHBondContact O-N 2.94Å
320T82.1Confident87.3Confident83 Ų8355.6 Ų55.651%0.50931%0.309SS..SBendtrans-122.6152.7-177.357.70000111.8K315 R318K315-T320 WeakPolarHBondContact CA-O 3.5Å; R318-T320 PolarHBondContact O-N 3.03Å
321L80.3Confident87.3Confident133 Ų13355.6 Ų55.670%0.69631%0.309SS*.PPolyproline II helixtrans-68.6140.7170.4-66.1172.9000109.8
322A80.4Confident87.3Confident15 Ų1554.2 Ų54.212%0.12430%0.303CS..PPolyproline II helixtrans-71142.5-17800000111.9F311 H314 E326F311-A322 HydrophobicContact CD1-CB 3.83Å; F311-A322 HydrophobicContact CE1-CB 3.99Å; H314-A322 HydrophobicContact CB-CB 3.8Å; H314-A322 VanDerWaalsContact CD2-CB 3.48Å; H314-A322 WeakPolarHBondContact CD2-CB 3.49Å; A322-E326 WeakPolarHBondContact CA-OE2 3.27Å; A322-E326 HydrophobicContact CB-CB 4.14Å
323S86.1Confident87.3Confident51 Ų5150.3 Ų50.336%0.35729%0.285SS..PPolyproline II helixtrans-75.4168167.176.40000111.2D325 E326 F327S323-D325 PolarHBondContact O-N 3.2Å; S323-D325 PolarHBondContact OG-N 3.14Å; S323-E326 PolarHBondContact N-OE2 3.09Å; S323-E326 VanDerWaalsContact N-OE2 3.11Å; S323-E326 PolarHBondContact O-N 3.47Å; S323-E326 VanDerWaalsContact O-N 3.16Å; S323-E326 WeakPolarHBondContact OG-CG 3.25Å; S323-E326 PolarHBondContact OG-N 2.9Å; S323-F327 WeakPolarHBondContact O-CB 3.47Å; S323-F327 PolarHBondContact O-N 2.97Å
324A83.6Confident87.4Confident54 Ų5450.3 Ų50.345%0.44629%0.285SS..Hα-helixtrans-60.1-35.2174.800000112.4E326 F327 L328A324-E326 VanDerWaalsContact C-N 3.27Å; A324-E326 PolarHBondContact O-N 3.1Å; A324-F327 PolarHBondContact O-N 2.98Å; A324-L328 PolarHBondContact O-N 3.27Å
325D83.8Confident87.7Confident135 Ų13550.2 Ų50.272%0.72228%0.284SS*.Hα-helixtrans-68.7-26.7178.2-57.4-40.1000112.5S323 P329S323-D325 PolarHBondContact O-N 3.2Å; S323-D325 PolarHBondContact OG-N 3.14Å; D325-P329 WeakPolarHBondContact O-CD 3.5Å; D325-P329 VanDerWaalsContact O-CG 3.32Å; D325-P329 WeakPolarHBondContact O-CG 3.34Å
326E86.8Confident87.9Confident58 Ų5844.7 Ų44.727%0.27126%0.26SS..Hα-helixtrans-85.8-34175-65.9177.5147.500111.7R318 A322 S323 A324 A330R318-E326 IonicContact CZ-OE1 3.6Å; R318-E326 IonicContact NH1-OE1 3.47Å; R318-E326 PolarHBondContact NH1-OE1 3.31Å; A322-E326 WeakPolarHBondContact CA-OE2 3.27Å; A322-E326 HydrophobicContact CB-CB 4.14Å; S323-E326 PolarHBondContact N-OE2 3.09Å; S323-E326 VanDerWaalsContact N-OE2 3.11Å; S323-E326 PolarHBondContact O-N 3.47Å; S323-E326 VanDerWaalsContact O-N 3.16Å; S323-E326 WeakPolarHBondContact OG-CG 3.25Å; S323-E326 PolarHBondContact OG-N 2.9Å; A324-E326 VanDerWaalsContact C-N 3.27Å; A324-E326 PolarHBondContact O-N 3.1Å; E326-A330 WeakPolarHBondContact O-CB 3.48Å; E326-A330 PolarHBondContact O-N 2.61Å
327F91.8Very high88Confident0 Ų042.8 Ų42.80%025%0.251CS..Hα-helixtrans-68.3-45.5-176.8171.9-106.2000113.5C307 I310 F311 S323 A324 A330 L331 Y366 Y367 N370C307-F327 HydrophobicContact CB-CE2 3.99Å; C307-F327 HydrophobicContact CB-CZ 3.9Å; I310-F327 HydrophobicContact CB-CE2 4.33Å; I310-F327 HydrophobicContact CD1-CE2 4.42Å; I310-F327 HydrophobicContact CG2-CD2 3.87Å; I310-F327 HydrophobicContact CG2-CE2 4.04Å; F311-F327 HydrophobicContact CD2-CD2 4.46Å; F311-F327 HydrophobicContact CD2-CE2 4.44Å; F311-F327 HydrophobicContact CE1-CB 4.14Å; F311-F327 AromaticContact CE1-CD2 3.9Å; F311-F327 HydrophobicContact CE1-CD2 3.9Å; F311-F327 HydrophobicContact CE1-CG 4.19Å; F311-F327 AromaticContact CE2-CD2 3.79Å; F311-F327 HydrophobicContact CE2-CD2 3.79Å; F311-F327 AromaticContact CE2-CE2 3.78Å; F311-F327 HydrophobicContact CE2-CE2 3.78Å; F311-F327 HydrophobicContact CE2-CG 4.46Å; F311-F327 HydrophobicContact CE2-CZ 4.44Å; F311-F327 HydrophobicContact CZ-CB 4.18Å; F311-F327 HydrophobicContact CZ-CD1 4.45Å; F311-F327 AromaticContact CZ-CD2 3.47Å; F311-F327 HydrophobicContact CZ-CD2 3.47Å; F311-F327 VanDerWaalsContact CZ-CD2 3.47Å; F311-F327 AromaticContact CZ-CE2 3.92Å; F311-F327 HydrophobicContact CZ-CE2 3.92Å; F311-F327 AromaticContact CZ-CG 3.77Å; F311-F327 HydrophobicContact CZ-CG 3.77Å; S323-F327 WeakPolarHBondContact O-CB 3.47Å; S323-F327 PolarHBondContact O-N 2.97Å; A324-F327 PolarHBondContact O-N 2.98Å; F327-A330 WeakPolarHBondContact O-CB 3.49Å; F327-A330 PolarHBondContact O-N 3.29Å; F327-L331 HydrophobicContact CE1-CD2 4.21Å; F327-L331 HydrophobicContact CZ-CB 4.48Å; F327-L331 HydrophobicContact CZ-CD2 4.16Å; F327-L331 PolarHBondContact O-N 3.2Å; F327-Y366 HydrophobicContact CD1-CE1 4.48Å; F327-Y366 HydrophobicContact CE1-CE1 4.29Å; F327-Y367 HydrophobicContact CE1-CD1 4.32Å; F327-Y367 AromaticContact CZ-CD1 3.94Å; F327-Y367 HydrophobicContact CZ-CD1 3.94Å; F327-Y367 HydrophobicContact CZ-CE1 4.26Å; F327-N370 HydrophobicContact CE1-CB 3.8Å
328L91.1Very high88.4Confident54 Ų5442.2 Ų42.228%0.28325%0.247SC..Hα-helixtrans-64.2-45.5-175.2-178.266.6000112.9A324 A330 L331 I332 N370 C373 A374A324-L328 PolarHBondContact O-N 3.27Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.37Å; L328-L331 PolarHBondContact O-N 3.05Å; L328-I332 HydrophobicContact CD1-CD1 4.47Å; L328-I332 HydrophobicContact CG-CD1 4.08Å; L328-I332 WeakPolarHBondContact O-CG1 3.48Å; L328-I332 PolarHBondContact O-N 3.12Å; L328-N370 HydrophobicContact CD1-CB 4.46Å; L328-C373 HydrophobicContact CD1-CB 4.4Å; L328-A374 HydrophobicContact CD1-CB 4.15Å
329P90Very high89.1Confident46 Ų4638.4 Ų38.430%0.29924%0.235SC..Hα-helixtrans-58.8-38.7171.8-24.935.1000113L265 D325 I332 Y333L265-P329 WeakPolarHBondContact CD2-O 3.46Å; D325-P329 WeakPolarHBondContact O-CD 3.5Å; D325-P329 VanDerWaalsContact O-CG 3.32Å; D325-P329 WeakPolarHBondContact O-CG 3.34Å; P329-I332 PolarHBondContact O-N 3.43Å; P329-Y333 WeakPolarHBondContact O-CB 3.39Å; P329-Y333 PolarHBondContact O-N 3Å
330A91.9Very high89.7Confident0 Ų035.6 Ų35.60%021%0.205CC..Hα-helixtrans-64.5-41176.100000112.3P267 F269 I310 H314 E326 F327 L328 Y333 V334P267-A330 HydrophobicContact CB-CB 4.15Å; F269-A330 HydrophobicContact CE1-CB 4.18Å; F269-A330 HydrophobicContact CE2-CB 4.38Å; F269-A330 HydrophobicContact CZ-CB 3.67Å; I310-A330 HydrophobicContact CG2-CB 3.8Å; H314-A330 WeakPolarHBondContact NE2-CB 3.4Å; E326-A330 WeakPolarHBondContact O-CB 3.48Å; E326-A330 PolarHBondContact O-N 2.61Å; F327-A330 WeakPolarHBondContact O-CB 3.49Å; F327-A330 PolarHBondContact O-N 3.29Å; L328-A330 VanDerWaalsContact C-N 3.28Å; L328-A330 PolarHBondContact O-N 3.37Å; A330-Y333 WeakPolarHBondContact O-CB 3.44Å; A330-Y333 PolarHBondContact O-N 3.4Å; A330-V334 WeakPolarHBondContact O-CG2 3.38Å; A330-V334 PolarHBondContact O-N 2.93Å
331L94.4Very high90.3Very high0 Ų033.7 Ų33.70%020%0.195CC..Hα-helixtrans-65.2-43.6174.5-177.861000111.9I310 F327 L328 Y333 V334 V335 N370 L371 A374I310-L331 HydrophobicContact CD1-CB 4.33Å; I310-L331 HydrophobicContact CD1-CD1 3.77Å; F327-L331 HydrophobicContact CE1-CD2 4.21Å; F327-L331 HydrophobicContact CZ-CB 4.48Å; F327-L331 HydrophobicContact CZ-CD2 4.16Å; F327-L331 PolarHBondContact O-N 3.2Å; L328-L331 PolarHBondContact O-N 3.05Å; L331-Y333 VanDerWaalsContact C-N 3.27Å; L331-Y333 PolarHBondContact O-N 2.8Å; L331-V334 PolarHBondContact O-N 2.93Å; L331-V335 HydrophobicContact CD1-CG2 4.39Å; L331-V335 WeakPolarHBondContact O-CG2 3.49Å; L331-V335 PolarHBondContact O-N 3.21Å; L331-N370 HydrophobicContact CD2-CB 3.97Å; L331-L371 HydrophobicContact CD2-CB 4.49Å; L331-A374 HydrophobicContact CD2-CB 4.31Å; L331-A374 HydrophobicContact CG-CB 4.32Å
332I93Very high90.9Very high9 Ų929.4 Ų29.45%0.04617%0.172CC..Hα-helixtrans-57.8-44.1174.1-69.3159.9000110.2L265 L328 P329 V335 L336 A374 F377 I378L265-I332 HydrophobicContact CD2-CB 4.33Å; L265-I332 HydrophobicContact CD2-CG2 4.02Å; L328-I332 HydrophobicContact CD1-CD1 4.47Å; L328-I332 HydrophobicContact CG-CD1 4.08Å; L328-I332 WeakPolarHBondContact O-CG1 3.48Å; L328-I332 PolarHBondContact O-N 3.12Å; P329-I332 PolarHBondContact O-N 3.43Å; I332-V335 PolarHBondContact O-N 3.39Å; I332-L336 HydrophobicContact CG2-CD1 3.97Å; I332-L336 HydrophobicContact CG2-CG 4.43Å; I332-L336 WeakPolarHBondContact O-CB 3.5Å; I332-L336 WeakPolarHBondContact O-CG 3.09Å; I332-L336 PolarHBondContact O-N 3.3Å; I332-A374 HydrophobicContact CG1-CB 3.61Å; I332-F377 HydrophobicContact CD1-CB 4.38Å; I332-F377 HydrophobicContact CD1-CD1 3.52Å; I332-F377 HydrophobicContact CD1-CE1 3.99Å; I332-F377 HydrophobicContact CD1-CG 4.05Å; I332-F377 HydrophobicContact CG1-CD1 4.18Å; I332-F377 HydrophobicContact CG2-CD1 4.15Å; I332-F377 HydrophobicContact CG2-CE1 4.35Å; I332-I378 HydrophobicContact CG2-CD1 4.27Å; I332-I378 HydrophobicContact CG2-CG1 4.01Å
333Y91.6Very high91.6Very high12 Ų1228.9 Ų28.95%0.04717%0.167CC..Hα-helixtrans-61-46.6177.5-175.7-91.3000112.2T261 L265 P267 F269 F280 P329 A330 L331 L336 K337T261-Y333 HydrophobicContact CG2-CD2 4.15Å; T261-Y333 HydrophobicContact CG2-CE2 4.15Å; T261-Y333 WeakPolarHBondContact O-CE2 3.18Å; L265-Y333 HydrophobicContact CD2-CD2 4.41Å; P267-Y333 HydrophobicContact CB-CD1 4.24Å; P267-Y333 HydrophobicContact CB-CG 4.05Å; P267-Y333 HydrophobicContact CG-CD1 3.84Å; P267-Y333 HydrophobicContact CG-CD2 3.99Å; P267-Y333 HydrophobicContact CG-CE1 4.07Å; P267-Y333 HydrophobicContact CG-CE2 4.2Å; P267-Y333 HydrophobicContact CG-CG 3.81Å; F269-Y333 HydrophobicContact CD2-CD1 4.45Å; F269-Y333 HydrophobicContact CE2-CD1 4.26Å; F280-Y333 HydrophobicContact CE1-CE1 4.4Å; F280-Y333 AromaticContact CE2-CD1 3.69Å; F280-Y333 HydrophobicContact CE2-CD1 3.69Å; F280-Y333 AromaticContact CE2-CE1 3.65Å; F280-Y333 HydrophobicContact CE2-CE1 3.65Å; F280-Y333 AromaticContact CZ-CD1 3.87Å; F280-Y333 HydrophobicContact CZ-CD1 3.87Å; F280-Y333 AromaticContact CZ-CE1 3.47Å; F280-Y333 HydrophobicContact CZ-CE1 3.47Å; F280-Y333 VanDerWaalsContact CZ-CE1 3.47Å; P329-Y333 WeakPolarHBondContact O-CB 3.39Å; P329-Y333 PolarHBondContact O-N 3Å; A330-Y333 WeakPolarHBondContact O-CB 3.44Å; A330-Y333 PolarHBondContact O-N 3.4Å; L331-Y333 VanDerWaalsContact C-N 3.27Å; L331-Y333 PolarHBondContact O-N 2.8Å; Y333-L336 PolarHBondContact O-N 3.39Å; Y333-K337 HydrophobicContact CD1-CG 4.27Å; Y333-K337 HydrophobicContact CE1-CG 3.87Å; Y333-K337 WeakPolarHBondContact O-CG 3.23Å; Y333-K337 PolarHBondContact O-N 2.99Å; Y333-K337 WeakPolarHBondContact OH-CE 3.32Å
334V93.4Very high92Very high0 Ų026.6 Ų26.60%015%0.151CC..Hα-helixtrans-60.4-45.9176.2170.60000111F280 I284 I287 I310 A330 L331 L336 K337 A338F280-V334 HydrophobicContact CD2-CG2 4.1Å; F280-V334 HydrophobicContact CE2-CG2 3.6Å; I284-V334 HydrophobicContact CG1-CG1 4.36Å; I287-V334 HydrophobicContact CG2-CG1 4.23Å; I310-V334 HydrophobicContact CD1-CB 4.26Å; I310-V334 HydrophobicContact CD1-CG2 3.85Å; I310-V334 HydrophobicContact CG1-CG2 3.9Å; A330-V334 WeakPolarHBondContact O-CG2 3.38Å; A330-V334 PolarHBondContact O-N 2.93Å; L331-V334 PolarHBondContact O-N 2.93Å; V334-L336 PolarHBondContact O-N 3.17Å; V334-K337 PolarHBondContact O-N 3.24Å; V334-A338 WeakPolarHBondContact O-CB 3.25Å; V334-A338 PolarHBondContact O-N 3.31Å
335V95.1Very high92.4Very high0 Ų024.4 Ų24.40%013%0.133CC..Hα-helixtrans-63.4-42.2179.5173.10000111.5I254 L331 I332 K337 A338 N339 P340 L371 L375 I378I254-V335 HydrophobicContact CD1-CG1 4.28Å; L331-V335 HydrophobicContact CD1-CG2 4.39Å; L331-V335 WeakPolarHBondContact O-CG2 3.49Å; L331-V335 PolarHBondContact O-N 3.21Å; I332-V335 PolarHBondContact O-N 3.39Å; V335-K337 VanDerWaalsContact C-N 3.33Å; V335-K337 PolarHBondContact O-N 3.46Å; V335-A338 PolarHBondContact O-N 3.03Å; V335-N339 PolarHBondContact O-N 2.94Å; V335-P340 HydrophobicContact CG1-CG 4.46Å; V335-L371 HydrophobicContact CG2-CD1 3.99Å; V335-L375 HydrophobicContact CG1-CD2 3.86Å; V335-I378 HydrophobicContact CB-CD1 3.98Å; V335-I378 HydrophobicContact CG1-CD1 3.57Å
336L93.2Very high92.9Very high1 Ų118.1 Ų18.11%0.00510%0.099CC..Hα-helixtrans-63.5-37.9176.2-76.1172.5000112.3I254 L257 V260 T261 I332 Y333 V334 I378I254-L336 HydrophobicContact CG2-CD2 4.26Å; I254-L336 WeakPolarHBondContact CG2-O 3.41Å; L257-L336 HydrophobicContact CB-CD2 4.04Å; V260-L336 HydrophobicContact CB-CD1 4.48Å; V260-L336 HydrophobicContact CG1-CD1 4.48Å; T261-L336 HydrophobicContact CG2-CB 3.53Å; T261-L336 HydrophobicContact CG2-CD1 4.08Å; T261-L336 HydrophobicContact CG2-CG 4.45Å; I332-L336 HydrophobicContact CG2-CD1 3.97Å; I332-L336 HydrophobicContact CG2-CG 4.43Å; I332-L336 WeakPolarHBondContact O-CB 3.5Å; I332-L336 WeakPolarHBondContact O-CG 3.09Å; I332-L336 PolarHBondContact O-N 3.3Å; Y333-L336 PolarHBondContact O-N 3.39Å; V334-L336 PolarHBondContact O-N 3.17Å; L336-I378 HydrophobicContact CD2-CD1 4.22Å; L336-I378 HydrophobicContact CD2-CG1 4.2Å; L336-I378 HydrophobicContact CD2-CG2 4.08Å; L336-I378 HydrophobicContact CG-CD1 4.11Å; L336-I378 HydrophobicContact CG-CG1 4.3Å
337K90.8Very high93.2Very high49 Ų4915.4 Ų15.421%0.2139%0.086CC..Hα-helixtrans-73.6-41.8176.9-76.4-59.2-157.3-166.90112.9Y258 T261 F280 I284 Y333 V334 V335Y258-K337 HydrophobicContact CE2-CD 3.62Å; Y258-K337 PolarHBondContact OH-NZ 3.36Å; T261-K337 HydrophobicContact CG2-CD 4Å; T261-K337 HydrophobicContact CG2-CG 4.07Å; T261-K337 VanDerWaalsContact OG1-CE 3.25Å; T261-K337 WeakPolarHBondContact OG1-CE 3.38Å; T261-K337 PolarHBondContact OG1-NZ 3.22Å; F280-K337 HydrophobicContact CZ-CB 4.05Å; F280-K337 HydrophobicContact CZ-CG 3.94Å; I284-K337 HydrophobicContact CD1-CB 4.05Å; Y333-K337 HydrophobicContact CD1-CG 4.27Å; Y333-K337 HydrophobicContact CE1-CG 3.87Å; Y333-K337 WeakPolarHBondContact O-CG 3.23Å; Y333-K337 PolarHBondContact O-N 2.99Å; Y333-K337 WeakPolarHBondContact OH-CE 3.32Å; V334-K337 PolarHBondContact O-N 3.24Å; V335-K337 VanDerWaalsContact C-N 3.33Å; V335-K337 PolarHBondContact O-N 3.46Å
338A94.4Very high93.2Very high13 Ų1316.6 Ų16.611%0.1079%0.091CC..Hα-helixtrans-75-35.6-176.100000113I284 I287 I288 V334 V335I284-A338 HydrophobicContact CB-CB 4.35Å; I284-A338 HydrophobicContact CG1-CB 4.25Å; I284-A338 HydrophobicContact CG2-CB 3.83Å; I287-A338 HydrophobicContact CG2-CB 3.44Å; I287-A338 VanDerWaalsContact CG2-CB 3.44Å; I288-A338 HydrophobicContact CD1-CB 4.39Å; I288-A338 HydrophobicContact CG1-CB 4.24Å; V334-A338 WeakPolarHBondContact O-CB 3.25Å; V334-A338 PolarHBondContact O-N 3.31Å; V335-A338 PolarHBondContact O-N 3.03Å
339N95.3Very high93.3Very high30 Ų3014.1 Ų14.116%0.168%0.078CC..  trans44.560.3-170.7-164.33.6000112.7Q251 I254 V335Q251-N339 WeakPolarHBondContact CG-OD1 3.45Å; I254-N339 WeakPolarHBondContact CD1-OD1 3.38Å; I254-N339 HydrophobicContact CG2-CB 3.72Å; V335-N339 PolarHBondContact O-N 2.94Å
340P95.4Very high93.5Very high4 Ų412.1 Ų12.13%0.0267%0.065CC..  trans-61.2136.2-170.223.7-32.6000111.7I287 V335 I343I287-P340 HydrophobicContact CG1-CB 4.26Å; I287-P340 HydrophobicContact CG1-CG 4.15Å; V335-P340 HydrophobicContact CG1-CG 4.46Å; P340-I343 HydrophobicContact CB-CB 4.31Å; P340-I343 HydrophobicContact CB-CD1 4.19Å; P340-I343 HydrophobicContact CB-CG1 4.46Å; P340-I343 HydrophobicContact CG-CB 3.91Å; P340-I343 HydrophobicContact CG-CD1 3.96Å; P340-I343 HydrophobicContact CG-CG1 3.84Å; P340-I343 HydrophobicContact CG-CG2 4.43Å
341P93.1Very high93.5Very high44 Ų4412.1 Ų12.129%0.2867%0.065SC..THydrogen-bonded Turntrans-70139.4-177.428.9-34.2000111.2N291 I343 N346N291-P341 HydrophobicContact CB-CG 3.96Å; P341-I343 PolarHBondContact O-N 3.47Å; P341-I343 VanDerWaalsContact O-N 3.17Å; P341-N346 PolarHBondContact O-ND2 2.97Å
342L93.6Very high93.3Very high42 Ų4213.3 Ų13.322%0.227%0.07CC..THydrogen-bonded Turntrans54.933.2173.8-53173.6000113.5F237 W238 D247 L344 S345 N346F237-L342 HydrophobicContact CE1-CD1 3.89Å; F237-L342 HydrophobicContact CZ-CB 4.24Å; F237-L342 HydrophobicContact CZ-CD1 4.28Å; W238-L342 HydrophobicContact CH2-CD1 3.54Å; W238-L342 HydrophobicContact CH2-CD2 4.49Å; W238-L342 HydrophobicContact CZ2-CD1 3.93Å; W238-L342 HydrophobicContact CZ3-CD1 4.44Å; D247-L342 HydrophobicContact CB-CD2 4.08Å; D247-L342 VanDerWaalsContact CG-CA 3.42Å; D247-L342 WeakPolarHBondContact OD1-CA 3.33Å; D247-L342 WeakPolarHBondContact OD2-CA 3.22Å; L342-L344 VanDerWaalsContact C-N 3.29Å; L342-L344 PolarHBondContact O-N 3.24Å; L342-S345 PolarHBondContact O-N 3.27Å; L342-N346 WeakPolarHBondContact O-CB 3.46Å; L342-N346 PolarHBondContact O-N 3.34Å; L342-N346 PolarHBondContact O-ND2 3.37Å
343I94.8Very high93.3Very high4 Ų412.9 Ų12.92%0.0217%0.068CC..Hα-helixtrans-64.7-33.6-170.1-168.760.5000112.4D247 F250 P340 P341 N346 V347 L371 L375D247-I343 PolarHBondContact OD1-N 2.93Å; D247-I343 VanDerWaalsContact OD1-N 3.13Å; F250-I343 HydrophobicContact CD1-CG2 3.64Å; F250-I343 HydrophobicContact CE1-CG2 3.63Å; P340-I343 HydrophobicContact CB-CB 4.31Å; P340-I343 HydrophobicContact CB-CD1 4.19Å; P340-I343 HydrophobicContact CB-CG1 4.46Å; P340-I343 HydrophobicContact CG-CB 3.91Å; P340-I343 HydrophobicContact CG-CD1 3.96Å; P340-I343 HydrophobicContact CG-CG1 3.84Å; P340-I343 HydrophobicContact CG-CG2 4.43Å; P341-I343 PolarHBondContact O-N 3.47Å; P341-I343 VanDerWaalsContact O-N 3.17Å; I343-N346 PolarHBondContact O-N 3.49Å; I343-V347 WeakPolarHBondContact O-CB 3.24Å; I343-V347 VanDerWaalsContact O-CG2 3.3Å; I343-V347 WeakPolarHBondContact O-CG2 3.43Å; I343-V347 PolarHBondContact O-N 2.85Å; I343-L371 HydrophobicContact CD1-CD2 4.4Å; I343-L375 HydrophobicContact CG1-CD1 3.91Å; I343-L375 HydrophobicContact CG1-CD2 3.91Å; I343-L375 HydrophobicContact CG2-CD2 4.02Å
344L93.9Very high93.4Very high3 Ų312.4 Ų12.42%0.0167%0.066CC..Hα-helixtrans-70.8-44.8177.8-62.9-174.2000111F79 W81 A246 D247 F250 L342 N346 V347 K348 L375F79-L344 HydrophobicContact CB-CD1 4.47Å; F79-L344 HydrophobicContact CD2-CB 3.83Å; F79-L344 HydrophobicContact CD2-CD1 3.98Å; F79-L344 HydrophobicContact CD2-CD2 4.45Å; F79-L344 HydrophobicContact CD2-CG 4.32Å; F79-L344 HydrophobicContact CE1-CD2 4.35Å; F79-L344 HydrophobicContact CE2-CB 3.59Å; F79-L344 HydrophobicContact CE2-CD1 4.41Å; F79-L344 HydrophobicContact CE2-CD2 4.12Å; F79-L344 HydrophobicContact CE2-CG 4.26Å; F79-L344 HydrophobicContact CG-CD1 4.15Å; F79-L344 HydrophobicContact CZ-CB 4.34Å; F79-L344 HydrophobicContact CZ-CD2 4.07Å; W81-L344 HydrophobicContact CH2-CD2 3.79Å; W81-L344 HydrophobicContact CZ2-CD2 3.65Å; A246-L344 HydrophobicContact CB-CD1 4.19Å; D247-L344 WeakPolarHBondContact OD1-CA 3.02Å; D247-L344 WeakPolarHBondContact OD1-CB 3.21Å; D247-L344 PolarHBondContact OD1-N 2.99Å; F250-L344 HydrophobicContact CB-CD1 3.61Å; F250-L344 HydrophobicContact CB-CG 4.15Å; F250-L344 HydrophobicContact CD1-CD1 4.45Å; F250-L344 HydrophobicContact CD1-CD2 4.33Å; F250-L344 HydrophobicContact CD1-CG 4.14Å; F250-L344 HydrophobicContact CD2-CD1 4.26Å; F250-L344 HydrophobicContact CG-CD1 3.86Å; F250-L344 HydrophobicContact CG-CD2 4.32Å; F250-L344 HydrophobicContact CG-CG 4.05Å; L342-L344 VanDerWaalsContact C-N 3.29Å; L342-L344 PolarHBondContact O-N 3.24Å; L344-N346 VanDerWaalsContact C-N 3.3Å; L344-N346 PolarHBondContact O-N 2.94Å; L344-V347 PolarHBondContact O-N 3.24Å; L344-K348 WeakPolarHBondContact O-CB 3.28Å; L344-K348 PolarHBondContact O-N 2.95Å; L344-L375 HydrophobicContact CD2-CD1 4.5Å
345S92.7Very high93.3Very high9 Ų912.7 Ų12.76%0.0637%0.067CC..Hα-helixtrans-61.2-38.9171.9-790000111.9D247 L342 K348 F349D247-S345 WeakPolarHBondContact OD2-CB 3.48Å; D247-S345 PolarHBondContact OD2-N 3.4Å; D247-S345 PolarHBondContact OD2-OG 3.02Å; L342-S345 PolarHBondContact O-N 3.27Å; S345-K348 PolarHBondContact O-N 3.07Å; S345-F349 WeakPolarHBondContact O-CB 3.41Å; S345-F349 PolarHBondContact O-N 3.17Å
346N94.3Very high92.9Very high2 Ų213.2 Ų13.21%0.0117%0.071CC..Hα-helixtrans-61.4-45.9174.5-82.5-68.1000112.5T290 N291 K299 P341 L342 I343 L344 F349 I350T290-N346 HydrophobicContact CG2-CB 4.49Å; N291-N346 PolarHBondContact OD1-ND2 3.39Å; K299-N346 WeakPolarHBondContact CE-OD1 3.41Å; K299-N346 PolarHBondContact NZ-OD1 3.1Å; P341-N346 PolarHBondContact O-ND2 2.97Å; L342-N346 WeakPolarHBondContact O-CB 3.46Å; L342-N346 PolarHBondContact O-N 3.34Å; L342-N346 PolarHBondContact O-ND2 3.37Å; I343-N346 PolarHBondContact O-N 3.49Å; L344-N346 VanDerWaalsContact C-N 3.3Å; L344-N346 PolarHBondContact O-N 2.94Å; N346-F349 PolarHBondContact O-N 3.33Å; N346-I350 VanDerWaalsContact O-CG1 3.28Å; N346-I350 WeakPolarHBondContact O-CG1 3.46Å; N346-I350 PolarHBondContact O-N 2.96Å
347V94Very high92.6Very high1 Ų115.9 Ų15.91%0.0069%0.09CC..Hα-helixtrans-65.1-43178166.10000111.5W81 L84 I343 L344 I350 S351 F368 L371 L375W81-V347 HydrophobicContact CZ3-CG1 4.21Å; L84-V347 HydrophobicContact CD1-CG1 4.01Å; L84-V347 HydrophobicContact CD2-CG1 3.64Å; L84-V347 HydrophobicContact CG-CG1 4.43Å; I343-V347 WeakPolarHBondContact O-CB 3.24Å; I343-V347 VanDerWaalsContact O-CG2 3.3Å; I343-V347 WeakPolarHBondContact O-CG2 3.43Å; I343-V347 PolarHBondContact O-N 2.85Å; L344-V347 PolarHBondContact O-N 3.24Å; V347-I350 PolarHBondContact O-N 3.32Å; V347-S351 WeakPolarHBondContact O-CB 3.42Å; V347-S351 PolarHBondContact O-N 3.18Å; V347-F368 HydrophobicContact CB-CE2 4.38Å; V347-F368 HydrophobicContact CG1-CE2 4.08Å; V347-F368 HydrophobicContact CG1-CZ 3.9Å; V347-F368 HydrophobicContact CG2-CE2 4.26Å; V347-F368 WeakPolarHBondContact O-CZ 3.33Å; V347-L371 HydrophobicContact CG2-CD2 3.94Å; V347-L371 HydrophobicContact CG2-CG 4.48Å; V347-L375 HydrophobicContact CG2-CD1 3.69Å
348K91.6Very high92.5Very high25 Ų2515.2 Ų15.211%0.1099%0.086CC..Hα-helixtrans-61.7-44.5173.2-86.3175.8167.2-179.20112.2G78 F79 L84 E243 L344 S345 I350 S351 R352G78-K348 PolarHBondContact O-NZ 3.44Å; F79-K348 HydrophobicContact CD2-CD 3.85Å; F79-K348 HydrophobicContact CD2-CG 4.39Å; F79-K348 HydrophobicContact CE2-CD 3.46Å; F79-K348 VanDerWaalsContact CE2-CD 3.46Å; F79-K348 HydrophobicContact CE2-CG 3.53Å; F79-K348 HydrophobicContact CZ-CD 4.4Å; F79-K348 HydrophobicContact CZ-CG 4.05Å; L84-K348 HydrophobicContact CD1-CB 4.49Å; L84-K348 HydrophobicContact CD1-CG 3.75Å; E243-K348 HydrophobicContact CG-CD 4.32Å; E243-K348 WeakPolarHBondContact OE1-CD 3.48Å; E243-K348 IonicContact OE1-NZ 2.67Å; E243-K348 PolarHBondContact OE1-NZ 2.99Å; L344-K348 WeakPolarHBondContact O-CB 3.28Å; L344-K348 PolarHBondContact O-N 2.95Å; S345-K348 PolarHBondContact O-N 3.07Å; K348-I350 VanDerWaalsContact C-N 3.35Å; K348-I350 PolarHBondContact O-N 2.92Å; K348-S351 PolarHBondContact O-N 2.68Å; K348-R352 WeakPolarHBondContact O-CB 3.36Å; K348-R352 WeakPolarHBondContact O-CG 3.38Å; K348-R352 PolarHBondContact O-N 3.02Å
349F92.7Very high92Very high3 Ų315.2 Ų15.21%0.0138%0.084CC..Hα-helixtrans-58.7-46.6178.1179.2-91.6000111.4C229 Y233 L236 F237 R294 P296 K299 S345 N346 R352 F353C229-F349 HydrophobicContact CB-CZ 4.23Å; Y233-F349 HydrophobicContact CD2-CE2 4.07Å; Y233-F349 AromaticContact CD2-CZ 3.88Å; Y233-F349 HydrophobicContact CD2-CZ 3.88Å; Y233-F349 HydrophobicContact CE2-CE1 4.29Å; Y233-F349 HydrophobicContact CE2-CE2 4.03Å; Y233-F349 AromaticContact CE2-CZ 3.85Å; Y233-F349 HydrophobicContact CE2-CZ 3.85Å; L236-F349 HydrophobicContact CB-CE2 3.95Å; F237-F349 HydrophobicContact CB-CD2 4.48Å; F237-F349 HydrophobicContact CD2-CB 4.19Å; F237-F349 AromaticContact CD2-CD2 3.9Å; F237-F349 HydrophobicContact CD2-CD2 3.9Å; F237-F349 HydrophobicContact CD2-CG 4.07Å; F237-F349 HydrophobicContact CE2-CB 4.38Å; R294-F349 WeakPolarHBondContact O-CZ 3.47Å; P296-F349 HydrophobicContact CG-CD1 4.38Å; P296-F349 HydrophobicContact CG-CE1 3.77Å; P296-F349 HydrophobicContact CG-CZ 4.49Å; K299-F349 HydrophobicContact CD-CD1 3.93Å; K299-F349 HydrophobicContact CD-CE1 4.28Å; S345-F349 WeakPolarHBondContact O-CB 3.41Å; S345-F349 PolarHBondContact O-N 3.17Å; N346-F349 PolarHBondContact O-N 3.33Å; F349-R352 PolarHBondContact O-N 2.98Å; F349-F353 AromaticContact CD2-CD2 3.45Å; F349-F353 HydrophobicContact CD2-CD2 3.45Å; F349-F353 VanDerWaalsContact CD2-CD2 3.45Å; F349-F353 AromaticContact CD2-CE2 3.71Å; F349-F353 HydrophobicContact CD2-CE2 3.71Å; F349-F353 AromaticContact CE2-CD2 3.57Å; F349-F353 HydrophobicContact CE2-CD2 3.57Å; F349-F353 AromaticContact CE2-CE2 3.99Å; F349-F353 HydrophobicContact CE2-CE2 3.99Å; F349-F353 AromaticContact CG-CD2 3.99Å; F349-F353 HydrophobicContact CG-CD2 3.99Å; F349-F353 HydrophobicContact CZ-CD2 4.21Å; F349-F353 VanDerWaalsContact O-CD2 3.3Å; F349-F353 WeakPolarHBondContact O-CD2 3.11Å; F349-F353 PolarHBondContact O-N 3.46Å
350I93.7Very high91.4Very high3 Ų317.7 Ų17.72%0.01510%0.095CC..Hα-helixtrans-60.6-48.6175.1-66.4164.5000110.1K299 L300 N346 V347 K348 R352 F353 A354 L359 F368K299-I350 HydrophobicContact CB-CD1 3.84Å; K299-I350 HydrophobicContact CB-CG1 4.08Å; K299-I350 HydrophobicContact CD-CD1 4.39Å; K299-I350 HydrophobicContact CD-CG1 4.12Å; L300-I350 HydrophobicContact CD1-CG2 4.16Å; L300-I350 HydrophobicContact CD2-CD1 4.46Å; L300-I350 HydrophobicContact CD2-CG2 3.93Å; L300-I350 HydrophobicContact CG-CG2 4.03Å; N346-I350 VanDerWaalsContact O-CG1 3.28Å; N346-I350 WeakPolarHBondContact O-CG1 3.46Å; N346-I350 PolarHBondContact O-N 2.96Å; V347-I350 PolarHBondContact O-N 3.32Å; K348-I350 VanDerWaalsContact C-N 3.35Å; K348-I350 PolarHBondContact O-N 2.92Å; I350-R352 VanDerWaalsContact C-N 3.28Å; I350-R352 PolarHBondContact O-N 3.48Å; I350-F353 PolarHBondContact O-N 3.49Å; I350-A354 HydrophobicContact CG2-CB 4.09Å; I350-A354 WeakPolarHBondContact O-CB 3.4Å; I350-A354 PolarHBondContact O-N 3.47Å; I350-L359 HydrophobicContact CG2-CD1 4.33Å; I350-L359 HydrophobicContact CG2-CD2 3.91Å; I350-F368 HydrophobicContact CB-CE2 3.72Å; I350-F368 HydrophobicContact CB-CZ 4Å; I350-F368 HydrophobicContact CD1-CD2 4.25Å; I350-F368 HydrophobicContact CD1-CE2 3.9Å; I350-F368 HydrophobicContact CG1-CE2 4.44Å; I350-F368 HydrophobicContact CG2-CD2 3.91Å; I350-F368 HydrophobicContact CG2-CE1 4.36Å; I350-F368 HydrophobicContact CG2-CE2 3.5Å; I350-F368 HydrophobicContact CG2-CG 4.49Å; I350-F368 HydrophobicContact CG2-CZ 3.75Å
351S91.6Very high90.6Very high1 Ų121.2 Ų21.21%0.00712%0.12CC..Hα-helixtrans-61.2-35.5-178.7-164.70000113.3L84 V347 K348L84-S351 PolarHBondContact O-OG 3.34Å; V347-S351 WeakPolarHBondContact O-CB 3.42Å; V347-S351 PolarHBondContact O-N 3.18Å; K348-S351 PolarHBondContact O-N 2.68Å
352R90.8Very high90.2Very high25 Ų2522 Ų229%0.09414%0.136CC..Hα-helixtrans-78.4-40.4-178.7-74.7180-180135.2-0.9113.3D183 S186 Q190 E243 K348 F349 I350D183-R352 IonicContact OD1-CZ 3.19Å; D183-R352 IonicContact OD1-NE 2.7Å; D183-R352 PolarHBondContact OD1-NE 2.75Å; D183-R352 IonicContact OD1-NH2 2.73Å; S186-R352 WeakPolarHBondContact OG-CA 3.49Å; S186-R352 WeakPolarHBondContact OG-CB 3.44Å; S186-R352 PolarHBondContact OG-O 3.18Å; Q190-R352 PolarHBondContact NE2-O 3Å; E243-R352 IonicContact OE1-CZ 3.76Å; E243-R352 IonicContact OE1-NH1 4Å; E243-R352 PolarHBondContact OE1-NH1 3.34Å; E243-R352 IonicContact OE1-NH2 3.65Å; E243-R352 PolarHBondContact OE1-NH2 3.44Å; E243-R352 IonicContact OE2-NH1 2.74Å; E243-R352 PolarHBondContact OE2-NH1 3.31Å; K348-R352 WeakPolarHBondContact O-CB 3.36Å; K348-R352 WeakPolarHBondContact O-CG 3.38Å; K348-R352 PolarHBondContact O-N 3.02Å; F349-R352 PolarHBondContact O-N 2.98Å; I350-R352 VanDerWaalsContact C-N 3.28Å; I350-R352 PolarHBondContact O-N 3.48Å
353F92.8Very high90Very high0 Ų025.1 Ų25.10%015%0.15CC..Hα-helixtrans-118.5-11.3-164.2-54.3-60.6000115.1L182 I189 Y193 L236 P296 F349 I350L182-F353 HydrophobicContact CD2-CE2 4.2Å; L182-F353 HydrophobicContact CD2-CZ 3.89Å; L182-F353 HydrophobicContact CG-CZ 4.32Å; I189-F353 HydrophobicContact CD1-CD1 3.63Å; I189-F353 HydrophobicContact CD1-CE1 3.77Å; Y193-F353 WeakPolarHBondContact CE2-O 3.39Å; Y193-F353 PolarHBondContact OH-O 2.98Å; L236-F353 HydrophobicContact CB-CD2 4.49Å; L236-F353 HydrophobicContact CB-CE2 3.89Å; L236-F353 HydrophobicContact CB-CZ 4.03Å; L236-F353 HydrophobicContact CD1-CE1 4.48Å; L236-F353 HydrophobicContact CD2-CE1 3.84Å; L236-F353 HydrophobicContact CD2-CE2 4.42Å; L236-F353 HydrophobicContact CD2-CZ 3.71Å; L236-F353 HydrophobicContact CG-CZ 4.29Å; P296-F353 HydrophobicContact CG-CB 4.21Å; F349-F353 AromaticContact CD2-CD2 3.45Å; F349-F353 HydrophobicContact CD2-CD2 3.45Å; F349-F353 VanDerWaalsContact CD2-CD2 3.45Å; F349-F353 AromaticContact CD2-CE2 3.71Å; F349-F353 HydrophobicContact CD2-CE2 3.71Å; F349-F353 AromaticContact CE2-CD2 3.57Å; F349-F353 HydrophobicContact CE2-CD2 3.57Å; F349-F353 AromaticContact CE2-CE2 3.99Å; F349-F353 HydrophobicContact CE2-CE2 3.99Å; F349-F353 AromaticContact CG-CD2 3.99Å; F349-F353 HydrophobicContact CG-CD2 3.99Å; F349-F353 HydrophobicContact CZ-CD2 4.21Å; F349-F353 VanDerWaalsContact O-CD2 3.3Å; F349-F353 WeakPolarHBondContact O-CD2 3.11Å; F349-F353 PolarHBondContact O-N 3.46Å; I350-F353 PolarHBondContact O-N 3.49Å
354A93.6Very high89.9Confident1 Ų125.7 Ų25.71%0.00816%0.155CC..SBendtrans-67.9152.2175.200000111.6Q190 E225 P296 I350 P356 L359Q190-A354 PolarHBondContact NE2-O 3.27Å; E225-A354 VanDerWaalsContact OE2-CA 3.27Å; E225-A354 WeakPolarHBondContact OE2-CA 3.48Å; P296-A354 HydrophobicContact CB-CB 3.69Å; P296-A354 HydrophobicContact CG-CB 4.42Å; I350-A354 HydrophobicContact CG2-CB 4.09Å; I350-A354 WeakPolarHBondContact O-CB 3.4Å; I350-A354 PolarHBondContact O-N 3.47Å; A354-P356 WeakPolarHBondContact O-CD 3.4Å; A354-L359 HydrophobicContact CB-CD1 3.83Å; A354-L359 HydrophobicContact CB-CG 4.05Å
355L91.7Very high89.8Confident7 Ų725.7 Ų25.74%0.03716%0.156CC..  trans-59.9125.6169.3-70.3169.8000110.8Y193 L221 E222 E225 S357 R358 L359Y193-L355 HydrophobicContact CD1-CD2 3.87Å; Y193-L355 HydrophobicContact CD2-CD2 3.73Å; Y193-L355 HydrophobicContact CE1-CD2 4.14Å; Y193-L355 HydrophobicContact CE2-CD2 3.99Å; Y193-L355 HydrophobicContact CG-CD2 3.67Å; L221-L355 HydrophobicContact CB-CD1 4.05Å; L221-L355 HydrophobicContact CB-CD2 3.96Å; E222-L355 HydrophobicContact CG-CD1 4.04Å; E225-L355 HydrophobicContact CB-CD1 4.37Å; E225-L355 HydrophobicContact CB-CG 4.23Å; E225-L355 HydrophobicContact CG-CG 4.47Å; E225-L355 PolarHBondContact OE2-N 3.27Å; L355-S357 VanDerWaalsContact C-N 3.26Å; L355-S357 PolarHBondContact O-N 3.17Å; L355-R358 WeakPolarHBondContact O-CB 3.31Å; L355-R358 PolarHBondContact O-N 3.06Å; L355-L359 PolarHBondContact O-N 3.23Å
356P87.7Confident89.8Confident10 Ų1029.8 Ų29.87%0.06517%0.171CC..Hα-helixtrans-59.1-35.4-177.9-27.735.4000113.5L92 A354 R358 L359 M360L92-P356 HydrophobicContact CD1-CB 4.3Å; A354-P356 WeakPolarHBondContact O-CD 3.4Å; P356-R358 PolarHBondContact O-N 2.88Å; P356-L359 PolarHBondContact O-N 2.89Å; P356-M360 VanDerWaalsContact O-CB 3.3Å; P356-M360 WeakPolarHBondContact O-CB 3.29Å; P356-M360 VanDerWaalsContact O-CG 3.23Å; P356-M360 WeakPolarHBondContact O-CG 3.44Å; P356-M360 PolarHBondContact O-N 3.48Å
357S86.3Confident89.9Confident58 Ų5830.6 Ų30.641%0.40617%0.174SC..Hα-helixtrans-57.1-36.8177.450.90000112.4L355 S361L355-S357 VanDerWaalsContact C-N 3.26Å; L355-S357 PolarHBondContact O-N 3.17Å; S357-S361 PolarHBondContact O-N 2.85Å; S357-S361 PolarHBondContact O-OG 3.41Å
358R87.5Confident89.9Confident35 Ų3530.7 Ų30.713%0.13217%0.174CC..Hα-helixtrans-74.7-33-179.5-168.7-178.7-67143-4.5113E222 E225 K297 L300 L355 P356 A364E222-R358 VanDerWaalsContact CG-NH2 3.3Å; E222-R358 IonicContact OE1-CZ 3.03Å; E222-R358 IonicContact OE1-NH2 3.98Å; E222-R358 PolarHBondContact OE1-NH2 3.39Å; E222-R358 IonicContact OE2-NH2 2.68Å; E225-R358 IonicContact OE1-CZ 2.75Å; E225-R358 IonicContact OE1-NH1 3.4Å; E225-R358 PolarHBondContact OE1-NH1 3.46Å; E225-R358 IonicContact OE1-NH2 2.77Å; E225-R358 IonicContact OE2-NH1 3.7Å; E225-R358 PolarHBondContact OE2-NH1 3.06Å; K297-R358 VanDerWaalsContact CA-NH1 3.35Å; K297-R358 VanDerWaalsContact CB-NH1 3.32Å; L300-R358 HydrophobicContact CD1-CG 4.1Å; L355-R358 WeakPolarHBondContact O-CB 3.31Å; L355-R358 PolarHBondContact O-N 3.06Å; P356-R358 PolarHBondContact O-N 2.88Å; R358-A364 HydrophobicContact CG-CB 4.43Å
359L85.8Confident90Very high12 Ų1232.5 Ų32.56%0.06319%0.187CC..Hα-helixtrans-82.6-27.9177.6-69.3-178.1000112.6M88 L300 I350 A354 L355 P356 G365 F368M88-L359 HydrophobicContact SD-CB 3.61Å; M88-L359 HydrophobicContact SD-CD1 3.52Å; M88-L359 VanDerWaalsContact SD-CD1 3.52Å; M88-L359 HydrophobicContact SD-CG 4.23Å; L300-L359 HydrophobicContact CD1-CD2 3.91Å; L300-L359 HydrophobicContact CD2-CD2 4.08Å; I350-L359 HydrophobicContact CG2-CD1 4.33Å; I350-L359 HydrophobicContact CG2-CD2 3.91Å; A354-L359 HydrophobicContact CB-CD1 3.83Å; A354-L359 HydrophobicContact CB-CG 4.05Å; L355-L359 PolarHBondContact O-N 3.23Å; P356-L359 PolarHBondContact O-N 2.89Å; L359-G365 VanDerWaalsContact O-CA 3.3Å; L359-G365 WeakPolarHBondContact O-CA 3.42Å; L359-F368 HydrophobicContact CD1-CE1 4.47Å; L359-F368 HydrophobicContact CD2-CB 4.26Å; L359-F368 HydrophobicContact CD2-CD1 3.7Å; L359-F368 HydrophobicContact CD2-CE1 4.18Å; L359-F368 HydrophobicContact CD2-CG 3.95Å
360M81.5Confident90.1Very high82 Ų8233.3 Ų33.340%0.40419%0.192SC..Hα-helixtrans-85.7-17.3-177.8-72-171.757.300114.4W89 L92 P356W89-M360 HydrophobicContact CE3-SD 4.32Å; W89-M360 HydrophobicContact CH2-CE 3.84Å; W89-M360 HydrophobicContact CH2-CG 3.82Å; W89-M360 HydrophobicContact CH2-SD 4.04Å; W89-M360 HydrophobicContact CZ3-CE 3.41Å; W89-M360 VanDerWaalsContact CZ3-CE 3.41Å; W89-M360 HydrophobicContact CZ3-CG 3.99Å; W89-M360 HydrophobicContact CZ3-SD 3.57Å; W89-M360 VanDerWaalsContact CZ3-SD 3.57Å; L92-M360 HydrophobicContact CD1-SD 3.82Å; L92-M360 HydrophobicContact CD2-CE 3.5Å; L92-M360 VanDerWaalsContact CD2-CE 3.5Å; L92-M360 HydrophobicContact CD2-SD 3.5Å; L92-M360 WeakPolarHBondContact CD2-SD 3.38Å; L92-M360 HydrophobicContact CG-SD 4.27Å; P356-M360 VanDerWaalsContact O-CB 3.3Å; P356-M360 WeakPolarHBondContact O-CB 3.29Å; P356-M360 VanDerWaalsContact O-CG 3.23Å; P356-M360 WeakPolarHBondContact O-CG 3.44Å; P356-M360 PolarHBondContact O-N 3.48Å
361S78.9Confident90.2Very high78 Ų7833.3 Ų33.355%0.54519%0.192SC..SBendtrans-144.8153-175.768.50000111.7S357S357-S361 PolarHBondContact O-N 2.85Å; S357-S361 PolarHBondContact O-OG 3.41Å
362G83.9Confident90.3Very high60 Ų6033.6 Ų33.662%0.61919%0.193SC*.Hα-helixtrans86.2178.4179.200000114.6A364 Y366G362-A364 VanDerWaalsContact C-N 3.34Å; G362-A364 PolarHBondContact O-N 3.48Å; G362-Y366 PolarHBondContact O-N 3.31Å
363E90.7Very high90.4Very high109 Ų10935.1 Ų35.151%0.50921%0.207SC..Hα-helixtrans-63.8-37.5-177.764-179.3173.100112.6T304 G365 Y366 Y367T304-E363 HydrophobicContact CG2-CG 4.27Å; E363-G365 PolarHBondContact O-N 3.11Å; E363-Y366 WeakPolarHBondContact O-CB 3.37Å; E363-Y366 PolarHBondContact O-N 2.92Å; E363-Y366 VanDerWaalsContact O-N 3.15Å; E363-Y367 HydrophobicContact CB-CD2 4.28Å; E363-Y367 HydrophobicContact CB-CE2 3.79Å; E363-Y367 HydrophobicContact CG-CE2 4.21Å; E363-Y367 VanDerWaalsContact O-CD2 3.22Å; E363-Y367 WeakPolarHBondContact O-CD2 3.41Å; E363-Y367 PolarHBondContact O-N 3.29Å
364A92.1Very high90.5Very high15 Ų1535.1 Ų35.112%0.12421%0.207CC..Hα-helixtrans-62.1-42.1-178.400000111.9R358 G362 Y367 F368R358-A364 HydrophobicContact CG-CB 4.43Å; G362-A364 VanDerWaalsContact C-N 3.34Å; G362-A364 PolarHBondContact O-N 3.48Å; A364-Y367 PolarHBondContact O-N 3.33Å; A364-F368 WeakPolarHBondContact O-CB 3.49Å; A364-F368 PolarHBondContact O-N 3.31Å
365G92.1Very high90.6Very high4 Ų435.1 Ų35.14%0.04121%0.207CC..Hα-helixtrans-65.3-39175.200000112.9L359 E363 T369L359-G365 VanDerWaalsContact O-CA 3.3Å; L359-G365 WeakPolarHBondContact O-CA 3.42Å; E363-G365 PolarHBondContact O-N 3.11Å; G365-T369 WeakPolarHBondContact O-CB 3.32Å; G365-T369 PolarHBondContact O-N 3.48Å; G365-T369 PolarHBondContact O-OG1 3.22Å
366Y93.2Very high90.6Very high95 Ų9536.2 Ų36.237%0.37321%0.213SC..Hα-helixtrans-63.4-48.7174.5172.6-100.5000111.6F327 G362 E363 T369 N370F327-Y366 HydrophobicContact CD1-CE1 4.48Å; F327-Y366 HydrophobicContact CE1-CE1 4.29Å; G362-Y366 PolarHBondContact O-N 3.31Å; E363-Y366 WeakPolarHBondContact O-CB 3.37Å; E363-Y366 PolarHBondContact O-N 2.92Å; E363-Y366 VanDerWaalsContact O-N 3.15Å; Y366-T369 PolarHBondContact O-N 3.1Å; Y366-N370 WeakPolarHBondContact CD2-ND2 3.38Å; Y366-N370 WeakPolarHBondContact CE1-ND2 3.48Å; Y366-N370 WeakPolarHBondContact CE2-ND2 3.38Å; Y366-N370 PolarHBondContact O-N 3.02Å; Y366-N370 PolarHBondContact O-ND2 3.46Å
367Y95.3Very high90.9Very high19 Ų1939.1 Ų39.18%0.07523%0.225CC..Hα-helixtrans-65.3-41.2178.1-62.3-34.7000112.5T304 C307 N308 F311 F327 E363 A364 T369 N370 L371T304-Y367 HydrophobicContact CG2-CD2 4.1Å; T304-Y367 HydrophobicContact CG2-CE2 3.92Å; C307-Y367 HydrophobicContact CB-CD1 3.58Å; C307-Y367 HydrophobicContact CB-CD2 3.85Å; C307-Y367 HydrophobicContact CB-CE1 3.8Å; C307-Y367 HydrophobicContact CB-CE2 4Å; C307-Y367 HydrophobicContact CB-CG 3.63Å; N308-Y367 PolarHBondContact OD1-OH 3.43Å; F311-Y367 AromaticContact CE2-CE1 3.7Å; F311-Y367 HydrophobicContact CE2-CE1 3.7Å; F311-Y367 AromaticContact CE2-CZ 3.99Å; F311-Y367 HydrophobicContact CZ-CE1 4.42Å; F327-Y367 HydrophobicContact CE1-CD1 4.32Å; F327-Y367 AromaticContact CZ-CD1 3.94Å; F327-Y367 HydrophobicContact CZ-CD1 3.94Å; F327-Y367 HydrophobicContact CZ-CE1 4.26Å; E363-Y367 HydrophobicContact CB-CD2 4.28Å; E363-Y367 HydrophobicContact CB-CE2 3.79Å; E363-Y367 HydrophobicContact CG-CE2 4.21Å; E363-Y367 VanDerWaalsContact O-CD2 3.22Å; E363-Y367 WeakPolarHBondContact O-CD2 3.41Å; E363-Y367 PolarHBondContact O-N 3.29Å; A364-Y367 PolarHBondContact O-N 3.33Å; Y367-T369 VanDerWaalsContact C-N 3.33Å; Y367-T369 PolarHBondContact O-N 3.24Å; Y367-N370 PolarHBondContact O-N 3.27Å; Y367-L371 WeakPolarHBondContact O-CB 3.32Å; Y367-L371 PolarHBondContact O-N 3.35Å
368F95.4Very high91.2Very high2 Ų236.4 Ų36.41%0.00921%0.206CC..Hα-helixtrans-60.8-42.2175.1-176.3-107.6000112.2F85 L300 L303 V347 I350 L359 A364 L371 C372F85-F368 HydrophobicContact CE1-CD1 4.39Å; F85-F368 AromaticContact CE1-CE1 3.96Å; F85-F368 HydrophobicContact CE1-CE1 3.96Å; L300-F368 HydrophobicContact CD2-CB 3.95Å; L300-F368 HydrophobicContact CD2-CD2 3.98Å; L300-F368 HydrophobicContact CD2-CG 4.16Å; L303-F368 HydrophobicContact CD2-CB 4.18Å; L303-F368 HydrophobicContact CD2-CD2 4.27Å; V347-F368 HydrophobicContact CB-CE2 4.38Å; V347-F368 HydrophobicContact CG1-CE2 4.08Å; V347-F368 HydrophobicContact CG1-CZ 3.9Å; V347-F368 HydrophobicContact CG2-CE2 4.26Å; V347-F368 WeakPolarHBondContact O-CZ 3.33Å; I350-F368 HydrophobicContact CB-CE2 3.72Å; I350-F368 HydrophobicContact CB-CZ 4Å; I350-F368 HydrophobicContact CD1-CD2 4.25Å; I350-F368 HydrophobicContact CD1-CE2 3.9Å; I350-F368 HydrophobicContact CG1-CE2 4.44Å; I350-F368 HydrophobicContact CG2-CD2 3.91Å; I350-F368 HydrophobicContact CG2-CE1 4.36Å; I350-F368 HydrophobicContact CG2-CE2 3.5Å; I350-F368 HydrophobicContact CG2-CG 4.49Å; I350-F368 HydrophobicContact CG2-CZ 3.75Å; L359-F368 HydrophobicContact CD1-CE1 4.47Å; L359-F368 HydrophobicContact CD2-CB 4.26Å; L359-F368 HydrophobicContact CD2-CD1 3.7Å; L359-F368 HydrophobicContact CD2-CE1 4.18Å; L359-F368 HydrophobicContact CD2-CG 3.95Å; A364-F368 WeakPolarHBondContact O-CB 3.49Å; A364-F368 PolarHBondContact O-N 3.31Å; F368-L371 PolarHBondContact O-N 3.28Å; F368-C372 PolarHBondContact O-N 3.41Å; F368-C372 PolarHBondContact O-SG 2.93Å
369T93.5Very high91.3Very high63 Ų6335.2 Ų35.239%0.38720%0.201SC..Hα-helixtrans-64.1-44.1175.9-56.70000111.1G365 Y366 Y367 L371 C372 C373G365-T369 WeakPolarHBondContact O-CB 3.32Å; G365-T369 PolarHBondContact O-N 3.48Å; G365-T369 PolarHBondContact O-OG1 3.22Å; Y366-T369 PolarHBondContact O-N 3.1Å; Y367-T369 VanDerWaalsContact C-N 3.33Å; Y367-T369 PolarHBondContact O-N 3.24Å; T369-L371 VanDerWaalsContact C-N 3.34Å; T369-L371 PolarHBondContact O-N 3.08Å; T369-C372 WeakPolarHBondContact O-CB 3.28Å; T369-C372 PolarHBondContact O-N 3.46Å; T369-C373 PolarHBondContact O-N 2.87Å; T369-C373 PolarHBondContact O-SG 2.97Å
370N93.9Very high91.6Very high21 Ų2138.9 Ų38.911%0.11222%0.221CC..Hα-helixtrans-63.5-38.9176.7-82.9-83.9000112.5F327 L328 L331 Y366 Y367 C373 A374F327-N370 HydrophobicContact CE1-CB 3.8Å; L328-N370 HydrophobicContact CD1-CB 4.46Å; L331-N370 HydrophobicContact CD2-CB 3.97Å; Y366-N370 WeakPolarHBondContact CD2-ND2 3.38Å; Y366-N370 WeakPolarHBondContact CE1-ND2 3.48Å; Y366-N370 WeakPolarHBondContact CE2-ND2 3.38Å; Y366-N370 PolarHBondContact O-N 3.02Å; Y366-N370 PolarHBondContact O-ND2 3.46Å; Y367-N370 PolarHBondContact O-N 3.27Å; N370-C373 PolarHBondContact O-N 3.24Å; N370-A374 WeakPolarHBondContact O-CB 3.47Å; N370-A374 PolarHBondContact O-N 2.89Å
371L95.7Very high92Very high3 Ų335 Ų352%0.01620%0.202CC..Hα-helixtrans-60.7-47173.1178.165.6000110.8I287 L303 L331 V335 I343 V347 Y367 F368 T369 C373 A374 L375I287-L371 HydrophobicContact CD1-CD1 4.33Å; L303-L371 HydrophobicContact CD1-CB 4.33Å; L303-L371 HydrophobicContact CD1-CD2 3.9Å; L303-L371 HydrophobicContact CD2-CB 4.26Å; L303-L371 HydrophobicContact CD2-CD2 3.85Å; L331-L371 HydrophobicContact CD2-CB 4.49Å; V335-L371 HydrophobicContact CG2-CD1 3.99Å; I343-L371 HydrophobicContact CD1-CD2 4.4Å; V347-L371 HydrophobicContact CG2-CD2 3.94Å; V347-L371 HydrophobicContact CG2-CG 4.48Å; Y367-L371 WeakPolarHBondContact O-CB 3.32Å; Y367-L371 PolarHBondContact O-N 3.35Å; F368-L371 PolarHBondContact O-N 3.28Å; T369-L371 VanDerWaalsContact C-N 3.34Å; T369-L371 PolarHBondContact O-N 3.08Å; L371-C373 VanDerWaalsContact C-N 3.31Å; L371-C373 PolarHBondContact O-N 3.22Å; L371-A374 PolarHBondContact O-N 3.27Å; L371-A374 VanDerWaalsContact O-N 3.17Å; L371-L375 HydrophobicContact CD1-CD1 4.11Å; L371-L375 HydrophobicContact CD1-CD2 4.48Å; L371-L375 HydrophobicContact CD1-CG 4.11Å; L371-L375 HydrophobicContact CG-CD1 3.9Å; L371-L375 HydrophobicContact CG-CG 4.32Å; L371-L375 VanDerWaalsContact O-CG 3.23Å; L371-L375 WeakPolarHBondContact O-CG 3.39Å; L371-L375 PolarHBondContact O-N 2.85Å
372C94.5Very high92.4Very high6 Ų634.2 Ų34.24%0.04119%0.192CC..Hα-helixtrans-59.5-42.7176.7-64.40000111.8W81 L84 F85 F368 T369 L375 N376W81-C372 HydrophobicContact CE3-CB 4.31Å; W81-C372 HydrophobicContact CZ3-CB 3.89Å; L84-C372 HydrophobicContact CD2-CB 4.35Å; F85-C372 HydrophobicContact CZ-CB 4.46Å; F368-C372 PolarHBondContact O-N 3.41Å; F368-C372 PolarHBondContact O-SG 2.93Å; T369-C372 WeakPolarHBondContact O-CB 3.28Å; T369-C372 PolarHBondContact O-N 3.46Å; C372-L375 PolarHBondContact O-N 2.87Å; C372-N376 WeakPolarHBondContact O-CB 3.28Å; C372-N376 PolarHBondContact O-N 3.08Å
373C93Very high92.5Very high58 Ų5831.9 Ų31.939%0.39217%0.166SC..Hα-helixtrans-61.6-44.7174.6-68.60000111.9L328 T369 N370 L371 N376 F377L328-C373 HydrophobicContact CD1-CB 4.4Å; T369-C373 PolarHBondContact O-N 2.87Å; T369-C373 PolarHBondContact O-SG 2.97Å; N370-C373 PolarHBondContact O-N 3.24Å; L371-C373 VanDerWaalsContact C-N 3.31Å; L371-C373 PolarHBondContact O-N 3.22Å; C373-N376 PolarHBondContact O-N 2.96Å; C373-F377 WeakPolarHBondContact O-CB 3.2Å; C373-F377 PolarHBondContact O-N 3.46Å
374A94.2Very high92.3Very high0 Ų034.3 Ų34.30%018%0.178CC..Hα-helixtrans-62.3-45.4178.700000111.8L328 L331 I332 N370 L371 F377 I378L328-A374 HydrophobicContact CD1-CB 4.15Å; L331-A374 HydrophobicContact CD2-CB 4.31Å; L331-A374 HydrophobicContact CG-CB 4.32Å; I332-A374 HydrophobicContact CG1-CB 3.61Å; N370-A374 WeakPolarHBondContact O-CB 3.47Å; N370-A374 PolarHBondContact O-N 2.89Å; L371-A374 PolarHBondContact O-N 3.27Å; L371-A374 VanDerWaalsContact O-N 3.17Å; A374-F377 WeakPolarHBondContact O-CB 3.31Å; A374-F377 PolarHBondContact O-N 3.23Å; A374-I378 VanDerWaalsContact O-CG1 3.29Å; A374-I378 WeakPolarHBondContact O-CG1 3.31Å; A374-I378 PolarHBondContact O-N 2.83Å
375L95.4Very high91.9Very high0 Ų036.1 Ų36.10%019%0.19CC..Hα-helixtrans-65.1-43.7178.5-65.1170.5000111.7W81 F250 V335 I343 L344 V347 L371 C372 F377 I378 Q379W81-L375 HydrophobicContact CH2-CB 3.35Å; W81-L375 HydrophobicContact CH2-CD1 3.82Å; W81-L375 HydrophobicContact CH2-CG 4.24Å; W81-L375 HydrophobicContact CZ2-CB 3.53Å; W81-L375 HydrophobicContact CZ3-CB 4.37Å; F250-L375 HydrophobicContact CE1-CD2 3.47Å; F250-L375 VanDerWaalsContact CE1-CD2 3.47Å; F250-L375 WeakPolarHBondContact CE2-O 3.48Å; F250-L375 HydrophobicContact CZ-CB 4.06Å; F250-L375 HydrophobicContact CZ-CD2 3.52Å; F250-L375 HydrophobicContact CZ-CG 4.4Å; V335-L375 HydrophobicContact CG1-CD2 3.86Å; I343-L375 HydrophobicContact CG1-CD1 3.91Å; I343-L375 HydrophobicContact CG1-CD2 3.91Å; I343-L375 HydrophobicContact CG2-CD2 4.02Å; L344-L375 HydrophobicContact CD2-CD1 4.5Å; V347-L375 HydrophobicContact CG2-CD1 3.69Å; L371-L375 HydrophobicContact CD1-CD1 4.11Å; L371-L375 HydrophobicContact CD1-CD2 4.48Å; L371-L375 HydrophobicContact CD1-CG 4.11Å; L371-L375 HydrophobicContact CG-CD1 3.9Å; L371-L375 HydrophobicContact CG-CG 4.32Å; L371-L375 VanDerWaalsContact O-CG 3.23Å; L371-L375 WeakPolarHBondContact O-CG 3.39Å; L371-L375 PolarHBondContact O-N 2.85Å; C372-L375 PolarHBondContact O-N 2.87Å; L375-F377 VanDerWaalsContact C-N 3.3Å; L375-F377 PolarHBondContact O-N 3.29Å; L375-I378 PolarHBondContact O-N 2.91Å; L375-Q379 PolarHBondContact O-N 3.24Å
376N93.2Very high91.5Very high30 Ų3036.9 Ų36.916%0.1619%0.193CC..Hα-helixtrans-62.7-37.7174.3-176.847.2000112.1W81 C372 C373 Q379 N380W81-N376 HydrophobicContact CD2-CB 3.82Å; W81-N376 HydrophobicContact CE3-CB 4.45Å; W81-N376 HydrophobicContact CG-CB 3.96Å; W81-N376 HydrophobicContact CZ2-CB 4.41Å; W81-N376 PolarHBondContact NE1-OD1 3.25Å; C372-N376 WeakPolarHBondContact O-CB 3.28Å; C372-N376 PolarHBondContact O-N 3.08Å; C373-N376 PolarHBondContact O-N 2.96Å; N376-Q379 PolarHBondContact O-N 2.93Å; N376-N380 PolarHBondContact O-N 3.13Å; N376-N380 PolarHBondContact O-ND2 3.18Å; N376-N380 PolarHBondContact OD1-ND2 3.01Å
377F92Very high91.1Very high72 Ų7239.1 Ų39.132%0.31621%0.205SC..Hα-helixtrans-63.5-48.8174.6178.6-97.8000111.3I332 C373 A374 L375 Q379 N380 L381I332-F377 HydrophobicContact CD1-CB 4.38Å; I332-F377 HydrophobicContact CD1-CD1 3.52Å; I332-F377 HydrophobicContact CD1-CE1 3.99Å; I332-F377 HydrophobicContact CD1-CG 4.05Å; I332-F377 HydrophobicContact CG1-CD1 4.18Å; I332-F377 HydrophobicContact CG2-CD1 4.15Å; I332-F377 HydrophobicContact CG2-CE1 4.35Å; C373-F377 WeakPolarHBondContact O-CB 3.2Å; C373-F377 PolarHBondContact O-N 3.46Å; A374-F377 WeakPolarHBondContact O-CB 3.31Å; A374-F377 PolarHBondContact O-N 3.23Å; L375-F377 VanDerWaalsContact C-N 3.3Å; L375-F377 PolarHBondContact O-N 3.29Å; F377-Q379 VanDerWaalsContact C-N 3.28Å; F377-Q379 PolarHBondContact O-N 3.33Å; F377-N380 CarbonylContact O-C 3.59Å; F377-N380 PolarHBondContact O-N 2.92Å; F377-N380 VanDerWaalsContact O-N 3.16Å; F377-L381 HydrophobicContact CD1-CD1 4.28Å; F377-L381 HydrophobicContact CE1-CD1 3.67Å; F377-L381 HydrophobicContact CE1-CG 4.29Å; F377-L381 HydrophobicContact CZ-CD1 4.31Å; F377-L381 WeakPolarHBondContact O-CB 3.4Å; F377-L381 PolarHBondContact O-N 3.44Å
378I93.5Very high90.5Very high0 Ų040 Ų400%021%0.21CC..Hα-helixtrans-58.6-41.5177.8-70165.8000111.1F250 I254 L257 I332 V335 L336 A374 L375 N380 L381F250-I378 HydrophobicContact CE2-CB 4.33Å; F250-I378 HydrophobicContact CE2-CG2 4.02Å; F250-I378 HydrophobicContact CZ-CB 4.14Å; F250-I378 HydrophobicContact CZ-CG2 3.89Å; I254-I378 HydrophobicContact CG1-CG2 3.97Å; L257-I378 HydrophobicContact CD1-CG2 4.24Å; I332-I378 HydrophobicContact CG2-CD1 4.27Å; I332-I378 HydrophobicContact CG2-CG1 4.01Å; V335-I378 HydrophobicContact CB-CD1 3.98Å; V335-I378 HydrophobicContact CG1-CD1 3.57Å; L336-I378 HydrophobicContact CD2-CD1 4.22Å; L336-I378 HydrophobicContact CD2-CG1 4.2Å; L336-I378 HydrophobicContact CD2-CG2 4.08Å; L336-I378 HydrophobicContact CG-CD1 4.11Å; L336-I378 HydrophobicContact CG-CG1 4.3Å; A374-I378 VanDerWaalsContact O-CG1 3.29Å; A374-I378 WeakPolarHBondContact O-CG1 3.31Å; A374-I378 PolarHBondContact O-N 2.83Å; L375-I378 PolarHBondContact O-N 2.91Å; I378-N380 VanDerWaalsContact C-N 3.33Å; I378-N380 PolarHBondContact O-N 2.9Å; I378-L381 WeakPolarHBondContact O-CB 3.41Å; I378-L381 PolarHBondContact O-N 3.1Å
379Q90.7Very high90.1Very high10 Ų1043.9 Ų43.95%0.04723%0.23CC..Hα-helixtrans-59.8-45.5178.1-170.8170.14.300111.6W76 F250 R253 L375 N376 F377W76-Q379 VanDerWaalsContact CB-NE2 3.26Å; W76-Q379 VanDerWaalsContact CD1-NE2 3.28Å; W76-Q379 HydrophobicContact CD2-CG 4.24Å; W76-Q379 HydrophobicContact CG-CG 4.29Å; F250-Q379 HydrophobicContact CD2-CB 4.44Å; F250-Q379 HydrophobicContact CE2-CB 4.06Å; R253-Q379 PolarHBondContact NE-O 3.35Å; R253-Q379 PolarHBondContact NH2-O 2.76Å; L375-Q379 PolarHBondContact O-N 3.24Å; N376-Q379 PolarHBondContact O-N 2.93Å; F377-Q379 VanDerWaalsContact C-N 3.28Å; F377-Q379 PolarHBondContact O-N 3.33Å
380N90.5Very high89.9Confident90 Ų9044.7 Ų44.748%0.48124%0.237SC..Hα-helixtrans-92.55.2-175.3-61.4-54.4000114.2N376 F377 I378 N382N376-N380 PolarHBondContact O-N 3.13Å; N376-N380 PolarHBondContact O-ND2 3.18Å; N376-N380 PolarHBondContact OD1-ND2 3.01Å; F377-N380 CarbonylContact O-C 3.59Å; F377-N380 PolarHBondContact O-N 2.92Å; F377-N380 VanDerWaalsContact O-N 3.16Å; I378-N380 VanDerWaalsContact C-N 3.33Å; I378-N380 PolarHBondContact O-N 2.9Å; N380-N382 PolarHBondContact O-N 2.71Å
381L89.6Confident89.7Confident0 Ų049 Ų490%026%0.26CS..  trans-61.9120.5-175.3-166.1156.5000110.9R253 L257 V260 F377 I378 L386 F393R253-L381 PolarHBondContact NH2-O 3.43Å; L257-L381 HydrophobicContact CD1-CB 3.98Å; L257-L381 HydrophobicContact CD1-CD1 4.4Å; L257-L381 HydrophobicContact CD1-CD2 4.34Å; L257-L381 HydrophobicContact CD1-CG 4.48Å; L257-L381 HydrophobicContact CD2-CD2 4.04Å; V260-L381 HydrophobicContact CG2-CD2 4.49Å; F377-L381 HydrophobicContact CD1-CD1 4.28Å; F377-L381 HydrophobicContact CE1-CD1 3.67Å; F377-L381 HydrophobicContact CE1-CG 4.29Å; F377-L381 HydrophobicContact CZ-CD1 4.31Å; F377-L381 WeakPolarHBondContact O-CB 3.4Å; F377-L381 PolarHBondContact O-N 3.44Å; I378-L381 WeakPolarHBondContact O-CB 3.41Å; I378-L381 PolarHBondContact O-N 3.1Å; L381-L386 HydrophobicContact CD2-CD1 3.88Å; L381-L386 HydrophobicContact CD2-CG 4.03Å; L381-F393 HydrophobicContact CD2-CE2 3.52Å; L381-F393 HydrophobicContact CD2-CZ 3.83Å
382N88.1Confident89.2Confident62 Ų6252.7 Ų52.733%0.33228%0.277SS..  trans-130.5175.7-17964.98.5000110.9N380 E384 S385 L386N380-N382 PolarHBondContact O-N 2.71Å; N382-E384 PolarHBondContact O-N 3Å; N382-E384 PolarHBondContact OD1-N 2.9Å; N382-S385 WeakPolarHBondContact O-CB 3.2Å; N382-S385 PolarHBondContact O-N 3.21Å; N382-S385 VanDerWaalsContact O-N 3.1Å; N382-S385 WeakPolarHBondContact OD1-CB 3.5Å; N382-S385 PolarHBondContact OD1-N 2.74Å; N382-S385 PolarHBondContact OD1-OG 3.5Å; N382-L386 PolarHBondContact O-N 3.01Å
383A86.1Confident88.9Confident10 Ų1053.5 Ų53.58%0.08328%0.28CS..THydrogen-bonded Turntrans-57.6-36.5179.200000112.8S385 L386 K387 M388 P390 F393A383-S385 VanDerWaalsContact C-N 3.34Å; A383-S385 PolarHBondContact O-N 3.01Å; A383-L386 CarbonylContact O-C 3.31Å; A383-L386 PolarHBondContact O-N 2.99Å; A383-K387 PolarHBondContact O-N 3.22Å; A383-M388 HydrophobicContact CB-CG 4.21Å; A383-M388 PolarHBondContact O-N 3.27Å; A383-P390 HydrophobicContact CB-CB 4.22Å; A383-F393 HydrophobicContact CB-CB 3.64Å; A383-F393 HydrophobicContact CB-CD1 4.48Å; A383-F393 HydrophobicContact CB-CD2 4.24Å; A383-F393 HydrophobicContact CB-CG 3.88Å
384E86.2Confident88.6Confident160 Ų16057.1 Ų57.175%0.74829%0.291SS*.THydrogen-bonded Turntrans-63.6-39.3176.8-61.9178.1172.400112N382 L386 K387N382-E384 PolarHBondContact O-N 3Å; N382-E384 PolarHBondContact OD1-N 2.9Å; E384-L386 PolarHBondContact O-N 3.41Å; E384-K387 PolarHBondContact O-N 2.9Å
385S85Confident88.3Confident54 Ų5457.7 Ų57.738%0.37830%0.296SS..THydrogen-bonded Turntrans-61.8-32.4177.4-580000111.9N382 A383N382-S385 WeakPolarHBondContact O-CB 3.2Å; N382-S385 PolarHBondContact O-N 3.21Å; N382-S385 VanDerWaalsContact O-N 3.1Å; N382-S385 WeakPolarHBondContact OD1-CB 3.5Å; N382-S385 PolarHBondContact OD1-N 2.74Å; N382-S385 PolarHBondContact OD1-OG 3.5Å; A383-S385 VanDerWaalsContact C-N 3.34Å; A383-S385 PolarHBondContact O-N 3.01Å
386L82.3Confident87.8Confident20 Ų2059.2 Ų59.211%0.10530%0.302CS..THydrogen-bonded Turntrans-94.9-1.1176.7-63.4-178.2000113.7W259 V260 P264 L265 L381 N382 A383 E384 M388 F393W259-L386 HydrophobicContact CH2-CD1 3.54Å; W259-L386 HydrophobicContact CZ2-CD1 4.29Å; W259-L386 HydrophobicContact CZ3-CD1 4.14Å; V260-L386 HydrophobicContact CG1-CD1 4.15Å; V260-L386 HydrophobicContact CG1-CD2 4.07Å; V260-L386 HydrophobicContact CG2-CD1 3.88Å; P264-L386 HydrophobicContact CG-CD1 4.2Å; P264-L386 HydrophobicContact CG-CD2 3.95Å; L265-L386 HydrophobicContact CD1-CD2 4.44Å; L381-L386 HydrophobicContact CD2-CD1 3.88Å; L381-L386 HydrophobicContact CD2-CG 4.03Å; N382-L386 PolarHBondContact O-N 3.01Å; A383-L386 CarbonylContact O-C 3.31Å; A383-L386 PolarHBondContact O-N 2.99Å; E384-L386 PolarHBondContact O-N 3.41Å; L386-M388 VanDerWaalsContact C-N 3.28Å; L386-M388 HydrophobicContact CB-CG 4.06Å; L386-M388 HydrophobicContact CB-SD 3.92Å; L386-M388 HydrophobicContact CD1-SD 3.9Å; L386-M388 PolarHBondContact O-N 2.86Å; L386-F393 HydrophobicContact CD1-CD2 4.01Å; L386-F393 HydrophobicContact CD1-CE2 3.85Å
387K84.3Confident87.3Confident142 Ų14259.2 Ų59.262%0.61730%0.304SS*.THydrogen-bonded Turntrans51.643.6-175.9-40.7-143.5-153.6173.90113.2W5 A383 E384W5-K387 HydrophobicContact CE3-CD 4.3Å; W5-K387 VanDerWaalsContact CE3-CE 3.47Å; W5-K387 HydrophobicContact CH2-CB 3.78Å; W5-K387 HydrophobicContact CH2-CD 3.15Å; W5-K387 HydrophobicContact CH2-CG 3.57Å; W5-K387 HydrophobicContact CZ2-CB 3.75Å; W5-K387 HydrophobicContact CZ2-CD 3.82Å; W5-K387 HydrophobicContact CZ2-CG 3.69Å; W5-K387 HydrophobicContact CZ3-CD 3.45Å; W5-K387 VanDerWaalsContact CZ3-CD 3.45Å; W5-K387 HydrophobicContact CZ3-CG 4.23Å; A383-K387 PolarHBondContact O-N 3.22Å; E384-K387 PolarHBondContact O-N 2.9Å
388M84.2Confident86.9Confident38 Ų3859.3 Ų59.319%0.18731%0.313CS..SBendtrans-122168.3178.669-172.8-63.600111.7W259 A383 L386 E392 F393 Y396W259-M388 HydrophobicContact CH2-CE 3.94Å; W259-M388 HydrophobicContact CH2-SD 3.5Å; W259-M388 WeakPolarHBondContact CH2-SD 3.49Å; W259-M388 HydrophobicContact CZ3-CE 4.23Å; W259-M388 HydrophobicContact CZ3-SD 4.07Å; A383-M388 HydrophobicContact CB-CG 4.21Å; A383-M388 PolarHBondContact O-N 3.27Å; L386-M388 VanDerWaalsContact C-N 3.28Å; L386-M388 HydrophobicContact CB-CG 4.06Å; L386-M388 HydrophobicContact CB-SD 3.92Å; L386-M388 HydrophobicContact CD1-SD 3.9Å; L386-M388 PolarHBondContact O-N 2.86Å; M388-E392 HydrophobicContact CE-CB 4.04Å; M388-E392 HydrophobicContact CE-CG 3.71Å; M388-F393 HydrophobicContact CE-CB 4.13Å; M388-F393 HydrophobicContact CG-CB 4.09Å; M388-F393 HydrophobicContact CG-CD2 4.4Å; M388-F393 HydrophobicContact SD-CB 3.96Å; M388-F393 HydrophobicContact SD-CD2 3.78Å; M388-F393 HydrophobicContact SD-CG 4.38Å; M388-Y396 HydrophobicContact CE-CD2 3.81Å; M388-Y396 HydrophobicContact CE-CE2 4Å
389N87.2Confident86.3Confident82 Ų8262.3 Ų62.344%0.43934%0.343SS..  trans-66.5132.7178.4-173.112.3000110.2D391 E392 F393N389-D391 VanDerWaalsContact C-N 3.26Å; N389-D391 PolarHBondContact O-N 2.87Å; N389-E392 HydrophobicContact CB-CB 4.08Å; N389-E392 PolarHBondContact O-N 3.07Å; N389-E392 VanDerWaalsContact O-N 3.15Å; N389-F393 PolarHBondContact O-N 3.39Å
390P89.1Confident85.8Confident80 Ų8069.4 Ų69.452%0.51938%0.377SS..Hα-helixtrans-50.4-41.5173.417.2-34.1000114.2A383 E392 F393 E394A383-P390 HydrophobicContact CB-CB 4.22Å; P390-E392 VanDerWaalsContact C-N 3.33Å; P390-E392 PolarHBondContact O-N 2.9Å; P390-F393 WeakPolarHBondContact O-CB 3.34Å; P390-F393 PolarHBondContact O-N 3.04Å; P390-E394 WeakPolarHBondContact O-CB 3.37Å; P390-E394 PolarHBondContact O-N 3.32Å
391D88.1Confident85.3Confident111 Ų11168.8 Ų68.859%0.59437%0.373SS*.Hα-helixtrans-65.4-39.3-179.2-57-34.9000111.7N389 A395N389-D391 VanDerWaalsContact C-N 3.26Å; N389-D391 PolarHBondContact O-N 2.87Å; D391-A395 VanDerWaalsContact O-CB 3.24Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 3.42Å
392E86.7Confident84.6Confident82 Ų8275.8 Ų75.838%0.38341%0.409SS..Hα-helixtrans-68.7-41.4177.5-173.5-177-172.200110.8M388 N389 P390 A395 Y396 L401M388-E392 HydrophobicContact CE-CB 4.04Å; M388-E392 HydrophobicContact CE-CG 3.71Å; N389-E392 HydrophobicContact CB-CB 4.08Å; N389-E392 PolarHBondContact O-N 3.07Å; N389-E392 VanDerWaalsContact O-N 3.15Å; P390-E392 VanDerWaalsContact C-N 3.33Å; P390-E392 PolarHBondContact O-N 2.9Å; E392-A395 PolarHBondContact O-N 3.09Å; E392-Y396 HydrophobicContact CG-CD2 3.99Å; E392-Y396 HydrophobicContact CG-CE2 3.53Å; E392-Y396 WeakPolarHBondContact O-CD2 3.48Å; E392-Y396 PolarHBondContact O-N 3.05Å; E392-L401 HydrophobicContact CG-CD1 4.41Å
393F88.2Confident83.9Confident22 Ų2274.7 Ų74.710%0.09641%0.405CS..Hα-helixtrans-60.7-45.8176178.2-86.3000111.6L257 W259 L381 A383 L386 M388 N389 P390 Y396 S397L257-F393 HydrophobicContact CD2-CE2 4.25Å; L257-F393 HydrophobicContact CD2-CZ 3.69Å; W259-F393 AromaticContact CH2-CD2 3.63Å; W259-F393 HydrophobicContact CH2-CD2 3.63Å; W259-F393 AromaticContact CH2-CE2 3.97Å; W259-F393 HydrophobicContact CH2-CE2 3.97Å; W259-F393 HydrophobicContact CH2-CG 4.48Å; W259-F393 AromaticContact CZ2-CD2 3.45Å; W259-F393 HydrophobicContact CZ2-CD2 3.45Å; W259-F393 VanDerWaalsContact CZ2-CD2 3.45Å; W259-F393 AromaticContact CZ2-CE2 3.53Å; W259-F393 HydrophobicContact CZ2-CE2 3.53Å; W259-F393 HydrophobicContact CZ2-CG 4.13Å; W259-F393 HydrophobicContact CZ2-CZ 4.28Å; L381-F393 HydrophobicContact CD2-CE2 3.52Å; L381-F393 HydrophobicContact CD2-CZ 3.83Å; A383-F393 HydrophobicContact CB-CB 3.64Å; A383-F393 HydrophobicContact CB-CD1 4.48Å; A383-F393 HydrophobicContact CB-CD2 4.24Å; A383-F393 HydrophobicContact CB-CG 3.88Å; L386-F393 HydrophobicContact CD1-CD2 4.01Å; L386-F393 HydrophobicContact CD1-CE2 3.85Å; M388-F393 HydrophobicContact CE-CB 4.13Å; M388-F393 HydrophobicContact CG-CB 4.09Å; M388-F393 HydrophobicContact CG-CD2 4.4Å; M388-F393 HydrophobicContact SD-CB 3.96Å; M388-F393 HydrophobicContact SD-CD2 3.78Å; M388-F393 HydrophobicContact SD-CG 4.38Å; N389-F393 PolarHBondContact O-N 3.39Å; P390-F393 WeakPolarHBondContact O-CB 3.34Å; P390-F393 PolarHBondContact O-N 3.04Å; F393-Y396 PolarHBondContact O-N 3.4Å; F393-S397 WeakPolarHBondContact O-CB 3.27Å; F393-S397 PolarHBondContact O-N 2.87Å; F393-S397 PolarHBondContact O-OG 3.28Å
394E86.8Confident82.9Confident134 Ų13477.2 Ų77.263%0.62642%0.42SS*.Hα-helixtrans-66.6-41.9178.3-171.2164.9-167.400110.7P390 Y396 S397 C398P390-E394 WeakPolarHBondContact O-CB 3.37Å; P390-E394 PolarHBondContact O-N 3.32Å; E394-Y396 VanDerWaalsContact C-N 3.35Å; E394-Y396 PolarHBondContact O-N 3.21Å; E394-S397 PolarHBondContact O-N 3.28Å; E394-S397 VanDerWaalsContact O-N 3.11Å; E394-C398 PolarHBondContact O-N 3.24Å; E394-C398 PolarHBondContact O-SG 2.99Å
395A86.4Confident81.7Confident12 Ų1274.8 Ų74.810%0.09941%0.412CS..Hα-helixtrans-60.8-38.5176.800000113.1D391 E392 C398 G399 Q400 L401D391-A395 VanDerWaalsContact O-CB 3.24Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 3.42Å; E392-A395 PolarHBondContact O-N 3.09Å; A395-C398 PolarHBondContact O-SG 2.79Å; A395-G399 PolarHBondContact O-N 2.98Å; A395-Q400 HydrophobicContact CB-CB 4.35Å; A395-Q400 PolarHBondContact O-N 3.43Å; A395-L401 HydrophobicContact CB-CB 4.39Å; A395-L401 HydrophobicContact CB-CD1 3.5Å; A395-L401 VanDerWaalsContact CB-CD1 3.5Å; A395-L401 HydrophobicContact CB-CG 3.86Å; A395-L401 PolarHBondContact O-N 2.85Å
396Y85Confident80.5Confident33 Ų3376.3 Ų76.313%0.12941%0.41CS..Hα-helixtrans-69.6-42.7170.2-73.1-57.2000112.6W259 M388 E392 F393 E394 C398 G399 L401 I402W259-Y396 HydrophobicContact CD2-CG 4.19Å; W259-Y396 HydrophobicContact CE3-CD2 4.2Å; W259-Y396 HydrophobicContact CE3-CG 4.09Å; W259-Y396 HydrophobicContact CH2-CD2 4.38Å; W259-Y396 HydrophobicContact CZ3-CD2 4.06Å; W259-Y396 HydrophobicContact CZ3-CG 4.39Å; M388-Y396 HydrophobicContact CE-CD2 3.81Å; M388-Y396 HydrophobicContact CE-CE2 4Å; E392-Y396 HydrophobicContact CG-CD2 3.99Å; E392-Y396 HydrophobicContact CG-CE2 3.53Å; E392-Y396 WeakPolarHBondContact O-CD2 3.48Å; E392-Y396 PolarHBondContact O-N 3.05Å; F393-Y396 PolarHBondContact O-N 3.4Å; E394-Y396 VanDerWaalsContact C-N 3.35Å; E394-Y396 PolarHBondContact O-N 3.21Å; Y396-C398 VanDerWaalsContact C-N 3.32Å; Y396-C398 PolarHBondContact O-N 3.41Å; Y396-G399 PolarHBondContact O-N 3.33Å; Y396-G399 VanDerWaalsContact O-N 3.15Å; Y396-L401 HydrophobicContact CD1-CB 3.49Å; Y396-L401 VanDerWaalsContact CD1-CB 3.49Å; Y396-L401 HydrophobicContact CE1-CB 3.46Å; Y396-L401 VanDerWaalsContact CE1-CB 3.46Å; Y396-L401 HydrophobicContact CE1-CD1 4.32Å; Y396-L401 HydrophobicContact CE1-CG 4.48Å; Y396-L401 HydrophobicContact CE2-CD1 4.5Å; Y396-L401 HydrophobicContact CG-CB 4.23Å; Y396-I402 WeakPolarHBondContact CE1-O 3.47Å
397S83.3Confident79.1Confident30 Ų3080.5 Ų80.521%0.2143%0.432CS..Hα-helixtrans-68.7-29.2-176.1-57.90000113.4W259 F393 E394W259-S397 PolarHBondContact NE1-OG 3.42Å; W259-S397 VanDerWaalsContact NE1-OG 3.14Å; F393-S397 WeakPolarHBondContact O-CB 3.27Å; F393-S397 PolarHBondContact O-N 2.87Å; F393-S397 PolarHBondContact O-OG 3.28Å; E394-S397 PolarHBondContact O-N 3.28Å; E394-S397 VanDerWaalsContact O-N 3.11Å
398C83.9Confident77.6Confident74 Ų7478 Ų7850%0.543%0.426SS..THydrogen-bonded Turntrans-91.1-1.8174.169.80000113.8E394 A395 Y396 Q400E394-C398 PolarHBondContact O-N 3.24Å; E394-C398 PolarHBondContact O-SG 2.99Å; A395-C398 PolarHBondContact O-SG 2.79Å; Y396-C398 VanDerWaalsContact C-N 3.32Å; Y396-C398 PolarHBondContact O-N 3.41Å; C398-Q400 WeakPolarHBondContact SG-CG 3.46Å
399G79.8Confident76.1Confident62 Ų6278.1 Ų78.164%0.63943%0.43SS*.THydrogen-bonded Turntrans76.815.1178.900000115.2A395 Y396A395-G399 PolarHBondContact O-N 2.98Å; Y396-G399 PolarHBondContact O-N 3.33Å; Y396-G399 VanDerWaalsContact O-N 3.15Å
400Q81.4Confident74.3Confident159 Ų15976.7 Ų76.774%0.74342%0.422SS*.SBendtrans-70.4-34.4171.8-75.6174.510.500112.1A395 C398A395-Q400 HydrophobicContact CB-CB 4.35Å; A395-Q400 PolarHBondContact O-N 3.43Å; C398-Q400 WeakPolarHBondContact SG-CG 3.46Å
401L78.9Confident72.4Confident77 Ų7777.5 Ų77.540%0.40342%0.419SS..SBendtrans-106.5141.6175.4-74.8170.5000111.2E392 A395 Y396E392-L401 HydrophobicContact CG-CD1 4.41Å; A395-L401 HydrophobicContact CB-CB 4.39Å; A395-L401 HydrophobicContact CB-CD1 3.5Å; A395-L401 VanDerWaalsContact CB-CD1 3.5Å; A395-L401 HydrophobicContact CB-CG 3.86Å; A395-L401 PolarHBondContact O-N 2.85Å; Y396-L401 HydrophobicContact CD1-CB 3.49Å; Y396-L401 VanDerWaalsContact CD1-CB 3.49Å; Y396-L401 HydrophobicContact CE1-CB 3.46Å; Y396-L401 VanDerWaalsContact CE1-CB 3.46Å; Y396-L401 HydrophobicContact CE1-CD1 4.32Å; Y396-L401 HydrophobicContact CE1-CG 4.48Å; Y396-L401 HydrophobicContact CE2-CD1 4.5Å; Y396-L401 HydrophobicContact CG-CB 4.23Å
402I75.2Confident70.8Confident148 Ų14873.4 Ų73.476%0.75940%0.403SS*.  trans-78.5123.5174.1-58.5171.6000108Y396Y396-I402 WeakPolarHBondContact CE1-O 3.47Å
403P73.1Confident69.4Low38 Ų3874.7 Ų74.725%0.24740%0.404CS..  trans-52.7138.6-179.8-26.435.3000111.4W259 C262 L405W259-P403 HydrophobicContact CB-CB 3.76Å; W259-P403 HydrophobicContact CB-CG 3.39Å; C262-P403 HydrophobicContact CB-CB 4.03Å; P403-L405 PolarHBondContact O-N 3.34Å
404P65.7Low68.1Low63 Ų6378.8 Ų78.841%0.40942%0.423SS..  trans-61.6113.9175.325.4-31000107.7C262 R406C262-P404 CarbonylContact C-O 3.59Å; P404-R406 PolarHBondContact O-N 3.42Å
405L61.4Low66.9Low109 Ų10974.9 Ų74.957%0.57141%0.414SS*.  trans-71.9116179.7-71.3168.9000108.4P403 D407 I416P403-L405 PolarHBondContact O-N 3.34Å; L405-D407 PolarHBondContact O-N 3.44Å; L405-I416 HydrophobicContact CD1-CD1 4.03Å; L405-I416 HydrophobicContact CD2-CD1 4.48Å
406R58.5Low66.2Low87 Ų8777.3 Ų77.333%0.32843%0.425SS..  trans-64.3127.6167.9-119.5176.1168.6-150.5-11.7109.9C262 D266 P404 N408 S409C262-R406 VanDerWaalsContact O-CB 3.31Å; C262-R406 WeakPolarHBondContact O-CB 3.35Å; C262-R406 PolarHBondContact O-N 3.44Å; D266-R406 VanDerWaalsContact CB-NH2 3.32Å; D266-R406 VanDerWaalsContact CG-CZ 3.43Å; D266-R406 IonicContact OD1-CZ 3.32Å; D266-R406 IonicContact OD1-NH1 3.33Å; D266-R406 PolarHBondContact OD1-NH1 3.25Å; D266-R406 IonicContact OD1-NH2 2.75Å; D266-R406 PolarHBondContact OD1-NH2 3.33Å; D266-R406 IonicContact OD2-CZ 3.93Å; D266-R406 IonicContact OD2-NH1 2.73Å; D266-R406 IonicContact OD2-NH2 3.2Å; D266-R406 PolarHBondContact OD2-NH2 3.35Å; P404-R406 PolarHBondContact O-N 3.42Å; R406-N408 PolarHBondContact O-N 3.47Å; R406-S409 PolarHBondContact O-N 3.05Å; R406-S409 PolarHBondContact O-OG 2.89Å
407D53.6Low65.5Low107 Ų10780.8 Ų80.857%0.57244%0.442SS*.THydrogen-bonded Turntrans-55.5-20.6174.8-80.1-28.6000113.6L405 R413L405-D407 PolarHBondContact O-N 3.44Å; D407-R413 WeakPolarHBondContact O-CD 3.22Å; D407-R413 PolarHBondContact O-NE 3.08Å; D407-R413 PolarHBondContact O-NH1 3.22Å; D407-R413 IonicContact OD1-CZ 2.71Å; D407-R413 IonicContact OD1-NE 3.8Å; D407-R413 IonicContact OD1-NH2 3.62Å; D407-R413 PolarHBondContact OD1-NH2 2.88Å; D407-R413 IonicContact OD2-NH2 3.77Å
408N52.3Low65.2Low91 Ų9182.6 Ų82.649%0.48746%0.455SS..THydrogen-bonded Turntrans-89.7-1.9-174.3-74.87.2000115.6L271 R406 L410L271-N408 WeakPolarHBondContact CB-O 3.36Å; R406-N408 PolarHBondContact O-N 3.47Å; N408-L410 PolarHBondContact O-N 2.87Å
409S53.5Low65.2Low39 Ų3984 Ų8427%0.27346%0.456SS..  trans-82.288.1176.165.10000110.8R406 H411 G412 R413R406-S409 PolarHBondContact O-N 3.05Å; R406-S409 PolarHBondContact O-OG 2.89Å; S409-H411 PolarHBondContact O-N 3.15Å; S409-H411 VanDerWaalsContact O-N 3.16Å; S409-G412 PolarHBondContact O-N 3.39Å; S409-G412 VanDerWaalsContact O-N 3.13Å; S409-R413 PolarHBondContact O-N 3.39Å
410L49.6Very low65.4Low52 Ų5285.6 Ų85.627%0.27245%0.447SS..Hα-helixtrans-52.4-37.9-178.7-17072.2000112.5L271 N408 R413 Q414L271-L410 VanDerWaalsContact O-CB 3.3Å; L271-L410 WeakPolarHBondContact O-CB 3.4Å; N408-L410 PolarHBondContact O-N 2.87Å; L410-R413 PolarHBondContact O-N 3.48Å; L410-Q414 WeakPolarHBondContact O-CB 3.38Å; L410-Q414 WeakPolarHBondContact O-CG 3.47Å; L410-Q414 PolarHBondContact O-N 3.16Å
411H49.4Very low65.7Low98 Ų9882.3 Ų82.345%0.45444%0.435SS..Hα-helixtrans-73.1-39.4-179.3-69.370.7000112.7V277 S409 A415V277-H411 WeakPolarHBondContact CG1-CE1 3.22Å; S409-H411 PolarHBondContact O-N 3.15Å; S409-H411 VanDerWaalsContact O-N 3.16Å; H411-A415 VanDerWaalsContact O-CB 3.28Å; H411-A415 WeakPolarHBondContact O-CB 3.2Å; H411-A415 PolarHBondContact O-N 3.38Å
412G53.6Low66.3Low25 Ų2581.6 Ų81.626%0.25844%0.436SS..Hα-helixtrans-64.4-44.5172.500000110.7S409 I416S409-G412 PolarHBondContact O-N 3.39Å; S409-G412 VanDerWaalsContact O-N 3.13Å; G412-I416 WeakPolarHBondContact O-CB 3.44Å; G412-I416 WeakPolarHBondContact O-CD1 3.48Å; G412-I416 WeakPolarHBondContact O-CG1 3.41Å; G412-I416 PolarHBondContact O-N 3.2Å
413R57.4Low67.1Low109 Ų10979.6 Ų79.641%0.41143%0.426SS..Hα-helixtrans-63.2-48.2176.2-84.2-176167.2-179.3-6.8112.6D407 S409 L410 A415 I416 E417D407-R413 WeakPolarHBondContact O-CD 3.22Å; D407-R413 PolarHBondContact O-NE 3.08Å; D407-R413 PolarHBondContact O-NH1 3.22Å; D407-R413 IonicContact OD1-CZ 2.71Å; D407-R413 IonicContact OD1-NE 3.8Å; D407-R413 IonicContact OD1-NH2 3.62Å; D407-R413 PolarHBondContact OD1-NH2 2.88Å; D407-R413 IonicContact OD2-NH2 3.77Å; S409-R413 PolarHBondContact O-N 3.39Å; L410-R413 PolarHBondContact O-N 3.48Å; R413-A415 PolarHBondContact O-N 3.11Å; R413-I416 PolarHBondContact O-N 2.98Å; R413-E417 WeakPolarHBondContact O-CA 3.46Å; R413-E417 WeakPolarHBondContact O-CB 3.43Å; R413-E417 VanDerWaalsContact O-CG 3.27Å; R413-E417 WeakPolarHBondContact O-CG 3.48Å; R413-E417 PolarHBondContact O-N 3.23Å
414Q60.5Low68.1Low107 Ų10784 Ų8450%0.544%0.442SS..Hα-helixtrans-64.4-41.8179.7-76.3178-0.700112.2L410 S418L410-Q414 WeakPolarHBondContact O-CB 3.38Å; L410-Q414 WeakPolarHBondContact O-CG 3.47Å; L410-Q414 PolarHBondContact O-N 3.16Å; Q414-S418 WeakPolarHBondContact O-CB 3.13Å; Q414-S418 PolarHBondContact O-N 2.9Å
415A62.8Low69.4Low52 Ų5283.8 Ų83.843%0.4345%0.446SS..Hα-helixtrans-66.1-44.3176.200000111.4H411 R413 S418 I419H411-A415 VanDerWaalsContact O-CB 3.28Å; H411-A415 WeakPolarHBondContact O-CB 3.2Å; H411-A415 PolarHBondContact O-N 3.38Å; R413-A415 PolarHBondContact O-N 3.11Å; A415-S418 PolarHBondContact O-N 3.21Å; A415-I419 WeakPolarHBondContact O-CB 3.34Å; A415-I419 WeakPolarHBondContact O-CD1 3.45Å; A415-I419 WeakPolarHBondContact O-CG1 3.47Å; A415-I419 PolarHBondContact O-N 3.09Å
416I70.7Confident71Confident64 Ų6483.6 Ų83.633%0.32845%0.445SS..Hα-helixtrans-68.1-42178.2-68.8168.5000111L405 G412 R413 I419 Q420L405-I416 HydrophobicContact CD1-CD1 4.03Å; L405-I416 HydrophobicContact CD2-CD1 4.48Å; G412-I416 WeakPolarHBondContact O-CB 3.44Å; G412-I416 WeakPolarHBondContact O-CD1 3.48Å; G412-I416 WeakPolarHBondContact O-CG1 3.41Å; G412-I416 PolarHBondContact O-N 3.2Å; R413-I416 PolarHBondContact O-N 2.98Å; I416-I419 PolarHBondContact O-N 2.94Å; I416-Q420 HydrophobicContact CG2-CG 4.16Å; I416-Q420 VanDerWaalsContact O-CB 3.26Å; I416-Q420 WeakPolarHBondContact O-CB 3.27Å; I416-Q420 WeakPolarHBondContact O-CG 3.5Å; I416-Q420 PolarHBondContact O-N 3.34Å
417E70.3Confident72.8Confident105 Ų10586.2 Ų86.249%0.49146%0.458SS..Hα-helixtrans-64.1-42.8175.3-79.9-177.7170.300110.8R413 Q420 N421R413-E417 WeakPolarHBondContact O-CA 3.46Å; R413-E417 WeakPolarHBondContact O-CB 3.43Å; R413-E417 VanDerWaalsContact O-CG 3.27Å; R413-E417 WeakPolarHBondContact O-CG 3.48Å; R413-E417 PolarHBondContact O-N 3.23Å; E417-Q420 PolarHBondContact O-N 2.74Å; E417-N421 VanDerWaalsContact O-CB 3.24Å; E417-N421 WeakPolarHBondContact O-CB 3.38Å; E417-N421 PolarHBondContact O-N 2.94Å; E417-N421 PolarHBondContact O-ND2 3.23Å; E417-N421 VanDerWaalsContact O-ND2 3.15Å
418S78.1Confident74.8Confident69 Ų6985 Ų8548%0.48346%0.455SS..Hα-helixtrans-58.3-50.6173.2-1780000110.6Q414 A415 Q420 N421 S422Q414-S418 WeakPolarHBondContact O-CB 3.13Å; Q414-S418 PolarHBondContact O-N 2.9Å; A415-S418 PolarHBondContact O-N 3.21Å; S418-Q420 PolarHBondContact O-N 3.19Å; S418-N421 PolarHBondContact O-N 3.07Å; S418-S422 WeakPolarHBondContact O-CB 3.23Å; S418-S422 PolarHBondContact O-N 2.7Å; S418-S422 PolarHBondContact O-OG 2.94Å; S418-S422 VanDerWaalsContact O-OG 3.05Å
419I84.2Confident76.9Confident102 Ų10286 Ų8652%0.52346%0.459SS..Hα-helixtrans-61-43.6176.5-69.8164.7000111.2A415 I416 N421 S422 L423A415-I419 WeakPolarHBondContact O-CB 3.34Å; A415-I419 WeakPolarHBondContact O-CD1 3.45Å; A415-I419 WeakPolarHBondContact O-CG1 3.47Å; A415-I419 PolarHBondContact O-N 3.09Å; I416-I419 PolarHBondContact O-N 2.94Å; I419-N421 VanDerWaalsContact C-N 3.33Å; I419-N421 PolarHBondContact O-N 3.4Å; I419-S422 PolarHBondContact O-N 2.86Å; I419-L423 HydrophobicContact CG2-CD1 4.01Å; I419-L423 HydrophobicContact CG2-CG 4.35Å; I419-L423 WeakPolarHBondContact O-CB 3.31Å; I419-L423 VanDerWaalsContact O-CG 3.3Å; I419-L423 WeakPolarHBondContact O-CG 3.45Å; I419-L423 PolarHBondContact O-N 3.46Å
420Q83.8Confident78.9Confident96 Ų9689.6 Ų89.645%0.44947%0.472SS..Hα-helixtrans-63.7-39.7178-78.4178.54.900111.5I416 E417 S418 L423 K424I416-Q420 HydrophobicContact CG2-CG 4.16Å; I416-Q420 VanDerWaalsContact O-CB 3.26Å; I416-Q420 WeakPolarHBondContact O-CB 3.27Å; I416-Q420 WeakPolarHBondContact O-CG 3.5Å; I416-Q420 PolarHBondContact O-N 3.34Å; E417-Q420 PolarHBondContact O-N 2.74Å; S418-Q420 PolarHBondContact O-N 3.19Å; Q420-L423 PolarHBondContact O-N 2.73Å; Q420-K424 WeakPolarHBondContact O-CB 3.44Å; Q420-K424 VanDerWaalsContact O-CG 3.29Å; Q420-K424 WeakPolarHBondContact O-CG 3.36Å; Q420-K424 PolarHBondContact O-N 3.18Å
421N87.1Confident81.1Confident90 Ų9090.9 Ų90.948%0.48148%0.479SS..Hα-helixtrans-68.8-41.9176.2-70.2-23.6000110.8E417 S418 I419 L423 K424 A425E417-N421 VanDerWaalsContact O-CB 3.24Å; E417-N421 WeakPolarHBondContact O-CB 3.38Å; E417-N421 PolarHBondContact O-N 2.94Å; E417-N421 PolarHBondContact O-ND2 3.23Å; E417-N421 VanDerWaalsContact O-ND2 3.15Å; S418-N421 PolarHBondContact O-N 3.07Å; I419-N421 VanDerWaalsContact C-N 3.33Å; I419-N421 PolarHBondContact O-N 3.4Å; N421-L423 VanDerWaalsContact C-N 3.34Å; N421-L423 PolarHBondContact O-N 3.32Å; N421-K424 PolarHBondContact O-N 3.14Å; N421-A425 WeakPolarHBondContact O-CB 3.3Å; N421-A425 PolarHBondContact O-N 3.42Å
422S91.1Very high83.3Confident62 Ų6291.7 Ų91.743%0.43448%0.483SS..Hα-helixtrans-60.5-42.2171.7-61.60000111.6S418 I419 A425 L426S418-S422 WeakPolarHBondContact O-CB 3.23Å; S418-S422 PolarHBondContact O-N 2.7Å; S418-S422 PolarHBondContact O-OG 2.94Å; S418-S422 VanDerWaalsContact O-OG 3.05Å; I419-S422 PolarHBondContact O-N 2.86Å; S422-A425 PolarHBondContact O-N 3.37Å; S422-L426 WeakPolarHBondContact O-CB 3.43Å; S422-L426 VanDerWaalsContact O-CG 3.27Å; S422-L426 WeakPolarHBondContact O-CG 3.45Å; S422-L426 PolarHBondContact O-N 3.46Å
423L93.3Very high85.3Confident106 Ų10693 Ų9356%0.55549%0.492SS*.Hα-helixtrans-65.8-40.4176.4-76.2173.1000112.2I419 Q420 N421 L426 K427I419-L423 HydrophobicContact CG2-CD1 4.01Å; I419-L423 HydrophobicContact CG2-CG 4.35Å; I419-L423 WeakPolarHBondContact O-CB 3.31Å; I419-L423 VanDerWaalsContact O-CG 3.3Å; I419-L423 WeakPolarHBondContact O-CG 3.45Å; I419-L423 PolarHBondContact O-N 3.46Å; Q420-L423 PolarHBondContact O-N 2.73Å; N421-L423 VanDerWaalsContact C-N 3.34Å; N421-L423 PolarHBondContact O-N 3.32Å; L423-L426 PolarHBondContact O-N 2.85Å; L423-K427 WeakPolarHBondContact O-CB 3.49Å; L423-K427 PolarHBondContact O-N 3.12Å
424K93Very high87.2Confident130 Ų13090.4 Ų90.457%0.56549%0.489SS*.Hα-helixtrans-62.7-46173.2-74.1170.4-173.7169.60111Q420 N421 K427 V428Q420-K424 WeakPolarHBondContact O-CB 3.44Å; Q420-K424 VanDerWaalsContact O-CG 3.29Å; Q420-K424 WeakPolarHBondContact O-CG 3.36Å; Q420-K424 PolarHBondContact O-N 3.18Å; N421-K424 PolarHBondContact O-N 3.14Å; K424-K427 PolarHBondContact O-N 3.33Å; K424-V428 WeakPolarHBondContact O-CG2 3.47Å; K424-V428 PolarHBondContact O-N 3.3Å
425A93.9Very high88.9Confident60 Ų6089.3 Ų89.350%0.49649%0.486SS..Hα-helixtrans-62.3-43177.200000111.7N421 S422 K427 V428 L429N421-A425 WeakPolarHBondContact O-CB 3.3Å; N421-A425 PolarHBondContact O-N 3.42Å; S422-A425 PolarHBondContact O-N 3.37Å; A425-K427 VanDerWaalsContact C-N 3.31Å; A425-K427 PolarHBondContact O-N 2.84Å; A425-V428 PolarHBondContact O-N 3.12Å; A425-L429 WeakPolarHBondContact O-CB 3.4Å; A425-L429 PolarHBondContact O-N 3.14Å
426L94.6Very high90.5Very high105 Ų10592.2 Ų92.255%0.5549%0.494SS..Hα-helixtrans-61.3-38.9174.8-79.1170.2000112.2S422 L423 L429 H430S422-L426 WeakPolarHBondContact O-CB 3.43Å; S422-L426 VanDerWaalsContact O-CG 3.27Å; S422-L426 WeakPolarHBondContact O-CG 3.45Å; S422-L426 PolarHBondContact O-N 3.46Å; L423-L426 PolarHBondContact O-N 2.85Å; L426-L429 PolarHBondContact O-N 2.91Å; L426-H430 VanDerWaalsContact O-CB 3.29Å; L426-H430 WeakPolarHBondContact O-CB 3.19Å; L426-H430 PolarHBondContact O-N 2.9Å
427K95.6Very high91.7Very high142 Ų14294.5 Ų94.562%0.61751%0.506SS*.Hα-helixtrans-66-44.2176.5-172174.8-179.9178.10112L423 K424 A425 H430 D431L423-K427 WeakPolarHBondContact O-CB 3.49Å; L423-K427 PolarHBondContact O-N 3.12Å; K424-K427 PolarHBondContact O-N 3.33Å; A425-K427 VanDerWaalsContact C-N 3.31Å; A425-K427 PolarHBondContact O-N 2.84Å; K427-H430 PolarHBondContact O-N 3.23Å; K427-D431 VanDerWaalsContact O-CG 3.3Å; K427-D431 PolarHBondContact O-N 2.91Å
428V95.9Very high93Very high82 Ų8296 Ų9650%0.49751%0.513SS..Hα-helixtrans-60.8-46.5175173.90000110.5K424 A425 H430 D431 E432K424-V428 WeakPolarHBondContact O-CG2 3.47Å; K424-V428 PolarHBondContact O-N 3.3Å; A425-V428 PolarHBondContact O-N 3.12Å; V428-H430 VanDerWaalsContact C-N 3.32Å; V428-H430 PolarHBondContact O-N 2.99Å; V428-D431 PolarHBondContact O-N 3.44Å; V428-E432 WeakPolarHBondContact O-CG 3.18Å; V428-E432 PolarHBondContact O-N 3.32Å
429L95.9Very high93.9Very high110 Ų11099.1 Ų99.158%0.57652%0.518SS*.Hα-helixtrans-60.3-41.8177.6-167.783.7000111.8A425 L426 E432 A433A425-L429 WeakPolarHBondContact O-CB 3.4Å; A425-L429 PolarHBondContact O-N 3.14Å; L426-L429 PolarHBondContact O-N 2.91Å; L429-E432 PolarHBondContact O-N 2.83Å; L429-A433 VanDerWaalsContact O-CB 3.31Å; L429-A433 WeakPolarHBondContact O-CB 3.31Å; L429-A433 PolarHBondContact O-N 3.04Å
430H96.5Very high94.4Very high116 Ų11696.8 Ų96.854%0.53751%0.514SS..Hα-helixtrans-61.5-47.7176.2173.3-81.5000111.5L426 K427 V428 E432 A433 C434L426-H430 VanDerWaalsContact O-CB 3.29Å; L426-H430 WeakPolarHBondContact O-CB 3.19Å; L426-H430 PolarHBondContact O-N 2.9Å; K427-H430 PolarHBondContact O-N 3.23Å; V428-H430 VanDerWaalsContact C-N 3.32Å; V428-H430 PolarHBondContact O-N 2.99Å; H430-E432 PolarHBondContact O-N 3.14Å; H430-A433 PolarHBondContact O-N 2.68Å; H430-C434 VanDerWaalsContact CE1-SG 3.55Å; H430-C434 PolarHBondContact O-N 3.34Å; H430-C434 PolarHBondContact O-SG 2.77Å
431D96.1Very high95Very high79 Ų7996.4 Ų96.442%0.42252%0.515SS..Hα-helixtrans-64.9-39.9-179.3-66.9-16.1000111.3K427 V428 C434 I435K427-D431 VanDerWaalsContact O-CG 3.3Å; K427-D431 PolarHBondContact O-N 2.91Å; V428-D431 PolarHBondContact O-N 3.44Å; D431-C434 PolarHBondContact O-N 3.48Å; D431-I435 WeakPolarHBondContact O-CG1 3.18Å; D431-I435 PolarHBondContact O-N 3.21Å; D431-I435 VanDerWaalsContact O-N 3.08Å
432E95.9Very high95.4Very high114 Ų11499 Ų9953%0.53352%0.522SS..Hα-helixtrans-63.5-42.7172.8-74.5-177177.400112.4V428 L429 H430 C434 I435 L436V428-E432 WeakPolarHBondContact O-CG 3.18Å; V428-E432 PolarHBondContact O-N 3.32Å; L429-E432 PolarHBondContact O-N 2.83Å; H430-E432 PolarHBondContact O-N 3.14Å; E432-C434 VanDerWaalsContact C-N 3.35Å; E432-C434 PolarHBondContact O-N 2.83Å; E432-I435 PolarHBondContact O-N 2.64Å; E432-L436 WeakPolarHBondContact O-CG 3.23Å; E432-L436 PolarHBondContact O-N 2.83Å
433A95.4Very high95.6Very high54 Ų54101.4 Ų101.445%0.44653%0.529SS..Hα-helixtrans-62.4-40.7176.500000111.9L429 H430 L436 L437L429-A433 VanDerWaalsContact O-CB 3.31Å; L429-A433 WeakPolarHBondContact O-CB 3.31Å; L429-A433 PolarHBondContact O-N 3.04Å; H430-A433 PolarHBondContact O-N 2.68Å; A433-L436 PolarHBondContact O-N 3.29Å; A433-L437 WeakPolarHBondContact O-CB 3.3Å; A433-L437 PolarHBondContact O-N 3.44Å
434C96.8Very high95.7Very high54 Ų54101.6 Ų101.637%0.36553%0.527SS..Hα-helixtrans-62-43.3174.1-740000112.1H430 D431 E432 L437 Q438H430-C434 VanDerWaalsContact CE1-SG 3.55Å; H430-C434 PolarHBondContact O-N 3.34Å; H430-C434 PolarHBondContact O-SG 2.77Å; D431-C434 PolarHBondContact O-N 3.48Å; E432-C434 VanDerWaalsContact C-N 3.35Å; E432-C434 PolarHBondContact O-N 2.83Å; C434-L437 PolarHBondContact O-N 3.31Å; C434-Q438 WeakPolarHBondContact O-CG 3.3Å; C434-Q438 PolarHBondContact O-N 2.87Å
435I96.4Very high95.8Very high84 Ų84101.5 Ų101.543%0.43153%0.529SS..Hα-helixtrans-64.3-42.5177.2-68.6166.2000110.8D431 E432 Q438 K439D431-I435 WeakPolarHBondContact O-CG1 3.18Å; D431-I435 PolarHBondContact O-N 3.21Å; D431-I435 VanDerWaalsContact O-N 3.08Å; E432-I435 PolarHBondContact O-N 2.64Å; I435-Q438 PolarHBondContact O-N 3.45Å; I435-K439 HydrophobicContact CG2-CD 4.26Å; I435-K439 WeakPolarHBondContact O-CG 3.35Å; I435-K439 PolarHBondContact O-N 3.4Å
436L95.9Very high96Very high113 Ų113102 Ų10259%0.59253%0.526SS*.Hα-helixtrans-63.4-42.7177-75.3172.8000111.8E432 A433 Q438 K439 A440E432-L436 WeakPolarHBondContact O-CG 3.23Å; E432-L436 PolarHBondContact O-N 2.83Å; A433-L436 PolarHBondContact O-N 3.29Å; L436-Q438 VanDerWaalsContact C-N 3.35Å; L436-Q438 PolarHBondContact O-N 3.3Å; L436-K439 PolarHBondContact O-N 2.9Å; L436-A440 WeakPolarHBondContact O-CB 3.24Å; L436-A440 PolarHBondContact O-N 3.14Å
437L96.7Very high96Very high111 Ų111101.1 Ų101.158%0.58153%0.525SS*.Hα-helixtrans-62.1-42.2176.7-171.668.1000111.6A433 C434 K439 A440 N441A433-L437 WeakPolarHBondContact O-CB 3.3Å; A433-L437 PolarHBondContact O-N 3.44Å; C434-L437 PolarHBondContact O-N 3.31Å; L437-K439 PolarHBondContact O-N 3.45Å; L437-A440 PolarHBondContact O-N 3.11Å; L437-N441 VanDerWaalsContact O-CG 3.29Å; L437-N441 PolarHBondContact O-N 3.32Å
438Q96.4Very high96Very high137 Ų13799.8 Ų99.864%0.6452%0.521SS*.Hα-helixtrans-61.8-42174.7-74177-8.100112.3C434 I435 L436 K442C434-Q438 WeakPolarHBondContact O-CG 3.3Å; C434-Q438 PolarHBondContact O-N 2.87Å; I435-Q438 PolarHBondContact O-N 3.45Å; L436-Q438 VanDerWaalsContact C-N 3.35Å; L436-Q438 PolarHBondContact O-N 3.3Å; Q438-K442 WeakPolarHBondContact O-CB 3.28Å; Q438-K442 PolarHBondContact O-N 3.14Å
439K96.3Very high96Very high134 Ų134100 Ų10058%0.58352%0.522SS*.Hα-helixtrans-65.5-40.1176.3-72.9175.5-179.5177.60111.9I435 L436 L437 K442 L443I435-K439 HydrophobicContact CG2-CD 4.26Å; I435-K439 WeakPolarHBondContact O-CG 3.35Å; I435-K439 PolarHBondContact O-N 3.4Å; L436-K439 PolarHBondContact O-N 2.9Å; L437-K439 PolarHBondContact O-N 3.45Å; K439-K442 PolarHBondContact O-N 3.13Å; K439-L443 WeakPolarHBondContact O-CB 3.36Å; K439-L443 PolarHBondContact O-N 3.09Å
440A95.4Very high95.9Very high53 Ų5397.4 Ų97.444%0.43852%0.516SS..Hα-helixtrans-63-47.317700000111.4L436 L437 K442 L443 E444L436-A440 WeakPolarHBondContact O-CB 3.24Å; L436-A440 PolarHBondContact O-N 3.14Å; L437-A440 PolarHBondContact O-N 3.11Å; A440-K442 VanDerWaalsContact C-N 3.32Å; A440-K442 PolarHBondContact O-N 3.49Å; A440-L443 WeakPolarHBondContact O-CB 3.14Å; A440-L443 PolarHBondContact O-N 2.76Å; A440-L443 VanDerWaalsContact O-N 3.16Å; A440-E444 PolarHBondContact O-N 3.41Å
441N96Very high95.8Very high89 Ų8993.5 Ų93.548%0.47651%0.505SS..Hα-helixtrans-61.1-40.9176.9-68.6-10.3000111.9L437 E444 E445L437-N441 VanDerWaalsContact O-CG 3.29Å; L437-N441 PolarHBondContact O-N 3.32Å; N441-E444 PolarHBondContact O-N 2.99Å; N441-E445 PolarHBondContact O-N 3.26Å
442K96.1Very high95.7Very high145 Ų14591.4 Ų91.463%0.6350%0.498SS*.Hα-helixtrans-64.8-40.6175.9-173175.2-177.3177.10111.9Q438 K439 A440 E444 E445 T446Q438-K442 WeakPolarHBondContact O-CB 3.28Å; Q438-K442 PolarHBondContact O-N 3.14Å; K439-K442 PolarHBondContact O-N 3.13Å; A440-K442 VanDerWaalsContact C-N 3.32Å; A440-K442 PolarHBondContact O-N 3.49Å; K442-E444 VanDerWaalsContact C-N 3.35Å; K442-E445 PolarHBondContact O-N 3.3Å; K442-T446 WeakPolarHBondContact O-CG2 3.36Å; K442-T446 PolarHBondContact O-N 2.8Å; K442-T446 VanDerWaalsContact O-N 3.09Å; K442-T446 PolarHBondContact O-OG1 3.31Å
443L95Very high95.6Very high112 Ų11291.4 Ų91.459%0.58650%0.498SS*.Hα-helixtrans-63-44.3175.9-179.262.6000110.7K439 A440 E445 T446 V447K439-L443 WeakPolarHBondContact O-CB 3.36Å; K439-L443 PolarHBondContact O-N 3.09Å; A440-L443 WeakPolarHBondContact O-CB 3.14Å; A440-L443 PolarHBondContact O-N 2.76Å; A440-L443 VanDerWaalsContact O-N 3.16Å; L443-E445 VanDerWaalsContact C-N 3.35Å; L443-E445 PolarHBondContact O-N 3.41Å; L443-T446 WeakPolarHBondContact CA-OG1 3.28Å; L443-T446 PolarHBondContact O-N 2.86Å; L443-T446 PolarHBondContact O-OG1 2.99Å; L443-V447 HydrophobicContact CD1-CG2 4.19Å; L443-V447 HydrophobicContact CG-CG2 4.37Å; L443-V447 WeakPolarHBondContact O-CG2 3.43Å; L443-V447 PolarHBondContact O-N 3.21Å
444E96.2Very high95.5Very high110 Ų11092 Ų9251%0.51450%0.498SS..Hα-helixtrans-56-47.8176.4-172.9179.9176.300111.9A440 N441 K442 T446 V447 Q448A440-E444 PolarHBondContact O-N 3.41Å; N441-E444 PolarHBondContact O-N 2.99Å; K442-E444 VanDerWaalsContact C-N 3.35Å; E444-T446 PolarHBondContact O-N 2.93Å; E444-V447 PolarHBondContact O-N 3.26Å; E444-Q448 WeakPolarHBondContact O-CG 3.49Å; E444-Q448 PolarHBondContact O-N 2.79Å; E444-Q448 PolarHBondContact OE1-NE2 2.9Å
445E95.7Very high95.3Very high128 Ų12896.2 Ų96.260%0.59851%0.506SS*.Hα-helixtrans-59.4-44.1176.5-172.6-177.3-176.900112N441 K442 L443 V447 Q448 T449N441-E445 PolarHBondContact O-N 3.26Å; K442-E445 PolarHBondContact O-N 3.3Å; L443-E445 VanDerWaalsContact C-N 3.35Å; L443-E445 PolarHBondContact O-N 3.41Å; E445-V447 PolarHBondContact O-N 2.81Å; E445-Q448 PolarHBondContact O-N 3.47Å; E445-T449 WeakPolarHBondContact O-CB 3.37Å; E445-T449 PolarHBondContact O-N 3.43Å; E445-T449 PolarHBondContact O-OG1 3.01Å
446T96.3Very high95.1Very high71 Ų7197 Ų9744%0.43651%0.511SS..Hα-helixtrans-65.3-39.5178.356.90000112.7K442 L443 E444 T449 A450K442-T446 WeakPolarHBondContact O-CG2 3.36Å; K442-T446 PolarHBondContact O-N 2.8Å; K442-T446 VanDerWaalsContact O-N 3.09Å; K442-T446 PolarHBondContact O-OG1 3.31Å; L443-T446 WeakPolarHBondContact CA-OG1 3.28Å; L443-T446 PolarHBondContact O-N 2.86Å; L443-T446 PolarHBondContact O-OG1 2.99Å; E444-T446 PolarHBondContact O-N 2.93Å; T446-T449 PolarHBondContact O-N 3.37Å; T446-A450 WeakPolarHBondContact O-CB 3.5Å; T446-A450 PolarHBondContact O-N 3.04Å
447V95.7Very high94.9Very high86 Ų8697.3 Ų97.352%0.52151%0.51SS..Hα-helixtrans-67.9-43178171.20000110.7L443 E444 E445 T449 A450 A451L443-V447 HydrophobicContact CD1-CG2 4.19Å; L443-V447 HydrophobicContact CG-CG2 4.37Å; L443-V447 WeakPolarHBondContact O-CG2 3.43Å; L443-V447 PolarHBondContact O-N 3.21Å; E444-V447 PolarHBondContact O-N 3.26Å; E445-V447 PolarHBondContact O-N 2.81Å; V447-T449 VanDerWaalsContact C-N 3.33Å; V447-T449 PolarHBondContact O-N 2.83Å; V447-A450 PolarHBondContact O-N 3.21Å; V447-A451 WeakPolarHBondContact O-CB 3.19Å; V447-A451 PolarHBondContact O-N 3.27Å
448Q95.3Very high94.6Very high114 Ų11496.5 Ų96.553%0.53351%0.505SS..Hα-helixtrans-61.8-42176.2-72.9-179.28.900111.7E444 E445 A451 A452E444-Q448 WeakPolarHBondContact O-CG 3.49Å; E444-Q448 PolarHBondContact O-N 2.79Å; E444-Q448 PolarHBondContact OE1-NE2 2.9Å; E445-Q448 PolarHBondContact O-N 3.47Å; Q448-A451 PolarHBondContact O-N 3.47Å; Q448-A452 WeakPolarHBondContact O-CB 3Å; Q448-A452 PolarHBondContact O-N 3.12Å
449T95.5Very high94.3Very high86 Ų8694.8 Ų94.853%0.52850%0.5SS..Hα-helixtrans-64.9-48.6177.5-54.60000111.4E445 T446 V447 A451 A452 E453E445-T449 WeakPolarHBondContact O-CB 3.37Å; E445-T449 PolarHBondContact O-N 3.43Å; E445-T449 PolarHBondContact O-OG1 3.01Å; T446-T449 PolarHBondContact O-N 3.37Å; V447-T449 VanDerWaalsContact C-N 3.33Å; V447-T449 PolarHBondContact O-N 2.83Å; T449-A451 VanDerWaalsContact C-N 3.32Å; T449-A451 PolarHBondContact O-N 3.39Å; T449-A452 PolarHBondContact O-N 2.96Å; T449-E453 PolarHBondContact O-N 3.29Å
450A94.3Very high94Very high55 Ų5591.9 Ų91.946%0.45549%0.494SS..Hα-helixtrans-62.9-38.7177.800000112.2T446 V447 E453 C454T446-A450 WeakPolarHBondContact O-CB 3.5Å; T446-A450 PolarHBondContact O-N 3.04Å; V447-A450 PolarHBondContact O-N 3.21Å; A450-E453 PolarHBondContact O-N 2.94Å; A450-C454 WeakPolarHBondContact O-CB 3.43Å; A450-C454 PolarHBondContact O-N 3.4Å
451A94.3Very high93.7Very high35 Ų3595.8 Ų95.829%0.28950%0.501SS..Hα-helixtrans-66.1-38.2175.500000112V447 Q448 T449 R455V447-A451 WeakPolarHBondContact O-CB 3.19Å; V447-A451 PolarHBondContact O-N 3.27Å; Q448-A451 PolarHBondContact O-N 3.47Å; T449-A451 VanDerWaalsContact C-N 3.32Å; T449-A451 PolarHBondContact O-N 3.39Å; A451-R455 WeakPolarHBondContact O-CG 3.5Å; A451-R455 PolarHBondContact O-N 2.95Å
452A94Very high93.2Very high34 Ų3496.8 Ų96.828%0.28150%0.504SS..Hα-helixtrans-67.2-41.6174.700000111.8Q448 T449 R455 N456Q448-A452 WeakPolarHBondContact O-CB 3Å; Q448-A452 PolarHBondContact O-N 3.12Å; T449-A452 PolarHBondContact O-N 2.96Å; A452-R455 PolarHBondContact O-N 3.31Å; A452-N456 WeakPolarHBondContact O-CB 3.18Å; A452-N456 PolarHBondContact O-N 2.85Å; A452-N456 PolarHBondContact O-ND2 2.83Å
453E94.4Very high92.7Very high114 Ų11492 Ų9253%0.53349%0.492SS..Hα-helixtrans-62.1-46.4175.5-172.1178.7177.700111.6T449 A450 R455 N456 Q457T449-E453 PolarHBondContact O-N 3.29Å; A450-E453 PolarHBondContact O-N 2.94Å; E453-R455 PolarHBondContact O-N 3.18Å; E453-N456 PolarHBondContact O-N 3.4Å; E453-Q457 WeakPolarHBondContact O-CG 3.33Å; E453-Q457 PolarHBondContact O-N 3.2Å; E453-Q457 PolarHBondContact OE1-NE2 3.1Å
454C92Very high92.1Very high67 Ų6794.2 Ų94.245%0.45349%0.492SS..Hα-helixtrans-60.1-44.5176.5-173.70000111.7A450 N456 Q457 I458A450-C454 WeakPolarHBondContact O-CB 3.43Å; A450-C454 PolarHBondContact O-N 3.4Å; C454-N456 PolarHBondContact O-N 3.49Å; C454-Q457 PolarHBondContact O-N 3.43Å; C454-I458 WeakPolarHBondContact O-CG1 3.41Å; C454-I458 PolarHBondContact O-N 3.49Å
455R93.2Very high91.3Very high143 Ų14396 Ų9654%0.5450%0.495SS..Hα-helixtrans-58.7-47.4173.9-77.2-171.4-63.9-89.60.8111.8A451 A452 E453 Q457 I458 D459A451-R455 WeakPolarHBondContact O-CG 3.5Å; A451-R455 PolarHBondContact O-N 2.95Å; A452-R455 PolarHBondContact O-N 3.31Å; E453-R455 PolarHBondContact O-N 3.18Å; R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.3Å; R455-I458 PolarHBondContact O-N 3.18Å; R455-D459 WeakPolarHBondContact O-CB 3.39Å; R455-D459 VanDerWaalsContact O-CG 3.28Å; R455-D459 PolarHBondContact O-N 3.27Å
456N92.6Very high90.4Very high99 Ų9992.7 Ų92.753%0.52949%0.487SS..Hα-helixtrans-62.4-37.9178.3-69.5-20.5000112.5A452 E453 C454 T460A452-N456 WeakPolarHBondContact O-CB 3.18Å; A452-N456 PolarHBondContact O-N 2.85Å; A452-N456 PolarHBondContact O-ND2 2.83Å; E453-N456 PolarHBondContact O-N 3.4Å; C454-N456 PolarHBondContact O-N 3.49Å; N456-T460 VanDerWaalsContact O-CB 3.31Å; N456-T460 WeakPolarHBondContact O-CB 3.15Å; N456-T460 PolarHBondContact O-N 2.92Å; N456-T460 PolarHBondContact O-OG1 3.1Å
457Q92.1Very high89.3Confident120 Ų12095.6 Ų95.656%0.56150%0.495SS*.Hα-helixtrans-65.7-43.1175.6-72.5-18020.400111.4E453 C454 R455 T460 F461E453-Q457 WeakPolarHBondContact O-CG 3.33Å; E453-Q457 PolarHBondContact O-N 3.2Å; E453-Q457 PolarHBondContact OE1-NE2 3.1Å; C454-Q457 PolarHBondContact O-N 3.43Å; R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.3Å; Q457-T460 PolarHBondContact O-N 3.24Å; Q457-F461 WeakPolarHBondContact O-CB 3.33Å; Q457-F461 PolarHBondContact O-N 3.42Å
458I90.9Very high87.9Confident94 Ų9497.5 Ų97.548%0.48250%0.499SS..Hα-helixtrans-62.5-48.1174.7-67.7167.6000110.2C454 R455 T460 F461 M462C454-I458 WeakPolarHBondContact O-CG1 3.41Å; C454-I458 PolarHBondContact O-N 3.49Å; R455-I458 PolarHBondContact O-N 3.18Å; I458-T460 VanDerWaalsContact C-N 3.31Å; I458-T460 PolarHBondContact O-N 3.17Å; I458-F461 PolarHBondContact O-N 2.88Å; I458-F461 VanDerWaalsContact O-N 3.17Å; I458-M462 HydrophobicContact CG2-CG 4.14Å; I458-M462 WeakPolarHBondContact O-CB 3.46Å; I458-M462 VanDerWaalsContact O-CG 3.26Å; I458-M462 WeakPolarHBondContact O-CG 3.45Å; I458-M462 PolarHBondContact O-N 2.74Å
459D89.5Confident86.3Confident102 Ų10293.8 Ų93.855%0.54549%0.487SS..Hα-helixtrans-61.5-40.5179.8-69.6-23.1000111.4R455 M462 A463R455-D459 WeakPolarHBondContact O-CB 3.39Å; R455-D459 VanDerWaalsContact O-CG 3.28Å; R455-D459 PolarHBondContact O-N 3.27Å; D459-M462 PolarHBondContact O-N 3.31Å; D459-A463 WeakPolarHBondContact O-CB 3.46Å; D459-A463 PolarHBondContact O-N 3.43Å
460T89.9Confident84.7Confident72 Ų7295.1 Ų95.144%0.44249%0.491SS..Hα-helixtrans-65.5-41.8175.5-56.30000111.6N456 Q457 I458 A463 R464N456-T460 VanDerWaalsContact O-CB 3.31Å; N456-T460 WeakPolarHBondContact O-CB 3.15Å; N456-T460 PolarHBondContact O-N 2.92Å; N456-T460 PolarHBondContact O-OG1 3.1Å; Q457-T460 PolarHBondContact O-N 3.24Å; I458-T460 VanDerWaalsContact C-N 3.31Å; I458-T460 PolarHBondContact O-N 3.17Å; T460-A463 PolarHBondContact O-N 2.78Å; T460-R464 WeakPolarHBondContact O-CG 3.19Å; T460-R464 PolarHBondContact O-N 3.42Å; T460-R464 VanDerWaalsContact O-N 3.07Å
461F89.1Confident83Confident136 Ų13698.8 Ų98.860%0.59650%0.503SS*.Hα-helixtrans-65.6-44.6176.8-178.9-93.4000111.5Q457 I458 A463 R464 Y465Q457-F461 WeakPolarHBondContact O-CB 3.33Å; Q457-F461 PolarHBondContact O-N 3.42Å; I458-F461 PolarHBondContact O-N 2.88Å; I458-F461 VanDerWaalsContact O-N 3.17Å; F461-A463 VanDerWaalsContact C-N 3.34Å; F461-A463 PolarHBondContact O-N 3.38Å; F461-R464 PolarHBondContact O-N 3.48Å; F461-Y465 WeakPolarHBondContact O-CB 3.36Å; F461-Y465 PolarHBondContact O-N 3.37Å
462M85.7Confident81.2Confident110 Ų110102.3 Ų102.354%0.54252%0.521SS..Hα-helixtrans-63.1-38.8176.6-70.5-60.1-65.300111.8I458 D459 Y465 S466I458-M462 HydrophobicContact CG2-CG 4.14Å; I458-M462 WeakPolarHBondContact O-CB 3.46Å; I458-M462 VanDerWaalsContact O-CG 3.26Å; I458-M462 WeakPolarHBondContact O-CG 3.45Å; I458-M462 PolarHBondContact O-N 2.74Å; D459-M462 PolarHBondContact O-N 3.31Å; M462-Y465 PolarHBondContact O-N 3.08Å; M462-S466 WeakPolarHBondContact O-CB 3.47Å; M462-S466 PolarHBondContact O-N 3.08Å
463A84.5Confident79.2Confident45 Ų45107 Ų10737%0.37254%0.541SS..Hα-helixtrans-62.3-48.7174.400000111.7D459 T460 F461 Y465 S466 E467D459-A463 WeakPolarHBondContact O-CB 3.46Å; D459-A463 PolarHBondContact O-N 3.43Å; T460-A463 PolarHBondContact O-N 2.78Å; F461-A463 VanDerWaalsContact C-N 3.34Å; F461-A463 PolarHBondContact O-N 3.38Å; A463-Y465 PolarHBondContact O-N 3.18Å; A463-S466 PolarHBondContact O-N 3.33Å; A463-S466 VanDerWaalsContact O-N 3.16Å; A463-S466 PolarHBondContact O-OG 3.47Å; A463-E467 PolarHBondContact O-N 2.73Å
464R83.2Confident77.1Confident157 Ų157104.9 Ų104.959%0.59255%0.55SS*.Hα-helixtrans-60.1-43.7175.7-73.1-177-172.5169.23.9112.4T460 F461 S466 E467 E468T460-R464 WeakPolarHBondContact O-CG 3.19Å; T460-R464 PolarHBondContact O-N 3.42Å; T460-R464 VanDerWaalsContact O-N 3.07Å; F461-R464 PolarHBondContact O-N 3.48Å; R464-S466 VanDerWaalsContact C-N 3.27Å; R464-S466 PolarHBondContact O-N 2.98Å; R464-E467 PolarHBondContact O-N 3.45Å; R464-E468 WeakPolarHBondContact O-CG 3.26Å; R464-E468 PolarHBondContact O-N 3.45Å
465Y79.3Confident75Confident147 Ų147106.3 Ų106.358%0.57656%0.561SS**Hα-helixtrans-61.9-36.9177.4-169.1-95.8000111.8F461 M462 A463 A469F461-Y465 WeakPolarHBondContact O-CB 3.36Å; F461-Y465 PolarHBondContact O-N 3.37Å; M462-Y465 PolarHBondContact O-N 3.08Å; A463-Y465 PolarHBondContact O-N 3.18Å; Y465-A469 VanDerWaalsContact O-CB 3.24Å; Y465-A469 WeakPolarHBondContact O-CB 3.35Å; Y465-A469 PolarHBondContact O-N 3.32Å
466S77.6Confident72.4Confident60 Ų60106.6 Ų106.642%0.4257%0.566SS.*Hα-helixtrans-69.2-33.7175.874.50000113.3M462 A463 R464 N470M462-S466 WeakPolarHBondContact O-CB 3.47Å; M462-S466 PolarHBondContact O-N 3.08Å; A463-S466 PolarHBondContact O-N 3.33Å; A463-S466 VanDerWaalsContact O-N 3.16Å; A463-S466 PolarHBondContact O-OG 3.47Å; R464-S466 VanDerWaalsContact C-N 3.27Å; R464-S466 PolarHBondContact O-N 2.98Å; S466-N470 WeakPolarHBondContact O-CB 3.19Å; S466-N470 VanDerWaalsContact O-CG 3.27Å; S466-N470 PolarHBondContact O-N 2.93Å; S466-N470 VanDerWaalsContact O-N 3.15Å; S466-N470 PolarHBondContact O-ND2 3.49Å
467E71.8Confident69.7Low131 Ų131105.1 Ų105.161%0.61257%0.574SS**Hα-helixtrans-68.6-46.9173.4-71176173.100110.9A463 R464 A469 N470 D471A463-E467 PolarHBondContact O-N 2.73Å; R464-E467 PolarHBondContact O-N 3.45Å; E467-A469 PolarHBondContact O-N 2.84Å; E467-N470 PolarHBondContact O-N 3.35Å; E467-D471 PolarHBondContact O-N 3.4Å
468E67.2Low67Low126 Ų126104.6 Ų104.659%0.58958%0.584SS**Hα-helixtrans-63.5-38.7176.7-71.2176.8-17800112.3R464 N470 D471 V472R464-E468 WeakPolarHBondContact O-CG 3.26Å; R464-E468 PolarHBondContact O-N 3.45Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 3.41Å; E468-D471 PolarHBondContact O-N 3.41Å; E468-V472 WeakPolarHBondContact O-CG2 3.39Å; E468-V472 PolarHBondContact O-N 2.93Å; E468-V472 VanDerWaalsContact O-N 3.07Å
469A62.1Low64.5Low36 Ų36104.4 Ų104.430%0.29859%0.588SS.*Hα-helixtrans-67.9-29.9175.800000113Y465 E467 N473Y465-A469 VanDerWaalsContact O-CB 3.24Å; Y465-A469 WeakPolarHBondContact O-CB 3.35Å; Y465-A469 PolarHBondContact O-N 3.32Å; E467-A469 PolarHBondContact O-N 2.84Å; A469-N473 PolarHBondContact O-N 2.86Å; A469-N473 PolarHBondContact O-ND2 3.11Å
470N60.1Low61.9Low114 Ų114109 Ų10961%0.6161%0.606SS**Hα-helixtrans-76.9-35.1174.5-75.9-32.8000112.2S466 E467 E468 N473 G474S466-N470 WeakPolarHBondContact O-CB 3.19Å; S466-N470 VanDerWaalsContact O-CG 3.27Å; S466-N470 PolarHBondContact O-N 2.93Å; S466-N470 VanDerWaalsContact O-N 3.15Å; S466-N470 PolarHBondContact O-ND2 3.49Å; E467-N470 PolarHBondContact O-N 3.35Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 3.41Å; N470-N473 PolarHBondContact O-N 3.49Å; N470-G474 PolarHBondContact O-N 3.3Å
471D58.8Low59.5Low132 Ų132113.7 Ų113.771%0.70662%0.623SS**Hα-helixtrans-68.9-34.9174.7-95.5-11.8000112.5E467 E468 G474E467-D471 PolarHBondContact O-N 3.4Å; E468-D471 PolarHBondContact O-N 3.41Å; D471-G474 PolarHBondContact O-N 3.36Å
472V57.6Low56.9Low110 Ų110114.5 Ų114.567%0.66763%0.632SS**Hα-helixtrans-71.8-34.2175.1176.40000111.8E468E468-V472 WeakPolarHBondContact O-CG2 3.39Å; E468-V472 PolarHBondContact O-N 2.93Å; E468-V472 VanDerWaalsContact O-N 3.07Å
473N52.4Low54.4Low132 Ų132116.6 Ų116.671%0.70665%0.645SS**Hα-helixtrans-80.4-16.7174.9-75.7-33.7000113.7A469 N470A469-N473 PolarHBondContact O-N 2.86Å; A469-N473 PolarHBondContact O-ND2 3.11Å; N470-N473 PolarHBondContact O-N 3.49Å
474G49.9Very low52.2Low69 Ų69122.6 Ų122.671%0.71167%0.671SS**Hα-helixtrans-79.3-14.5174.600000114.8N470 D471N470-G474 PolarHBondContact O-N 3.3Å; D471-G474 PolarHBondContact O-N 3.36Å
475S48Very low50Low98 Ų98118.3 Ų118.369%0.68568%0.675SS**THydrogen-bonded Turntrans-113.329-176.8-169.70000114
476F39Very low47.9Very low148 Ų148121 Ų12165%0.64969%0.69SS**  trans-148.375.2162.5-139.6-97.8000112
477G35.5Very low45.8Very low68 Ų68127.2 Ų127.270%0.70171%0.712SS**  trans-75.6128.715000000108.9
478S35.4Very low44.3Very low109 Ų109129.1 Ų129.176%0.76272%0.721SS**  trans65.494.1175.664.30000117.3
479T37.7Very low42.9Very low91 Ų91132.7 Ų132.756%0.55874%0.738SS**  -156102.9110.9-50.80000108.8E481T479-E481 HydrophobicContact CG2-CB 4.21Å; T479-E481 HydrophobicContact CG2-CG 3.91Å; T479-E481 PolarHBondContact O-N 3.38Å
480E35.5Very low42Very low198 Ų198138.8 Ų138.893%0.92576%0.76SS**  trans-66.9103.6152.4-85.2176.9129.500108.3
481E39.3Very low41.4Very low171 Ų171138.9 Ų138.980%0.79977%0.767SS**  trans-146.379.6156-79.8-174.4163.600104.8T479T479-E481 HydrophobicContact CG2-CB 4.21Å; T479-E481 HydrophobicContact CG2-CG 3.91Å; T479-E481 PolarHBondContact O-N 3.38Å
482L34.1Very low41.2Very low153 Ų153140.1 Ų140.180%0.80177%0.774SS**  21.8101.784.6-144.794.1000113
483L34.4Very low40.8Very low154 Ų154142.7 Ų142.781%0.80678%0.783SS**  156.683.1128-80.1153.8000111.4
484D38Very low41.3Very low171 Ų171142.2 Ų142.291%0.91479%0.787SS**  -165.6131.2125-99.7-17.2000106.1
485G36.9Very low41.8Very low66 Ų66144 Ų14468%0.6879%0.788SS**  cis176.8156.610.600000106.3
486K34Very low42Very low204 Ų204145.1 Ų145.189%0.88779%0.793SS**  trans-41.7151.7173-67.1160.8174.2172.20112.6E488K486-E488 PolarHBondContact O-N 3.4Å
487E34.7Very low42.6Very low191 Ų191146.5 Ų146.589%0.89381%0.806SS**  trans-33110.8154.2-65.4170.9138.100111.9
488E40.2Very low43.6Very low171 Ų171152.4 Ų152.480%0.79981%0.813SS**  trans-125.7115.7141.9-82.4-169.1172.500107.9K486 Q490K486-E488 PolarHBondContact O-N 3.4Å; E488-Q490 PolarHBondContact O-N 3.01Å
489Q36.5Very low44.3Very low200 Ų200153.4 Ų153.494%0.93582%0.817SS**  trans-60.9113.6169.1-68.9170-7.800108.6
490Q44.7Very low44.7Very low164 Ų164157.2 Ų157.277%0.76683%0.828SS**  trans-125.8141.1160.8-78.2-163.8-7.300111.1E488 N492E488-Q490 PolarHBondContact O-N 3.01Å; Q490-N492 PolarHBondContact O-N 3.46Å
491P46.6Very low45.1Very low116 Ų116155.5 Ų155.575%0.75383%0.825SS**SBendtrans-111.353.3-13638.2-27.4000112.1
492N55.1Low45.4Very low158 Ų158152.4 Ų152.485%0.84582%0.817SS**  trans-153.120.5-176.2-85.1-41.9000116.3Q490Q490-N492 PolarHBondContact O-N 3.46Å
493L48.4Very low45.6Very low165 Ų165150.7 Ų150.786%0.86482%0.818SS**SBendtrans-121.6124.9172.4-83.9146.8000110
494P62.5Low45.9Very low122 Ų122145.5 Ų145.579%0.79280%0.801SS**PPolyproline II helixtrans-67.6137.5179.426.2-31.7000111
495S62.1Low46Very low106 Ų106143.2 Ų143.274%0.74180%0.796SS**PPolyproline II helixtrans-57.1144.7175.7-37.90000111.4L497S495-L497 PolarHBondContact O-N 3.36Å
496P51Low46.2Very low121 Ų121150 Ų15079%0.78681%0.807SS**PPolyproline II helixtrans-60.2127.3172.623.8-31.3000110.1K498P496-K498 PolarHBondContact O-N 2.85Å; P496-K498 VanDerWaalsContact O-N 3.15Å
497L52.9Low46.6Very low177 Ų177147 Ų14793%0.92780%0.796SS**  trans-62.4114175.2-72.2164.4000109S495S495-L497 PolarHBondContact O-N 3.36Å
498K56Low46.7Very low193 Ų193146.6 Ų146.684%0.83979%0.792SS**  trans-71.2137.3166.9-74.5179.3177.1177.20108.6P496 E500P496-K498 PolarHBondContact O-N 2.85Å; P496-K498 VanDerWaalsContact O-N 3.15Å; K498-E500 PolarHBondContact O-N 3.06Å; K498-E500 VanDerWaalsContact O-N 3.16Å
499P48.9Very low46.3Very low129 Ų129147.8 Ų147.884%0.83879%0.789SS**  trans-63118.2172.924.9-31.2000109.2L501P499-L501 PolarHBondContact O-N 3.05Å
500E48Very low46.3Very low171 Ų171146 Ų14680%0.79979%0.785SS**  trans-78113.7170.7-166.1172-171.500108.2K498 V502K498-E500 PolarHBondContact O-N 3.06Å; K498-E500 VanDerWaalsContact O-N 3.16Å; E500-V502 VanDerWaalsContact C-N 3.26Å; E500-V502 HydrophobicContact CB-CG2 4.49Å; E500-V502 HydrophobicContact CG-CG2 4.04Å; E500-V502 PolarHBondContact O-N 3.1Å
501L42.9Very low45.9Very low163 Ų163146.2 Ų146.285%0.85379%0.786SS**  trans-69.788.1165.3-97.9149.8000107.6P499 S503P499-L501 PolarHBondContact O-N 3.05Å; L501-S503 PolarHBondContact O-N 3.2Å
502V46.3Very low45.3Very low105 Ų105148.9 Ų148.964%0.63679%0.789SS**  trans-76.478.6165-175.30000107.7E500 G504E500-V502 VanDerWaalsContact C-N 3.26Å; E500-V502 HydrophobicContact CB-CG2 4.49Å; E500-V502 HydrophobicContact CG-CG2 4.04Å; E500-V502 PolarHBondContact O-N 3.1Å; V502-G504 VanDerWaalsContact C-N 3.31Å; V502-G504 PolarHBondContact O-N 3.22Å
503S37.3Very low44.4Very low118 Ų118150.4 Ų150.483%0.82579%0.791SS**  trans-70.694.3149.943.10000107.7L501L501-S503 PolarHBondContact O-N 3.2Å
504G41.9Very low43.9Very low44 Ų44152.4 Ų152.445%0.45479%0.793SS.*  trans-157.1135.2170.300000109.3V502 F506V502-G504 VanDerWaalsContact C-N 3.31Å; V502-G504 PolarHBondContact O-N 3.22Å; G504-F506 PolarHBondContact O-N 2.72Å
505P40Very low42.6Very low123 Ų123156 Ų15680%0.79980%0.796SS**  trans-73.3120.4-178.930.3-29.8000108.6E507P505-E507 PolarHBondContact O-N 3.22Å; P505-E507 VanDerWaalsContact O-N 3.07Å
506F40Very low41.4Very low209 Ų209159.7 Ų159.792%0.91780%0.801SS**  trans-7798.9165.3-115-91.2000108.4G504G504-F506 PolarHBondContact O-N 2.72Å
507E42.3Very low40.9Very low141 Ų141161.4 Ų161.466%0.65980%0.804SS**  trans-49.1139.7166.1-68.4175.4144.300111.6P505 R509P505-E507 PolarHBondContact O-N 3.22Å; P505-E507 VanDerWaalsContact O-N 3.07Å; E507-R509 PolarHBondContact O-N 3.28Å
508K37.5Very low40.3Very low183 Ų183160.2 Ų160.280%0.79680%0.798SS**  trans-17.3116.8146.5-63.5175.1174.8-174.10113.3
509R32.3Very low39.4Very low195 Ų195158.3 Ų158.374%0.73680%0.797SS**  trans-167.277.7151.4-112.7178.1-74.7172.5-3.9108.8E507E507-R509 PolarHBondContact O-N 3.28Å
510D36.3Very low39.3Very low162 Ų162159.3 Ų159.387%0.86679%0.794SS**  trans-151.638.5158-85.3-30.2000109
511E36.2Very low38.9Very low169 Ų169160 Ų16079%0.7980%0.795SS**SBendtrans-111.110.6171.3-84.8-170.7155.700113
512E33.8Very low38.6Very low172 Ų172163.4 Ų163.480%0.80481%0.814SS**SBendtrans-113.22-177.4-81.8-179.4157.700116.3
513E36.2Very low38.2Very low191 Ų191166.3 Ų166.389%0.89382%0.823SS**SBendtrans-105.214174.5-94.4-173.9166.200115
514K37.4Very low38.3Very low207 Ų207168.8 Ų168.890%0.982%0.823SS**SBendtrans-112.819175-87.5-175.1177.4176.40115.1
515K36.1Very low38.1Very low197 Ų197175.8 Ų175.886%0.85784%0.843SS**SBendtrans-1217.4179.8-92.3-173.8177178.90117.3
516E36.8Very low37.9Very low184 Ų184178.9 Ų178.986%0.8685%0.846SS**SBendtrans-125.614.3-175.7-102.8-178.3172.400116.9
517N39.5Very low37.8Very low156 Ų156177 Ų17783%0.83484%0.841SS**SBendtrans-139.733.6178.6-89.9-37.4000115.4
518N40.7Very low37.5Very low152 Ų152179.4 Ų179.481%0.81385%0.853SS**  trans-132.132.4168.3-113.119.5000113
519D38.1Very low37.5Very low153 Ų153179.1 Ų179.182%0.81886%0.858SS**SBendtrans-91.2131.9142-87.4-37000106.6
520I44.9Very low37.9Very low151 Ų151177.9 Ų177.977%0.77487%0.867SS**SBendtrans98.587.9-174.9-51.2161.4000112.5
521F40.3Very low38.1Very low186 Ų186179.3 Ų179.382%0.81687%0.867SS**  trans88.668.4174.7-68.5-82.6000118.8
522N36.7Very low38.2Very low233 Ų233180.2 Ų180.2100%1.24687%0.874SS**  -176.70107-112.6-7.3000111.7

Retrieved 522 of 522 residues in 456.8 ms (Link to these results)

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