A0A087XS69_POEFO Loading...

Solute carrier family 39 member 8

AlphaFold DB , UniProt , Accession A0A087XS69, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 456 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
1M44.9Very low50.4Low242 Ų242128.7 Ų128.7100%1.19268%0.679SS**  085.50-157.9163.884.800106.1
2F42Very low50.2Low209 Ų209128.3 Ų128.392%0.91768%0.676SS**  trans-80.8132-174.3-88.7-91.9000109.4V4F2-V4 PolarHBondContact O-N 3.03Å
3D44.7Very low49.9Very low107 Ų107123.1 Ų123.157%0.57266%0.663SS**  trans-76.6102.1-162.4-145.5-29.9000111.5K5 W6D3-K5 PolarHBondContact O-N 2.93Å; D3-W6 PolarHBondContact O-N 2.86Å
4V54.6Low49.3Very low120 Ų120124.6 Ų124.673%0.72767%0.67SS**Hα-helixtrans-57.7-16.8179176.60000112.2F2 W6 A8F2-V4 PolarHBondContact O-N 3.03Å; V4-W6 PolarHBondContact O-N 3.25Å; V4-A8 PolarHBondContact O-N 3.2Å
5K52.6Low48.7Very low165 Ų165121.1 Ų121.172%0.71766%0.658SS**Hα-helixtrans-68.4-29179-67-178.7176.5-179.60113.9D3 A9D3-K5 PolarHBondContact O-N 2.93Å; K5-A9 PolarHBondContact O-N 3.27Å
6W51.8Low48.3Very low194 Ų194118.4 Ų118.474%0.73566%0.657SS**Hα-helixtrans-75-35.1179.8-97.292.3000113.2D3 V4 A9 C10D3-W6 PolarHBondContact O-N 2.86Å; V4-W6 PolarHBondContact O-N 3.25Å; W6-A9 PolarHBondContact O-N 3.24Å; W6-C10 PolarHBondContact O-N 3.38Å
7L53.5Low47.9Very low140 Ų140118.8 Ų118.873%0.73366%0.663SS**Hα-helixtrans-71.1-34.9177.1-84.6156.4000112.3C10 A11L7-C10 PolarHBondContact O-N 3.29Å; L7-A11 WeakPolarHBondContact O-CB 3.39Å; L7-A11 PolarHBondContact O-N 3.29Å
8A55.3Low47.6Very low52 Ų52118.4 Ų118.443%0.4366%0.664SS.*Hα-helixtrans-68.7-34.7175.500000112.7V4 A11 L12V4-A8 PolarHBondContact O-N 3.2Å; A8-A11 PolarHBondContact O-N 3.23Å; A8-L12 PolarHBondContact O-N 3.41Å
9A54.3Low47Very low58 Ų58121.6 Ų121.648%0.47967%0.673SS.*Hα-helixtrans-68.2-38.8176.100000112.4K5 W6 A13K5-A9 PolarHBondContact O-N 3.27Å; W6-A9 PolarHBondContact O-N 3.24Å; A9-A13 WeakPolarHBondContact O-CB 3.38Å; A9-A13 PolarHBondContact O-N 2.87Å
10C48Very low46.4Very low68 Ų68118.8 Ų118.846%0.45967%0.673SS.*Hα-helixtrans-69.1-37.5173.4-77.60000112.7W6 L7 A13 L14W6-C10 PolarHBondContact O-N 3.38Å; L7-C10 PolarHBondContact O-N 3.29Å; C10-A13 PolarHBondContact O-N 2.9Å; C10-L14 WeakPolarHBondContact O-CB 3.19Å; C10-L14 PolarHBondContact O-N 3.38Å
11A52.5Low45.9Very low61 Ų61119 Ų11950%0.50468%0.677SS.*Hα-helixtrans-66.6-38176.900000112.4L7 A8 L14 S15L7-A11 WeakPolarHBondContact O-CB 3.39Å; L7-A11 PolarHBondContact O-N 3.29Å; A8-A11 PolarHBondContact O-N 3.23Å; A11-L14 PolarHBondContact O-N 3.31Å; A11-S15 PolarHBondContact O-N 3.41Å; A11-S15 VanDerWaalsContact O-N 3.17Å; A11-S15 PolarHBondContact O-OG 3.4Å
12L48.2Very low45.7Very low123 Ų123116 Ų11664%0.64466%0.66SS**Hα-helixtrans-73-33.7176-76.1166.9000112.8A8 S15 A16A8-L12 PolarHBondContact O-N 3.41Å; L12-S15 WeakPolarHBondContact CA-OG 3.45Å; L12-S15 PolarHBondContact O-N 3Å; L12-S15 PolarHBondContact O-OG 3.23Å; L12-A16 WeakPolarHBondContact O-CB 3.29Å; L12-A16 PolarHBondContact O-N 2.78Å
13A46.3Very low45.7Very low61 Ų61112 Ų11250%0.50465%0.652SS.*Hα-helixtrans-69.4-32.3173.400000112.7A9 C10A9-A13 WeakPolarHBondContact O-CB 3.38Å; A9-A13 PolarHBondContact O-N 2.87Å; C10-A13 PolarHBondContact O-N 2.9Å
14L41.3Very low45.7Very low145 Ų145111.3 Ų111.376%0.75966%0.662SS**Hα-helixtrans-74-25.6173.2-88.2150.9000113.2C10 A11C10-L14 WeakPolarHBondContact O-CB 3.19Å; C10-L14 PolarHBondContact O-N 3.38Å; A11-L14 PolarHBondContact O-N 3.31Å
15S40.4Very low45.1Very low71 Ų71107.4 Ų107.450%0.49765%0.645SS.*Hα-helixtrans-84.8-10.5174.458.70000114.8A11 L12A11-S15 PolarHBondContact O-N 3.41Å; A11-S15 VanDerWaalsContact O-N 3.17Å; A11-S15 PolarHBondContact O-OG 3.4Å; L12-S15 WeakPolarHBondContact CA-OG 3.45Å; L12-S15 PolarHBondContact O-N 3Å; L12-S15 PolarHBondContact O-OG 3.23Å
16A41.7Very low45Very low78 Ų78110.7 Ų110.765%0.64565%0.653SS**SBendtrans-99.33.1-173.800000115L12L12-A16 WeakPolarHBondContact O-CB 3.29Å; L12-A16 PolarHBondContact O-N 2.78Å
17V43.1Very low45.2Very low125 Ų125107 Ų10776%0.75865%0.648SS**SBendtrans-105.610.3-179.6-178.10000113.2
18T42.4Very low45.5Very low112 Ų112102.3 Ų102.369%0.68763%0.633SS**  trans-127.758.3173.157.10000111.5
19H35.2Very low46.2Very low179 Ų179105.1 Ų105.183%0.82964%0.637SS**  trans-123.563.9148.8-89.7-60.4000108V21H19-V21 PolarHBondContact O-N 2.96Å
20G34.4Very low47.3Very low66 Ų66107.6 Ų107.668%0.6864%0.639SS**  trans-57.4117143.600000105.4E22G20-E22 PolarHBondContact O-N 3.42Å
21V37.3Very low48.8Very low122 Ų122111 Ų11174%0.73965%0.646SS**  trans-59.695.1167.6178.20000105.2H19 V23H19-V21 PolarHBondContact O-N 2.96Å; V21-V23 HydrophobicContact CG1-CG2 3.67Å; V21-V23 PolarHBondContact O-N 3.27Å
22E39.7Very low50.1Low179 Ų179109.7 Ų109.784%0.83663%0.63SS**  trans-60.892155.1-88.1-172.7149.600105G20 A24G20-E22 PolarHBondContact O-N 3.42Å; E22-A24 PolarHBondContact O-N 3.23Å
23V43.1Very low51.7Low125 Ų125108.2 Ų108.276%0.75862%0.62SS**  trans-66.575.9150.7-176.50000105V21 G25V21-V23 HydrophobicContact CG1-CG2 3.67Å; V21-V23 PolarHBondContact O-N 3.27Å; V23-G25 PolarHBondContact O-N 2.96Å
24A43.9Very low53.4Low94 Ų94109.8 Ų109.878%0.77762%0.62SS**  trans-68.17015900000106.9E22E22-A24 PolarHBondContact O-N 3.23Å
25G42.5Very low55.4Low37 Ų37105.8 Ų105.838%0.38160%0.599SS.*  trans-106.8106.817000000107.2V23 N27 G28V23-G25 PolarHBondContact O-N 2.96Å; G25-N27 PolarHBondContact O-N 2.9Å; G25-G28 PolarHBondContact O-N 3.46Å
26R50.8Low57.4Low235 Ų235102.7 Ų102.789%0.88758%0.577SS**Hα-helixtrans-42.3-11.4172.9-87.3171.1157.2165.5-7.8116
27N56.2Low59.4Low117 Ų117106.7 Ų106.763%0.62658%0.582SS**Hα-helixtrans-87.5-26.7-174.6-61.85.1000114.3G25 F31G25-N27 PolarHBondContact O-N 2.9Å; N27-F31 WeakPolarHBondContact O-CD2 3.45Å; N27-F31 VanDerWaalsContact O-CE2 3.23Å; N27-F31 WeakPolarHBondContact O-CE2 3.18Å
28G60.1Low61.2Low40 Ų40108.2 Ų108.241%0.41258%0.578SS.*Hα-helixtrans-76.5-37.5-176.300000113.1G25 E30 F31 L32G25-G28 PolarHBondContact O-N 3.46Å; G28-E30 VanDerWaalsContact C-N 3.29Å; G28-E30 PolarHBondContact O-N 3.01Å; G28-F31 PolarHBondContact O-N 3.24Å; G28-L32 WeakPolarHBondContact O-CD1 3.4Å
29Q68.2Low63Low111 Ų111105.6 Ų105.652%0.51956%0.556SS.*Hα-helixtrans-67-32.1-178.4-161.4177.3-39.800112.2F31 L32 E33 V96Q29-F31 VanDerWaalsContact C-N 3.31Å; Q29-F31 PolarHBondContact O-N 2.95Å; Q29-L32 PolarHBondContact O-N 3.07Å; Q29-L32 VanDerWaalsContact O-N 3.15Å; Q29-E33 HydrophobicContact CG-CG 4.43Å; Q29-E33 PolarHBondContact NE2-OE1 2.63Å; Q29-E33 WeakPolarHBondContact O-CB 3.23Å; Q29-E33 WeakPolarHBondContact O-CG 3.43Å; Q29-E33 PolarHBondContact O-N 2.97Å; Q29-V96 HydrophobicContact CG-CG1 3.72Å
30E78Confident65.1Low110 Ų11097.8 Ų97.851%0.51452%0.524SS..Hα-helixtrans-59.9-38.2177.3-169.7177.9178.700112.1G28 L32 E33 N34G28-E30 VanDerWaalsContact C-N 3.29Å; G28-E30 PolarHBondContact O-N 3.01Å; E30-L32 PolarHBondContact O-N 2.92Å; E30-E33 PolarHBondContact O-N 2.88Å; E30-N34 WeakPolarHBondContact O-CB 3.15Å; E30-N34 PolarHBondContact O-N 3.32Å; E30-N34 PolarHBondContact O-ND2 3.41Å
31F79.4Confident67.2Low140 Ų140100.7 Ų100.761%0.61452%0.52SS*.Hα-helixtrans-64.1-41.2175.7-67.6-80.4000112.2N27 G28 Q29 N34 I35N27-F31 WeakPolarHBondContact O-CD2 3.45Å; N27-F31 VanDerWaalsContact O-CE2 3.23Å; N27-F31 WeakPolarHBondContact O-CE2 3.18Å; G28-F31 PolarHBondContact O-N 3.24Å; Q29-F31 VanDerWaalsContact C-N 3.31Å; Q29-F31 PolarHBondContact O-N 2.95Å; F31-N34 PolarHBondContact O-N 2.88Å; F31-I35 WeakPolarHBondContact O-CG1 3.45Å; F31-I35 PolarHBondContact O-N 3.48Å; F31-I35 VanDerWaalsContact O-N 3.13Å
32L81Confident68.9Low33 Ų33102.4 Ų102.417%0.17353%0.525CS..Hα-helixtrans-73.6-36.2179.4-76.475.7000111.3G28 Q29 E30 N34 I35 L36 V96 L99 G100G28-L32 WeakPolarHBondContact O-CD1 3.4Å; Q29-L32 PolarHBondContact O-N 3.07Å; Q29-L32 VanDerWaalsContact O-N 3.15Å; E30-L32 PolarHBondContact O-N 2.92Å; L32-N34 VanDerWaalsContact C-N 3.32Å; L32-I35 PolarHBondContact O-N 2.94Å; L32-L36 WeakPolarHBondContact O-CG 3.38Å; L32-L36 PolarHBondContact O-N 3.34Å; L32-V96 HydrophobicContact CB-CG1 3.88Å; L32-V96 HydrophobicContact CD2-CG1 4.22Å; L32-V96 WeakPolarHBondContact CD2-O 3.43Å; L32-L99 HydrophobicContact CB-CD2 4.3Å; L32-L99 HydrophobicContact CD2-CB 4.26Å; L32-L99 HydrophobicContact CD2-CG 4.45Å; L32-L99 HydrophobicContact CG-CD2 4.37Å; L32-G100 VanDerWaalsContact CD2-CA 3.42Å; L32-G100 VanDerWaalsContact CD2-N 3.31Å
33E81.8Confident70.7Confident92 Ų92102.3 Ų102.343%0.4352%0.522SS..Hα-helixtrans-64.1-38.3172.9-74.9179.7-17100111.4Q29 E30 L36 H37 V96Q29-E33 HydrophobicContact CG-CG 4.43Å; Q29-E33 PolarHBondContact NE2-OE1 2.63Å; Q29-E33 WeakPolarHBondContact O-CB 3.23Å; Q29-E33 WeakPolarHBondContact O-CG 3.43Å; Q29-E33 PolarHBondContact O-N 2.97Å; E30-E33 PolarHBondContact O-N 2.88Å; E33-L36 PolarHBondContact O-N 2.95Å; E33-H37 WeakPolarHBondContact O-CB 3.3Å; E33-H37 PolarHBondContact O-N 3.48Å; E33-V96 HydrophobicContact CG-CG2 3.91Å
34N81.7Confident72.6Confident94 Ų9496.9 Ų96.950%0.50349%0.49SS..Hα-helixtrans-64.5-38.6173.8-72.5-24.6000112.3E30 F31 L32 H37 F38E30-N34 WeakPolarHBondContact O-CB 3.15Å; E30-N34 PolarHBondContact O-N 3.32Å; E30-N34 PolarHBondContact O-ND2 3.41Å; F31-N34 PolarHBondContact O-N 2.88Å; L32-N34 VanDerWaalsContact C-N 3.32Å; N34-H37 PolarHBondContact O-N 3.46Å; N34-F38 PolarHBondContact O-N 3.46Å; N34-F38 VanDerWaalsContact O-N 3.13Å
35I81.8Confident74.6Confident61 Ų6192.4 Ų92.431%0.31345%0.453SS..Hα-helixtrans-63.2-46.1174.3-67165.4000110.2F31 L32 H37 F38 Y39 M53 L99F31-I35 WeakPolarHBondContact O-CG1 3.45Å; F31-I35 PolarHBondContact O-N 3.48Å; F31-I35 VanDerWaalsContact O-N 3.13Å; L32-I35 PolarHBondContact O-N 2.94Å; I35-H37 VanDerWaalsContact C-N 3.31Å; I35-H37 PolarHBondContact O-N 3.36Å; I35-F38 PolarHBondContact O-N 3.44Å; I35-Y39 HydrophobicContact CG2-CD2 4.1Å; I35-Y39 PolarHBondContact O-N 2.83Å; I35-M53 HydrophobicContact CG2-SD 3.56Å; I35-M53 VanDerWaalsContact CG2-SD 3.56Å; I35-L99 HydrophobicContact CB-CD2 4.02Å; I35-L99 HydrophobicContact CD1-CD2 4.44Å; I35-L99 HydrophobicContact CG2-CD2 3.75Å
36L83.3Confident76.6Confident6 Ų693.1 Ų93.13%0.03145%0.45CS..Hα-helixtrans-69.2-27.3177.7-68173.6000113.2L32 E33 F38 G40 I45 V96 L99L32-L36 WeakPolarHBondContact O-CG 3.38Å; L32-L36 PolarHBondContact O-N 3.34Å; E33-L36 PolarHBondContact O-N 2.95Å; L36-F38 VanDerWaalsContact C-N 3.33Å; L36-G40 CarbonylContact O-C 3.51Å; L36-G40 WeakPolarHBondContact O-CA 3.33Å; L36-G40 PolarHBondContact O-N 3.43Å; L36-I45 HydrophobicContact CD2-CB 3.69Å; L36-I45 HydrophobicContact CD2-CG2 3.65Å; L36-V96 HydrophobicContact CD1-CB 4.13Å; L36-V96 HydrophobicContact CD1-CG2 3.38Å; L36-L99 HydrophobicContact CD2-CD2 4.28Å; L36-L99 HydrophobicContact CG-CD2 4.15Å
37H82.8Confident78.1Confident163 Ų16384.3 Ų84.376%0.75542%0.422SS*.Hα-helixtrans-69.7-32.6173.3-174.8-77.5000111.9E33 N34 I35E33-H37 WeakPolarHBondContact O-CB 3.3Å; E33-H37 PolarHBondContact O-N 3.48Å; N34-H37 PolarHBondContact O-N 3.46Å; I35-H37 VanDerWaalsContact C-N 3.31Å; I35-H37 PolarHBondContact O-N 3.36Å
38F81Confident79Confident156 Ų15681.4 Ų81.468%0.68442%0.415SS*.Hα-helixtrans-88.2-43.7-179.3-169.1-87.9000112.9N34 I35 L36N34-F38 PolarHBondContact O-N 3.46Å; N34-F38 VanDerWaalsContact O-N 3.13Å; I35-F38 PolarHBondContact O-N 3.44Å; L36-F38 VanDerWaalsContact C-N 3.33Å
39Y80.4Confident80Confident57 Ų5782.5 Ų82.522%0.22441%0.408CS..Hα-helixtrans-103.4-14.5-174.2-68.8-79.8000114.1I35 K49 M53 L56I35-Y39 HydrophobicContact CG2-CD2 4.1Å; I35-Y39 PolarHBondContact O-N 2.83Å; Y39-K49 WeakPolarHBondContact O-CD 3.32Å; Y39-M53 HydrophobicContact CD1-CB 3.91Å; Y39-M53 HydrophobicContact CD1-CG 4.15Å; Y39-M53 HydrophobicContact CD2-CG 3.95Å; Y39-M53 HydrophobicContact CD2-SD 4.13Å; Y39-M53 HydrophobicContact CE1-CB 4.01Å; Y39-M53 HydrophobicContact CE1-CG 4.07Å; Y39-M53 HydrophobicContact CE2-CG 3.86Å; Y39-M53 HydrophobicContact CE2-SD 4.45Å; Y39-M53 HydrophobicContact CG-CB 4.19Å; Y39-M53 HydrophobicContact CG-CG 4.1Å; Y39-M53 HydrophobicContact CG-SD 4.43Å; Y39-L56 HydrophobicContact CE1-CD1 3.84Å
40G79.9Confident80.7Confident15 Ų1577.2 Ų77.216%0.15538%0.383CS..  trans-102.6174-175.400000114.5L36 S44L36-G40 CarbonylContact O-C 3.51Å; L36-G40 WeakPolarHBondContact O-CA 3.33Å; L36-G40 PolarHBondContact O-N 3.43Å; G40-S44 CarbonylContact C-O 3.55Å; G40-S44 WeakPolarHBondContact CA-O 3.37Å
41E78.1Confident80.8Confident127 Ų12774.1 Ų74.159%0.59337%0.369SS*.BIsolated β-bridgetrans-125.4141.3166.2-82.3172.7-151.100108.2K43 S44 K49E41-K43 PolarHBondContact O-N 2.95Å; E41-K43 VanDerWaalsContact O-N 3.08Å; E41-S44 PolarHBondContact N-O 2.98Å; E41-S44 PolarHBondContact O-N 3.33Å; E41-S44 PolarHBondContact O-OG 2.72Å; E41-K49 VanDerWaalsContact CD-NZ 3.31Å; E41-K49 IonicContact OE1-NZ 2.99Å; E41-K49 PolarHBondContact OE1-NZ 3.32Å
42N74.3Confident80.7Confident159 Ų15971 Ų7185%0.8536%0.359SS*.THydrogen-bonded Turntrans52.633.6177.4-61.6-32.9000115.7S44N42-S44 PolarHBondContact O-N 3.19Å
43K77.4Confident80.8Confident176 Ų17669.8 Ų69.877%0.76535%0.352SS*.THydrogen-bonded Turntrans65.921-177.1-48.6-179.6177.6-174.50114.4E41E41-K43 PolarHBondContact O-N 2.95Å; E41-K43 VanDerWaalsContact O-N 3.08Å
44S82.3Confident80.7Confident11 Ų1165.6 Ų65.68%0.07733%0.333CS..BIsolated β-bridgetrans-129.7159.2168.760.90000111.3G40 E41 N42 E93 L94G40-S44 CarbonylContact C-O 3.55Å; G40-S44 WeakPolarHBondContact CA-O 3.37Å; E41-S44 PolarHBondContact N-O 2.98Å; E41-S44 PolarHBondContact O-N 3.33Å; E41-S44 PolarHBondContact O-OG 2.72Å; N42-S44 PolarHBondContact O-N 3.19Å; S44-E93 WeakPolarHBondContact CB-OE2 2.91Å; S44-E93 PolarHBondContact OG-OE2 2.79Å; S44-L94 CarbonylContact C-O 3.49Å; S44-L94 WeakPolarHBondContact CA-O 3.24Å; S44-L94 WeakPolarHBondContact CB-O 3.26Å
45I85.1Confident80.2Confident1 Ų162.5 Ų62.51%0.00532%0.316CS..EExtended strand (participates in β ladder)trans-121.7133.8175-170.2173.3000109.4L36 K49 L50 L94L36-I45 HydrophobicContact CD2-CB 3.69Å; L36-I45 HydrophobicContact CD2-CG2 3.65Å; I45-K49 HydrophobicContact CD1-CB 4.24Å; I45-K49 HydrophobicContact CG1-CB 3.76Å; I45-L50 HydrophobicContact CD1-CB 4.19Å; I45-L50 HydrophobicContact CD1-CD1 4.44Å; I45-L50 HydrophobicContact CG1-CB 4.43Å; I45-L94 HydrophobicContact CG2-CB 3.63Å; I45-L94 PolarHBondContact N-O 3.13Å; I45-L94 PolarHBondContact O-N 3.17Å
46T85.6Confident79.9Confident52 Ų5263.2 Ų63.232%0.31932%0.32SS..EExtended strand (participates in β ladder)trans-80.7161.6175.958.40000110.6A48 K49 L50 E93T46-A48 VanDerWaalsContact C-N 3.29Å; T46-A48 PolarHBondContact O-N 3.24Å; T46-K49 PolarHBondContact O-N 3.19Å; T46-K49 WeakPolarHBondContact OG1-CG 3.27Å; T46-L50 WeakPolarHBondContact O-CB 3.4Å; T46-L50 PolarHBondContact O-N 3.1Å; T46-E93 HydrophobicContact CG2-CG 4.43Å
47T81.5Confident79.6Confident49 Ų4965.3 Ų65.330%0.30133%0.331SS..Hα-helixtrans-57.1-41.2178.155.60000112.6L50 E51 L83T47-L50 WeakPolarHBondContact O-CB 3.32Å; T47-L50 PolarHBondContact O-N 3.19Å; T47-E51 PolarHBondContact O-N 3.5Å; T47-L83 HydrophobicContact CG2-CD1 3.54Å
48A76.3Confident79Confident57 Ų5758.9 Ų58.947%0.47130%0.304SS..Hα-helixtrans-62.3-45.9176.900000112.8T46 L50 E51 D52T46-A48 VanDerWaalsContact C-N 3.29Å; T46-A48 PolarHBondContact O-N 3.24Å; A48-L50 VanDerWaalsContact C-N 3.29Å; A48-L50 PolarHBondContact O-N 2.89Å; A48-E51 VanDerWaalsContact O-CB 3.3Å; A48-E51 WeakPolarHBondContact O-CB 3.27Å; A48-E51 PolarHBondContact O-N 3.43Å; A48-D52 PolarHBondContact O-N 3Å; A48-D52 VanDerWaalsContact O-N 3.08Å
49K80.7Confident78.4Confident62 Ų6255.4 Ų55.427%0.2730%0.304SS..Hα-helixtrans-71.1-26.5178.4-66.4-167-173-174.30112.8Y39 E41 I45 T46 M53Y39-K49 WeakPolarHBondContact O-CD 3.32Å; E41-K49 VanDerWaalsContact CD-NZ 3.31Å; E41-K49 IonicContact OE1-NZ 2.99Å; E41-K49 PolarHBondContact OE1-NZ 3.32Å; I45-K49 HydrophobicContact CD1-CB 4.24Å; I45-K49 HydrophobicContact CG1-CB 3.76Å; T46-K49 PolarHBondContact O-N 3.19Å; T46-K49 WeakPolarHBondContact OG1-CG 3.27Å; K49-M53 PolarHBondContact O-N 3.44Å; K49-M53 VanDerWaalsContact O-N 3.09Å
50L83.2Confident77.6Confident1 Ų163.1 Ų63.11%0.00533%0.333CS..Hα-helixtrans-67.9-39.5171.4-179.463.5000111I45 T46 T47 A48 M53 L54 A79 L83 L94 I102I45-L50 HydrophobicContact CD1-CB 4.19Å; I45-L50 HydrophobicContact CD1-CD1 4.44Å; I45-L50 HydrophobicContact CG1-CB 4.43Å; T46-L50 WeakPolarHBondContact O-CB 3.4Å; T46-L50 PolarHBondContact O-N 3.1Å; T47-L50 WeakPolarHBondContact O-CB 3.32Å; T47-L50 PolarHBondContact O-N 3.19Å; A48-L50 VanDerWaalsContact C-N 3.29Å; A48-L50 PolarHBondContact O-N 2.89Å; L50-M53 HydrophobicContact CD1-CE 3.66Å; L50-M53 WeakPolarHBondContact O-CB 3.46Å; L50-M53 PolarHBondContact O-N 2.95Å; L50-L54 WeakPolarHBondContact O-CG 3.36Å; L50-L54 PolarHBondContact O-N 3.43Å; L50-A79 HydrophobicContact CB-CB 4.46Å; L50-A79 HydrophobicContact CD2-CB 4.14Å; L50-A79 HydrophobicContact CG-CB 4.17Å; L50-L83 HydrophobicContact CD2-CD1 4.21Å; L50-L83 HydrophobicContact CD2-CD2 4.08Å; L50-L83 HydrophobicContact CD2-CG 4.24Å; L50-L94 HydrophobicContact CD2-CD1 4.38Å; L50-L94 HydrophobicContact CD2-CD2 4.32Å; L50-I102 HydrophobicContact CD1-CD1 4.08Å; L50-I102 HydrophobicContact CD2-CD1 3.81Å
51E80.3Confident77.1Confident44 Ų4465.2 Ų65.221%0.20634%0.336CS..Hα-helixtrans-59.4-50.2172.1-163.270.9-16800110.6T47 A48 M53 L54 L55 A79T47-E51 PolarHBondContact O-N 3.5Å; A48-E51 VanDerWaalsContact O-CB 3.3Å; A48-E51 WeakPolarHBondContact O-CB 3.27Å; A48-E51 PolarHBondContact O-N 3.43Å; E51-M53 PolarHBondContact O-N 3.1Å; E51-L54 WeakPolarHBondContact O-CB 3.34Å; E51-L54 PolarHBondContact O-N 2.85Å; E51-L55 HydrophobicContact CG-CD1 4.37Å; E51-L55 VanDerWaalsContact O-CG 3.28Å; E51-L55 WeakPolarHBondContact O-CG 3.24Å; E51-L55 PolarHBondContact O-N 3.2Å; E51-A79 HydrophobicContact CB-CB 4.36Å; E51-A79 WeakPolarHBondContact OE2-CA 3.38Å; E51-A79 WeakPolarHBondContact OE2-CB 3.32Å; E51-A79 PolarHBondContact OE2-N 3.28Å
52D76.9Confident76.3Confident76 Ų7662.3 Ų62.341%0.40633%0.33SS..Hα-helixtrans-56.1-39.2177.3-66.2-21.2000112.8A48 L55 L56A48-D52 PolarHBondContact O-N 3Å; A48-D52 VanDerWaalsContact O-N 3.08Å; D52-L55 PolarHBondContact O-N 2.63Å; D52-L56 PolarHBondContact O-N 2.9Å; D52-L56 VanDerWaalsContact O-N 3.11Å
53M81.9Confident75.6Confident6 Ų663.8 Ų63.83%0.0333%0.331CS..Hα-helixtrans-65.4-45.5176.5-173.2-168.18000111.5I35 Y39 K49 L50 E51 L55 L56 I57 V106I35-M53 HydrophobicContact CG2-SD 3.56Å; I35-M53 VanDerWaalsContact CG2-SD 3.56Å; Y39-M53 HydrophobicContact CD1-CB 3.91Å; Y39-M53 HydrophobicContact CD1-CG 4.15Å; Y39-M53 HydrophobicContact CD2-CG 3.95Å; Y39-M53 HydrophobicContact CD2-SD 4.13Å; Y39-M53 HydrophobicContact CE1-CB 4.01Å; Y39-M53 HydrophobicContact CE1-CG 4.07Å; Y39-M53 HydrophobicContact CE2-CG 3.86Å; Y39-M53 HydrophobicContact CE2-SD 4.45Å; Y39-M53 HydrophobicContact CG-CB 4.19Å; Y39-M53 HydrophobicContact CG-CG 4.1Å; Y39-M53 HydrophobicContact CG-SD 4.43Å; K49-M53 PolarHBondContact O-N 3.44Å; K49-M53 VanDerWaalsContact O-N 3.09Å; L50-M53 HydrophobicContact CD1-CE 3.66Å; L50-M53 WeakPolarHBondContact O-CB 3.46Å; L50-M53 PolarHBondContact O-N 2.95Å; E51-M53 PolarHBondContact O-N 3.1Å; M53-L55 VanDerWaalsContact C-N 3.26Å; M53-L55 PolarHBondContact O-N 3.02Å; M53-L56 PolarHBondContact O-N 3.17Å; M53-I57 HydrophobicContact CE-CD1 4.21Å; M53-I57 HydrophobicContact CG-CD1 4.05Å; M53-I57 WeakPolarHBondContact O-CD1 3.37Å; M53-I57 VanDerWaalsContact O-CG1 3.25Å; M53-I57 WeakPolarHBondContact O-CG1 3.25Å; M53-I57 PolarHBondContact O-N 3.16Å; M53-I57 VanDerWaalsContact O-N 3.15Å; M53-V106 HydrophobicContact CE-CG1 3.84Å; M53-V106 HydrophobicContact CE-CG2 4.31Å
54L80Confident74.8Confident4 Ų460 Ų602%0.02133%0.328CS..Hα-helixtrans-60.8-37.7177.6-70.8170.2000111.5L50 E51 I57 S58 A79 I82 V106 Q109L50-L54 WeakPolarHBondContact O-CG 3.36Å; L50-L54 PolarHBondContact O-N 3.43Å; E51-L54 WeakPolarHBondContact O-CB 3.34Å; E51-L54 PolarHBondContact O-N 2.85Å; L54-I57 PolarHBondContact O-N 3.48Å; L54-S58 PolarHBondContact O-N 3.07Å; L54-S58 PolarHBondContact O-OG 3.37Å; L54-A79 HydrophobicContact CD1-CB 4.16Å; L54-I82 HydrophobicContact CD1-CD1 3.8Å; L54-I82 HydrophobicContact CD2-CD1 4.42Å; L54-V106 HydrophobicContact CD2-CB 4.27Å; L54-V106 HydrophobicContact CD2-CG1 4.02Å; L54-V106 HydrophobicContact CD2-CG2 4.08Å; L54-Q109 HydrophobicContact CD2-CB 4.47Å; L54-Q109 HydrophobicContact CD2-CG 4.41Å
55L72Confident73.9Confident30 Ų3061.6 Ų61.616%0.15733%0.334CS..Hα-helixtrans-66.5-43.5178-68.6170.9000113.4E51 D52 M53 I57 S58 A59 Y117E51-L55 HydrophobicContact CG-CD1 4.37Å; E51-L55 VanDerWaalsContact O-CG 3.28Å; E51-L55 WeakPolarHBondContact O-CG 3.24Å; E51-L55 PolarHBondContact O-N 3.2Å; D52-L55 PolarHBondContact O-N 2.63Å; M53-L55 VanDerWaalsContact C-N 3.26Å; M53-L55 PolarHBondContact O-N 3.02Å; L55-I57 VanDerWaalsContact C-N 3.26Å; L55-I57 PolarHBondContact O-N 3.03Å; L55-S58 WeakPolarHBondContact CA-OG 3.32Å; L55-S58 PolarHBondContact O-N 3.13Å; L55-S58 PolarHBondContact O-OG 3.34Å; L55-A59 VanDerWaalsContact O-CB 3.31Å; L55-A59 WeakPolarHBondContact O-CB 3.28Å; L55-A59 PolarHBondContact O-N 2.83Å; L55-Y117 HydrophobicContact CD1-CD2 3.78Å; L55-Y117 HydrophobicContact CD1-CE2 3.34Å; L55-Y117 HydrophobicContact CD2-CD2 3.26Å; L55-Y117 HydrophobicContact CD2-CE2 3.81Å; L55-Y117 HydrophobicContact CD2-CG 4.18Å; L55-Y117 HydrophobicContact CG-CD2 4.09Å; L55-Y117 HydrophobicContact CG-CE2 4.13Å
56L74.5Confident72.6Confident76 Ų7665.9 Ų65.940%0.39837%0.365SS..Hα-helixtrans-64.4-35.1175.5-81.3167.2000112.2Y39 D52 M53 R60Y39-L56 HydrophobicContact CE1-CD1 3.84Å; D52-L56 PolarHBondContact O-N 2.9Å; D52-L56 VanDerWaalsContact O-N 3.11Å; M53-L56 PolarHBondContact O-N 3.17Å; L56-R60 PolarHBondContact O-N 3.47Å
57I77.2Confident71.2Confident49 Ų4972.7 Ų72.725%0.25139%0.393SS..Hα-helixtrans-68.2-43.1177.9-70.4169.1000110.6M53 L54 L55 V106 V110M53-I57 HydrophobicContact CE-CD1 4.21Å; M53-I57 HydrophobicContact CG-CD1 4.05Å; M53-I57 WeakPolarHBondContact O-CD1 3.37Å; M53-I57 VanDerWaalsContact O-CG1 3.25Å; M53-I57 WeakPolarHBondContact O-CG1 3.25Å; M53-I57 PolarHBondContact O-N 3.16Å; M53-I57 VanDerWaalsContact O-N 3.15Å; L54-I57 PolarHBondContact O-N 3.48Å; L55-I57 VanDerWaalsContact C-N 3.26Å; L55-I57 PolarHBondContact O-N 3.03Å; I57-V106 HydrophobicContact CD1-CG1 3.88Å; I57-V110 HydrophobicContact CG2-CG2 3.29Å
58S70.8Confident70.4Confident29 Ų2974 Ų7420%0.20342%0.416CS..Hα-helixtrans-68.5-36.3176.156.30000112.5L54 L55 R60 R61L54-S58 PolarHBondContact O-N 3.07Å; L54-S58 PolarHBondContact O-OG 3.37Å; L55-S58 WeakPolarHBondContact CA-OG 3.32Å; L55-S58 PolarHBondContact O-N 3.13Å; L55-S58 PolarHBondContact O-OG 3.34Å; S58-R60 PolarHBondContact O-N 3.07Å; S58-R61 WeakPolarHBondContact O-CB 3.39Å
59A67.8Low70.2Confident82 Ų8272.5 Ų72.568%0.67840%0.4SS*.Hα-helixtrans-69.4-29.218000000113.9L55 R61L55-A59 VanDerWaalsContact O-CB 3.31Å; L55-A59 WeakPolarHBondContact O-CB 3.28Å; L55-A59 PolarHBondContact O-N 2.83Å; A59-R61 VanDerWaalsContact C-N 3.34Å
60R64.4Low69.7Low219 Ų21975.3 Ų75.383%0.82643%0.425SS*.THydrogen-bonded Turntrans-93.719-179.8-70.6-167.7178.4-160.52114.2L56 S58L56-R60 PolarHBondContact O-N 3.47Å; S58-R60 PolarHBondContact O-N 3.07Å
61R68.3Low69.1Low60 Ų6077.2 Ų77.223%0.22644%0.435CS..  trans-64.7147-179.1-176.1-178.7170.8-172.96112.3S58 A59 I65 L112 P113S58-R61 WeakPolarHBondContact O-CB 3.39Å; A59-R61 VanDerWaalsContact C-N 3.34Å; R61-I65 HydrophobicContact CG-CD1 3.92Å; R61-I65 VanDerWaalsContact NH2-CG2 3.26Å; R61-I65 PolarHBondContact NH2-O 3.27Å; R61-L112 PolarHBondContact NH1-O 3.45Å; R61-P113 VanDerWaalsContact NH1-CA 3.34Å
62S63Low68.3Low66 Ų6681.9 Ų81.946%0.46246%0.456SS..  trans-77.9133.6171.6-177.40000111.9S64 I65S62-S64 PolarHBondContact O-N 3.08Å; S62-S64 VanDerWaalsContact O-N 3.09Å; S62-S64 PolarHBondContact OG-N 3.44Å; S62-S64 PolarHBondContact OG-OG 3.15Å; S62-I65 PolarHBondContact O-N 2.89Å
63E58.9Low67.4Low189 Ų18983.8 Ų83.888%0.88348%0.476SS*.G310 helixtrans-58.9-18.3174.5-68178.2169.400113.6I65E63-I65 PolarHBondContact O-N 2.82Å
64S59.8Low67Low98 Ų9889.6 Ų89.669%0.68550%0.501SS*.G310 helixtrans-69.3-7.4-17962.70000115.6S62S62-S64 PolarHBondContact O-N 3.08Å; S62-S64 VanDerWaalsContact O-N 3.09Å; S62-S64 PolarHBondContact OG-N 3.44Å; S62-S64 PolarHBondContact OG-OG 3.15Å
65I62.9Low66.4Low43 Ų4398.1 Ų98.122%0.22154%0.541CS..G310 helixtrans-93.77.8-174.2-50.6168.2000111.4R61 S62 E63R61-I65 HydrophobicContact CG-CD1 3.92Å; R61-I65 VanDerWaalsContact NH2-CG2 3.26Å; R61-I65 PolarHBondContact NH2-O 3.27Å; S62-I65 PolarHBondContact O-N 2.89Å; E63-I65 PolarHBondContact O-N 2.82Å
66S58Low66.5Low91 Ų9198.5 Ų98.564%0.63655%0.545SS*.  trans-93.6-25.9-171.9-155.90000114.9G68S66-G68 PolarHBondContact O-N 3.19Å
67E57.3Low66.6Low195 Ų19596.8 Ų96.891%0.91154%0.539SS*.THydrogen-bonded Turntrans-87.3112.5-178.4-73.5-169.5159.400111.4
68G64.9Low66.7Low76 Ų7696.2 Ų96.278%0.78454%0.539SS*.THydrogen-bonded Turntrans78.725.5172.100000115.7S66 P70S66-G68 PolarHBondContact O-N 3.19Å; G68-P70 WeakPolarHBondContact O-CD 3.28Å
69N71.6Confident67.1Low26 Ų2694.9 Ų94.914%0.13953%0.53CS..  trans-71118.6-178.4-173.8-8.3000111.9L71 E72 L111N69-L71 PolarHBondContact O-N 3.39Å; N69-L71 WeakPolarHBondContact OD1-CB 3.25Å; N69-L71 PolarHBondContact OD1-N 2.69Å; N69-E72 WeakPolarHBondContact O-CB 3.27Å; N69-E72 PolarHBondContact O-N 3.34Å; N69-L111 PolarHBondContact ND2-O 3.15Å
70P70.8Confident67.7Low122 Ų12297.8 Ų97.879%0.79253%0.529SS*.THydrogen-bonded Turntrans-67.3-6.1178.928.7-35.9000114.2G68G68-P70 WeakPolarHBondContact O-CD 3.28Å
71L69.2Low68.5Low41 Ų4192.7 Ų92.722%0.21552%0.515CS..THydrogen-bonded Turntrans-104.99.6179.9-58.2175.6000113.6N69 S73 K74 L111 L112 P113N69-L71 PolarHBondContact O-N 3.39Å; N69-L71 WeakPolarHBondContact OD1-CB 3.25Å; N69-L71 PolarHBondContact OD1-N 2.69Å; L71-S73 PolarHBondContact O-N 2.92Å; L71-K74 HydrophobicContact CD2-CD 4.17Å; L71-K74 PolarHBondContact O-N 2.59Å; L71-K74 VanDerWaalsContact O-N 3.1Å; L71-L111 HydrophobicContact CD1-CB 4.04Å; L71-L112 HydrophobicContact CB-CD2 4.17Å; L71-L112 HydrophobicContact CD1-CD2 4.5Å; L71-P113 WeakPolarHBondContact O-CD 3.37Å
72E63.1Low69.2Low141 Ų14190.1 Ų90.166%0.65951%0.506SS*.THydrogen-bonded Turntrans-56.8-22.6-177.7-170.5177-174.300114.5N69 P113N69-E72 WeakPolarHBondContact O-CB 3.27Å; N69-E72 PolarHBondContact O-N 3.34Å; E72-P113 WeakPolarHBondContact O-CG 3.38Å
73S59.3Low70.2Confident117 Ų11787.2 Ų87.282%0.81849%0.485SS*.THydrogen-bonded Turntrans-100.310.8-179.474.90000114.5L71L71-S73 PolarHBondContact O-N 2.92Å
74K72.7Confident71.5Confident128 Ų12881.6 Ų81.656%0.55747%0.467SS*.PPolyproline II helixtrans-100.4131.9-176.9-74.7-150.4177.6-173.30112.3L71 L112L71-K74 HydrophobicContact CD2-CD 4.17Å; L71-K74 PolarHBondContact O-N 2.59Å; L71-K74 VanDerWaalsContact O-N 3.1Å; K74-L112 HydrophobicContact CB-CD2 3.64Å
75E67.4Low72.7Confident183 Ų18384.5 Ų84.586%0.85547%0.469SS*.PPolyproline II helixtrans-70.4150.4173.7-66.9175.8-177.300111.8P77E75-P77 WeakPolarHBondContact O-CD 3.37Å
76C73.9Confident73.7Confident37 Ų3786 Ų8625%0.2547%0.474CS..PPolyproline II helixtrans-86.7119.6179.8-64.20000110.9L112 C115C76-L112 HydrophobicContact CB-CD1 4.48Å; C76-C115 HydrophobicContact CB-CB 3.58Å; C76-C115 WeakPolarHBondContact CB-SG 3.43Å; C76-C115 WeakPolarHBondContact SG-CA 3.28Å; C76-C115 WeakPolarHBondContact SG-CB 3.36Å; C76-C115 CovalentContact SG-SG 2.02Å; C76-C115 PolarHBondContact SG-SG 2.84Å
77P76.7Confident74.8Confident40 Ų4084.8 Ų84.826%0.2648%0.476SS..PPolyproline II helixtrans-75.2141.517830.9-34.8000111.3E75 Q81 I82E75-P77 WeakPolarHBondContact O-CD 3.37Å; P77-Q81 VanDerWaalsContact CA-OE1 3.24Å; P77-Q81 HydrophobicContact CB-CB 4.06Å; P77-I82 HydrophobicContact CB-CG1 3.95Å; P77-I82 HydrophobicContact CG-CD1 4.17Å; P77-I82 HydrophobicContact CG-CG1 3.87Å
78S79.3Confident76Confident37 Ų3776.2 Ų76.226%0.25944%0.436SS..PPolyproline II helixtrans-72.5164.6170.169.80000111.6E80 Q81 I82S78-E80 PolarHBondContact O-N 3.2Å; S78-Q81 PolarHBondContact O-N 3.15Å; S78-Q81 WeakPolarHBondContact OG-CG 3.2Å; S78-Q81 PolarHBondContact OG-N 3.37Å; S78-I82 WeakPolarHBondContact O-CG1 3.46Å; S78-I82 PolarHBondContact O-N 3.23Å
79A80.6Confident76.3Confident2 Ų275 Ų752%0.01742%0.423CS..Hα-helixtrans-54.4-39.9173.500000111.2L50 E51 L54 Q81 I82 L83L50-A79 HydrophobicContact CB-CB 4.46Å; L50-A79 HydrophobicContact CD2-CB 4.14Å; L50-A79 HydrophobicContact CG-CB 4.17Å; E51-A79 HydrophobicContact CB-CB 4.36Å; E51-A79 WeakPolarHBondContact OE2-CA 3.38Å; E51-A79 WeakPolarHBondContact OE2-CB 3.32Å; E51-A79 PolarHBondContact OE2-N 3.28Å; L54-A79 HydrophobicContact CD1-CB 4.16Å; A79-Q81 PolarHBondContact O-N 3.39Å; A79-I82 PolarHBondContact O-N 3.19Å; A79-L83 WeakPolarHBondContact O-CB 3.37Å; A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 2.88Å
80E80.2Confident76.5Confident142 Ų14281.7 Ų81.766%0.66446%0.459SS*.Hα-helixtrans-64.6-39.1177.1-65.7-170.716700113S78 L83 S84S78-E80 PolarHBondContact O-N 3.2Å; E80-L83 PolarHBondContact O-N 3.49Å; E80-S84 WeakPolarHBondContact O-CB 3.01Å; E80-S84 PolarHBondContact O-N 3.08Å; E80-S84 PolarHBondContact O-OG 3.48Å
81Q81.3Confident76.8Confident112 Ų11278.5 Ų78.552%0.52344%0.435SS..Hα-helixtrans-68.7-39.9176.3-71.4176.9-1200111.6P77 S78 A79 S84 H85P77-Q81 VanDerWaalsContact CA-OE1 3.24Å; P77-Q81 HydrophobicContact CB-CB 4.06Å; S78-Q81 PolarHBondContact O-N 3.15Å; S78-Q81 WeakPolarHBondContact OG-CG 3.2Å; S78-Q81 PolarHBondContact OG-N 3.37Å; A79-Q81 PolarHBondContact O-N 3.39Å; Q81-S84 WeakPolarHBondContact CA-OG 3.25Å; Q81-S84 PolarHBondContact O-OG 3.38Å; Q81-H85 VanDerWaalsContact O-CB 3.29Å; Q81-H85 WeakPolarHBondContact O-CB 3.49Å; Q81-H85 PolarHBondContact O-N 3.32Å
82I83.3Confident77Confident7 Ų781.8 Ų81.84%0.03646%0.457CS..Hα-helixtrans-62.4-49.6172.7-64.9170.4000109.4L54 P77 S78 A79 S84 H85 F86 I102 A105L54-I82 HydrophobicContact CD1-CD1 3.8Å; L54-I82 HydrophobicContact CD2-CD1 4.42Å; P77-I82 HydrophobicContact CB-CG1 3.95Å; P77-I82 HydrophobicContact CG-CD1 4.17Å; P77-I82 HydrophobicContact CG-CG1 3.87Å; S78-I82 WeakPolarHBondContact O-CG1 3.46Å; S78-I82 PolarHBondContact O-N 3.23Å; A79-I82 PolarHBondContact O-N 3.19Å; I82-S84 PolarHBondContact O-N 2.89Å; I82-H85 PolarHBondContact O-N 2.96Å; I82-F86 HydrophobicContact CG2-CD2 4.21Å; I82-F86 HydrophobicContact CG2-CE2 4.37Å; I82-F86 VanDerWaalsContact O-CD2 3.27Å; I82-F86 WeakPolarHBondContact O-CD2 3.5Å; I82-F86 PolarHBondContact O-N 2.99Å; I82-F86 VanDerWaalsContact O-N 3.15Å; I82-I102 HydrophobicContact CG2-CB 4.1Å; I82-I102 HydrophobicContact CG2-CG2 4.15Å; I82-A105 HydrophobicContact CG2-CB 3.86Å
83L83.9Confident77.8Confident4 Ų480 Ų802%0.02145%0.448CS..Hα-helixtrans-62.6-44.2-178.1-68.7172.1000112T47 L50 A79 E80 H85 F86 G87 F88 L94T47-L83 HydrophobicContact CG2-CD1 3.54Å; L50-L83 HydrophobicContact CD2-CD1 4.21Å; L50-L83 HydrophobicContact CD2-CD2 4.08Å; L50-L83 HydrophobicContact CD2-CG 4.24Å; A79-L83 WeakPolarHBondContact O-CB 3.37Å; A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 2.88Å; E80-L83 PolarHBondContact O-N 3.49Å; L83-H85 PolarHBondContact O-N 3.42Å; L83-F86 PolarHBondContact O-N 3.31Å; L83-G87 PolarHBondContact O-N 3.39Å; L83-F88 HydrophobicContact CB-CB 4.17Å; L83-F88 HydrophobicContact CD2-CB 4Å; L83-F88 HydrophobicContact CD2-CD2 4.32Å; L83-F88 WeakPolarHBondContact O-CA 3.37Å; L83-F88 WeakPolarHBondContact O-CB 3.31Å; L83-F88 PolarHBondContact O-N 3.27Å; L83-L94 HydrophobicContact CD1-CD1 4Å; L83-L94 HydrophobicContact CD2-CD1 3.67Å; L83-L94 HydrophobicContact CD2-CD2 3.35Å; L83-L94 HydrophobicContact CD2-CG 3.97Å
84S84.4Confident78.9Confident72 Ų7274.4 Ų74.450%0.50341%0.409SS..Hα-helixtrans-63.6-39.6176.357.60000112.6E80 Q81 I82 F86 G87E80-S84 WeakPolarHBondContact O-CB 3.01Å; E80-S84 PolarHBondContact O-N 3.08Å; E80-S84 PolarHBondContact O-OG 3.48Å; Q81-S84 WeakPolarHBondContact CA-OG 3.25Å; Q81-S84 PolarHBondContact O-OG 3.38Å; I82-S84 PolarHBondContact O-N 2.89Å; S84-F86 VanDerWaalsContact C-N 3.28Å; S84-F86 PolarHBondContact O-N 2.68Å; S84-G87 PolarHBondContact O-N 2.94Å; S84-G87 VanDerWaalsContact O-N 3.1Å
85H85.6Confident79.6Confident159 Ų15971.4 Ų71.474%0.73640%0.402SS*.Hα-helixtrans-62.3-34.3177.3-166.480.5000113Q81 I82 L83Q81-H85 VanDerWaalsContact O-CB 3.29Å; Q81-H85 WeakPolarHBondContact O-CB 3.49Å; Q81-H85 PolarHBondContact O-N 3.32Å; I82-H85 PolarHBondContact O-N 2.96Å; L83-H85 PolarHBondContact O-N 3.42Å
86F84.6Confident80.3Confident74 Ų7464.2 Ų64.233%0.32537%0.37SS..THydrogen-bonded Turntrans-92.37.7177.5-73.8-97.1000113.8I82 L83 S84 F88 R101 I102 A105I82-F86 HydrophobicContact CG2-CD2 4.21Å; I82-F86 HydrophobicContact CG2-CE2 4.37Å; I82-F86 VanDerWaalsContact O-CD2 3.27Å; I82-F86 WeakPolarHBondContact O-CD2 3.5Å; I82-F86 PolarHBondContact O-N 2.99Å; I82-F86 VanDerWaalsContact O-N 3.15Å; L83-F86 PolarHBondContact O-N 3.31Å; S84-F86 VanDerWaalsContact C-N 3.28Å; S84-F86 PolarHBondContact O-N 2.68Å; F86-F88 HydrophobicContact CB-CD2 3.74Å; F86-F88 HydrophobicContact CB-CE2 3.72Å; F86-R101 WeakPolarHBondContact CD1-O 3.3Å; F86-R101 WeakPolarHBondContact CE1-O 3.24Å; F86-I102 HydrophobicContact CB-CG2 4.06Å; F86-I102 HydrophobicContact CD1-CG2 4.46Å; F86-I102 HydrophobicContact CD2-CG2 4.16Å; F86-I102 HydrophobicContact CG-CG2 3.97Å; F86-A105 HydrophobicContact CE2-CB 3.67Å; F86-A105 HydrophobicContact CZ-CB 4.02Å
87G80.3Confident80.6Confident66 Ų6664.6 Ų64.668%0.6838%0.38SS*.THydrogen-bonded Turntrans8120.8176.100000115.1L83 S84L83-G87 PolarHBondContact O-N 3.39Å; S84-G87 PolarHBondContact O-N 2.94Å; S84-G87 VanDerWaalsContact O-N 3.1Å
88F83.8Confident81Confident15 Ų1564.8 Ų64.87%0.06638%0.378CS..  trans-109.514.9-177.3-54.6-46.7000114.3L83 F86 N90 I91 H98 R101 I102L83-F88 HydrophobicContact CB-CB 4.17Å; L83-F88 HydrophobicContact CD2-CB 4Å; L83-F88 HydrophobicContact CD2-CD2 4.32Å; L83-F88 WeakPolarHBondContact O-CA 3.37Å; L83-F88 WeakPolarHBondContact O-CB 3.31Å; L83-F88 PolarHBondContact O-N 3.27Å; F86-F88 HydrophobicContact CB-CD2 3.74Å; F86-F88 HydrophobicContact CB-CE2 3.72Å; F88-N90 PolarHBondContact O-N 2.89Å; F88-I91 HydrophobicContact CB-CD1 4.06Å; F88-I91 HydrophobicContact CB-CG1 4.45Å; F88-I91 HydrophobicContact CD1-CD1 3.56Å; F88-I91 HydrophobicContact CE1-CD1 4.44Å; F88-I91 HydrophobicContact CG-CD1 4.2Å; F88-I91 PolarHBondContact O-N 2.93Å; F88-H98 AromaticContact CE1-CD2 3.82Å; F88-H98 HydrophobicContact CE2-CB 4.48Å; F88-R101 HydrophobicContact CE2-CB 4.16Å; F88-R101 HydrophobicContact CZ-CB 4.24Å; F88-I102 HydrophobicContact CD2-CG2 4.02Å; F88-I102 HydrophobicContact CE2-CG2 3.98Å
89G71.4Confident81.2Confident50 Ų5063.4 Ų63.452%0.51537%0.367SS..THydrogen-bonded Turntrans-59.7-19.7-174.500000116.1
90N74.5Confident81.3Confident166 Ų16665 Ų6589%0.88838%0.384SS*.THydrogen-bonded Turntrans-102.46.3179.8-65.3-3.8000113.4F88F88-N90 PolarHBondContact O-N 2.89Å
91I76.8Confident81.5Confident56 Ų5666 Ų6629%0.28738%0.382SS..  trans-100.1121.5-174.4-56.4-177.1000109.1F88 E93F88-I91 HydrophobicContact CB-CD1 4.06Å; F88-I91 HydrophobicContact CB-CG1 4.45Å; F88-I91 HydrophobicContact CD1-CD1 3.56Å; F88-I91 HydrophobicContact CE1-CD1 4.44Å; F88-I91 HydrophobicContact CG-CD1 4.2Å; F88-I91 PolarHBondContact O-N 2.93Å; I91-E93 WeakPolarHBondContact CG2-O 3.48Å
92T73.4Confident81.8Confident110 Ų11060.8 Ų60.868%0.67536%0.357SS*.SBendtrans-81.2-24.8179.453.30000113.1
93E80.6Confident81.9Confident103 Ų10363.3 Ų63.348%0.48138%0.375SS..EExtended strand (participates in β ladder)trans-134122.6-175.8-75.1-171.8-158.900112.3S44 T46 I91S44-E93 WeakPolarHBondContact CB-OE2 2.91Å; S44-E93 PolarHBondContact OG-OE2 2.79Å; T46-E93 HydrophobicContact CG2-CG 4.43Å; I91-E93 WeakPolarHBondContact CG2-O 3.48Å
94L83.4Confident82.1Confident0 Ų066.9 Ų66.90%040%0.398CS..EExtended strand (participates in β ladder)trans-93.2132.9178.8-79.693.5000111.6S44 I45 L50 L83 H98 I102S44-L94 CarbonylContact C-O 3.49Å; S44-L94 WeakPolarHBondContact CA-O 3.24Å; S44-L94 WeakPolarHBondContact CB-O 3.26Å; I45-L94 HydrophobicContact CG2-CB 3.63Å; I45-L94 PolarHBondContact N-O 3.13Å; I45-L94 PolarHBondContact O-N 3.17Å; L50-L94 HydrophobicContact CD2-CD1 4.38Å; L50-L94 HydrophobicContact CD2-CD2 4.32Å; L83-L94 HydrophobicContact CD1-CD1 4Å; L83-L94 HydrophobicContact CD2-CD1 3.67Å; L83-L94 HydrophobicContact CD2-CD2 3.35Å; L83-L94 HydrophobicContact CD2-CG 3.97Å; L94-H98 HydrophobicContact CB-CB 4.04Å; L94-H98 HydrophobicContact CD2-CB 3.75Å; L94-H98 HydrophobicContact CG-CB 4Å; L94-I102 HydrophobicContact CD2-CD1 3.7Å
95T85.9Confident82Confident65 Ų6564.3 Ų64.340%0.39938%0.382SS..  trans-97.5173.9175.663.90000110.9G97 H98 L99T95-G97 PolarHBondContact O-N 3.11Å; T95-G97 VanDerWaalsContact O-N 3.14Å; T95-H98 PolarHBondContact N-ND1 3.18Å; T95-H98 WeakPolarHBondContact O-CB 3.37Å; T95-H98 PolarHBondContact O-N 2.81Å; T95-H98 PolarHBondContact OG1-ND1 3.1Å; T95-L99 PolarHBondContact O-N 3.46Å
96V83.4Confident81.9Confident31 Ų3157.5 Ų57.519%0.18835%0.351CS..Hα-helixtrans-48.1-42.4175-178.30000112Q29 L32 E33 L36 H98 L99 G100Q29-V96 HydrophobicContact CG-CG1 3.72Å; L32-V96 HydrophobicContact CB-CG1 3.88Å; L32-V96 HydrophobicContact CD2-CG1 4.22Å; L32-V96 WeakPolarHBondContact CD2-O 3.43Å; E33-V96 HydrophobicContact CG-CG2 3.91Å; L36-V96 HydrophobicContact CD1-CB 4.13Å; L36-V96 HydrophobicContact CD1-CG2 3.38Å; V96-H98 PolarHBondContact O-N 3.32Å; V96-L99 PolarHBondContact O-N 3.39Å; V96-G100 PolarHBondContact O-N 2.95Å
97G80.1Confident81.8Confident45 Ų4559.6 Ų59.646%0.46437%0.365SS..Hα-helixtrans-68.6-32.7179.600000113.7T95T95-G97 PolarHBondContact O-N 3.11Å; T95-G97 VanDerWaalsContact O-N 3.14Å
98H84.4Confident81.8Confident45 Ų4559.4 Ų59.421%0.20835%0.351CS..Hα-helixtrans-72.4-43.2174.9-57.4153.4000110.7F88 L94 T95 V96 G100 R101 I102F88-H98 AromaticContact CE1-CD2 3.82Å; F88-H98 HydrophobicContact CE2-CB 4.48Å; L94-H98 HydrophobicContact CB-CB 4.04Å; L94-H98 HydrophobicContact CD2-CB 3.75Å; L94-H98 HydrophobicContact CG-CB 4Å; T95-H98 PolarHBondContact N-ND1 3.18Å; T95-H98 WeakPolarHBondContact O-CB 3.37Å; T95-H98 PolarHBondContact O-N 2.81Å; T95-H98 PolarHBondContact OG1-ND1 3.1Å; V96-H98 PolarHBondContact O-N 3.32Å; H98-G100 VanDerWaalsContact C-N 3.3Å; H98-G100 PolarHBondContact O-N 2.86Å; H98-R101 PolarHBondContact O-N 3.21Å; H98-I102 PolarHBondContact O-N 3.12Å; H98-I102 VanDerWaalsContact O-N 3.15Å
99L82.6Confident81.5Confident7 Ų759.4 Ų59.44%0.03735%0.351CS..Hα-helixtrans-61-39178.4-170.262.1000111.8L32 I35 L36 T95 V96 R101 I102 C103L32-L99 HydrophobicContact CB-CD2 4.3Å; L32-L99 HydrophobicContact CD2-CB 4.26Å; L32-L99 HydrophobicContact CD2-CG 4.45Å; L32-L99 HydrophobicContact CG-CD2 4.37Å; I35-L99 HydrophobicContact CB-CD2 4.02Å; I35-L99 HydrophobicContact CD1-CD2 4.44Å; I35-L99 HydrophobicContact CG2-CD2 3.75Å; L36-L99 HydrophobicContact CD2-CD2 4.28Å; L36-L99 HydrophobicContact CG-CD2 4.15Å; T95-L99 PolarHBondContact O-N 3.46Å; V96-L99 PolarHBondContact O-N 3.39Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.19Å; L99-I102 HydrophobicContact CD1-CD1 4.03Å; L99-I102 HydrophobicContact CD1-CG1 4.18Å; L99-I102 WeakPolarHBondContact O-CG1 3.21Å; L99-I102 PolarHBondContact O-N 3.11Å; L99-C103 WeakPolarHBondContact O-CB 3.35Å; L99-C103 PolarHBondContact O-N 2.94Å
100G84.6Confident81.7Confident36 Ų3659 Ų5937%0.37134%0.338SS..Hα-helixtrans-64.1-30.2175.400000114L32 V96 H98L32-G100 VanDerWaalsContact CD2-CA 3.42Å; L32-G100 VanDerWaalsContact CD2-N 3.31Å; V96-G100 PolarHBondContact O-N 2.95Å; H98-G100 VanDerWaalsContact C-N 3.3Å; H98-G100 PolarHBondContact O-N 2.86Å
101R84.4Confident81.7Confident164 Ų16454.9 Ų54.962%0.61932%0.316SS*.Hα-helixtrans-78.4-35.7177.9-72.5177.1179.1-174.66.9112.7F86 F88 H98 L99 P104F86-R101 WeakPolarHBondContact CD1-O 3.3Å; F86-R101 WeakPolarHBondContact CE1-O 3.24Å; F88-R101 HydrophobicContact CE2-CB 4.16Å; F88-R101 HydrophobicContact CZ-CB 4.24Å; H98-R101 PolarHBondContact O-N 3.21Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.19Å; R101-P104 WeakPolarHBondContact O-CD 3.48Å
102I86.9Confident81.5Confident1 Ų152.6 Ų52.61%0.00531%0.305CS..Hα-helixtrans-86.1-9177.265.2171.2000113.4L50 I82 F86 F88 L94 H98 L99 P104 A105 V106L50-I102 HydrophobicContact CD1-CD1 4.08Å; L50-I102 HydrophobicContact CD2-CD1 3.81Å; I82-I102 HydrophobicContact CG2-CB 4.1Å; I82-I102 HydrophobicContact CG2-CG2 4.15Å; F86-I102 HydrophobicContact CB-CG2 4.06Å; F86-I102 HydrophobicContact CD1-CG2 4.46Å; F86-I102 HydrophobicContact CD2-CG2 4.16Å; F86-I102 HydrophobicContact CG-CG2 3.97Å; F88-I102 HydrophobicContact CD2-CG2 4.02Å; F88-I102 HydrophobicContact CE2-CG2 3.98Å; L94-I102 HydrophobicContact CD2-CD1 3.7Å; H98-I102 PolarHBondContact O-N 3.12Å; H98-I102 VanDerWaalsContact O-N 3.15Å; L99-I102 HydrophobicContact CD1-CD1 4.03Å; L99-I102 HydrophobicContact CD1-CG1 4.18Å; L99-I102 WeakPolarHBondContact O-CG1 3.21Å; L99-I102 PolarHBondContact O-N 3.11Å; I102-P104 VanDerWaalsContact C-CD 3.45Å; I102-P104 VanDerWaalsContact C-N 3.34Å; I102-A105 WeakPolarHBondContact O-CA 3.13Å; I102-A105 WeakPolarHBondContact O-CB 3.32Å; I102-A105 PolarHBondContact O-N 3.33Å; I102-V106 HydrophobicContact CD1-CG2 4.35Å; I102-V106 HydrophobicContact CG1-CG2 4.26Å; I102-V106 PolarHBondContact O-N 3.42Å
103C85.6Confident81Confident61 Ų6149 Ų4941%0.41228%0.283SS..Hα-helixtrans-49.7-42.3-178.4-176.80000114.2L99 A105 V106 L107L99-C103 WeakPolarHBondContact O-CB 3.35Å; L99-C103 PolarHBondContact O-N 2.94Å; C103-A105 VanDerWaalsContact C-N 3.31Å; C103-A105 PolarHBondContact O-N 3.09Å; C103-V106 PolarHBondContact O-N 3.47Å; C103-L107 WeakPolarHBondContact O-CB 3.39Å; C103-L107 PolarHBondContact O-N 3.26Å
104P86.6Confident80.1Confident78 Ų7849.3 Ų49.351%0.50630%0.297SS..Hα-helixtrans-62-35.6174.8-23.735.4000113.7R101 I102 T108R101-P104 WeakPolarHBondContact O-CD 3.48Å; I102-P104 VanDerWaalsContact C-CD 3.45Å; I102-P104 VanDerWaalsContact C-N 3.34Å; P104-T108 WeakPolarHBondContact O-CB 3.36Å; P104-T108 PolarHBondContact O-N 3.14Å; P104-T108 PolarHBondContact O-OG1 3.36Å
105A83.2Confident79Confident19 Ų1950.6 Ų50.616%0.15731%0.305CS..Hα-helixtrans-70.7-43.9177.100000111.3I82 F86 I102 C103 L107 T108 Q109I82-A105 HydrophobicContact CG2-CB 3.86Å; F86-A105 HydrophobicContact CE2-CB 3.67Å; F86-A105 HydrophobicContact CZ-CB 4.02Å; I102-A105 WeakPolarHBondContact O-CA 3.13Å; I102-A105 WeakPolarHBondContact O-CB 3.32Å; I102-A105 PolarHBondContact O-N 3.33Å; C103-A105 VanDerWaalsContact C-N 3.31Å; C103-A105 PolarHBondContact O-N 3.09Å; A105-L107 VanDerWaalsContact C-N 3.32Å; A105-L107 PolarHBondContact O-N 2.92Å; A105-T108 PolarHBondContact O-N 2.9Å; A105-Q109 PolarHBondContact O-N 3.21Å; A105-Q109 VanDerWaalsContact O-N 3.14Å
106V84.4Confident77.3Confident16 Ų1652.8 Ų52.810%0.09732%0.32CS..Hα-helixtrans-58.3-43.5173.81770000111.1M53 L54 I57 I102 C103 Q109M53-V106 HydrophobicContact CE-CG1 3.84Å; M53-V106 HydrophobicContact CE-CG2 4.31Å; L54-V106 HydrophobicContact CD2-CB 4.27Å; L54-V106 HydrophobicContact CD2-CG1 4.02Å; L54-V106 HydrophobicContact CD2-CG2 4.08Å; I57-V106 HydrophobicContact CD1-CG1 3.88Å; I102-V106 HydrophobicContact CD1-CG2 4.35Å; I102-V106 HydrophobicContact CG1-CG2 4.26Å; I102-V106 PolarHBondContact O-N 3.42Å; C103-V106 PolarHBondContact O-N 3.47Å; V106-Q109 VanDerWaalsContact O-CB 3.23Å; V106-Q109 WeakPolarHBondContact O-CB 3.28Å; V106-Q109 PolarHBondContact O-N 3.48Å
107L82.2Confident75.5Confident117 Ų11757.6 Ų57.661%0.61334%0.336SS*.Hα-helixtrans-69-35.4178.9-171.167.6000112.2C103 A105 Q109 V110C103-L107 WeakPolarHBondContact O-CB 3.39Å; C103-L107 PolarHBondContact O-N 3.26Å; A105-L107 VanDerWaalsContact C-N 3.32Å; A105-L107 PolarHBondContact O-N 2.92Å; L107-Q109 PolarHBondContact O-N 3.38Å; L107-V110 WeakPolarHBondContact O-CB 3.36Å; L107-V110 PolarHBondContact O-N 2.84Å
108T80.3Confident74Confident63 Ų6360.9 Ų60.939%0.38735%0.347SS..Hα-helixtrans-65.9-29.4177-56.90000111.5P104 A105 V110 L111 L112P104-T108 WeakPolarHBondContact O-CB 3.36Å; P104-T108 PolarHBondContact O-N 3.14Å; P104-T108 PolarHBondContact O-OG1 3.36Å; A105-T108 PolarHBondContact O-N 2.9Å; T108-V110 PolarHBondContact O-N 3.33Å; T108-L111 WeakPolarHBondContact O-CB 3.23Å; T108-L111 PolarHBondContact O-N 3.49Å; T108-L112 PolarHBondContact O-N 3.24Å
109Q77.1Confident71.8Confident14 Ų1462.5 Ų62.57%0.06536%0.357CS..Hα-helixtrans-56.7-32.7174.6-156.677.2-7.800112.8L54 A105 V106 L107 L111L54-Q109 HydrophobicContact CD2-CB 4.47Å; L54-Q109 HydrophobicContact CD2-CG 4.41Å; A105-Q109 PolarHBondContact O-N 3.21Å; A105-Q109 VanDerWaalsContact O-N 3.14Å; V106-Q109 VanDerWaalsContact O-CB 3.23Å; V106-Q109 WeakPolarHBondContact O-CB 3.28Å; V106-Q109 PolarHBondContact O-N 3.48Å; L107-Q109 PolarHBondContact O-N 3.38Å; Q109-L111 PolarHBondContact O-N 3.3Å
110V75Confident69.8Low41 Ų4164.9 Ų64.925%0.24837%0.373CS..THydrogen-bonded Turntrans-66.5-25.9176.8-176.90000112.1I57 L107 T108I57-V110 HydrophobicContact CG2-CG2 3.29Å; L107-V110 WeakPolarHBondContact O-CB 3.36Å; L107-V110 PolarHBondContact O-N 2.84Å; T108-V110 PolarHBondContact O-N 3.33Å
111L75.1Confident67.9Low81 Ų8170.5 Ų70.542%0.42439%0.393SS..THydrogen-bonded Turntrans-96.9-14.9-174.3-56.8177.8000112.9N69 L71 T108 Q109N69-L111 PolarHBondContact ND2-O 3.15Å; L71-L111 HydrophobicContact CD1-CB 4.04Å; T108-L111 WeakPolarHBondContact O-CB 3.23Å; T108-L111 PolarHBondContact O-N 3.49Å; Q109-L111 PolarHBondContact O-N 3.3Å
112L71.4Confident65.6Low8 Ų867.6 Ų67.64%0.04239%0.394CS..SBendtrans-71.4147.2177-68.8177.7000111R61 L71 K74 C76 T108R61-L112 PolarHBondContact NH1-O 3.45Å; L71-L112 HydrophobicContact CB-CD2 4.17Å; L71-L112 HydrophobicContact CD1-CD2 4.5Å; K74-L112 HydrophobicContact CB-CD2 3.64Å; C76-L112 HydrophobicContact CB-CD1 4.48Å; T108-L112 PolarHBondContact O-N 3.24Å
113P64.1Low63.4Low33 Ų3373.3 Ų73.321%0.21443%0.429CS..SBendtrans-55.5163.2169.729.8-39.4000111R61 L71 E72 C115R61-P113 VanDerWaalsContact NH1-CA 3.34Å; L71-P113 WeakPolarHBondContact O-CD 3.37Å; E72-P113 WeakPolarHBondContact O-CG 3.38Å; P113-C115 PolarHBondContact O-N 3.34Å
114S61.8Low61.4Low111 Ų11173.3 Ų73.378%0.77643%0.428SS*.  trans-35.4100.5-174.9-56.40000112.5P116S114-P116 WeakPolarHBondContact O-CD 3.26Å
115C59.7Low59.4Low26 Ų2674.6 Ų74.618%0.17644%0.438CS..  trans-67.7112.9172.7-64.20000106.8C76 P113 Y117C76-C115 HydrophobicContact CB-CB 3.58Å; C76-C115 WeakPolarHBondContact CB-SG 3.43Å; C76-C115 WeakPolarHBondContact SG-CA 3.28Å; C76-C115 WeakPolarHBondContact SG-CB 3.36Å; C76-C115 CovalentContact SG-SG 2.02Å; C76-C115 PolarHBondContact SG-SG 2.84Å; P113-C115 PolarHBondContact O-N 3.34Å; C115-Y117 PolarHBondContact O-N 2.91Å
116P50.8Low57.9Low111 Ų11177.1 Ų77.172%0.72145%0.452SS*.  trans-63115.5172.726.5-30.1000106.7S114 V118S114-P116 WeakPolarHBondContact O-CD 3.26Å; P116-V118 PolarHBondContact O-N 3.43Å
117Y46.3Very low57Low132 Ų13280.9 Ų80.952%0.51847%0.471SS..  trans-57.2118.5168.2174.5-141.9000107.7L55 C115 D119L55-Y117 HydrophobicContact CD1-CD2 3.78Å; L55-Y117 HydrophobicContact CD1-CE2 3.34Å; L55-Y117 HydrophobicContact CD2-CD2 3.26Å; L55-Y117 HydrophobicContact CD2-CE2 3.81Å; L55-Y117 HydrophobicContact CD2-CG 4.18Å; L55-Y117 HydrophobicContact CG-CD2 4.09Å; L55-Y117 HydrophobicContact CG-CE2 4.13Å; C115-Y117 PolarHBondContact O-N 2.91Å; Y117-D119 WeakPolarHBondContact CD1-OD1 3.37Å; Y117-D119 HydrophobicContact CE1-CB 4.38Å; Y117-D119 WeakPolarHBondContact CE1-OD1 3.37Å; Y117-D119 VanDerWaalsContact CE2-CA 3.44Å; Y117-D119 HydrophobicContact CE2-CB 4.18Å; Y117-D119 VanDerWaalsContact OH-CG 3.23Å; Y117-D119 PolarHBondContact OH-OD1 3.38Å; Y117-D119 PolarHBondContact OH-OD2 3.18Å
118V46.6Very low56.6Low115 Ų11584.9 Ų84.970%0.69748%0.48SS*.  trans-103.2108.5157.5-178.90000104.2P116 P120P116-V118 PolarHBondContact O-N 3.43Å; V118-P120 VanDerWaalsContact O-N 3.15Å
119D40.3Very low56.6Low79 Ų7983.5 Ų83.542%0.42247%0.472SS..  trans-46.8124.3172.8-61.232.7000107.9Y117 I121Y117-D119 WeakPolarHBondContact CD1-OD1 3.37Å; Y117-D119 HydrophobicContact CE1-CB 4.38Å; Y117-D119 WeakPolarHBondContact CE1-OD1 3.37Å; Y117-D119 VanDerWaalsContact CE2-CA 3.44Å; Y117-D119 HydrophobicContact CE2-CB 4.18Å; Y117-D119 VanDerWaalsContact OH-CG 3.23Å; Y117-D119 PolarHBondContact OH-OD1 3.38Å; Y117-D119 PolarHBondContact OH-OD2 3.18Å; D119-I121 PolarHBondContact O-N 3.34Å
120P39.2Very low57.1Low56 Ų5683.8 Ų83.836%0.36448%0.475SS..  trans-54.7121.1167.622.7-30.2000105.5V118 T122V118-P120 VanDerWaalsContact O-N 3.15Å; P120-T122 PolarHBondContact O-N 2.88Å
121I44.1Very low57.8Low154 Ų15484.8 Ų84.879%0.7948%0.475SS*.  trans-38.890.7-173.1-58.9168.1000109.2D119 V123D119-I121 PolarHBondContact O-N 3.34Å; I121-V123 VanDerWaalsContact C-N 3.3Å; I121-V123 PolarHBondContact O-N 3.46Å
122T36.7Very low58.6Low103 Ų10383 Ų8363%0.63248%0.476SS*.  trans-65.3108.2157.2420000101.1P120 P124P120-T122 PolarHBondContact O-N 2.88Å; T122-P124 WeakPolarHBondContact O-CA 3.4Å; T122-P124 WeakPolarHBondContact O-CD 3.37Å
123V41.4Very low59.6Low122 Ų12287.2 Ų87.274%0.73949%0.491SS*.  trans-40.6110.4165.5-170.60000104.4I121 S125I121-V123 VanDerWaalsContact C-N 3.3Å; I121-V123 PolarHBondContact O-N 3.46Å; V123-S125 PolarHBondContact O-N 3.39Å
124P42.9Very low61.1Low61 Ų6185.6 Ų85.640%0.39648%0.481SS..  trans-57.7122.5-167.5-25.934.8000105.1T122 V126 N385T122-P124 WeakPolarHBondContact O-CA 3.4Å; T122-P124 WeakPolarHBondContact O-CD 3.37Å; P124-V126 VanDerWaalsContact C-N 3.31Å; P124-V126 PolarHBondContact O-N 2.57Å; P124-N385 WeakPolarHBondContact CB-OD1 3.3Å; P124-N385 WeakPolarHBondContact CG-OD1 3.45Å
125S44.8Very low62.7Low104 Ų10484.2 Ų84.273%0.72746%0.461SS*.  trans-50.5113.4160.749.70000103.5V123 D127V123-S125 PolarHBondContact O-N 3.39Å; S125-D127 VanDerWaalsContact C-N 3.26Å; S125-D127 WeakPolarHBondContact O-CA 3.19Å; S125-D127 PolarHBondContact O-N 3.44Å
126V51.9Low64.4Low72 Ų7287.6 Ų87.644%0.43648%0.477SS..  trans-50.1101.7-176.3175.60000105.8P124 Y128P124-V126 VanDerWaalsContact C-N 3.31Å; P124-V126 PolarHBondContact O-N 2.57Å; V126-Y128 PolarHBondContact O-N 3.25Å
127D64.7Low66.5Low96 Ų9682.7 Ų82.751%0.51345%0.446SS..  trans-73.6107.2-173.4-169.5-2.4000103.9S125 S129 V130S125-D127 VanDerWaalsContact C-N 3.26Å; S125-D127 WeakPolarHBondContact O-CA 3.19Å; S125-D127 PolarHBondContact O-N 3.44Å; D127-S129 PolarHBondContact O-N 3.29Å; D127-S129 WeakPolarHBondContact OD1-CB 3.25Å; D127-S129 PolarHBondContact OD1-N 2.99Å; D127-S129 PolarHBondContact OD1-OG 3.18Å; D127-S129 VanDerWaalsContact OD1-OG 3.1Å; D127-S129 PolarHBondContact OD2-OG 2.84Å; D127-V130 HydrophobicContact CB-CG2 4.25Å; D127-V130 WeakPolarHBondContact O-CB 3.48Å; D127-V130 PolarHBondContact O-N 3.48Å
128Y74.9Confident68.9Low201 Ų20176.4 Ų76.479%0.78842%0.422SS*.Hα-helixtrans-56.6-18.6-178.7-68.7-79.5000110.7V126 G132V126-Y128 PolarHBondContact O-N 3.25Å; Y128-G132 PolarHBondContact O-N 3.29Å
129S79.8Confident71.1Confident33 Ų3373.3 Ų73.323%0.23140%0.403CS..Hα-helixtrans-57.1-43.8169.980.50000112.7D127 W131 G132 Y133D127-S129 PolarHBondContact O-N 3.29Å; D127-S129 WeakPolarHBondContact OD1-CB 3.25Å; D127-S129 PolarHBondContact OD1-N 2.99Å; D127-S129 PolarHBondContact OD1-OG 3.18Å; D127-S129 VanDerWaalsContact OD1-OG 3.1Å; D127-S129 PolarHBondContact OD2-OG 2.84Å; S129-W131 PolarHBondContact O-N 2.89Å; S129-G132 PolarHBondContact O-N 3.44Å; S129-G132 VanDerWaalsContact O-N 3.16Å; S129-Y133 WeakPolarHBondContact O-CD2 3.23Å; S129-Y133 PolarHBondContact O-N 2.94Å
130V86.9Confident73.6Confident20 Ų2073.8 Ų73.812%0.12141%0.405CS..Hα-helixtrans-61.6-44.6-178.7170.20000111D127 G134 F323 T324 I381D127-V130 HydrophobicContact CB-CG2 4.25Å; D127-V130 WeakPolarHBondContact O-CB 3.48Å; D127-V130 PolarHBondContact O-N 3.48Å; V130-G134 PolarHBondContact O-N 3.01Å; V130-F323 HydrophobicContact CG1-CB 3.87Å; V130-T324 HydrophobicContact CG1-CG2 4.32Å; V130-I381 HydrophobicContact CG1-CD1 4.2Å; V130-I381 HydrophobicContact CG1-CG1 4.16Å; V130-I381 HydrophobicContact CG1-CG2 4.29Å
131W91.3Very high76.2Confident63 Ų6371.1 Ų71.124%0.23939%0.387CS..Hα-helixtrans-64.3-45.1175.2-70.790000111.4S129 G134 F135 V378 I381 L382S129-W131 PolarHBondContact O-N 2.89Å; W131-G134 PolarHBondContact O-N 3.44Å; W131-F135 HydrophobicContact CE3-CD2 4.28Å; W131-F135 AromaticContact CE3-CE2 3.65Å; W131-F135 HydrophobicContact CE3-CE2 3.65Å; W131-F135 HydrophobicContact CZ3-CE2 4.13Å; W131-F135 WeakPolarHBondContact O-CB 3.44Å; W131-F135 VanDerWaalsContact O-CD2 3.28Å; W131-F135 WeakPolarHBondContact O-CD2 3.37Å; W131-F135 PolarHBondContact O-N 3.06Å; W131-V378 HydrophobicContact CH2-CG1 4.36Å; W131-V378 HydrophobicContact CZ3-CG2 4.18Å; W131-I381 HydrophobicContact CD2-CD1 3.94Å; W131-I381 HydrophobicContact CD2-CG2 4.37Å; W131-I381 HydrophobicContact CE3-CD1 3.83Å; W131-I381 HydrophobicContact CG-CD1 4.39Å; W131-I381 HydrophobicContact CH2-CG2 4.41Å; W131-I381 HydrophobicContact CZ2-CB 4.43Å; W131-I381 HydrophobicContact CZ2-CG2 3.78Å; W131-I381 HydrophobicContact CZ3-CD1 4.24Å; W131-L382 HydrophobicContact CZ2-CD2 4.35Å
132G91.9Very high78.4Confident43 Ų4364 Ų6444%0.44335%0.351SS..Hα-helixtrans-60.1-50.4178.500000112.7Y128 S129 L136Y128-G132 PolarHBondContact O-N 3.29Å; S129-G132 PolarHBondContact O-N 3.44Å; S129-G132 VanDerWaalsContact O-N 3.16Å; G132-L136 WeakPolarHBondContact O-CB 3.24Å; G132-L136 PolarHBondContact O-N 2.9Å
133Y92.3Very high80.9Confident96 Ų9663.8 Ų63.838%0.37635%0.345SS..Hα-helixtrans-66.3-41.6178.1-67-54.6000112.2S129 L136 A137 F323 V327 F331S129-Y133 WeakPolarHBondContact O-CD2 3.23Å; S129-Y133 PolarHBondContact O-N 2.94Å; Y133-L136 PolarHBondContact O-N 3.35Å; Y133-A137 VanDerWaalsContact O-CB 3.32Å; Y133-A137 WeakPolarHBondContact O-CB 3.28Å; Y133-A137 PolarHBondContact O-N 3.37Å; Y133-F323 HydrophobicContact CG-CE1 4.37Å; Y133-V327 HydrophobicContact CD2-CG1 4.5Å; Y133-V327 HydrophobicContact CD2-CG2 4.38Å; Y133-V327 HydrophobicContact CE2-CG1 4.43Å; Y133-V327 HydrophobicContact CE2-CG2 4.31Å; Y133-F331 HydrophobicContact CD1-CE2 4.43Å; Y133-F331 AromaticContact CD1-CZ 3.99Å; Y133-F331 HydrophobicContact CD1-CZ 3.99Å; Y133-F331 HydrophobicContact CE1-CZ 4.32Å
134G94.5Very high82.8Confident0 Ų058.7 Ų58.70%032%0.316CS..Hα-helixtrans-61-51.117700000112.7V130 W131 L136 A137 V138 L377V130-G134 PolarHBondContact O-N 3.01Å; W131-G134 PolarHBondContact O-N 3.44Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 3.29Å; G134-A137 PolarHBondContact O-N 2.87Å; G134-V138 WeakPolarHBondContact O-CG2 3.39Å; G134-V138 PolarHBondContact O-N 3.33Å; G134-L377 VanDerWaalsContact C-CD2 3.46Å
135F95.6Very high84.2Confident82 Ų8256 Ų5636%0.3630%0.299SS..Hα-helixtrans-63.5-39.3177.4-87.7-70.8000111.8W131 T139 Y374 L377 V378W131-F135 HydrophobicContact CE3-CD2 4.28Å; W131-F135 AromaticContact CE3-CE2 3.65Å; W131-F135 HydrophobicContact CE3-CE2 3.65Å; W131-F135 HydrophobicContact CZ3-CE2 4.13Å; W131-F135 WeakPolarHBondContact O-CB 3.44Å; W131-F135 VanDerWaalsContact O-CD2 3.28Å; W131-F135 WeakPolarHBondContact O-CD2 3.37Å; W131-F135 PolarHBondContact O-N 3.06Å; F135-T139 VanDerWaalsContact O-CB 3.31Å; F135-T139 WeakPolarHBondContact O-CB 3.12Å; F135-T139 PolarHBondContact O-N 3.37Å; F135-T139 PolarHBondContact O-OG1 3.34Å; F135-Y374 AromaticContact CD1-CD1 3.6Å; F135-Y374 HydrophobicContact CD1-CD1 3.6Å; F135-Y374 AromaticContact CD1-CE1 3.7Å; F135-Y374 HydrophobicContact CD1-CE1 3.7Å; F135-Y374 AromaticContact CE1-CD1 3.68Å; F135-Y374 HydrophobicContact CE1-CD1 3.68Å; F135-Y374 HydrophobicContact CE1-CE1 4.2Å; F135-L377 HydrophobicContact CD1-CD2 4.05Å; F135-L377 HydrophobicContact CD2-CD2 4.32Å; F135-L377 HydrophobicContact CE1-CD2 4.32Å; F135-L377 HydrophobicContact CG-CD2 4.02Å; F135-V378 HydrophobicContact CZ-CG2 4.45Å
136L95.1Very high85.8Confident96 Ų9654.1 Ų54.150%0.50328%0.28SS..Hα-helixtrans-62-45.6175.8178.662.5000111.4G132 Y133 G134 T139 I140G132-L136 WeakPolarHBondContact O-CB 3.24Å; G132-L136 PolarHBondContact O-N 2.9Å; Y133-L136 PolarHBondContact O-N 3.35Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 3.29Å; L136-T139 WeakPolarHBondContact O-CB 3.39Å; L136-T139 PolarHBondContact O-N 3.02Å; L136-I140 HydrophobicContact CD1-CD1 4.15Å; L136-I140 HydrophobicContact CD1-CG1 4.46Å; L136-I140 HydrophobicContact CG-CD1 4.05Å; L136-I140 VanDerWaalsContact O-CG1 3.31Å; L136-I140 WeakPolarHBondContact O-CG1 3.34Å; L136-I140 PolarHBondContact O-N 3.49Å
137A95.4Very high86.8Confident9 Ų954.8 Ų54.87%0.07428%0.281CS..Hα-helixtrans-61.8-50.2178.800000111.9Y133 G134 T139 I140 I141 I319 F323 S334Y133-A137 VanDerWaalsContact O-CB 3.32Å; Y133-A137 WeakPolarHBondContact O-CB 3.28Å; Y133-A137 PolarHBondContact O-N 3.37Å; G134-A137 PolarHBondContact O-N 2.87Å; A137-T139 VanDerWaalsContact C-N 3.27Å; A137-T139 PolarHBondContact O-N 3.25Å; A137-I140 WeakPolarHBondContact O-CB 3.46Å; A137-I140 PolarHBondContact O-N 3.15Å; A137-I140 VanDerWaalsContact O-N 3.09Å; A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 2.96Å; A137-I319 HydrophobicContact CB-CG2 4.4Å; A137-F323 HydrophobicContact CB-CE2 4.01Å; A137-F323 HydrophobicContact CB-CZ 4.33Å; A137-S334 WeakPolarHBondContact CB-OG 3.31Å
138V95.7Very high86.9Confident0 Ų050.6 Ų50.60%026%0.26CS..Hα-helixtrans-62.1-36.8176.7176.40000111.4G134 I140 I141 N142 I319 C373 Y374 L377G134-V138 WeakPolarHBondContact O-CG2 3.39Å; G134-V138 PolarHBondContact O-N 3.33Å; V138-I140 VanDerWaalsContact C-N 3.35Å; V138-I140 PolarHBondContact O-N 2.86Å; V138-I141 PolarHBondContact O-N 2.79Å; V138-N142 WeakPolarHBondContact O-CB 3.39Å; V138-N142 VanDerWaalsContact O-CG 3.31Å; V138-N142 PolarHBondContact O-N 3.15Å; V138-I319 HydrophobicContact CG2-CD1 4.12Å; V138-I319 HydrophobicContact CG2-CG2 4.44Å; V138-C373 HydrophobicContact CG1-CB 4Å; V138-Y374 HydrophobicContact CB-CD1 4.05Å; V138-Y374 HydrophobicContact CB-CE1 3.84Å; V138-Y374 HydrophobicContact CG1-CD1 3.51Å; V138-Y374 HydrophobicContact CG1-CD2 4.13Å; V138-Y374 HydrophobicContact CG1-CE1 3.47Å; V138-Y374 VanDerWaalsContact CG1-CE1 3.47Å; V138-Y374 HydrophobicContact CG1-CE2 4.11Å; V138-Y374 HydrophobicContact CG1-CG 3.85Å; V138-L377 HydrophobicContact CG2-CB 4.13Å; V138-L377 HydrophobicContact CG2-CD1 4.22Å; V138-L377 HydrophobicContact CG2-CD2 3.94Å; V138-L377 HydrophobicContact CG2-CG 4.32Å
139T94.6Very high86.6Confident50 Ų5044 Ų4431%0.30724%0.238SC..Hα-helixtrans-62-43.6174-56.50000111.3F135 L136 A137 N142 L143 Y374F135-T139 VanDerWaalsContact O-CB 3.31Å; F135-T139 WeakPolarHBondContact O-CB 3.12Å; F135-T139 PolarHBondContact O-N 3.37Å; F135-T139 PolarHBondContact O-OG1 3.34Å; L136-T139 WeakPolarHBondContact O-CB 3.39Å; L136-T139 PolarHBondContact O-N 3.02Å; A137-T139 VanDerWaalsContact C-N 3.27Å; A137-T139 PolarHBondContact O-N 3.25Å; T139-N142 PolarHBondContact O-N 2.85Å; T139-L143 HydrophobicContact CG2-CD1 3.96Å; T139-L143 WeakPolarHBondContact O-CB 3.47Å; T139-L143 VanDerWaalsContact O-CD1 3.25Å; T139-L143 WeakPolarHBondContact O-CD1 3.38Å; T139-L143 PolarHBondContact O-N 3.21Å; T139-Y374 WeakPolarHBondContact CA-OH 3.45Å; T139-Y374 PolarHBondContact OG1-OH 3.26Å
140I92.8Very high86.2Confident89 Ų8948 Ų4846%0.45626%0.256SS..Hα-helixtrans-64.1-43.4177.7-69.8166000110.8L136 A137 V138 L143 A144 V338L136-I140 HydrophobicContact CD1-CD1 4.15Å; L136-I140 HydrophobicContact CD1-CG1 4.46Å; L136-I140 HydrophobicContact CG-CD1 4.05Å; L136-I140 VanDerWaalsContact O-CG1 3.31Å; L136-I140 WeakPolarHBondContact O-CG1 3.34Å; L136-I140 PolarHBondContact O-N 3.49Å; A137-I140 WeakPolarHBondContact O-CB 3.46Å; A137-I140 PolarHBondContact O-N 3.15Å; A137-I140 VanDerWaalsContact O-N 3.09Å; V138-I140 VanDerWaalsContact C-N 3.35Å; V138-I140 PolarHBondContact O-N 2.86Å; I140-L143 PolarHBondContact O-N 2.88Å; I140-A144 WeakPolarHBondContact O-CB 3.46Å; I140-A144 PolarHBondContact O-N 3.38Å; I140-V338 HydrophobicContact CG2-CG2 4.36Å
141I92.1Very high85.5Confident0 Ų049.1 Ų49.10%026%0.261CS..Hα-helixtrans-57.8-53.8176-69.5160.3000110.1A137 V138 L143 A144 S145 I319 I337 V338 E341A137-I141 WeakPolarHBondContact O-CG1 3.26Å; A137-I141 PolarHBondContact O-N 2.96Å; V138-I141 PolarHBondContact O-N 2.79Å; I141-L143 PolarHBondContact O-N 3.22Å; I141-A144 WeakPolarHBondContact O-CB 3.3Å; I141-A144 PolarHBondContact O-N 2.95Å; I141-S145 WeakPolarHBondContact O-CB 3.5Å; I141-S145 PolarHBondContact O-N 3.02Å; I141-I319 HydrophobicContact CD1-CD1 3.31Å; I141-I337 HydrophobicContact CD1-CB 4.28Å; I141-I337 HydrophobicContact CD1-CG2 3.84Å; I141-I337 HydrophobicContact CG1-CG2 4.38Å; I141-I337 HydrophobicContact CG2-CG2 4.26Å; I141-V338 HydrophobicContact CB-CG2 4.27Å; I141-V338 HydrophobicContact CD1-CG2 4.31Å; I141-V338 HydrophobicContact CG1-CB 4.38Å; I141-V338 HydrophobicContact CG1-CG2 3.27Å; I141-E341 HydrophobicContact CG2-CB 4.19Å; I141-E341 HydrophobicContact CG2-CG 3.7Å
142N91Very high84.6Confident4 Ų448.5 Ų48.52%0.02126%0.262CS..Hα-helixtrans-65.5-21.2179.7-69.20.8000113.2V138 T139 S145 L146 A370 M371 Y374V138-N142 WeakPolarHBondContact O-CB 3.39Å; V138-N142 VanDerWaalsContact O-CG 3.31Å; V138-N142 PolarHBondContact O-N 3.15Å; T139-N142 PolarHBondContact O-N 2.85Å; N142-S145 VanDerWaalsContact O-CB 3.22Å; N142-S145 WeakPolarHBondContact O-CB 3.4Å; N142-S145 PolarHBondContact O-OG 3.47Å; N142-L146 WeakPolarHBondContact O-CD1 3.48Å; N142-L146 WeakPolarHBondContact O-CG 3.19Å; N142-L146 PolarHBondContact O-N 3.26Å; N142-A370 PolarHBondContact ND2-O 3.17Å; N142-A370 VanDerWaalsContact ND2-O 3.1Å; N142-M371 WeakPolarHBondContact ND2-CE 3.28Å; N142-Y374 WeakPolarHBondContact ND2-CE2 3.41Å
143L88.3Confident84Confident98 Ų9850.5 Ų50.551%0.51327%0.267SS..Hα-helixtrans-81.1-37.2170.3-99.969.4000112.3T139 I140 I141 S145 L146 L147T139-L143 HydrophobicContact CG2-CD1 3.96Å; T139-L143 WeakPolarHBondContact O-CB 3.47Å; T139-L143 VanDerWaalsContact O-CD1 3.25Å; T139-L143 WeakPolarHBondContact O-CD1 3.38Å; T139-L143 PolarHBondContact O-N 3.21Å; I140-L143 PolarHBondContact O-N 2.88Å; I141-L143 PolarHBondContact O-N 3.22Å; L143-S145 VanDerWaalsContact C-N 3.32Å; L143-L146 PolarHBondContact O-N 3.04Å; L143-L147 PolarHBondContact O-N 3.24Å
144A82.3Confident83.2Confident16 Ų1650.2 Ų50.213%0.13227%0.268CS..Hα-helixtrans-65.5-39.9176.600000111.6I140 I141 L147I140-A144 WeakPolarHBondContact O-CB 3.46Å; I140-A144 PolarHBondContact O-N 3.38Å; I141-A144 WeakPolarHBondContact O-CB 3.3Å; I141-A144 PolarHBondContact O-N 2.95Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 3.01Å
145S72.6Confident82.3Confident5 Ų552.8 Ų52.84%0.03528%0.284CS..Hα-helixtrans-40-62.2158.7141.80000113.3I141 N142 L143 L147 G148 E345I141-S145 WeakPolarHBondContact O-CB 3.5Å; I141-S145 PolarHBondContact O-N 3.02Å; N142-S145 VanDerWaalsContact O-CB 3.22Å; N142-S145 WeakPolarHBondContact O-CB 3.4Å; N142-S145 PolarHBondContact O-OG 3.47Å; L143-S145 VanDerWaalsContact C-N 3.32Å; S145-L147 VanDerWaalsContact C-N 3.27Å; S145-L147 PolarHBondContact O-N 2.79Å; S145-G148 PolarHBondContact O-N 3.41Å; S145-G148 VanDerWaalsContact O-N 3.16Å; S145-E345 VanDerWaalsContact CA-CD 3.45Å; S145-E345 WeakPolarHBondContact CA-OE2 3.49Å; S145-E345 WeakPolarHBondContact CB-OE1 3.31Å; S145-E345 WeakPolarHBondContact CB-OE2 3.39Å; S145-E345 PolarHBondContact OG-OE1 3.2Å; S145-E345 PolarHBondContact OG-OE2 3.41Å
146L78.6Confident81.4Confident64 Ų6457.6 Ų57.634%0.33531%0.305SS..Hα-helixtrans-65-25.2177.7-71.9164.3000114.1N142 L143 G148 L149 V363 L367N142-L146 WeakPolarHBondContact O-CD1 3.48Å; N142-L146 WeakPolarHBondContact O-CG 3.19Å; N142-L146 PolarHBondContact O-N 3.26Å; L143-L146 PolarHBondContact O-N 3.04Å; L146-G148 PolarHBondContact O-N 2.7Å; L146-L149 WeakPolarHBondContact O-CB 3.45Å; L146-L149 PolarHBondContact O-N 2.79Å; L146-L149 VanDerWaalsContact O-N 3.07Å; L146-V363 HydrophobicContact CD2-CG1 4.38Å; L146-L367 HydrophobicContact CD1-CD1 4.27Å; L146-L367 HydrophobicContact CD2-CD1 4.45Å
147L72.6Confident80.9Confident86 Ų8658 Ų5845%0.4530%0.302SS..Hα-helixtrans-62.5-25.5176.1-103.5137.4000112.3L143 A144 S145 L149 L150 L151L143-L147 PolarHBondContact O-N 3.24Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 3.01Å; S145-L147 VanDerWaalsContact C-N 3.27Å; S145-L147 PolarHBondContact O-N 2.79Å; L147-L149 PolarHBondContact O-N 3.03Å; L147-L150 HydrophobicContact CD2-CD1 4.14Å; L147-L150 HydrophobicContact CG-CD1 4.3Å; L147-L150 WeakPolarHBondContact O-CB 3.39Å; L147-L150 PolarHBondContact O-N 3.32Å; L147-L151 PolarHBondContact O-N 3.15Å
148G67.2Low80.3Confident7 Ų763.4 Ų63.47%0.07234%0.336CS..Hα-helixtrans-54.6-33.2170.600000113S145 L146 L151S145-G148 PolarHBondContact O-N 3.41Å; S145-G148 VanDerWaalsContact O-N 3.16Å; L146-G148 PolarHBondContact O-N 2.7Å; G148-L151 WeakPolarHBondContact O-CB 3.26Å; G148-L151 PolarHBondContact O-N 3.38Å; G148-L151 VanDerWaalsContact O-N 3.15Å
149L68.6Low79.8Confident63 Ų6368.1 Ų68.133%0.3336%0.355SS..Hα-helixtrans-66.7-39.4175.8-173.271000112.3L146 L147 L151 I152 F349 V359 V363L146-L149 WeakPolarHBondContact O-CB 3.45Å; L146-L149 PolarHBondContact O-N 2.79Å; L146-L149 VanDerWaalsContact O-N 3.07Å; L147-L149 PolarHBondContact O-N 3.03Å; L149-L151 PolarHBondContact O-N 3.04Å; L149-I152 HydrophobicContact CD1-CD1 3.33Å; L149-I152 HydrophobicContact CG-CD1 4.18Å; L149-I152 WeakPolarHBondContact O-CB 3.3Å; L149-I152 WeakPolarHBondContact O-CD1 3.41Å; L149-I152 VanDerWaalsContact O-CG1 3.3Å; L149-I152 WeakPolarHBondContact O-CG1 3.19Å; L149-I152 PolarHBondContact O-N 3.46Å; L149-F349 HydrophobicContact CD1-CE2 4.21Å; L149-F349 HydrophobicContact CD1-CZ 4.07Å; L149-V359 HydrophobicContact CD1-CG1 4.01Å; L149-V363 HydrophobicContact CD1-CG2 3.57Å; L149-V363 HydrophobicContact CD2-CG2 4.04Å; L149-V363 HydrophobicContact CG-CG2 4.37Å
150L70.1Confident79.4Confident118 Ų11867 Ų6762%0.61835%0.346SS*.Hα-helixtrans-66.7-19176-64.5176.4000111.8L147 P153L147-L150 HydrophobicContact CD2-CD1 4.14Å; L147-L150 HydrophobicContact CG-CD1 4.3Å; L147-L150 WeakPolarHBondContact O-CB 3.39Å; L147-L150 PolarHBondContact O-N 3.32Å; L150-P153 VanDerWaalsContact O-CD 3.31Å; L150-P153 WeakPolarHBondContact O-CD 3.41Å; L150-P153 WeakPolarHBondContact O-CG 3.43Å
151L72.1Confident79.1Confident43 Ų4364.9 Ų64.923%0.22534%0.338CS..THydrogen-bonded Turntrans-89.2-8.7-180-64.5176.4000114.4L147 G148 L149 F154 T155 F342 L346L147-L151 PolarHBondContact O-N 3.15Å; G148-L151 WeakPolarHBondContact O-CB 3.26Å; G148-L151 PolarHBondContact O-N 3.38Å; G148-L151 VanDerWaalsContact O-N 3.15Å; L149-L151 PolarHBondContact O-N 3.04Å; L151-F154 HydrophobicContact CD2-CD2 3.92Å; L151-F154 CarbonylContact O-C 3.5Å; L151-F154 VanDerWaalsContact O-CA 3.29Å; L151-F154 WeakPolarHBondContact O-CA 3.21Å; L151-F154 VanDerWaalsContact O-CB 3.3Å; L151-F154 WeakPolarHBondContact O-CB 3.49Å; L151-F154 PolarHBondContact O-N 2.86Å; L151-T155 PolarHBondContact O-N 2.95Å; L151-F342 HydrophobicContact CD1-CE1 4.48Å; L151-F342 HydrophobicContact CD1-CE2 3.52Å; L151-F342 HydrophobicContact CD1-CZ 3.25Å; L151-L346 HydrophobicContact CB-CD1 4.46Å
152I74.1Confident79Confident50 Ų5068.2 Ų68.226%0.25635%0.354SS..Hα-helixtrans-51.3-47.1172.9-63.5171.8000114.2L149 F154 T155 F349L149-I152 HydrophobicContact CD1-CD1 3.33Å; L149-I152 HydrophobicContact CG-CD1 4.18Å; L149-I152 WeakPolarHBondContact O-CB 3.3Å; L149-I152 WeakPolarHBondContact O-CD1 3.41Å; L149-I152 VanDerWaalsContact O-CG1 3.3Å; L149-I152 WeakPolarHBondContact O-CG1 3.19Å; L149-I152 PolarHBondContact O-N 3.46Å; I152-F154 PolarHBondContact O-N 2.89Å; I152-F154 VanDerWaalsContact O-N 3.17Å; I152-T155 PolarHBondContact O-N 2.95Å; I152-T155 PolarHBondContact O-OG1 3.29Å; I152-F349 HydrophobicContact CD1-CD1 4.32Å; I152-F349 HydrophobicContact CD1-CE1 3.29Å; I152-F349 HydrophobicContact CD1-CE2 4.5Å; I152-F349 HydrophobicContact CD1-CZ 3.4Å; I152-F349 HydrophobicContact CG1-CD1 4.5Å; I152-F349 HydrophobicContact CG1-CE1 3.76Å; I152-F349 HydrophobicContact CG1-CZ 4.36Å
153P77.6Confident78.9Confident84 Ų8471 Ų7155%0.54537%0.371SS..Hα-helixtrans-62.3-23.417622.4-33000112.6L150L150-P153 VanDerWaalsContact O-CD 3.31Å; L150-P153 WeakPolarHBondContact O-CD 3.41Å; L150-P153 WeakPolarHBondContact O-CG 3.43Å
154F77Confident78.9Confident91 Ų9167.6 Ų67.640%0.39935%0.353SS..Hα-helixtrans-88.3-20.7178.9-60.1-77000113.3L151 I152 K156 K157 Y159 F160L151-F154 HydrophobicContact CD2-CD2 3.92Å; L151-F154 CarbonylContact O-C 3.5Å; L151-F154 VanDerWaalsContact O-CA 3.29Å; L151-F154 WeakPolarHBondContact O-CA 3.21Å; L151-F154 VanDerWaalsContact O-CB 3.3Å; L151-F154 WeakPolarHBondContact O-CB 3.49Å; L151-F154 PolarHBondContact O-N 2.86Å; I152-F154 PolarHBondContact O-N 2.89Å; I152-F154 VanDerWaalsContact O-N 3.17Å; F154-K156 PolarHBondContact O-N 3.5Å; F154-K156 VanDerWaalsContact O-N 3.14Å; F154-K157 VanDerWaalsContact O-CB 3.26Å; F154-K157 WeakPolarHBondContact O-CB 3.39Å; F154-K157 PolarHBondContact O-N 3.08Å; F154-Y159 VanDerWaalsContact CD1-OH 3.28Å; F154-Y159 WeakPolarHBondContact CD1-OH 3.42Å; F154-F160 WeakPolarHBondContact O-CB 3.18Å
155T74.4Confident79.4Confident53 Ų5366.9 Ų66.933%0.32535%0.347SS..Hα-helixtrans-58.4-29.2176.3630000112.8L151 I152 K157 F160L151-T155 PolarHBondContact O-N 2.95Å; I152-T155 PolarHBondContact O-N 2.95Å; I152-T155 PolarHBondContact O-OG1 3.29Å; T155-K157 PolarHBondContact O-N 3.42Å; T155-F160 HydrophobicContact CG2-CD1 4.33Å; T155-F160 HydrophobicContact CG2-CD2 4.39Å; T155-F160 HydrophobicContact CG2-CE1 3.83Å; T155-F160 HydrophobicContact CG2-CE2 3.9Å; T155-F160 HydrophobicContact CG2-CZ 3.62Å
156K76.5Confident80.4Confident184 Ų18470.2 Ų70.280%0.836%0.359SS*.THydrogen-bonded Turntrans-75.8-6.5177.7-60.4-174.4-179.3-177.70113.8F154F154-K156 PolarHBondContact O-N 3.5Å; F154-K156 VanDerWaalsContact O-N 3.14Å
157K86.1Confident81.1Confident104 Ų10470 Ų7045%0.45236%0.356SS..SBendtrans-86.5146.4-177-62.6-68.7-173.4178.70110.9F154 T155 Y159 F160F154-K157 VanDerWaalsContact O-CB 3.26Å; F154-K157 WeakPolarHBondContact O-CB 3.39Å; F154-K157 PolarHBondContact O-N 3.08Å; T155-K157 PolarHBondContact O-N 3.42Å; K157-Y159 HydrophobicContact CB-CD1 3.76Å; K157-Y159 HydrophobicContact CB-CE1 3.38Å; K157-Y159 HydrophobicContact CB-CE2 4.28Å; K157-Y159 HydrophobicContact CB-CG 4.36Å; K157-Y159 HydrophobicContact CD-CE1 4.21Å; K157-Y159 HydrophobicContact CG-CE1 3.75Å; K157-Y159 PolarHBondContact O-N 2.81Å; K157-Y159 VanDerWaalsContact O-N 3.16Å; K157-F160 WeakPolarHBondContact O-CB 3.42Å; K157-F160 PolarHBondContact O-N 3.42Å; K157-F160 VanDerWaalsContact O-N 3.11Å
158P82.8Confident82.1Confident122 Ų12266.2 Ų66.279%0.79234%0.336SS*.THydrogen-bonded Turntrans-66.8-18.8-17627.2-35.8000114.2
159Y85Confident83.4Confident100 Ų10065.9 Ų65.939%0.39233%0.332SS..THydrogen-bonded Turntrans-88-10.4177.661.4-98.9000113.4F154 K157 Q162 V163F154-Y159 VanDerWaalsContact CD1-OH 3.28Å; F154-Y159 WeakPolarHBondContact CD1-OH 3.42Å; K157-Y159 HydrophobicContact CB-CD1 3.76Å; K157-Y159 HydrophobicContact CB-CE1 3.38Å; K157-Y159 HydrophobicContact CB-CE2 4.28Å; K157-Y159 HydrophobicContact CB-CG 4.36Å; K157-Y159 HydrophobicContact CD-CE1 4.21Å; K157-Y159 HydrophobicContact CG-CE1 3.75Å; K157-Y159 PolarHBondContact O-N 2.81Å; K157-Y159 VanDerWaalsContact O-N 3.16Å; Y159-Q162 WeakPolarHBondContact O-CB 3.39Å; Y159-Q162 PolarHBondContact O-N 3.09Å; Y159-V163 HydrophobicContact CD2-CG2 4.11Å; Y159-V163 PolarHBondContact O-N 3.17Å
160F86.1Confident84.7Confident25 Ų2563.6 Ų63.611%0.1132%0.32CS..Hα-helixtrans-61-43.4-175.6-178.5-95.2000113.7F154 T155 K157 Q162 V163 L164 L346F154-F160 WeakPolarHBondContact O-CB 3.18Å; T155-F160 HydrophobicContact CG2-CD1 4.33Å; T155-F160 HydrophobicContact CG2-CD2 4.39Å; T155-F160 HydrophobicContact CG2-CE1 3.83Å; T155-F160 HydrophobicContact CG2-CE2 3.9Å; T155-F160 HydrophobicContact CG2-CZ 3.62Å; K157-F160 WeakPolarHBondContact O-CB 3.42Å; K157-F160 PolarHBondContact O-N 3.42Å; K157-F160 VanDerWaalsContact O-N 3.11Å; F160-Q162 PolarHBondContact O-N 3.44Å; F160-V163 PolarHBondContact O-N 2.78Å; F160-V163 VanDerWaalsContact O-N 3.12Å; F160-L164 HydrophobicContact CE1-CB 4.3Å; F160-L164 HydrophobicContact CE1-CD2 4.06Å; F160-L164 WeakPolarHBondContact O-CB 3.17Å; F160-L164 PolarHBondContact O-N 2.89Å; F160-L346 HydrophobicContact CE1-CD2 4.2Å; F160-L346 HydrophobicContact CE2-CD1 4.23Å; F160-L346 HydrophobicContact CZ-CD1 3.71Å; F160-L346 HydrophobicContact CZ-CD2 3.77Å; F160-L346 HydrophobicContact CZ-CG 4.38Å
161P86.7Confident85.9Confident46 Ų4658 Ų5830%0.29929%0.291SS..Hα-helixtrans-60.9-31.2177.4-23.935.1000113.1T165 I415 F428P161-T165 WeakPolarHBondContact O-CB 3.19Å; P161-T165 PolarHBondContact O-N 2.71Å; P161-T165 PolarHBondContact O-OG1 3.03Å; P161-I415 HydrophobicContact CB-CG2 4.45Å; P161-F428 HydrophobicContact CB-CE1 4.23Å; P161-F428 HydrophobicContact CB-CZ 4.06Å
162Q90Very high87.1Confident69 Ų6955.9 Ų55.932%0.32228%0.28SS..Hα-helixtrans-68.3-46.1175.7-66.6177.9-3600111.1Y159 F160 T165 Y166 F428 I431Y159-Q162 WeakPolarHBondContact O-CB 3.39Å; Y159-Q162 PolarHBondContact O-N 3.09Å; F160-Q162 PolarHBondContact O-N 3.44Å; Q162-T165 PolarHBondContact O-N 2.84Å; Q162-Y166 PolarHBondContact O-N 3.22Å; Q162-Y166 VanDerWaalsContact O-N 3.1Å; Q162-F428 HydrophobicContact CG-CE2 4.02Å; Q162-F428 HydrophobicContact CG-CZ 3.89Å; Q162-I431 HydrophobicContact CB-CD1 3.77Å; Q162-I431 HydrophobicContact CG-CD1 4.03Å; Q162-I431 WeakPolarHBondContact O-CG2 3.44Å
163V89.3Confident88.2Confident63 Ų6353.5 Ų53.538%0.38227%0.268SS..Hα-helixtrans-63.4-44.6176.9175.60000110.6Y159 F160 T165 Y166 F167Y159-V163 HydrophobicContact CD2-CG2 4.11Å; Y159-V163 PolarHBondContact O-N 3.17Å; F160-V163 PolarHBondContact O-N 2.78Å; F160-V163 VanDerWaalsContact O-N 3.12Å; V163-T165 PolarHBondContact O-N 2.68Å; V163-Y166 WeakPolarHBondContact O-CB 3.12Å; V163-Y166 PolarHBondContact O-N 2.8Å; V163-F167 HydrophobicContact CG1-CD2 3.73Å; V163-F167 HydrophobicContact CG1-CE2 3.53Å; V163-F167 VanDerWaalsContact O-CD2 3.23Å; V163-F167 WeakPolarHBondContact O-CD2 3.45Å; V163-F167 PolarHBondContact O-N 3.15Å; V163-F167 VanDerWaalsContact O-N 3.11Å
164L88.4Confident89Confident27 Ų2749.5 Ų49.514%0.14124%0.242CC..Hα-helixtrans-61.6-43.5177.4-175.561.7000111.7F160 Y166 F167 I168 P343 L346 I415F160-L164 HydrophobicContact CE1-CB 4.3Å; F160-L164 HydrophobicContact CE1-CD2 4.06Å; F160-L164 WeakPolarHBondContact O-CB 3.17Å; F160-L164 PolarHBondContact O-N 2.89Å; L164-Y166 VanDerWaalsContact C-N 3.26Å; L164-Y166 PolarHBondContact O-N 3.37Å; L164-F167 PolarHBondContact O-N 3.15Å; L164-F167 VanDerWaalsContact O-N 3.13Å; L164-I168 HydrophobicContact CD1-CD1 4.27Å; L164-I168 HydrophobicContact CD1-CG1 4.34Å; L164-I168 HydrophobicContact CD2-CD1 4.46Å; L164-I168 HydrophobicContact CG-CD1 3.87Å; L164-I168 HydrophobicContact CG-CG1 4.38Å; L164-I168 WeakPolarHBondContact O-CG1 2.91Å; L164-I168 PolarHBondContact O-N 2.78Å; L164-P343 HydrophobicContact CD1-CB 4.38Å; L164-L346 HydrophobicContact CD1-CD2 4.11Å; L164-L346 HydrophobicContact CD2-CD2 4.37Å; L164-I415 HydrophobicContact CD2-CD1 4.19Å
165T91.8Very high89.9Confident0 Ų045.2 Ų45.20%022%0.223CC..Hα-helixtrans-59.1-38.5176-58.70000111.9P161 Q162 V163 G169 M412 F428 I431 Q432P161-T165 WeakPolarHBondContact O-CB 3.19Å; P161-T165 PolarHBondContact O-N 2.71Å; P161-T165 PolarHBondContact O-OG1 3.03Å; Q162-T165 PolarHBondContact O-N 2.84Å; V163-T165 PolarHBondContact O-N 2.68Å; T165-G169 PolarHBondContact O-N 3.2Å; T165-M412 HydrophobicContact CG2-CG 4.27Å; T165-F428 HydrophobicContact CG2-CD1 4.06Å; T165-F428 WeakPolarHBondContact OG1-CD1 3.33Å; T165-F428 WeakPolarHBondContact OG1-CE1 3.47Å; T165-I431 HydrophobicContact CG2-CG2 4.13Å; T165-Q432 HydrophobicContact CG2-CG 3.44Å; T165-Q432 VanDerWaalsContact CG2-CG 3.44Å
166Y94.3Very high90.9Very high75 Ų7543.2 Ų43.229%0.29421%0.21SC..Hα-helixtrans-62.4-47.5175176.6-97.2000111.5Q162 V163 L164 G169 L170 A434Q162-Y166 PolarHBondContact O-N 3.22Å; Q162-Y166 VanDerWaalsContact O-N 3.1Å; V163-Y166 WeakPolarHBondContact O-CB 3.12Å; V163-Y166 PolarHBondContact O-N 2.8Å; L164-Y166 VanDerWaalsContact C-N 3.26Å; L164-Y166 PolarHBondContact O-N 3.37Å; Y166-G169 PolarHBondContact O-N 3.45Å; Y166-L170 HydrophobicContact CE1-CD2 4.36Å; Y166-L170 WeakPolarHBondContact O-CB 3.04Å; Y166-L170 PolarHBondContact O-N 2.87Å; Y166-A434 HydrophobicContact CD2-CB 4.38Å; Y166-A434 HydrophobicContact CE2-CB 4.28Å
167F92.7Very high91.9Very high61 Ų6134.5 Ų34.527%0.26817%0.172SC..Hα-helixtrans-67.7-38.9-179.2-78.6-69.8000113V163 L164 G169 L170 A171 F342V163-F167 HydrophobicContact CG1-CD2 3.73Å; V163-F167 HydrophobicContact CG1-CE2 3.53Å; V163-F167 VanDerWaalsContact O-CD2 3.23Å; V163-F167 WeakPolarHBondContact O-CD2 3.45Å; V163-F167 PolarHBondContact O-N 3.15Å; V163-F167 VanDerWaalsContact O-N 3.11Å; L164-F167 PolarHBondContact O-N 3.15Å; L164-F167 VanDerWaalsContact O-N 3.13Å; F167-G169 VanDerWaalsContact C-N 3.35Å; F167-L170 HydrophobicContact CD1-CD2 4.11Å; F167-L170 HydrophobicContact CE1-CD2 4.44Å; F167-L170 WeakPolarHBondContact O-CB 3.41Å; F167-L170 PolarHBondContact O-N 3.13Å; F167-A171 WeakPolarHBondContact O-CB 3.48Å; F167-A171 PolarHBondContact O-N 3.05Å; F167-F342 HydrophobicContact CB-CD1 4.03Å; F167-F342 HydrophobicContact CB-CE1 4.12Å; F167-F342 AromaticContact CD1-CD1 3.82Å; F167-F342 HydrophobicContact CD1-CD1 3.82Å; F167-F342 AromaticContact CD1-CE1 3.95Å; F167-F342 HydrophobicContact CD1-CE1 3.95Å; F167-F342 HydrophobicContact CD2-CD1 4.15Å; F167-F342 AromaticContact CD2-CE1 3.5Å; F167-F342 HydrophobicContact CD2-CE1 3.5Å; F167-F342 HydrophobicContact CD2-CZ 4.4Å; F167-F342 HydrophobicContact CE1-CD1 4.29Å; F167-F342 HydrophobicContact CE1-CE1 4.22Å; F167-F342 AromaticContact CE2-CE1 3.79Å; F167-F342 HydrophobicContact CE2-CE1 3.79Å; F167-F342 HydrophobicContact CE2-CZ 4.3Å; F167-F342 AromaticContact CG-CD1 3.75Å; F167-F342 HydrophobicContact CG-CD1 3.75Å; F167-F342 AromaticContact CG-CE1 3.6Å; F167-F342 HydrophobicContact CG-CE1 3.6Å; F167-F342 HydrophobicContact CZ-CE1 4.14Å
168I93.3Very high92.3Very high6 Ų629.6 Ų29.63%0.03115%0.151CC..Hα-helixtrans-63.4-43.9172.8-62.9167.4000110L164 L170 A171 I172 P343 M408 E411 M412 I415L164-I168 HydrophobicContact CD1-CD1 4.27Å; L164-I168 HydrophobicContact CD1-CG1 4.34Å; L164-I168 HydrophobicContact CD2-CD1 4.46Å; L164-I168 HydrophobicContact CG-CD1 3.87Å; L164-I168 HydrophobicContact CG-CG1 4.38Å; L164-I168 WeakPolarHBondContact O-CG1 2.91Å; L164-I168 PolarHBondContact O-N 2.78Å; I168-L170 VanDerWaalsContact C-N 3.32Å; I168-L170 PolarHBondContact O-N 3.01Å; I168-A171 WeakPolarHBondContact O-CB 3.34Å; I168-A171 PolarHBondContact O-N 3.18Å; I168-I172 HydrophobicContact CG2-CD1 4.01Å; I168-I172 WeakPolarHBondContact O-CD1 3.09Å; I168-I172 VanDerWaalsContact O-CG1 3.28Å; I168-I172 WeakPolarHBondContact O-CG1 3.42Å; I168-I172 PolarHBondContact O-N 3.32Å; I168-P343 HydrophobicContact CG1-CB 3.75Å; I168-M408 HydrophobicContact CG2-CB 4.22Å; I168-M408 WeakPolarHBondContact CG2-O 3.39Å; I168-M408 HydrophobicContact CG2-SD 4.41Å; I168-E411 HydrophobicContact CD1-CG 4.26Å; I168-M412 HydrophobicContact CG2-CB 3.67Å; I168-M412 HydrophobicContact CG2-CG 4.15Å; I168-I415 HydrophobicContact CD1-CD1 3.51Å
169G95.6Very high92.9Very high0 Ų023.8 Ų23.80%011%0.113CC..Hα-helixtrans-59.9-42.7174.100000112.6T165 Y166 F167 I172 G173 M412 G435 L436T165-G169 PolarHBondContact O-N 3.2Å; Y166-G169 PolarHBondContact O-N 3.45Å; F167-G169 VanDerWaalsContact C-N 3.35Å; G169-I172 PolarHBondContact O-N 3.46Å; G169-G173 PolarHBondContact O-N 2.88Å; G169-M412 VanDerWaalsContact CA-SD 3.56Å; G169-G435 VanDerWaalsContact C-C 3.44Å; G169-G435 CarbonylContact O-C 3.59Å; G169-L436 VanDerWaalsContact O-CA 3.24Å; G169-L436 WeakPolarHBondContact O-CA 3.48Å; G169-L436 PolarHBondContact O-N 3.32Å
170L95.9Very high93.4Very high14 Ų1419.6 Ų19.67%0.07310%0.098CC..Hα-helixtrans-59.2-47.8175.4-176.770.8000111.2Y166 F167 I168 G173 T174 C339 G435 T438 I442Y166-L170 HydrophobicContact CE1-CD2 4.36Å; Y166-L170 WeakPolarHBondContact O-CB 3.04Å; Y166-L170 PolarHBondContact O-N 2.87Å; F167-L170 HydrophobicContact CD1-CD2 4.11Å; F167-L170 HydrophobicContact CE1-CD2 4.44Å; F167-L170 WeakPolarHBondContact O-CB 3.41Å; F167-L170 PolarHBondContact O-N 3.13Å; I168-L170 VanDerWaalsContact C-N 3.32Å; I168-L170 PolarHBondContact O-N 3.01Å; L170-G173 PolarHBondContact O-N 3.06Å; L170-T174 PolarHBondContact O-N 3.48Å; L170-T174 PolarHBondContact O-OG1 3.25Å; L170-C339 HydrophobicContact CD2-CB 4.41Å; L170-C339 HydrophobicContact CG-CB 4.36Å; L170-G435 WeakPolarHBondContact CA-O 3.38Å; L170-T438 HydrophobicContact CD1-CG2 3.9Å; L170-I442 HydrophobicContact CD1-CD1 4.15Å
171A95.1Very high93.6Very high0 Ų018.5 Ų18.50%09%0.093CC..Hα-helixtrans-57.4-5117700000112.3F167 I168 G173 T174 L175 C339 E340 P343F167-A171 WeakPolarHBondContact O-CB 3.48Å; F167-A171 PolarHBondContact O-N 3.05Å; I168-A171 WeakPolarHBondContact O-CB 3.34Å; I168-A171 PolarHBondContact O-N 3.18Å; A171-G173 PolarHBondContact O-N 3.44Å; A171-T174 PolarHBondContact O-N 3.24Å; A171-T174 PolarHBondContact O-OG1 3.23Å; A171-T174 VanDerWaalsContact O-OG1 3.06Å; A171-L175 WeakPolarHBondContact O-CB 3.4Å; A171-L175 VanDerWaalsContact O-CG 3.24Å; A171-L175 WeakPolarHBondContact O-CG 3.49Å; A171-L175 PolarHBondContact O-N 3.14Å; A171-C339 WeakPolarHBondContact CB-O 3.49Å; A171-E340 HydrophobicContact CB-CB 4.07Å; A171-P343 HydrophobicContact CB-CG 3.93Å
172I96.3Very high93.8Very high0 Ų017.4 Ų17.40%08%0.084CC..Hα-helixtrans-57.3-44176.7-61.8159.6000109.9I168 G169 F176 A404 M408 F409 M412 L436I168-I172 HydrophobicContact CG2-CD1 4.01Å; I168-I172 WeakPolarHBondContact O-CD1 3.09Å; I168-I172 VanDerWaalsContact O-CG1 3.28Å; I168-I172 WeakPolarHBondContact O-CG1 3.42Å; I168-I172 PolarHBondContact O-N 3.32Å; G169-I172 PolarHBondContact O-N 3.46Å; I172-F176 WeakPolarHBondContact O-CB 3.27Å; I172-F176 PolarHBondContact O-N 3.37Å; I172-F176 VanDerWaalsContact O-N 3.08Å; I172-A404 HydrophobicContact CG2-CB 4.41Å; I172-M408 HydrophobicContact CD1-CB 4.18Å; I172-M408 HydrophobicContact CG1-CB 3.6Å; I172-F409 HydrophobicContact CD1-CB 3.98Å; I172-F409 HydrophobicContact CD1-CD2 4.32Å; I172-M412 HydrophobicContact CD1-CB 4.07Å; I172-M412 HydrophobicContact CD1-CE 3.79Å; I172-M412 HydrophobicContact CD1-CG 4.49Å; I172-M412 HydrophobicContact CD1-SD 3.77Å; I172-L436 HydrophobicContact CB-CD1 4.02Å; I172-L436 HydrophobicContact CG2-CD1 3.62Å
173G96.4Very high93.9Very high0 Ų014.3 Ų14.30%07%0.07CC..Hα-helixtrans-61.4-48.4179.200000112.3G169 L170 A171 S177G169-G173 PolarHBondContact O-N 2.88Å; L170-G173 PolarHBondContact O-N 3.06Å; A171-G173 PolarHBondContact O-N 3.44Å; G173-S177 WeakPolarHBondContact O-CB 3.43Å; G173-S177 PolarHBondContact O-N 3.09Å; G173-S177 PolarHBondContact O-OG 3.07Å
174T96.2Very high94Very high0 Ų014 Ų140%07%0.065CC..Hα-helixtrans-69.8-44.6-179.450.20000112.2L170 A171 S177 N178 C339 I443L170-T174 PolarHBondContact O-N 3.48Å; L170-T174 PolarHBondContact O-OG1 3.25Å; A171-T174 PolarHBondContact O-N 3.24Å; A171-T174 PolarHBondContact O-OG1 3.23Å; A171-T174 VanDerWaalsContact O-OG1 3.06Å; T174-S177 PolarHBondContact O-N 3.37Å; T174-N178 WeakPolarHBondContact O-CB 3.49Å; T174-N178 PolarHBondContact O-N 3Å; T174-C339 HydrophobicContact CG2-CB 4.09Å; T174-C339 WeakPolarHBondContact OG1-CB 3.49Å; T174-I443 HydrophobicContact CG2-CG1 4.28Å
175L94.9Very high94Very high0 Ų013 Ų130%06%0.06CC..Hα-helixtrans-68.4-50.2-176.5-67.6170.3000113.7A171 S177 N178 A179 E340 F400 I403 A404A171-L175 WeakPolarHBondContact O-CB 3.4Å; A171-L175 VanDerWaalsContact O-CG 3.24Å; A171-L175 WeakPolarHBondContact O-CG 3.49Å; A171-L175 PolarHBondContact O-N 3.14Å; L175-S177 PolarHBondContact O-N 3Å; L175-N178 PolarHBondContact O-N 3.32Å; L175-A179 WeakPolarHBondContact O-CB 3.45Å; L175-A179 PolarHBondContact O-N 3.19Å; L175-E340 HydrophobicContact CD1-CB 3.61Å; L175-E340 HydrophobicContact CD1-CG 4.25Å; L175-E340 WeakPolarHBondContact CD1-OE2 3.06Å; L175-E340 HydrophobicContact CD2-CB 4.01Å; L175-E340 HydrophobicContact CD2-CG 4.07Å; L175-E340 WeakPolarHBondContact CD2-OE1 3.23Å; L175-E340 WeakPolarHBondContact CD2-OE2 3.49Å; L175-E340 HydrophobicContact CG-CB 3.92Å; L175-E340 HydrophobicContact CG-CG 4.49Å; L175-F400 HydrophobicContact CD2-CD2 3.84Å; L175-F400 HydrophobicContact CD2-CE2 4.08Å; L175-F400 HydrophobicContact CD2-CG 4.07Å; L175-I403 HydrophobicContact CD1-CB 4.5Å; L175-I403 HydrophobicContact CD1-CG2 3.99Å; L175-A404 HydrophobicContact CB-CB 3.95Å; L175-A404 HydrophobicContact CD1-CB 4.28Å
176F96.4Very high93.6Very high11 Ų1115.9 Ų15.95%0.0487%0.074CC..Hα-helixtrans-57.8-44.8178.3-177.4-72.7000109.6I172 A179 V180 I204 F205 F208 L401 A404 L405I172-F176 WeakPolarHBondContact O-CB 3.27Å; I172-F176 PolarHBondContact O-N 3.37Å; I172-F176 VanDerWaalsContact O-N 3.08Å; F176-A179 PolarHBondContact O-N 2.74Å; F176-V180 HydrophobicContact CD1-CG2 4.1Å; F176-V180 HydrophobicContact CE1-CB 4.45Å; F176-V180 HydrophobicContact CE1-CG2 3.78Å; F176-V180 HydrophobicContact CZ-CG2 4.24Å; F176-V180 WeakPolarHBondContact O-CG2 3.4Å; F176-V180 PolarHBondContact O-N 3.1Å; F176-I204 HydrophobicContact CE1-CG2 4.39Å; F176-I204 HydrophobicContact CZ-CG2 4.19Å; F176-F205 AromaticContact CD1-CD2 3.56Å; F176-F205 HydrophobicContact CD1-CD2 3.56Å; F176-F205 HydrophobicContact CD1-CE2 4.29Å; F176-F205 HydrophobicContact CE1-CB 4.07Å; F176-F205 AromaticContact CE1-CD2 3.82Å; F176-F205 HydrophobicContact CE1-CD2 3.82Å; F176-F205 HydrophobicContact CE1-CG 4.41Å; F176-F205 HydrophobicContact CG-CD2 4.44Å; F176-F208 HydrophobicContact CE2-CB 4.35Å; F176-F208 HydrophobicContact CE2-CD1 4.42Å; F176-F208 HydrophobicContact CE2-CD2 4.45Å; F176-F208 HydrophobicContact CE2-CG 4.15Å; F176-F208 HydrophobicContact CZ-CB 4.02Å; F176-F208 HydrophobicContact CZ-CD1 4.5Å; F176-F208 HydrophobicContact CZ-CG 4.25Å; F176-L401 HydrophobicContact CD2-CD2 3.69Å; F176-L401 HydrophobicContact CE2-CD2 3.89Å; F176-L401 HydrophobicContact CG-CD2 4.18Å; F176-A404 HydrophobicContact CB-CB 4.27Å; F176-L405 HydrophobicContact CD2-CD1 4.2Å; F176-L405 HydrophobicContact CD2-CD2 3.83Å; F176-L405 HydrophobicContact CD2-CG 4.1Å; F176-L405 HydrophobicContact CE2-CD1 4.04Å; F176-L405 HydrophobicContact CE2-CD2 4.05Å; F176-L405 HydrophobicContact CE2-CG 4.37Å
177S95.7Very high93.3Very high2 Ų213.4 Ų13.41%0.0147%0.069CC..Hα-helixtrans-67-41.6-179.9-56.10000111.7G173 T174 L175 A179 V180 L181 F440G173-S177 WeakPolarHBondContact O-CB 3.43Å; G173-S177 PolarHBondContact O-N 3.09Å; G173-S177 PolarHBondContact O-OG 3.07Å; T174-S177 PolarHBondContact O-N 3.37Å; L175-S177 PolarHBondContact O-N 3Å; S177-A179 VanDerWaalsContact C-N 3.34Å; S177-A179 PolarHBondContact O-N 2.91Å; S177-V180 PolarHBondContact O-N 3.3Å; S177-L181 WeakPolarHBondContact O-CA 3.38Å; S177-L181 WeakPolarHBondContact O-CB 3.43Å; S177-L181 PolarHBondContact O-N 3.31Å; S177-F440 WeakPolarHBondContact OG-CA 3.35Å; S177-F440 VanDerWaalsContact OG-CD2 3.26Å; S177-F440 WeakPolarHBondContact OG-CD2 3.04Å
178N95.3Very high93Very high0 Ų016 Ų160%09%0.085CC..Hα-helixtrans-63.1-43.2177.8-16656.4000111.1T174 L175 Q182 L183 A336 F400 I443T174-N178 WeakPolarHBondContact O-CB 3.49Å; T174-N178 PolarHBondContact O-N 3Å; L175-N178 PolarHBondContact O-N 3.32Å; N178-Q182 WeakPolarHBondContact O-CA 3.19Å; N178-Q182 WeakPolarHBondContact O-CB 3.43Å; N178-Q182 PolarHBondContact O-N 3.02Å; N178-Q182 PolarHBondContact OD1-OE1 3.3Å; N178-L183 PolarHBondContact O-N 3.15Å; N178-A336 HydrophobicContact CB-CB 3.81Å; N178-F400 HydrophobicContact CB-CD2 4.47Å; N178-F400 WeakPolarHBondContact ND2-CE2 3.27Å; N178-I443 HydrophobicContact CB-CG2 4.48Å
179A95.6Very high92.3Very high0 Ų018.2 Ų18.20%011%0.109CC..Iπ-helixtrans-59.6-49.7175.700000111.9L175 F176 S177 I184 F400 L401L175-A179 WeakPolarHBondContact O-CB 3.45Å; L175-A179 PolarHBondContact O-N 3.19Å; F176-A179 PolarHBondContact O-N 2.74Å; S177-A179 VanDerWaalsContact C-N 3.34Å; S177-A179 PolarHBondContact O-N 2.91Å; A179-I184 VanDerWaalsContact O-CB 3.26Å; A179-I184 WeakPolarHBondContact O-CB 3.45Å; A179-I184 WeakPolarHBondContact O-CD1 3.43Å; A179-I184 WeakPolarHBondContact O-CG1 3.1Å; A179-I184 PolarHBondContact O-N 3.18Å; A179-F400 HydrophobicContact CB-CB 4.01Å; A179-L401 HydrophobicContact CB-CD2 4.19Å; A179-L401 HydrophobicContact CB-CG 3.8Å
180V94.9Very high91.4Very high12 Ų1222.8 Ų22.87%0.07313%0.129CC..Iπ-helixtrans-81.8-34.6-172.4175.20000113.5F176 S177 P185 A201 I204 L401F176-V180 HydrophobicContact CD1-CG2 4.1Å; F176-V180 HydrophobicContact CE1-CB 4.45Å; F176-V180 HydrophobicContact CE1-CG2 3.78Å; F176-V180 HydrophobicContact CZ-CG2 4.24Å; F176-V180 WeakPolarHBondContact O-CG2 3.4Å; F176-V180 PolarHBondContact O-N 3.1Å; S177-V180 PolarHBondContact O-N 3.3Å; V180-P185 VanDerWaalsContact O-CD 3.26Å; V180-P185 WeakPolarHBondContact O-CD 3.47Å; V180-P185 WeakPolarHBondContact O-CG 3.31Å; V180-A201 HydrophobicContact CG1-CB 3.99Å; V180-I204 HydrophobicContact CG1-CB 3.97Å; V180-I204 HydrophobicContact CG1-CD1 3.88Å; V180-I204 HydrophobicContact CG1-CG2 3.99Å; V180-I204 HydrophobicContact CG2-CG2 4.32Å; V180-L401 HydrophobicContact CG2-CD2 4.11Å
181L91.2Very high90Very high2 Ų226 Ų261%0.0115%0.146CC..Iπ-helixtrans-92.1-24.1-176.5-67.8165000113.4S177 Y197 V198 A201 V202 F440 I443 L444 T447S177-L181 WeakPolarHBondContact O-CA 3.38Å; S177-L181 WeakPolarHBondContact O-CB 3.43Å; S177-L181 PolarHBondContact O-N 3.31Å; L181-Y197 WeakPolarHBondContact O-CE2 3.15Å; L181-Y197 PolarHBondContact O-OH 3.49Å; L181-V198 HydrophobicContact CD2-CG1 4.23Å; L181-A201 HydrophobicContact CD2-CB 3.48Å; L181-A201 VanDerWaalsContact CD2-CB 3.48Å; L181-A201 HydrophobicContact CG-CB 4.37Å; L181-V202 HydrophobicContact CD2-CG2 4.37Å; L181-F440 HydrophobicContact CD1-CE2 4.26Å; L181-I443 HydrophobicContact CD1-CG2 4.25Å; L181-L444 HydrophobicContact CD1-CB 4.37Å; L181-L444 HydrophobicContact CD1-CD1 4.27Å; L181-T447 HydrophobicContact CB-CG2 4.44Å
182Q89.7Confident88.5Confident24 Ų2427.9 Ų27.911%0.11216%0.159CC..Iπ-helixtrans-124.5-65.3-174-59.9-174.2-4.500112N178 I184 P185 E186 S332 T447N178-Q182 WeakPolarHBondContact O-CA 3.19Å; N178-Q182 WeakPolarHBondContact O-CB 3.43Å; N178-Q182 PolarHBondContact O-N 3.02Å; N178-Q182 PolarHBondContact OD1-OE1 3.3Å; Q182-I184 PolarHBondContact O-N 3.2Å; Q182-P185 WeakPolarHBondContact O-CD 3.5Å; Q182-E186 WeakPolarHBondContact O-CB 3.22Å; Q182-E186 PolarHBondContact O-N 3.45Å; Q182-S332 PolarHBondContact NE2-OG 3.12Å; Q182-S332 PolarHBondContact OE1-OG 3.25Å; Q182-T447 PolarHBondContact NE2-OG1 3.47Å
183L92.1Very high86.8Confident4 Ų434.1 Ų34.12%0.02119%0.186CC..Iπ-helixtrans-65-47.4-169.2-57.1179.4000113.5N178 A187 V318 F393 A396 F400N178-L183 PolarHBondContact O-N 3.15Å; L183-A187 VanDerWaalsContact O-CB 3.22Å; L183-A187 WeakPolarHBondContact O-CB 3.45Å; L183-A187 PolarHBondContact O-N 3.07Å; L183-V318 HydrophobicContact CD1-CG1 4.42Å; L183-V318 HydrophobicContact CD2-CG1 4.14Å; L183-F393 HydrophobicContact CB-CB 4.4Å; L183-F393 HydrophobicContact CD2-CD1 3.75Å; L183-F393 HydrophobicContact CD2-CE1 4.36Å; L183-F393 HydrophobicContact CD2-CG 4.4Å; L183-F393 WeakPolarHBondContact O-CB 3.3Å; L183-A396 HydrophobicContact CD1-CB 3.98Å; L183-F400 HydrophobicContact CD1-CD2 3.56Å; L183-F400 HydrophobicContact CD1-CE2 3.79Å; L183-F400 HydrophobicContact CD1-CG 4.14Å
184I92.5Very high85.1Confident56 Ų5637.5 Ų37.529%0.28721%0.214SC..Hα-helixtrans-67.5-48.8-179.6-67.6166.3000111.4A179 Q182 E186 A187 L188 L401A179-I184 VanDerWaalsContact O-CB 3.26Å; A179-I184 WeakPolarHBondContact O-CB 3.45Å; A179-I184 WeakPolarHBondContact O-CD1 3.43Å; A179-I184 WeakPolarHBondContact O-CG1 3.1Å; A179-I184 PolarHBondContact O-N 3.18Å; Q182-I184 PolarHBondContact O-N 3.2Å; I184-E186 VanDerWaalsContact C-N 3.34Å; I184-E186 PolarHBondContact O-N 2.97Å; I184-A187 WeakPolarHBondContact O-CB 3.43Å; I184-A187 PolarHBondContact O-N 3.06Å; I184-L188 HydrophobicContact CG2-CD1 3.99Å; I184-L188 VanDerWaalsContact O-CG 3.31Å; I184-L188 WeakPolarHBondContact O-CG 3.35Å; I184-L188 PolarHBondContact O-N 3.1Å; I184-L401 HydrophobicContact CD1-CD1 3.77Å
185P87.9Confident83.7Confident6 Ų641 Ų414%0.03923%0.233CC..Hα-helixtrans-58.4-43.3175-26.535.6000113.3V180 Q182 A187 L188 G189 F190 Y197V180-P185 VanDerWaalsContact O-CD 3.26Å; V180-P185 WeakPolarHBondContact O-CD 3.47Å; V180-P185 WeakPolarHBondContact O-CG 3.31Å; Q182-P185 WeakPolarHBondContact O-CD 3.5Å; P185-A187 PolarHBondContact O-N 3.06Å; P185-L188 CarbonylContact O-C 3.42Å; P185-L188 PolarHBondContact O-N 3.24Å; P185-L188 VanDerWaalsContact O-N 3.12Å; P185-G189 PolarHBondContact O-N 3.29Å; P185-F190 HydrophobicContact CB-CB 4.18Å; P185-F190 HydrophobicContact CB-CD2 4.43Å; P185-F190 PolarHBondContact O-N 3.07Å; P185-Y197 HydrophobicContact CB-CD1 4.41Å; P185-Y197 HydrophobicContact CB-CD2 4.08Å; P185-Y197 HydrophobicContact CB-CE1 3.83Å; P185-Y197 HydrophobicContact CB-CE2 3.54Å; P185-Y197 HydrophobicContact CG-CD2 3.86Å; P185-Y197 HydrophobicContact CG-CE2 3.32Å
186E84.5Confident82.6Confident61 Ų6146.9 Ų46.929%0.28526%0.264SS..Hα-helixtrans-63.4-42177.3-165.670.8-155.400111.1Q182 I184 L188 G189 V325 N390 F393Q182-E186 WeakPolarHBondContact O-CB 3.22Å; Q182-E186 PolarHBondContact O-N 3.45Å; I184-E186 VanDerWaalsContact C-N 3.34Å; I184-E186 PolarHBondContact O-N 2.97Å; E186-L188 PolarHBondContact O-N 3.34Å; E186-G189 PolarHBondContact O-N 3.34Å; E186-V325 WeakPolarHBondContact OE1-CG1 3.26Å; E186-N390 PolarHBondContact O-ND2 3.35Å; E186-F393 HydrophobicContact CB-CD2 3.94Å; E186-F393 HydrophobicContact CB-CE2 4.38Å; E186-F393 HydrophobicContact CG-CD2 3.42Å; E186-F393 VanDerWaalsContact CG-CD2 3.42Å; E186-F393 HydrophobicContact CG-CE2 3.43Å; E186-F393 VanDerWaalsContact CG-CE2 3.43Å; E186-F393 HydrophobicContact CG-CG 4.38Å; E186-F393 HydrophobicContact CG-CZ 4.39Å
187A88.1Confident82Confident22 Ų2247.3 Ų47.318%0.18227%0.265CS..Hα-helixtrans-60.4-32.3174.300000113.1L183 I184 P185 N390 F393 A394L183-A187 VanDerWaalsContact O-CB 3.22Å; L183-A187 WeakPolarHBondContact O-CB 3.45Å; L183-A187 PolarHBondContact O-N 3.07Å; I184-A187 WeakPolarHBondContact O-CB 3.43Å; I184-A187 PolarHBondContact O-N 3.06Å; P185-A187 PolarHBondContact O-N 3.06Å; A187-N390 WeakPolarHBondContact CB-O 3.39Å; A187-F393 HydrophobicContact CB-CB 4.01Å; A187-A394 HydrophobicContact CB-CB 3.87Å
188L85.1Confident81.6Confident116 Ų11647.9 Ų47.961%0.60727%0.269SS*.Hα-helixtrans-87.7-8.6177.4-64174.4000113.3I184 P185 E186 F190I184-L188 HydrophobicContact CG2-CD1 3.99Å; I184-L188 VanDerWaalsContact O-CG 3.31Å; I184-L188 WeakPolarHBondContact O-CG 3.35Å; I184-L188 PolarHBondContact O-N 3.1Å; P185-L188 CarbonylContact O-C 3.42Å; P185-L188 PolarHBondContact O-N 3.24Å; P185-L188 VanDerWaalsContact O-N 3.12Å; E186-L188 PolarHBondContact O-N 3.34Å; L188-F190 HydrophobicContact CB-CD2 3.81Å; L188-F190 HydrophobicContact CB-CE2 3.73Å; L188-F190 HydrophobicContact CB-CZ 4.4Å; L188-F190 HydrophobicContact CD1-CD2 4.21Å; L188-F190 HydrophobicContact CD1-CE2 3.67Å; L188-F190 HydrophobicContact CG-CE2 4.36Å
189G78.3Confident81.2Confident53 Ų5351.6 Ų51.655%0.54630%0.3SS..THydrogen-bonded Turntrans7926.5-179.400000114.5P185 E186P185-G189 PolarHBondContact O-N 3.29Å; E186-G189 PolarHBondContact O-N 3.34Å
190F76.3Confident80.9Confident95 Ų9559 Ų5942%0.41733%0.332SS..  trans-85.8134.4176.1-65.4-48000112P185 L188 D195 Y197P185-F190 HydrophobicContact CB-CB 4.18Å; P185-F190 HydrophobicContact CB-CD2 4.43Å; P185-F190 PolarHBondContact O-N 3.07Å; L188-F190 HydrophobicContact CB-CD2 3.81Å; L188-F190 HydrophobicContact CB-CE2 3.73Å; L188-F190 HydrophobicContact CB-CZ 4.4Å; L188-F190 HydrophobicContact CD1-CD2 4.21Å; L188-F190 HydrophobicContact CD1-CE2 3.67Å; L188-F190 HydrophobicContact CG-CE2 4.36Å; F190-D195 WeakPolarHBondContact CA-OD2 3.42Å; F190-Y197 HydrophobicContact CB-CD1 3.79Å; F190-Y197 HydrophobicContact CB-CE1 4.07Å; F190-Y197 HydrophobicContact CB-CG 4.48Å
191D67.6Low80.7Confident81 Ų8158.6 Ų58.643%0.43333%0.33SS..  trans-94.4128.4174.3-176.5-36.1000110.2K193 A194 D195D191-K193 PolarHBondContact O-N 2.97Å; D191-K193 VanDerWaalsContact O-N 3.15Å; D191-K193 PolarHBondContact OD1-N 2.78Å; D191-A194 HydrophobicContact CB-CB 3.93Å; D191-A194 PolarHBondContact O-N 2.63Å; D191-D195 PolarHBondContact N-OD2 2.94Å; D191-D195 PolarHBondContact O-N 2.91Å
192P63.6Low80.8Confident40 Ų4060.8 Ų60.826%0.2634%0.344SS..THydrogen-bonded Turntrans-54.1-33.2178.9-20.625.6000114.5Y197 V198P192-Y197 HydrophobicContact CB-CE1 4Å; P192-Y197 HydrophobicContact CG-CE1 3.93Å; P192-Y197 VanDerWaalsContact N-CE1 3.34Å; P192-V198 HydrophobicContact CB-CG2 4.1Å
193K60.9Low80.9Confident132 Ų13261.8 Ų61.857%0.57436%0.36SS*.THydrogen-bonded Turntrans-89.2-35.3-177.2-69.3-175174.4-177.60112.9D191 G451D191-K193 PolarHBondContact O-N 2.97Å; D191-K193 VanDerWaalsContact O-N 3.15Å; D191-K193 PolarHBondContact OD1-N 2.78Å; K193-G451 PolarHBondContact NZ-O 2.83Å
194A60.9Low81.1Confident71 Ų7166.2 Ų66.259%0.58738%0.383SS*.THydrogen-bonded Turntrans-81.6-41.4-176.700000112.1D191D191-A194 HydrophobicContact CB-CB 3.93Å; D191-A194 PolarHBondContact O-N 2.63Å
195D66.1Low81.1Confident74 Ų7464 Ų6440%0.39637%0.371SS..SBendtrans-98.1-4.1-166.3-64.3-49.8000114.3F190 D191 Y197F190-D195 WeakPolarHBondContact CA-OD2 3.42Å; D191-D195 PolarHBondContact N-OD2 2.94Å; D191-D195 PolarHBondContact O-N 2.91Å; D195-Y197 HydrophobicContact CB-CD1 4.43Å; D195-Y197 PolarHBondContact O-N 2.93Å
196N72.6Confident81.4Confident123 Ų12365.3 Ų65.366%0.65839%0.386SS*.  trans45.734.9-175.5-75.1-60000112.8V198N196-V198 VanDerWaalsContact C-N 3.31Å; N196-V198 PolarHBondContact O-N 2.96Å
197Y83.6Confident82Confident19 Ų1964.2 Ų64.28%0.07539%0.39CS..Hα-helixtrans-75.6-23.3-175.378.8-102.9000112.2L181 P185 F190 P192 D195 A199 K200 A201L181-Y197 WeakPolarHBondContact O-CE2 3.15Å; L181-Y197 PolarHBondContact O-OH 3.49Å; P185-Y197 HydrophobicContact CB-CD1 4.41Å; P185-Y197 HydrophobicContact CB-CD2 4.08Å; P185-Y197 HydrophobicContact CB-CE1 3.83Å; P185-Y197 HydrophobicContact CB-CE2 3.54Å; P185-Y197 HydrophobicContact CG-CD2 3.86Å; P185-Y197 HydrophobicContact CG-CE2 3.32Å; F190-Y197 HydrophobicContact CB-CD1 3.79Å; F190-Y197 HydrophobicContact CB-CE1 4.07Å; F190-Y197 HydrophobicContact CB-CG 4.48Å; P192-Y197 HydrophobicContact CB-CE1 4Å; P192-Y197 HydrophobicContact CG-CE1 3.93Å; P192-Y197 VanDerWaalsContact N-CE1 3.34Å; D195-Y197 HydrophobicContact CB-CD1 4.43Å; D195-Y197 PolarHBondContact O-N 2.93Å; Y197-A199 VanDerWaalsContact C-N 3.27Å; Y197-A199 PolarHBondContact O-N 3.48Å; Y197-K200 WeakPolarHBondContact O-CA 3.37Å; Y197-K200 WeakPolarHBondContact O-CB 3.12Å; Y197-K200 PolarHBondContact O-N 2.89Å; Y197-A201 HydrophobicContact CD2-CB 4.16Å; Y197-A201 HydrophobicContact CE2-CB 4.47Å; Y197-A201 PolarHBondContact O-N 3.16Å
198V86.3Confident82.2Confident14 Ų1465.1 Ų65.19%0.08539%0.39CS..Hα-helixtrans-54.5-42.8-174.5-179.40000111.3L181 P192 N196 K200 A201 V202 L444 T447 M448L181-V198 HydrophobicContact CD2-CG1 4.23Å; P192-V198 HydrophobicContact CB-CG2 4.1Å; N196-V198 VanDerWaalsContact C-N 3.31Å; N196-V198 PolarHBondContact O-N 2.96Å; V198-K200 VanDerWaalsContact C-N 3.32Å; V198-K200 PolarHBondContact O-N 2.93Å; V198-A201 PolarHBondContact O-N 2.81Å; V198-V202 HydrophobicContact CG1-CG2 4.36Å; V198-V202 WeakPolarHBondContact O-CB 3.43Å; V198-V202 VanDerWaalsContact O-CG2 3.25Å; V198-V202 WeakPolarHBondContact O-CG2 3.22Å; V198-V202 PolarHBondContact O-N 2.8Å; V198-L444 HydrophobicContact CG1-CD1 3.96Å; V198-T447 HydrophobicContact CG2-CG2 4.32Å; V198-M448 HydrophobicContact CG1-SD 3.83Å
199A87.4Confident82.7Confident78 Ų7862 Ų6265%0.64537%0.371SS*.Hα-helixtrans-62.4-37.5177.100000112.8Y197 G203Y197-A199 VanDerWaalsContact C-N 3.27Å; Y197-A199 PolarHBondContact O-N 3.48Å; A199-G203 PolarHBondContact O-N 3.13Å; A199-G203 VanDerWaalsContact O-N 3.13Å
200K89.3Confident83.5Confident155 Ų15564.6 Ų64.667%0.67437%0.371SS*.Hα-helixtrans-69.7-42.1176.6-59.2173.7-174.9164.50110.7Y197 V198 G203 I204Y197-K200 WeakPolarHBondContact O-CA 3.37Å; Y197-K200 WeakPolarHBondContact O-CB 3.12Å; Y197-K200 PolarHBondContact O-N 2.89Å; V198-K200 VanDerWaalsContact C-N 3.32Å; V198-K200 PolarHBondContact O-N 2.93Å; K200-G203 WeakPolarHBondContact O-CA 3.47Å; K200-G203 PolarHBondContact O-N 3.34Å; K200-I204 PolarHBondContact O-N 2.87Å; K200-I204 VanDerWaalsContact O-N 3.15Å
201A90.4Very high84.3Confident5 Ų565.8 Ų65.84%0.04138%0.382CS..Hα-helixtrans-65.4-39176.700000112.6V180 L181 Y197 V198 G203 I204 F205V180-A201 HydrophobicContact CG1-CB 3.99Å; L181-A201 HydrophobicContact CD2-CB 3.48Å; L181-A201 VanDerWaalsContact CD2-CB 3.48Å; L181-A201 HydrophobicContact CG-CB 4.37Å; Y197-A201 HydrophobicContact CD2-CB 4.16Å; Y197-A201 HydrophobicContact CE2-CB 4.47Å; Y197-A201 PolarHBondContact O-N 3.16Å; V198-A201 PolarHBondContact O-N 2.81Å; A201-G203 PolarHBondContact O-N 2.84Å; A201-I204 WeakPolarHBondContact O-CB 3.47Å; A201-I204 PolarHBondContact O-N 3.36Å; A201-I204 VanDerWaalsContact O-N 3.08Å; A201-F205 PolarHBondContact O-N 3.46Å
202V92.9Very high85.5Confident48 Ų4862.1 Ų62.129%0.29136%0.362SS..Hα-helixtrans-58.8-38.2168.7168.40000110.9L181 V198 I204 F205 G206 F440 L444L181-V202 HydrophobicContact CD2-CG2 4.37Å; V198-V202 HydrophobicContact CG1-CG2 4.36Å; V198-V202 WeakPolarHBondContact O-CB 3.43Å; V198-V202 VanDerWaalsContact O-CG2 3.25Å; V198-V202 WeakPolarHBondContact O-CG2 3.22Å; V198-V202 PolarHBondContact O-N 2.8Å; V202-I204 VanDerWaalsContact C-N 3.32Å; V202-I204 PolarHBondContact O-N 3.4Å; V202-F205 PolarHBondContact O-N 3.46Å; V202-G206 PolarHBondContact O-N 3.17Å; V202-F440 HydrophobicContact CB-CZ 4.43Å; V202-F440 HydrophobicContact CG1-CZ 4.08Å; V202-F440 HydrophobicContact CG2-CZ 4.04Å; V202-L444 HydrophobicContact CG2-CD1 3.64Å; V202-L444 HydrophobicContact CG2-CD2 4.38Å
203G93.4Very high86.9Confident44 Ų4464.2 Ų64.245%0.45437%0.367SS..Hα-helixtrans-60.3-37.217300000113.8A199 K200 A201 G206 G207A199-G203 PolarHBondContact O-N 3.13Å; A199-G203 VanDerWaalsContact O-N 3.13Å; K200-G203 WeakPolarHBondContact O-CA 3.47Å; K200-G203 PolarHBondContact O-N 3.34Å; A201-G203 PolarHBondContact O-N 2.84Å; G203-G206 PolarHBondContact O-N 2.83Å; G203-G207 PolarHBondContact O-N 2.99Å
204I94.5Very high88.4Confident98 Ų9861 Ų6150%0.50336%0.359SS..Hα-helixtrans-62.8-49.7175.8-62.9171.6000110.2F176 V180 K200 A201 V202 G206 G207 F208F176-I204 HydrophobicContact CE1-CG2 4.39Å; F176-I204 HydrophobicContact CZ-CG2 4.19Å; V180-I204 HydrophobicContact CG1-CB 3.97Å; V180-I204 HydrophobicContact CG1-CD1 3.88Å; V180-I204 HydrophobicContact CG1-CG2 3.99Å; V180-I204 HydrophobicContact CG2-CG2 4.32Å; K200-I204 PolarHBondContact O-N 2.87Å; K200-I204 VanDerWaalsContact O-N 3.15Å; A201-I204 WeakPolarHBondContact O-CB 3.47Å; A201-I204 PolarHBondContact O-N 3.36Å; A201-I204 VanDerWaalsContact O-N 3.08Å; V202-I204 VanDerWaalsContact C-N 3.32Å; V202-I204 PolarHBondContact O-N 3.4Å; I204-G206 VanDerWaalsContact C-N 3.33Å; I204-G206 PolarHBondContact O-N 3.34Å; I204-G207 PolarHBondContact O-N 3.47Å; I204-F208 PolarHBondContact O-N 3.26Å
205F93.4Very high89.8Confident9 Ų961.6 Ų61.64%0.03935%0.349CS..Hα-helixtrans-61.5-42.7174.8-176.3-89.2000111.7F176 A201 V202 G207 F208 Y209 L436 L437 F440F176-F205 AromaticContact CD1-CD2 3.56Å; F176-F205 HydrophobicContact CD1-CD2 3.56Å; F176-F205 HydrophobicContact CD1-CE2 4.29Å; F176-F205 HydrophobicContact CE1-CB 4.07Å; F176-F205 AromaticContact CE1-CD2 3.82Å; F176-F205 HydrophobicContact CE1-CD2 3.82Å; F176-F205 HydrophobicContact CE1-CG 4.41Å; F176-F205 HydrophobicContact CG-CD2 4.44Å; A201-F205 PolarHBondContact O-N 3.46Å; V202-F205 PolarHBondContact O-N 3.46Å; F205-G207 VanDerWaalsContact C-N 3.32Å; F205-G207 PolarHBondContact O-N 3.02Å; F205-F208 PolarHBondContact O-N 3.06Å; F205-Y209 HydrophobicContact CE1-CG 4.44Å; F205-Y209 VanDerWaalsContact O-CB 3.31Å; F205-Y209 WeakPolarHBondContact O-CB 3.45Å; F205-Y209 PolarHBondContact O-N 3.17Å; F205-L436 HydrophobicContact CE2-CD1 4.45Å; F205-L436 HydrophobicContact CZ-CD1 4.39Å; F205-L436 HydrophobicContact CZ-CG 4.03Å; F205-L437 HydrophobicContact CE1-CD2 4.42Å; F205-F440 HydrophobicContact CB-CD2 3.9Å; F205-F440 HydrophobicContact CB-CE2 3.56Å; F205-F440 HydrophobicContact CB-CZ 4.41Å; F205-F440 HydrophobicContact CD1-CB 4.4Å; F205-F440 HydrophobicContact CD1-CD1 4.16Å; F205-F440 AromaticContact CD1-CD2 3.37Å; F205-F440 HydrophobicContact CD1-CD2 3.37Å; F205-F440 HydrophobicContact CD1-CE1 4.28Å; F205-F440 AromaticContact CD1-CE2 3.55Å; F205-F440 HydrophobicContact CD1-CE2 3.55Å; F205-F440 AromaticContact CD1-CG 3.71Å; F205-F440 HydrophobicContact CD1-CG 3.71Å; F205-F440 AromaticContact CD1-CZ 4Å; F205-F440 HydrophobicContact CD1-CZ 4Å; F205-F440 HydrophobicContact CD2-CB 4.41Å; F205-F440 AromaticContact CD2-CD2 3.47Å; F205-F440 HydrophobicContact CD2-CD2 3.47Å; F205-F440 VanDerWaalsContact CD2-CD2 3.47Å; F205-F440 HydrophobicContact CD2-CE2 4.08Å; F205-F440 HydrophobicContact CD2-CG 4.19Å; F205-F440 HydrophobicContact CE1-CB 3.78Å; F205-F440 AromaticContact CE1-CD1 3.99Å; F205-F440 HydrophobicContact CE1-CD1 3.99Å; F205-F440 AromaticContact CE1-CD2 3.66Å; F205-F440 HydrophobicContact CE1-CD2 3.66Å; F205-F440 HydrophobicContact CE1-CE2 4.25Å; F205-F440 AromaticContact CE1-CG 3.52Å; F205-F440 HydrophobicContact CE1-CG 3.52Å; F205-F440 HydrophobicContact CE2-CB 3.79Å; F205-F440 AromaticContact CE2-CD2 3.75Å; F205-F440 HydrophobicContact CE2-CD2 3.75Å; F205-F440 HydrophobicContact CE2-CG 4.03Å; F205-F440 AromaticContact CG-CD2 3.27Å; F205-F440 HydrophobicContact CG-CD2 3.27Å; F205-F440 AromaticContact CG-CE2 3.44Å; F205-F440 HydrophobicContact CG-CE2 3.44Å; F205-F440 VanDerWaalsContact CG-CE2 3.44Å; F205-F440 HydrophobicContact CG-CG 4.05Å; F205-F440 HydrophobicContact CG-CZ 4.31Å; F205-F440 HydrophobicContact CZ-CB 3.43Å; F205-F440 VanDerWaalsContact CZ-CB 3.43Å; F205-F440 AromaticContact CZ-CD2 3.84Å; F205-F440 HydrophobicContact CZ-CD2 3.84Å; F205-F440 AromaticContact CZ-CG 3.69Å; F205-F440 HydrophobicContact CZ-CG 3.69Å
206G95Very high90.8Very high34 Ų3458.7 Ų58.735%0.35133%0.333SS..Hα-helixtrans-60-39.117800000113.1V202 G203 I204 Y209 L210V202-G206 PolarHBondContact O-N 3.17Å; G203-G206 PolarHBondContact O-N 2.83Å; I204-G206 VanDerWaalsContact C-N 3.33Å; I204-G206 PolarHBondContact O-N 3.34Å; G206-Y209 PolarHBondContact O-N 3.25Å; G206-L210 VanDerWaalsContact O-CB 3.24Å; G206-L210 WeakPolarHBondContact O-CB 3.38Å; G206-L210 PolarHBondContact O-N 2.98Å
207G95.5Very high91.6Very high37 Ų3755.1 Ų55.138%0.38131%0.313SS..Hα-helixtrans-64.1-47.7174.700000112.6G203 I204 F205 L210 L211G203-G207 PolarHBondContact O-N 2.99Å; I204-G207 PolarHBondContact O-N 3.47Å; F205-G207 VanDerWaalsContact C-N 3.32Å; F205-G207 PolarHBondContact O-N 3.02Å; G207-L210 PolarHBondContact O-N 3.47Å; G207-L211 PolarHBondContact O-N 2.99Å
208F93.8Very high91.8Very high41 Ų4158.2 Ų58.218%0.1833%0.331CS..Hα-helixtrans-57.7-50.4173.2162.8-103.2000111.4F176 I204 F205 L210 L211 F212 L405 F409 L436F176-F208 HydrophobicContact CE2-CB 4.35Å; F176-F208 HydrophobicContact CE2-CD1 4.42Å; F176-F208 HydrophobicContact CE2-CD2 4.45Å; F176-F208 HydrophobicContact CE2-CG 4.15Å; F176-F208 HydrophobicContact CZ-CB 4.02Å; F176-F208 HydrophobicContact CZ-CD1 4.5Å; F176-F208 HydrophobicContact CZ-CG 4.25Å; I204-F208 PolarHBondContact O-N 3.26Å; F205-F208 PolarHBondContact O-N 3.06Å; F208-L210 VanDerWaalsContact C-N 3.35Å; F208-L210 PolarHBondContact O-N 3.43Å; F208-L211 PolarHBondContact O-N 3.46Å; F208-F212 WeakPolarHBondContact O-CB 3.45Å; F208-F212 PolarHBondContact O-N 3.41Å; F208-L405 HydrophobicContact CD2-CD2 4.06Å; F208-L405 HydrophobicContact CE2-CD2 3.49Å; F208-L405 VanDerWaalsContact CE2-CD2 3.49Å; F208-L405 HydrophobicContact CZ-CD2 3.91Å; F208-F409 HydrophobicContact CE2-CD2 4.43Å; F208-F409 HydrophobicContact CE2-CE2 4.16Å; F208-F409 AromaticContact CZ-CD2 3.96Å; F208-F409 HydrophobicContact CZ-CD2 3.96Å; F208-F409 AromaticContact CZ-CE2 3.81Å; F208-F409 HydrophobicContact CZ-CE2 3.81Å; F208-L436 HydrophobicContact CE1-CD1 4.24Å; F208-L436 HydrophobicContact CE1-CD2 4.14Å
209Y94.9Very high91.7Very high52 Ų5261.7 Ų61.720%0.20435%0.345CS..Hα-helixtrans-61.7-40.8-178.6-179-103.6000112.4F205 G206 F212 F213 N433 L436 L437F205-Y209 HydrophobicContact CE1-CG 4.44Å; F205-Y209 VanDerWaalsContact O-CB 3.31Å; F205-Y209 WeakPolarHBondContact O-CB 3.45Å; F205-Y209 PolarHBondContact O-N 3.17Å; G206-Y209 PolarHBondContact O-N 3.25Å; Y209-F212 HydrophobicContact CD2-CD1 4.16Å; Y209-F212 HydrophobicContact CE2-CD1 4.21Å; Y209-F212 HydrophobicContact CE2-CE1 4.38Å; Y209-F212 PolarHBondContact O-N 2.83Å; Y209-F213 VanDerWaalsContact O-CB 3.25Å; Y209-F213 WeakPolarHBondContact O-CB 3.41Å; Y209-F213 PolarHBondContact O-N 3.27Å; Y209-N433 VanDerWaalsContact CE2-OD1 3.28Å; Y209-N433 WeakPolarHBondContact CE2-OD1 3.08Å; Y209-N433 PolarHBondContact OH-OD1 2.75Å; Y209-L436 HydrophobicContact CD2-CD2 3.75Å; Y209-L436 HydrophobicContact CE2-CD2 4.14Å; Y209-L437 HydrophobicContact CD2-CD2 4.16Å; Y209-L437 HydrophobicContact CE1-CD2 4.4Å; Y209-L437 HydrophobicContact CE2-CD1 4.45Å; Y209-L437 HydrophobicContact CE2-CD2 3.81Å; Y209-L437 HydrophobicContact CE2-CG 4.09Å
210L95.4Very high91.5Very high106 Ų10661.1 Ų61.156%0.55533%0.329SS*.Hα-helixtrans-63-47.4178.4-175.8152.8000111.2G206 G207 F208 F213 V214G206-L210 VanDerWaalsContact O-CB 3.24Å; G206-L210 WeakPolarHBondContact O-CB 3.38Å; G206-L210 PolarHBondContact O-N 2.98Å; G207-L210 PolarHBondContact O-N 3.47Å; F208-L210 VanDerWaalsContact C-N 3.35Å; F208-L210 PolarHBondContact O-N 3.43Å; L210-F213 PolarHBondContact O-N 2.91Å; L210-V214 HydrophobicContact CD2-CG2 4.2Å; L210-V214 WeakPolarHBondContact O-CB 3.36Å; L210-V214 VanDerWaalsContact O-CG2 3.29Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 3.35Å
211L93.7Very high91.1Very high120 Ų12061.6 Ų61.663%0.62833%0.332SS*.Hα-helixtrans-63.4-45177.5-73.3179.3000111.4G207 F208 F213 V214 E215G207-L211 PolarHBondContact O-N 2.99Å; F208-L211 PolarHBondContact O-N 3.46Å; L211-F213 PolarHBondContact O-N 3.38Å; L211-V214 PolarHBondContact O-N 2.86Å; L211-E215 VanDerWaalsContact O-CB 3.27Å; L211-E215 WeakPolarHBondContact O-CB 3.43Å; L211-E215 PolarHBondContact O-N 3.33Å
212F91.6Very high90.6Very high5 Ų568.2 Ų68.22%0.02236%0.36CS..Hα-helixtrans-54.2-52173.4161.3-102.9000111.8F208 Y209 V214 E215 K216 F409 M412 Q432 L436F208-F212 WeakPolarHBondContact O-CB 3.45Å; F208-F212 PolarHBondContact O-N 3.41Å; Y209-F212 HydrophobicContact CD2-CD1 4.16Å; Y209-F212 HydrophobicContact CE2-CD1 4.21Å; Y209-F212 HydrophobicContact CE2-CE1 4.38Å; Y209-F212 PolarHBondContact O-N 2.83Å; F212-V214 PolarHBondContact O-N 2.94Å; F212-E215 PolarHBondContact O-N 3.46Å; F212-K216 HydrophobicContact CD2-CG 4.01Å; F212-K216 HydrophobicContact CE2-CD 4.22Å; F212-K216 HydrophobicContact CE2-CG 3.71Å; F212-K216 HydrophobicContact CZ-CG 4.05Å; F212-K216 WeakPolarHBondContact O-CG 3.31Å; F212-K216 PolarHBondContact O-N 3.13Å; F212-F409 AromaticContact CD2-CE2 3.48Å; F212-F409 HydrophobicContact CD2-CE2 3.48Å; F212-F409 VanDerWaalsContact CD2-CE2 3.48Å; F212-F409 AromaticContact CD2-CZ 3.6Å; F212-F409 HydrophobicContact CD2-CZ 3.6Å; F212-F409 AromaticContact CE2-CE2 3.87Å; F212-F409 HydrophobicContact CE2-CE2 3.87Å; F212-F409 HydrophobicContact CE2-CZ 4.15Å; F212-F409 HydrophobicContact CG-CE2 4.34Å; F212-M412 HydrophobicContact CE2-CE 4.19Å; F212-M412 HydrophobicContact CZ-CE 4.45Å; F212-Q432 HydrophobicContact CZ-CB 4.45Å; F212-L436 HydrophobicContact CD1-CD2 4.14Å; F212-L436 HydrophobicContact CE1-CD2 4.11Å
213F93Very high89.1Confident83 Ų8368.7 Ų68.736%0.36438%0.375SS..Hα-helixtrans-61.3-48.2-177-174.4-89.4000111Y209 L210 L211 K216 I217 F429Y209-F213 VanDerWaalsContact O-CB 3.25Å; Y209-F213 WeakPolarHBondContact O-CB 3.41Å; Y209-F213 PolarHBondContact O-N 3.27Å; L210-F213 PolarHBondContact O-N 2.91Å; L211-F213 PolarHBondContact O-N 3.38Å; F213-K216 PolarHBondContact O-N 3.05Å; F213-I217 HydrophobicContact CD1-CG1 4.01Å; F213-I217 HydrophobicContact CE1-CD1 4.35Å; F213-I217 HydrophobicContact CE1-CG1 3.73Å; F213-I217 HydrophobicContact CZ-CD1 4.24Å; F213-I217 HydrophobicContact CZ-CG1 4.07Å; F213-I217 WeakPolarHBondContact O-CB 3.45Å; F213-I217 WeakPolarHBondContact O-CG1 3.47Å; F213-I217 PolarHBondContact O-N 2.9Å; F213-F429 HydrophobicContact CD2-CE2 4.48Å; F213-F429 AromaticContact CD2-CZ 3.78Å; F213-F429 HydrophobicContact CD2-CZ 3.78Å; F213-F429 HydrophobicContact CE2-CE1 4.19Å; F213-F429 AromaticContact CE2-CZ 3.62Å; F213-F429 HydrophobicContact CE2-CZ 3.62Å; F213-F429 HydrophobicContact CZ-CZ 4.34Å
214V92.1Very high87.3Confident66 Ų6672.6 Ų72.640%0.438%0.384SS..Hα-helixtrans-61.4-46.9177.9171.50000110.9L210 L211 F212 K216 I217 L218L210-V214 HydrophobicContact CD2-CG2 4.2Å; L210-V214 WeakPolarHBondContact O-CB 3.36Å; L210-V214 VanDerWaalsContact O-CG2 3.29Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 3.35Å; L211-V214 PolarHBondContact O-N 2.86Å; F212-V214 PolarHBondContact O-N 2.94Å; V214-K216 PolarHBondContact O-N 2.99Å; V214-I217 PolarHBondContact O-N 2.86Å; V214-L218 HydrophobicContact CG1-CD1 3.7Å; V214-L218 HydrophobicContact CG1-CG 4.17Å; V214-L218 WeakPolarHBondContact O-CB 3.4Å; V214-L218 VanDerWaalsContact O-CG 3.23Å; V214-L218 WeakPolarHBondContact O-CG 3.42Å; V214-L218 PolarHBondContact O-N 3.15Å
215E90.4Very high85.2Confident82 Ų8270.9 Ų70.938%0.38339%0.39SS..Hα-helixtrans-58.6-45.9179.2-172.2-168.7126.700111.8L211 F212 L218 K219L211-E215 VanDerWaalsContact O-CB 3.27Å; L211-E215 WeakPolarHBondContact O-CB 3.43Å; L211-E215 PolarHBondContact O-N 3.33Å; F212-E215 PolarHBondContact O-N 3.46Å; E215-L218 PolarHBondContact O-N 3.01Å; E215-K219 HydrophobicContact CG-CD 4.22Å; E215-K219 WeakPolarHBondContact O-CB 3.42Å; E215-K219 WeakPolarHBondContact O-CG 3.45Å; E215-K219 PolarHBondContact O-N 3.25Å; E215-K219 WeakPolarHBondContact OE1-CE 3.26Å; E215-K219 IonicContact OE1-NZ 2.63Å; E215-K219 PolarHBondContact OE1-NZ 3.47Å
216K87.9Confident82.7Confident14 Ų1478.1 Ų78.16%0.06142%0.424CS..Hα-helixtrans-65-42.5178.4-69-51.5-173.8-156.70112.4F212 F213 V214 K219 M220 D413 F429F212-K216 HydrophobicContact CD2-CG 4.01Å; F212-K216 HydrophobicContact CE2-CD 4.22Å; F212-K216 HydrophobicContact CE2-CG 3.71Å; F212-K216 HydrophobicContact CZ-CG 4.05Å; F212-K216 WeakPolarHBondContact O-CG 3.31Å; F212-K216 PolarHBondContact O-N 3.13Å; F213-K216 PolarHBondContact O-N 3.05Å; V214-K216 PolarHBondContact O-N 2.99Å; K216-K219 PolarHBondContact O-N 2.95Å; K216-M220 WeakPolarHBondContact O-CB 3.19Å; K216-M220 PolarHBondContact O-N 3.47Å; K216-D413 IonicContact NZ-OD1 3.09Å; K216-D413 PolarHBondContact NZ-OD1 2.99Å; K216-D413 IonicContact NZ-OD2 3.01Å; K216-F429 HydrophobicContact CB-CD2 3.73Å; K216-F429 HydrophobicContact CB-CE2 3.46Å; K216-F429 VanDerWaalsContact CB-CE2 3.46Å; K216-F429 HydrophobicContact CG-CD2 4.11Å; K216-F429 HydrophobicContact CG-CE2 4.03Å
217I88.6Confident80.1Confident47 Ų4785 Ų8524%0.24145%0.447CS..Hα-helixtrans-62.4-45.6177.4-71.1-66.3000110.3F213 V214 M220 F221 F429F213-I217 HydrophobicContact CD1-CG1 4.01Å; F213-I217 HydrophobicContact CE1-CD1 4.35Å; F213-I217 HydrophobicContact CE1-CG1 3.73Å; F213-I217 HydrophobicContact CZ-CD1 4.24Å; F213-I217 HydrophobicContact CZ-CG1 4.07Å; F213-I217 WeakPolarHBondContact O-CB 3.45Å; F213-I217 WeakPolarHBondContact O-CG1 3.47Å; F213-I217 PolarHBondContact O-N 2.9Å; V214-I217 PolarHBondContact O-N 2.86Å; I217-M220 PolarHBondContact O-N 3.05Å; I217-F221 HydrophobicContact CG2-CD2 3.45Å; I217-F221 VanDerWaalsContact CG2-CD2 3.45Å; I217-F221 HydrophobicContact CG2-CE2 3.4Å; I217-F221 VanDerWaalsContact CG2-CE2 3.4Å; I217-F221 WeakPolarHBondContact O-CD2 3.28Å; I217-F221 PolarHBondContact O-N 2.87Å; I217-F429 HydrophobicContact CD1-CE1 4.08Å; I217-F429 HydrophobicContact CD1-CZ 3.92Å; I217-F429 HydrophobicContact CG1-CZ 4.21Å
218L87.4Confident77.3Confident84 Ų8490.2 Ų90.244%0.4446%0.461SS..Hα-helixtrans-60.8-47.2175.6-69.4172.3000111.8V214 E215 M220 F221 F222V214-L218 HydrophobicContact CG1-CD1 3.7Å; V214-L218 HydrophobicContact CG1-CG 4.17Å; V214-L218 WeakPolarHBondContact O-CB 3.4Å; V214-L218 VanDerWaalsContact O-CG 3.23Å; V214-L218 WeakPolarHBondContact O-CG 3.42Å; V214-L218 PolarHBondContact O-N 3.15Å; E215-L218 PolarHBondContact O-N 3.01Å; L218-M220 PolarHBondContact O-N 3.19Å; L218-F221 PolarHBondContact O-N 3.38Å; L218-F222 HydrophobicContact CB-CD2 4.34Å; L218-F222 HydrophobicContact CD2-CD2 4.05Å; L218-F222 HydrophobicContact CD2-CE2 3.63Å; L218-F222 WeakPolarHBondContact O-CB 3.48Å; L218-F222 WeakPolarHBondContact O-CD2 3.26Å; L218-F222 PolarHBondContact O-N 3.36Å
219K84.5Confident74.3Confident88 Ų8891.7 Ų91.738%0.38349%0.488SS..Hα-helixtrans-58.5-36.5176.5-78.2175.5171.8174.70112.1E215 K216 G223E215-K219 HydrophobicContact CG-CD 4.22Å; E215-K219 WeakPolarHBondContact O-CB 3.42Å; E215-K219 WeakPolarHBondContact O-CG 3.45Å; E215-K219 PolarHBondContact O-N 3.25Å; E215-K219 WeakPolarHBondContact OE1-CE 3.26Å; E215-K219 IonicContact OE1-NZ 2.63Å; E215-K219 PolarHBondContact OE1-NZ 3.47Å; K216-K219 PolarHBondContact O-N 2.95Å; K219-G223 PolarHBondContact O-N 2.93Å
220M82.9Confident71.6Confident66 Ų6696.8 Ų96.833%0.32551%0.513SS..Hα-helixtrans-73.9-38.9178.3-163.5170.6-61.500112.8K216 I217 L218 K425 I426 F429K216-M220 WeakPolarHBondContact O-CB 3.19Å; K216-M220 PolarHBondContact O-N 3.47Å; I217-M220 PolarHBondContact O-N 3.05Å; L218-M220 PolarHBondContact O-N 3.19Å; M220-K425 HydrophobicContact CE-CB 4.39Å; M220-I426 HydrophobicContact CE-CG1 4.37Å; M220-I426 HydrophobicContact SD-CG1 3.57Å; M220-I426 VanDerWaalsContact SD-CG1 3.57Å; M220-F429 HydrophobicContact CE-CB 3.82Å; M220-F429 HydrophobicContact CE-CG 4.13Å
221F82.7Confident68.5Low165 Ų16597.2 Ų97.272%0.72453%0.525SS*.Hα-helixtrans-75.1-43.5178.7-83.1-63.6000113.5I217 L218I217-F221 HydrophobicContact CG2-CD2 3.45Å; I217-F221 VanDerWaalsContact CG2-CD2 3.45Å; I217-F221 HydrophobicContact CG2-CE2 3.4Å; I217-F221 VanDerWaalsContact CG2-CE2 3.4Å; I217-F221 WeakPolarHBondContact O-CD2 3.28Å; I217-F221 PolarHBondContact O-N 2.87Å; L218-F221 PolarHBondContact O-N 3.38Å
222F78.1Confident65.8Low144 Ų14499.4 Ų99.463%0.63253%0.532SS*.Hα-helixtrans-85.8-7.6-175-73.2-73.3000113.8L218 I224L218-F222 HydrophobicContact CB-CD2 4.34Å; L218-F222 HydrophobicContact CD2-CD2 4.05Å; L218-F222 HydrophobicContact CD2-CE2 3.63Å; L218-F222 WeakPolarHBondContact O-CB 3.48Å; L218-F222 WeakPolarHBondContact O-CD2 3.26Å; L218-F222 PolarHBondContact O-N 3.36Å; F222-I224 HydrophobicContact CB-CD1 4.07Å; F222-I224 HydrophobicContact CB-CG1 3.97Å; F222-I224 PolarHBondContact O-N 2.93Å
223G62.1Low62.8Low58 Ų58109.1 Ų109.160%0.59858%0.575SS**  trans55.829.117300000113.8K219 G225K219-G223 PolarHBondContact O-N 2.93Å; G223-G225 PolarHBondContact O-N 3.01Å
224I56.6Low59.8Low125 Ų125111.1 Ų111.164%0.64159%0.593SS**  trans-72.580.9178.5-56.5172.1000107.3F222F222-I224 HydrophobicContact CB-CD1 4.07Å; F222-I224 HydrophobicContact CB-CG1 3.97Å; F222-I224 PolarHBondContact O-N 2.93Å
225G49.2Very low57Low62 Ų62113.9 Ų113.964%0.63961%0.613SS**  trans-118.320.7-177.400000113.4G223G223-G225 PolarHBondContact O-N 3.01Å
226H41.6Very low54.2Low162 Ų162114.6 Ų114.675%0.7563%0.633SS**  trans-132.183.6170.3-96.1-80.2000109.3
227E39.3Very low51.6Low178 Ų178120.5 Ų120.583%0.83267%0.665SS**  trans-115.1110.5157.1-76.6-167.4131.500108.5G229E227-G229 PolarHBondContact O-N 2.72Å; E227-G229 VanDerWaalsContact O-N 3.07Å
228H38.6Very low48.7Very low146 Ų146124.4 Ų124.468%0.67669%0.691SS**  trans-65.196.7167-69.4-62.9000108.9H230H228-H230 VanDerWaalsContact C-N 3.34Å; H228-H230 PolarHBondContact O-N 3.19Å
229G30.1Very low46.2Very low73 Ų73125.5 Ų125.575%0.75370%0.704SS**  trans-7091.4163.100000109.6E227 S231E227-G229 PolarHBondContact O-N 2.72Å; E227-G229 VanDerWaalsContact O-N 3.07Å; G229-S231 PolarHBondContact O-N 2.77Å; G229-S231 VanDerWaalsContact O-N 3.09Å
230H37.9Very low43.5Very low159 Ų159129.6 Ų129.674%0.73672%0.724SS**  trans-72.489.8167.7-69.2-76.3000109.6H228 H232H228-H230 VanDerWaalsContact C-N 3.34Å; H228-H230 PolarHBondContact O-N 3.19Å; H230-H232 PolarHBondContact O-N 2.63Å
231S31.3Very low40.7Very low115 Ų115134.2 Ų134.280%0.80475%0.745SS**  trans-80.9105.6156.955.50000108.3G229 F233G229-S231 PolarHBondContact O-N 2.77Å; G229-S231 VanDerWaalsContact O-N 3.09Å; S231-F233 PolarHBondContact O-N 2.99Å
232H35.8Very low38Very low166 Ų166131.8 Ų131.877%0.76974%0.739SS**  trans-50.7114.7169.5-95-93.8000111.4H230H230-H232 PolarHBondContact O-N 2.63Å
233F28.9Very low35.5Very low209 Ų209129.8 Ų129.892%0.91774%0.744SS**  trans-159.191141.8-101.2-75000108.3S231S231-F233 PolarHBondContact O-N 2.99Å
234T29.5Very low33.9Very low124 Ų124133.9 Ų133.976%0.76176%0.756SS**  trans-106.4122164.645.10000108.2
235P34.5Very low32.5Very low124 Ų124135.8 Ų135.881%0.80576%0.763SS**  trans-76141.7155.40.717.7000108.8
236A30.6Very low31.3Very low98 Ų98140.7 Ų140.781%0.8177%0.774SS**  trans-65.4129.2-174.500000114.5
237D32.8Very low30.6Very low138 Ų138135.9 Ų135.974%0.73877%0.768SS**  trans19.4115142.3-64.9-23.6000121.4
238T28.4Very low29.9Very low128 Ų128135.6 Ų135.679%0.78577%0.772SS**  90.5160.599.361.50000115.7
239P35.1Very low29.3Very low108 Ų108132.9 Ų132.970%0.70178%0.775SS**  cis-138.1148.915.535.1-12.6000119.8
240Q26.5Very low29Very low174 Ų174140.5 Ų140.581%0.81378%0.781SS**  55.7120.5126.6-156.41730.800121.8
241E24.1Very low28.4Very low163 Ų163140 Ų14076%0.76279%0.789SS**  -179.1131114.2-100.1-162.5140.400115.6
242N27.2Very low28.1Very low113 Ų113143.8 Ų143.860%0.60479%0.791SS**  trans68.9103.7136.7-55.8-14.7000123.9
243S26.2Very low27.5Very low103 Ų103139.3 Ų139.372%0.7279%0.79SS**  22135.8126.863.40000121.6
244V27.4Very low27.3Very low143 Ų143136.8 Ų136.887%0.86779%0.786SS**  -173.5140.2118.4159.80000110.7
245Q26.6Very low27.1Very low166 Ų166135.7 Ų135.778%0.77678%0.783SS**  trans-74151.2175.5-70.3166.5-37.600113.4
246N25.7Very low26.9Very low165 Ų165136.4 Ų136.488%0.88279%0.785SS**  -179.2148.2121.3-93.4-21.7000112.3
247G25.1Very low26.6Very low60 Ų60137.4 Ų137.462%0.61978%0.781SS**  trans-86.8170.3-177.600000114.8
248D26.5Very low26.4Very low173 Ų173138.7 Ų138.793%0.92579%0.787SS**  173.5138.5123.9-80.2-17.3000113.3
249A25.9Very low26.5Very low88 Ų88138.3 Ų138.373%0.72779%0.785SS**  trans25120.8156.900000125.8
250W22.4Very low26.3Very low234 Ų234139.9 Ų139.989%0.88679%0.787SS**  trans41.2113.8130.9-69.278.6000123
251V25.3Very low26.5Very low148 Ų148138.4 Ų138.490%0.89779%0.79SS**  trans-143.6135140.1178.90000110.1
252K24.6Very low26.6Very low194 Ų194134.9 Ų134.984%0.84379%0.788SS**  trans-78144.9175.3-99.8178.2171.4178.50112.1
253G24.3Very low26.6Very low72 Ų72136 Ų13674%0.74280%0.8SS**  trans142.5112.2149.800000116.8
254D24.6Very low26.7Very low157 Ų157139.1 Ų139.184%0.8481%0.806SS**  trans75.5109.9149.7-66.5-5.6000123.8
255S25.2Very low26.6Very low101 Ų101137.3 Ų137.371%0.70680%0.8SS**  trans52.8121130.964.30000122.6
256V30.9Very low26.7Very low139 Ų139135.8 Ų135.884%0.84280%0.802SS**  trans65.8100150.6-171.10000116.6
257V23.7Very low26.6Very low119 Ų119136 Ų13672%0.72180%0.803SS**  trans-139.5113.5162.2177.80000108.6
258L28.6Very low26.8Very low164 Ų164142.1 Ų142.186%0.85981%0.813SS**  trans-95.498.2151-164.874000106.1
259T30.7Very low26.6Very low121 Ų121141.1 Ų141.174%0.74281%0.807SS**  trans40.4120.1156.9-7.10000121.4
260N31.6Very low26.6Very low140 Ų140141.8 Ų141.875%0.74981%0.807SS**  trans-80167.7170.7-76.3-27.8000114.2
261V29.7Very low26.8Very low144 Ų144138.7 Ų138.787%0.87381%0.807SS**  158.9135.9125.21620000107.9
262A26.7Very low26.9Very low89 Ų89136.3 Ų136.374%0.73680%0.803SS**  cis-153.9155.31.500000110
263T28.3Very low26.9Very low137 Ų137134.2 Ų134.284%0.8481%0.806SS**  trans-68.8140.816320.90000111.8
264I27.3Very low26.9Very low168 Ų168139 Ų13986%0.86281%0.809SS**  trans-123.7133.1147.5-66.8-177.9000109.3
265S25Very low27.3Very low105 Ų105136.7 Ų136.773%0.73480%0.802SS**  trans-59.3149.2-176.2-19.70000114.5
266T29.4Very low27.3Very low134 Ų134140.9 Ų140.982%0.82281%0.811SS**  trans-51134.6154.127.80000112.5
267D23Very low27.3Very low168 Ų168143.1 Ų143.190%0.89881%0.812SS**  trans-141.2140.4141.3-117.9-22.8000112.3
268K29Very low27.3Very low189 Ų189144.9 Ų144.982%0.82282%0.817SS**  trans-78.8140.5-172.3-66.4169.1173.6172.80111.2
269N23.7Very low27.2Very low152 Ų152141 Ų14181%0.81381%0.808SS**  166.9149.7112.3-102.3-4.3000112.6
270S24.4Very low27.1Very low102 Ų102144.8 Ų144.871%0.71382%0.818SS**  trans99.3106.4147.571.70000119.4
271L27.5Very low27Very low170 Ų170143.5 Ų143.589%0.8982%0.815SS**  trans95.6108.7133.5-63.3161000118.3
272A26.5Very low27.1Very low98 Ų98142 Ų14281%0.8181%0.811SS**  trans-61.4139.4168.500000112.5
273V25.6Very low27.6Very low149 Ų149144.1 Ų144.190%0.90381%0.806SS**  trans-141.2121.7143.6179.50000106.6
274E24.1Very low28.1Very low173 Ų173144.1 Ų144.181%0.80881%0.805SS**  trans-94.7179.6175.3-144.7-167.317800109.6
275P33Very low28.6Very low108 Ų108140.7 Ų140.770%0.70179%0.787SS**  -98.1152.9-97.235.9-22.6000112.5
276Q24.2Very low29.7Very low190 Ų190139.3 Ų139.389%0.88878%0.776SS**  trans-122.9111.4163.7-137.1170.5-22.600109.7D278Q276-D278 PolarHBondContact O-N 3.24Å
277Q30.5Very low30.9Very low186 Ų186139.9 Ų139.987%0.86977%0.769SS**  trans-52.3126.1168-79.5160.3-35.700109.4
278D24.1Very low32.3Very low156 Ų156139.1 Ų139.183%0.83475%0.753SS**  trans-140.1123.6150.3-95-38000110.6Q276Q276-D278 PolarHBondContact O-N 3.24Å
279A27.8Very low33.6Very low81 Ų81132 Ų13267%0.66972%0.724SS**  trans48.5104159.400000118.2V281A279-V281 VanDerWaalsContact C-N 3.27Å; A279-V281 PolarHBondContact O-N 3.16Å
280Q28.5Very low34.6Very low202 Ų202135.1 Ų135.194%0.94473%0.725SS**  trans-52.493.6145.3-71.2-176.2-46.600109.7
281V28.4Very low36.1Very low113 Ų113132 Ų13269%0.68571%0.709SS**  trans-87.1112.6152.9-178.80000105.2A279 E283A279-V281 VanDerWaalsContact C-N 3.27Å; A279-V281 PolarHBondContact O-N 3.16Å; V281-E283 PolarHBondContact O-N 2.88Å
282S31.6Very low37.3Very low113 Ų113131.4 Ų131.479%0.7970%0.699SS**  trans-6477.6167.3-1730000107.9V284S282-V284 PolarHBondContact O-N 3.22Å; S282-V284 VanDerWaalsContact O-N 3.1Å
283E38.2Very low38.6Very low133 Ų133136.7 Ų136.762%0.62170%0.698SS**  trans-77.4101.2-179.8-154.2176-162.300106.8V281 M285V281-E283 PolarHBondContact O-N 2.88Å; E283-M285 HydrophobicContact CG-CB 4.13Å; E283-M285 PolarHBondContact O-N 2.98Å; E283-M285 VanDerWaalsContact OE2-CE 3.24Å; E283-M285 WeakPolarHBondContact OE2-CE 3.37Å
284V37.8Very low40.3Very low136 Ų136132.5 Ų132.582%0.82467%0.67SS**  trans-66.469.8160.8-177.30000106.4S282 C286S282-V284 PolarHBondContact O-N 3.22Å; S282-V284 VanDerWaalsContact O-N 3.1Å; V284-C286 PolarHBondContact O-N 2.94Å
285M38.7Very low41.8Very low97 Ų97130.4 Ų130.448%0.47867%0.669SS.*  trans-79115177.2-171.7128.959.700106.7E283 H287 L289E283-M285 HydrophobicContact CG-CB 4.13Å; E283-M285 PolarHBondContact O-N 2.98Å; E283-M285 VanDerWaalsContact OE2-CE 3.24Å; E283-M285 WeakPolarHBondContact OE2-CE 3.37Å; M285-H287 PolarHBondContact O-N 3.22Å; M285-L289 HydrophobicContact CG-CB 3.79Å; M285-L289 HydrophobicContact CG-CD1 4.18Å; M285-L289 HydrophobicContact SD-CB 4.18Å; M285-L289 HydrophobicContact SD-CD1 4.45Å
286C47.8Very low43.1Very low75 Ų75128.7 Ų128.751%0.50766%0.66SS.*  trans-48.7137.2176.2-78.50000110.2V284 W288 L289V284-C286 PolarHBondContact O-N 2.94Å; C286-W288 PolarHBondContact O-N 3.41Å; C286-L289 HydrophobicContact CB-CD1 4.45Å; C286-L289 PolarHBondContact O-N 3.12Å
287H55.3Low45.2Very low146 Ų146120.5 Ų120.568%0.67662%0.622SS**G310 helixtrans-50.2-29178.7-178.771.2000113.2M285 L289 R290M285-H287 PolarHBondContact O-N 3.22Å; H287-L289 VanDerWaalsContact C-N 3.35Å; H287-L289 PolarHBondContact O-N 2.93Å; H287-R290 VanDerWaalsContact O-CB 3.27Å; H287-R290 WeakPolarHBondContact O-CB 3.4Å; H287-R290 PolarHBondContact O-N 3.21Å
288W51.5Low47.3Very low152 Ų152117.7 Ų117.758%0.57661%0.607SS**G310 helixtrans-68.3-23.6177.9-62.393.1000115C286 R290 P360C286-W288 PolarHBondContact O-N 3.41Å; W288-R290 VanDerWaalsContact C-N 3.27Å; W288-R290 PolarHBondContact O-N 3.27Å; W288-P360 HydrophobicContact CE3-CB 4.09Å; W288-P360 HydrophobicContact CZ3-CB 4.49Å
289L56.4Low50Low40 Ų40115.9 Ų115.921%0.20960%0.602CS.*G310 helixtrans-87.26.5177.6-67.2170.6000112.8M285 C286 H287 G291 I294M285-L289 HydrophobicContact CG-CB 3.79Å; M285-L289 HydrophobicContact CG-CD1 4.18Å; M285-L289 HydrophobicContact SD-CB 4.18Å; M285-L289 HydrophobicContact SD-CD1 4.45Å; C286-L289 HydrophobicContact CB-CD1 4.45Å; C286-L289 PolarHBondContact O-N 3.12Å; H287-L289 VanDerWaalsContact C-N 3.35Å; H287-L289 PolarHBondContact O-N 2.93Å; L289-G291 VanDerWaalsContact C-N 3.28Å; L289-G291 PolarHBondContact O-N 3.33Å; L289-I294 HydrophobicContact CD2-CD1 4.11Å
290R44.4Very low52.3Low217 Ų217115.7 Ų115.782%0.81959%0.592SS**  trans-76.476.9179.7-160.3176.3-177.71731.3110.9H287 W288H287-R290 VanDerWaalsContact O-CB 3.27Å; H287-R290 WeakPolarHBondContact O-CB 3.4Å; H287-R290 PolarHBondContact O-N 3.21Å; W288-R290 VanDerWaalsContact C-N 3.27Å; W288-R290 PolarHBondContact O-N 3.27Å
291G57.1Low54.6Low38 Ų38106.1 Ų106.139%0.39255%0.548SS..SBendtrans-150.7-172.5175.100000111.6L289 R293L289-G291 VanDerWaalsContact C-N 3.28Å; L289-G291 PolarHBondContact O-N 3.33Å; G291-R293 PolarHBondContact O-N 3.23Å
292K51.7Low57.3Low157 Ų157106.2 Ų106.268%0.68354%0.536SS*.SBendtrans-44.7138.9174.2-107.7-179.7177.7178.50109.9I294 Q361K292-I294 PolarHBondContact O-N 3.39Å; K292-Q361 PolarHBondContact O-NE2 3.35Å
293R54.8Low59.8Low209 Ų209107 Ų10779%0.78953%0.528SS*.  trans-47.5127.5177.6-91.2-167.5-93.8-178.3-6.1109.4G291 T295 S296G291-R293 PolarHBondContact O-N 3.23Å; R293-T295 PolarHBondContact O-N 3.25Å; R293-S296 PolarHBondContact O-N 2.02Å; R293-S296 PolarHBondContact O-OG 2.87Å
294I59.8Low62Low61 Ų61102 Ų10231%0.31351%0.505SS..G310 helixtrans-51.5-26.1179.8-61.7169.3000111.5L289 K292 S296 I297 W302L289-I294 HydrophobicContact CD2-CD1 4.11Å; K292-I294 PolarHBondContact O-N 3.39Å; I294-S296 PolarHBondContact O-N 3.07Å; I294-I297 HydrophobicContact CB-CD1 4.5Å; I294-I297 HydrophobicContact CG2-CD1 4.26Å; I294-I297 PolarHBondContact O-N 2.98Å; I294-W302 HydrophobicContact CG2-CH2 4.17Å; I294-W302 HydrophobicContact CG2-CZ2 3.54Å
295T57Low64.2Low129 Ų12996.4 Ų96.479%0.79147%0.473SS*.G310 helixtrans-67.3-6.7175.655.40000115.5R293R293-T295 PolarHBondContact O-N 3.25Å
296S59.2Low66.7Low72 Ų7297.4 Ų97.450%0.50348%0.479SS..G310 helixtrans-1053.6178.365.20000114.6R293 I294R293-S296 PolarHBondContact O-N 2.02Å; R293-S296 PolarHBondContact O-OG 2.87Å; I294-S296 PolarHBondContact O-N 3.07Å
297I69.4Low68.6Low18 Ų1897.6 Ų97.69%0.09248%0.482CS..SBendtrans-81138.2-178.2-59.9172.9000109.5I294 A301 M357I294-I297 HydrophobicContact CB-CD1 4.5Å; I294-I297 HydrophobicContact CG2-CD1 4.26Å; I294-I297 PolarHBondContact O-N 2.98Å; I297-A301 HydrophobicContact CG2-CB 3.58Å; I297-M357 HydrophobicContact CD1-CE 3.8Å; I297-M357 HydrophobicContact CD1-CG 4.03Å; I297-M357 HydrophobicContact CG1-CG 4.48Å; I297-M357 HydrophobicContact CG2-CE 4.15Å; I297-M357 HydrophobicContact CG2-CG 4.33Å
298K74.1Confident70.2Confident126 Ų12690.8 Ų90.855%0.54845%0.45SS..  trans-60.8138.2178.2-64.1179.5-176.2169.70110.6V300 A301 A355K298-V300 PolarHBondContact O-N 3.27Å; K298-A301 WeakPolarHBondContact O-CB 3.31Å; K298-A301 PolarHBondContact O-N 3.34Å; K298-A355 HydrophobicContact CB-CB 4.48Å
299T80.8Confident72.2Confident118 Ų11884.9 Ų84.972%0.72443%0.434SS*.Hα-helixtrans-50.4-30.5176.2-50.70000113.2A301 W302 M303T299-A301 VanDerWaalsContact C-N 3.29Å; T299-A301 PolarHBondContact O-N 3.42Å; T299-W302 PolarHBondContact O-N 3.39Å; T299-M303 PolarHBondContact O-N 3.18Å; T299-M303 VanDerWaalsContact O-N 3.15Å
300V75.9Confident73.9Confident78 Ų7886.6 Ų86.647%0.47345%0.446SS..Hα-helixtrans-56.5-38.7176.4-178.80000112.4K298 W302 M303 I304K298-V300 PolarHBondContact O-N 3.27Å; V300-W302 VanDerWaalsContact C-N 3.33Å; V300-W302 PolarHBondContact O-N 3.22Å; V300-M303 PolarHBondContact O-N 3.4Å; V300-I304 HydrophobicContact CG1-CD1 3.76Å; V300-I304 HydrophobicContact CG1-CG1 4.41Å; V300-I304 VanDerWaalsContact O-CG1 3.3Å; V300-I304 WeakPolarHBondContact O-CG1 3.15Å; V300-I304 PolarHBondContact O-N 2.93Å
301A78Confident76.1Confident1 Ų177 Ų771%0.00841%0.41CS..Hα-helixtrans-66.3-34.9179.500000112.7I297 K298 T299 S305 L352 A355 M357I297-A301 HydrophobicContact CG2-CB 3.58Å; K298-A301 WeakPolarHBondContact O-CB 3.31Å; K298-A301 PolarHBondContact O-N 3.34Å; T299-A301 VanDerWaalsContact C-N 3.29Å; T299-A301 PolarHBondContact O-N 3.42Å; A301-S305 WeakPolarHBondContact O-CB 3.38Å; A301-S305 PolarHBondContact O-N 3.03Å; A301-L352 HydrophobicContact CB-CD2 3.68Å; A301-A355 HydrophobicContact CB-CB 3.94Å; A301-M357 HydrophobicContact CB-CE 4.38Å
302W83.6Confident77.9Confident114 Ų11475.1 Ų75.143%0.43239%0.391SS..Hα-helixtrans-71.6-38.7176-70.7112.8000112.3I294 T299 V300 L306 F365I294-W302 HydrophobicContact CG2-CH2 4.17Å; I294-W302 HydrophobicContact CG2-CZ2 3.54Å; T299-W302 PolarHBondContact O-N 3.39Å; V300-W302 VanDerWaalsContact C-N 3.33Å; V300-W302 PolarHBondContact O-N 3.22Å; W302-L306 WeakPolarHBondContact O-CB 3.36Å; W302-L306 PolarHBondContact O-N 3Å; W302-F365 AromaticContact CH2-CE1 3.61Å; W302-F365 HydrophobicContact CH2-CE1 3.61Å; W302-F365 AromaticContact CH2-CZ 3.67Å; W302-F365 HydrophobicContact CH2-CZ 3.67Å; W302-F365 HydrophobicContact CZ2-CZ 4.45Å; W302-F365 HydrophobicContact CZ3-CD1 4.34Å; W302-F365 AromaticContact CZ3-CE1 3.52Å; W302-F365 HydrophobicContact CZ3-CE1 3.52Å; W302-F365 HydrophobicContact CZ3-CZ 4.07Å
303M85.3Confident79.9Confident130 Ų13070.8 Ų70.864%0.6437%0.372SS*.Hα-helixtrans-62.7-45.3175.9-171.6-174.680.500111T299 V300 L306 S307T299-M303 PolarHBondContact O-N 3.18Å; T299-M303 VanDerWaalsContact O-N 3.15Å; V300-M303 PolarHBondContact O-N 3.4Å; M303-L306 PolarHBondContact O-N 3.5Å; M303-S307 WeakPolarHBondContact O-CB 3.4Å; M303-S307 PolarHBondContact O-N 2.97Å
304I82.8Confident81.8Confident27 Ų2762.1 Ų62.114%0.13834%0.342CS..Hα-helixtrans-63.4-53.4178.4-67.9167.6000110.4V300 L306 S307 D308 D348 I351V300-I304 HydrophobicContact CG1-CD1 3.76Å; V300-I304 HydrophobicContact CG1-CG1 4.41Å; V300-I304 VanDerWaalsContact O-CG1 3.3Å; V300-I304 WeakPolarHBondContact O-CG1 3.15Å; V300-I304 PolarHBondContact O-N 2.93Å; I304-L306 VanDerWaalsContact C-N 3.26Å; I304-L306 PolarHBondContact O-N 3.42Å; I304-S307 WeakPolarHBondContact O-CB 3.2Å; I304-S307 PolarHBondContact O-N 3.31Å; I304-D308 WeakPolarHBondContact O-CB 3.22Å; I304-D308 PolarHBondContact O-N 3.48Å; I304-D348 HydrophobicContact CG2-CB 4.4Å; I304-D348 WeakPolarHBondContact CG2-OD1 3.05Å; I304-D348 WeakPolarHBondContact CG2-OD2 3.49Å; I304-I351 HydrophobicContact CD1-CB 4.28Å; I304-I351 HydrophobicContact CD1-CD1 4.48Å; I304-I351 HydrophobicContact CD1-CG2 3.37Å
305S85.3Confident83.5Confident19 Ų1959.2 Ų59.213%0.13333%0.327CS..Hα-helixtrans-60.5-33.3-179.1178.80000113.4A301 A309A301-S305 WeakPolarHBondContact O-CB 3.38Å; A301-S305 PolarHBondContact O-N 3.03Å; S305-A309 WeakPolarHBondContact O-CB 3Å; S305-A309 PolarHBondContact O-N 3.23Å
306L90.1Very high85.4Confident118 Ų11853.1 Ų53.162%0.61829%0.289SS*.Hα-helixtrans-72.9-41.2174.4-179.865000112.1W302 M303 I304 D308 A309 V310W302-L306 WeakPolarHBondContact O-CB 3.36Å; W302-L306 PolarHBondContact O-N 3Å; M303-L306 PolarHBondContact O-N 3.5Å; I304-L306 VanDerWaalsContact C-N 3.26Å; I304-L306 PolarHBondContact O-N 3.42Å; L306-D308 VanDerWaalsContact C-N 3.35Å; L306-A309 PolarHBondContact O-N 3.27Å; L306-V310 WeakPolarHBondContact O-CG2 3.31Å; L306-V310 PolarHBondContact O-N 3.44Å; L306-V310 VanDerWaalsContact O-N 3.13Å
307S88.5Confident87.1Confident80 Ų8050.9 Ų50.956%0.55927%0.271SS*.Hα-helixtrans-60.4-48.6176.9-1700000110.3M303 I304 A309 V310 H311M303-S307 WeakPolarHBondContact O-CB 3.4Å; M303-S307 PolarHBondContact O-N 2.97Å; I304-S307 WeakPolarHBondContact O-CB 3.2Å; I304-S307 PolarHBondContact O-N 3.31Å; S307-A309 VanDerWaalsContact C-N 3.31Å; S307-A309 PolarHBondContact O-N 3.28Å; S307-V310 PolarHBondContact O-N 2.89Å; S307-V310 VanDerWaalsContact O-N 3.11Å; S307-H311 WeakPolarHBondContact O-CB 3.42Å; S307-H311 PolarHBondContact O-N 3.46Å
308D89.1Confident88.4Confident3 Ų350 Ų502%0.01627%0.267CS..Hα-helixtrans-58.5-41.1174.8-172.652.1000110.8I304 L306 V310 H311 N312 H344 S369I304-D308 WeakPolarHBondContact O-CB 3.22Å; I304-D308 PolarHBondContact O-N 3.48Å; L306-D308 VanDerWaalsContact C-N 3.35Å; D308-V310 VanDerWaalsContact C-N 3.29Å; D308-V310 PolarHBondContact O-N 3Å; D308-H311 PolarHBondContact O-CD2 2.94Å; D308-H311 PolarHBondContact O-N 3.17Å; D308-H311 IonicContact OD1-CD2 3.46Å; D308-H311 PolarHBondContact OD1-CD2 2.99Å; D308-H311 IonicContact OD1-CE1 2.59Å; D308-H311 IonicContact OD1-NE2 3.4Å; D308-H311 PolarHBondContact OD1-NE2 3Å; D308-H311 VanDerWaalsContact OD1-NE2 3.09Å; D308-N312 WeakPolarHBondContact O-CB 2.95Å; D308-N312 PolarHBondContact O-N 2.99Å; D308-N312 PolarHBondContact O-ND2 3.37Å; D308-N312 PolarHBondContact OD1-ND2 3.26Å; D308-N312 PolarHBondContact OD2-ND2 3.39Å; D308-H344 IonicContact OD1-CE1 3.59Å; D308-H344 PolarHBondContact OD1-CE1 3.14Å; D308-H344 IonicContact OD1-ND1 2.87Å; D308-H344 PolarHBondContact OD1-ND1 3.33Å; D308-S369 WeakPolarHBondContact CB-OG 2.93Å; D308-S369 PolarHBondContact O-OG 3.02Å; D308-S369 WeakPolarHBondContact OD2-CB 3.43Å; D308-S369 PolarHBondContact OD2-OG 3.28Å
309A92.1Very high89.4Confident27 Ų2744 Ų4422%0.22324%0.241CC..Hα-helixtrans-65.7-31.3177.300000113.4S305 L306 S307 F313 S369 S372S305-A309 WeakPolarHBondContact O-CB 3Å; S305-A309 PolarHBondContact O-N 3.23Å; L306-A309 PolarHBondContact O-N 3.27Å; S307-A309 VanDerWaalsContact C-N 3.31Å; S307-A309 PolarHBondContact O-N 3.28Å; A309-F313 WeakPolarHBondContact O-CB 3.39Å; A309-F313 PolarHBondContact O-N 2.93Å; A309-S369 WeakPolarHBondContact CA-OG 3.47Å; A309-S369 PolarHBondContact N-OG 3.24Å; A309-S372 WeakPolarHBondContact O-CB 3.49Å; A309-S372 PolarHBondContact O-OG 2.96Å
310V92.3Very high90Very high77 Ų7738.4 Ų38.447%0.46721%0.206SC..Hα-helixtrans-75-38.3176.5171.90000111.1L306 S307 D308 I314L306-V310 WeakPolarHBondContact O-CG2 3.31Å; L306-V310 PolarHBondContact O-N 3.44Å; L306-V310 VanDerWaalsContact O-N 3.13Å; S307-V310 PolarHBondContact O-N 2.89Å; S307-V310 VanDerWaalsContact O-N 3.11Å; D308-V310 VanDerWaalsContact C-N 3.29Å; D308-V310 PolarHBondContact O-N 3Å; V310-I314 HydrophobicContact CG1-CD1 4.3Å; V310-I314 WeakPolarHBondContact O-CG1 3.27Å; V310-I314 PolarHBondContact O-N 3.11Å
311H91.8Very high90.8Very high14 Ų1434.7 Ų34.77%0.06518%0.184CC..Hα-helixtrans-60.6-51.4176.4123.9127.9000110.8S307 D308 F313 I314 D315 E341 H344S307-H311 WeakPolarHBondContact O-CB 3.42Å; S307-H311 PolarHBondContact O-N 3.46Å; D308-H311 PolarHBondContact O-CD2 2.94Å; D308-H311 PolarHBondContact O-N 3.17Å; D308-H311 IonicContact OD1-CD2 3.46Å; D308-H311 PolarHBondContact OD1-CD2 2.99Å; D308-H311 IonicContact OD1-CE1 2.59Å; D308-H311 IonicContact OD1-NE2 3.4Å; D308-H311 PolarHBondContact OD1-NE2 3Å; D308-H311 VanDerWaalsContact OD1-NE2 3.09Å; H311-F313 VanDerWaalsContact C-N 3.28Å; H311-F313 PolarHBondContact O-N 2.91Å; H311-I314 WeakPolarHBondContact O-CA 3.2Å; H311-I314 PolarHBondContact O-N 3.26Å; H311-D315 IonicContact NE2-OD2 3.59Å; H311-D315 PolarHBondContact O-N 3.05Å; H311-E341 IonicContact CE1-OE1 2.69Å; H311-E341 PolarHBondContact CE1-OE1 3.01Å; H311-E341 IonicContact CE1-OE2 3.81Å; H311-E341 IonicContact ND1-OE1 3.95Å; H311-E341 VanDerWaalsContact NE2-CD 3.31Å; H311-E341 IonicContact NE2-OE1 3.97Å; H311-E341 PolarHBondContact NE2-OE1 3.16Å; H311-E341 IonicContact NE2-OE2 3.89Å; H311-E341 PolarHBondContact NE2-OE2 3.23Å; H311-H344 AromaticContact CE1-CE1 3.61Å; H311-H344 AromaticContact CE1-CG 3.98Å; H311-H344 AromaticContact CE1-ND1 3.36Å; H311-H344 PolarHBondContact CE1-ND1 3.09Å; H311-H344 AromaticContact ND1-CE1 3.92Å; H311-H344 AromaticContact NE2-ND1 3.7Å
312N93.6Very high91.4Very high0 Ų034.7 Ų34.70%018%0.184CC..Hα-helixtrans-65-36.5-177.4-90.1-48000110.6D308 I314 D315 G316 E341 S369 S372 C373D308-N312 WeakPolarHBondContact O-CB 2.95Å; D308-N312 PolarHBondContact O-N 2.99Å; D308-N312 PolarHBondContact O-ND2 3.37Å; D308-N312 PolarHBondContact OD1-ND2 3.26Å; D308-N312 PolarHBondContact OD2-ND2 3.39Å; N312-I314 VanDerWaalsContact C-N 3.34Å; N312-D315 PolarHBondContact O-N 2.94Å; N312-G316 PolarHBondContact O-N 2.94Å; N312-E341 PolarHBondContact OD1-OE2 2.91Å; N312-S369 PolarHBondContact ND2-OG 3.4Å; N312-S372 WeakPolarHBondContact CB-OG 3.45Å; N312-C373 HydrophobicContact CB-CB 4.21Å; N312-C373 WeakPolarHBondContact O-CA 3.47Å; N312-C373 VanDerWaalsContact O-CB 3.3Å; N312-C373 WeakPolarHBondContact O-CB 3.42Å
313F95.6Very high91.8Very high65 Ų6529.4 Ų29.429%0.28516%0.164SC..Hα-helixtrans-60.5-42.4172.8173.7-97000112.2A309 H311 G316 L317 S372 V375 G376 F379A309-F313 WeakPolarHBondContact O-CB 3.39Å; A309-F313 PolarHBondContact O-N 2.93Å; H311-F313 VanDerWaalsContact C-N 3.28Å; H311-F313 PolarHBondContact O-N 2.91Å; F313-G316 PolarHBondContact O-N 2.86Å; F313-L317 WeakPolarHBondContact O-CB 3.18Å; F313-L317 PolarHBondContact O-N 3.41Å; F313-S372 PolarHBondContact N-OG 3.17Å; F313-V375 HydrophobicContact CD2-CB 4.37Å; F313-V375 HydrophobicContact CD2-CG1 4.34Å; F313-V375 HydrophobicContact CE2-CG1 4.11Å; F313-G376 WeakPolarHBondContact O-CA 3.03Å; F313-F379 HydrophobicContact CE2-CD2 4.14Å
314I94.4Very high91.9Very high28 Ų2825.2 Ų25.214%0.14415%0.146CC..Hα-helixtrans-72.4-36.1-179.9-68.2170.9000110.7V310 H311 N312 G316 L317 V318 M399V310-I314 HydrophobicContact CG1-CD1 4.3Å; V310-I314 WeakPolarHBondContact O-CG1 3.27Å; V310-I314 PolarHBondContact O-N 3.11Å; H311-I314 WeakPolarHBondContact O-CA 3.2Å; H311-I314 PolarHBondContact O-N 3.26Å; N312-I314 VanDerWaalsContact C-N 3.34Å; I314-G316 VanDerWaalsContact C-N 3.35Å; I314-G316 PolarHBondContact O-N 3.04Å; I314-L317 WeakPolarHBondContact O-CB 2.97Å; I314-L317 PolarHBondContact O-N 3.2Å; I314-V318 HydrophobicContact CG2-CG2 4.25Å; I314-V318 WeakPolarHBondContact O-CB 3.44Å; I314-V318 WeakPolarHBondContact O-CG2 3.36Å; I314-V318 PolarHBondContact O-N 3.12Å; I314-M399 HydrophobicContact CB-CE 3.96Å; I314-M399 HydrophobicContact CB-SD 3.67Å; I314-M399 HydrophobicContact CD1-CE 3.22Å; I314-M399 HydrophobicContact CD1-SD 4.06Å; I314-M399 HydrophobicContact CG1-CE 4.1Å; I314-M399 HydrophobicContact CG1-SD 4.43Å; I314-M399 HydrophobicContact CG2-CE 4.09Å; I314-M399 HydrophobicContact CG2-SD 3.36Å; I314-M399 WeakPolarHBondContact CG2-SD 3.36Å
315D95.1Very high91.9Very high0 Ų026.6 Ų26.60%016%0.155CC..Hα-helixtrans-59.1-47.6172.6-65-26.4000111.6H311 N312 L317 V318 I319 I337 F400H311-D315 IonicContact NE2-OD2 3.59Å; H311-D315 PolarHBondContact O-N 3.05Å; N312-D315 PolarHBondContact O-N 2.94Å; D315-L317 VanDerWaalsContact C-N 3.35Å; D315-L317 PolarHBondContact O-N 3.21Å; D315-V318 PolarHBondContact O-N 3.35Å; D315-I319 WeakPolarHBondContact O-CD1 3.42Å; D315-I319 WeakPolarHBondContact O-CG1 3.44Å; D315-I319 PolarHBondContact O-N 3.04Å; D315-I337 HydrophobicContact CB-CD1 3.96Å; D315-I337 HydrophobicContact CB-CG1 4.31Å; D315-I337 HydrophobicContact CB-CG2 3.9Å; D315-F400 WeakPolarHBondContact OD1-CE1 3.41Å
316G96.1Very high91.8Very high0 Ų028 Ų280%017%0.165CC..Hα-helixtrans-57.3-47.7173.100000112.2N312 F313 I314 V318 I319 G320 C373 G376 L377N312-G316 PolarHBondContact O-N 2.94Å; F313-G316 PolarHBondContact O-N 2.86Å; I314-G316 VanDerWaalsContact C-N 3.35Å; I314-G316 PolarHBondContact O-N 3.04Å; G316-V318 PolarHBondContact O-N 3.38Å; G316-I319 PolarHBondContact O-N 3.44Å; G316-G320 PolarHBondContact O-N 2.68Å; G316-C373 VanDerWaalsContact CA-O 3.3Å; G316-C373 WeakPolarHBondContact CA-O 3.4Å; G316-C373 WeakPolarHBondContact CA-SG 3.5Å; G316-C373 PolarHBondContact N-SG 2.89Å; G316-G376 CarbonylContact O-C 3.48Å; G316-L377 WeakPolarHBondContact O-CA 3.22Å; G316-L377 PolarHBondContact O-N 2.89Å
317L95.7Very high91.5Very high25 Ų2524.1 Ų24.113%0.13115%0.146CC..Hα-helixtrans-55.4-41.8179.1-173.975.9000111.5F313 I314 D315 A321 G376 F379 G380 L383 I392F313-L317 WeakPolarHBondContact O-CB 3.18Å; F313-L317 PolarHBondContact O-N 3.41Å; I314-L317 WeakPolarHBondContact O-CB 2.97Å; I314-L317 PolarHBondContact O-N 3.2Å; D315-L317 VanDerWaalsContact C-N 3.35Å; D315-L317 PolarHBondContact O-N 3.21Å; L317-A321 WeakPolarHBondContact O-CB 3.43Å; L317-A321 PolarHBondContact O-N 3.06Å; L317-G376 VanDerWaalsContact CA-O 3.26Å; L317-G376 WeakPolarHBondContact CA-O 3.49Å; L317-G376 PolarHBondContact N-O 2.92Å; L317-F379 HydrophobicContact CD1-CB 3.85Å; L317-G380 VanDerWaalsContact O-CA 3.24Å; L317-G380 WeakPolarHBondContact O-CA 3.36Å; L317-L383 HydrophobicContact CD1-CD1 4.19Å; L317-I392 HydrophobicContact CD1-CD1 4.38Å; L317-I392 HydrophobicContact CD2-CG1 4.4Å; L317-I392 HydrophobicContact CD2-CG2 3.91Å; L317-I392 HydrophobicContact CG-CD1 4.36Å; L317-I392 HydrophobicContact CG-CG1 4.48Å; L317-I392 HydrophobicContact CG-CG2 3.8Å
318V95.5Very high91.3Very high0 Ų021.6 Ų21.60%013%0.126CC..Hα-helixtrans-77.6-38.6-176.3167.60000112.2L183 I314 D315 G316 G320 A321 S322 T333 I392 A396 F400L183-V318 HydrophobicContact CD1-CG1 4.42Å; L183-V318 HydrophobicContact CD2-CG1 4.14Å; I314-V318 HydrophobicContact CG2-CG2 4.25Å; I314-V318 WeakPolarHBondContact O-CB 3.44Å; I314-V318 WeakPolarHBondContact O-CG2 3.36Å; I314-V318 PolarHBondContact O-N 3.12Å; D315-V318 PolarHBondContact O-N 3.35Å; G316-V318 PolarHBondContact O-N 3.38Å; V318-G320 VanDerWaalsContact C-N 3.32Å; V318-A321 PolarHBondContact O-N 3.49Å; V318-S322 VanDerWaalsContact O-CB 3.23Å; V318-S322 WeakPolarHBondContact O-CB 3.21Å; V318-S322 PolarHBondContact O-N 3.42Å; V318-S322 PolarHBondContact O-OG 2.88Å; V318-T333 HydrophobicContact CG1-CG2 3.44Å; V318-T333 VanDerWaalsContact CG1-CG2 3.44Å; V318-I392 HydrophobicContact CG2-CG2 3.91Å; V318-A396 HydrophobicContact CB-CB 4.23Å; V318-A396 HydrophobicContact CG1-CB 4.11Å; V318-A396 HydrophobicContact CG2-CB 3.1Å; V318-F400 HydrophobicContact CG1-CZ 4.25Å
319I95.7Very high91.1Very high0 Ų022.6 Ų22.60%014%0.135CC..Hα-helixtrans-58.4-48.9170-69164.3000109.7A137 V138 I141 D315 G316 S322 F323 T333 I337 L377A137-I319 HydrophobicContact CB-CG2 4.4Å; V138-I319 HydrophobicContact CG2-CD1 4.12Å; V138-I319 HydrophobicContact CG2-CG2 4.44Å; I141-I319 HydrophobicContact CD1-CD1 3.31Å; D315-I319 WeakPolarHBondContact O-CD1 3.42Å; D315-I319 WeakPolarHBondContact O-CG1 3.44Å; D315-I319 PolarHBondContact O-N 3.04Å; G316-I319 PolarHBondContact O-N 3.44Å; I319-S322 PolarHBondContact O-N 2.63Å; I319-F323 HydrophobicContact CG2-CD2 3.7Å; I319-F323 HydrophobicContact CG2-CE2 3.64Å; I319-F323 VanDerWaalsContact O-CD2 3.29Å; I319-F323 WeakPolarHBondContact O-CD2 3.3Å; I319-F323 PolarHBondContact O-N 3.33Å; I319-T333 HydrophobicContact CG1-CG2 4.32Å; I319-I337 HydrophobicContact CD1-CD1 3.64Å; I319-I337 HydrophobicContact CG1-CD1 3.42Å; I319-I337 VanDerWaalsContact CG1-CD1 3.42Å; I319-L377 HydrophobicContact CB-CD1 4.38Å; I319-L377 HydrophobicContact CG2-CD1 3.84Å
320G94Very high91.1Very high0 Ų021.3 Ų21.30%012%0.124CC..Hα-helixtrans-59.1-50.7179.600000112.1G316 V318 S322 F323 T324G316-G320 PolarHBondContact O-N 2.68Å; V318-G320 VanDerWaalsContact C-N 3.32Å; G320-S322 VanDerWaalsContact C-N 3.33Å; G320-S322 PolarHBondContact O-N 3.16Å; G320-F323 PolarHBondContact O-N 3.44Å; G320-T324 WeakPolarHBondContact O-CG2 3.38Å; G320-T324 PolarHBondContact O-N 2.99Å
321A92Very high91Very high0 Ų021.4 Ų21.40%012%0.119CC..Hα-helixtrans-61.3-40176.800000112.3L317 V318 F323 T324 V325 P389 I392 F393L317-A321 WeakPolarHBondContact O-CB 3.43Å; L317-A321 PolarHBondContact O-N 3.06Å; V318-A321 PolarHBondContact O-N 3.49Å; A321-F323 PolarHBondContact O-N 3.47Å; A321-T324 PolarHBondContact O-N 3.25Å; A321-T324 VanDerWaalsContact O-N 3.16Å; A321-T324 PolarHBondContact O-OG1 2.86Å; A321-V325 PolarHBondContact O-N 3.28Å; A321-P389 HydrophobicContact CB-CB 4.1Å; A321-I392 HydrophobicContact CB-CB 4.18Å; A321-I392 HydrophobicContact CB-CD1 3.9Å; A321-I392 HydrophobicContact CB-CG2 3.82Å; A321-F393 HydrophobicContact CB-CE1 3.8Å; A321-F393 HydrophobicContact CB-CZ 4.07Å
322S91.6Very high90.9Very high1 Ų120.8 Ų20.81%0.00712%0.116CC..Hα-helixtrans-65-41.7-179.2-610000112.7V318 I319 G320 T324 V325 S326 T333 F393V318-S322 VanDerWaalsContact O-CB 3.23Å; V318-S322 WeakPolarHBondContact O-CB 3.21Å; V318-S322 PolarHBondContact O-N 3.42Å; V318-S322 PolarHBondContact O-OG 2.88Å; I319-S322 PolarHBondContact O-N 2.63Å; G320-S322 VanDerWaalsContact C-N 3.33Å; G320-S322 PolarHBondContact O-N 3.16Å; S322-T324 PolarHBondContact O-N 3.49Å; S322-V325 PolarHBondContact O-N 3.46Å; S322-V325 VanDerWaalsContact O-N 3.12Å; S322-S326 PolarHBondContact O-N 3.47Å; S322-T333 PolarHBondContact OG-OG1 3.39Å; S322-F393 WeakPolarHBondContact OG-CE1 3.24Å
323F91.1Very high90.9Very high4 Ų420.9 Ų20.92%0.01812%0.116CC..Hα-helixtrans-68.8-22.2175.8-79.7-69.9000113.2V130 Y133 A137 I319 G320 A321 V325 G330 F331V130-F323 HydrophobicContact CG1-CB 3.87Å; Y133-F323 HydrophobicContact CG-CE1 4.37Å; A137-F323 HydrophobicContact CB-CE2 4.01Å; A137-F323 HydrophobicContact CB-CZ 4.33Å; I319-F323 HydrophobicContact CG2-CD2 3.7Å; I319-F323 HydrophobicContact CG2-CE2 3.64Å; I319-F323 VanDerWaalsContact O-CD2 3.29Å; I319-F323 WeakPolarHBondContact O-CD2 3.3Å; I319-F323 PolarHBondContact O-N 3.33Å; G320-F323 PolarHBondContact O-N 3.44Å; A321-F323 PolarHBondContact O-N 3.47Å; F323-V325 VanDerWaalsContact C-N 3.31Å; F323-G330 VanDerWaalsContact CZ-C 3.44Å; F323-F331 HydrophobicContact CE1-CD2 4.36Å
324T87.3Confident90.9Very high42 Ų4218.1 Ų18.126%0.25811%0.105SC..Hα-helixtrans-73.5-22.9171.165.20000113.2V130 G320 A321 S322 I381V130-T324 HydrophobicContact CG1-CG2 4.32Å; G320-T324 WeakPolarHBondContact O-CG2 3.38Å; G320-T324 PolarHBondContact O-N 2.99Å; A321-T324 PolarHBondContact O-N 3.25Å; A321-T324 VanDerWaalsContact O-N 3.16Å; A321-T324 PolarHBondContact O-OG1 2.86Å; S322-T324 PolarHBondContact O-N 3.49Å; T324-I381 HydrophobicContact CG2-CB 4.49Å; T324-I381 HydrophobicContact CG2-CG2 4.29Å
325V82.7Confident90.8Very high56 Ų5619.1 Ų19.134%0.33911%0.112SC..Hα-helixtrans-82.6-55.7174.2174.80000110.8E186 A321 S322 F323 P389 F393E186-V325 WeakPolarHBondContact OE1-CG1 3.26Å; A321-V325 PolarHBondContact O-N 3.28Å; S322-V325 PolarHBondContact O-N 3.46Å; S322-V325 VanDerWaalsContact O-N 3.12Å; F323-V325 VanDerWaalsContact C-N 3.31Å; V325-P389 HydrophobicContact CG2-CB 4.31Å; V325-P389 HydrophobicContact CG2-CG 3.57Å; V325-F393 HydrophobicContact CG2-CE2 3.64Å; V325-F393 HydrophobicContact CG2-CZ 3.65Å
326S83.8Confident90.7Very high49 Ų4919.1 Ų19.134%0.34311%0.112SC..  trans-161.5154174.568.80000111.8S322 L328 A329 G330S322-S326 PolarHBondContact O-N 3.47Å; S326-L328 PolarHBondContact O-N 3.28Å; S326-A329 PolarHBondContact O-N 3.48Å; S326-A329 WeakPolarHBondContact OG-CB 3.48Å; S326-A329 PolarHBondContact OG-N 2.92Å; S326-G330 PolarHBondContact O-N 3.36Å
327V84.7Confident90.6Very high36 Ų3619.1 Ų19.122%0.21811%0.112CC..Hα-helixtrans-55.1-40.4174.7174.50000111.1Y133 G330 F331 L455Y133-V327 HydrophobicContact CD2-CG1 4.5Å; Y133-V327 HydrophobicContact CD2-CG2 4.38Å; Y133-V327 HydrophobicContact CE2-CG1 4.43Å; Y133-V327 HydrophobicContact CE2-CG2 4.31Å; V327-G330 PolarHBondContact O-N 3.1Å; V327-F331 HydrophobicContact CG1-CD2 3.58Å; V327-F331 HydrophobicContact CG1-CE2 3.4Å; V327-F331 WeakPolarHBondContact O-CD2 3.34Å; V327-F331 PolarHBondContact O-N 2.53Å; V327-L455 HydrophobicContact CG1-CD1 3.89Å
328L83.5Confident90.5Very high26 Ų2619.9 Ų19.914%0.13612%0.118CC..Hα-helixtrans-73.3-40.5-178.8-168.578.9000113.2S326 G330 F331 S332 I446 A450 I453S326-L328 PolarHBondContact O-N 3.28Å; L328-G330 VanDerWaalsContact C-N 3.26Å; L328-G330 PolarHBondContact O-N 3.48Å; L328-F331 PolarHBondContact O-N 3.43Å; L328-S332 WeakPolarHBondContact O-CB 3.49Å; L328-S332 PolarHBondContact O-N 3Å; L328-I446 HydrophobicContact CD1-CG2 4.12Å; L328-I446 HydrophobicContact CD2-CG2 4.15Å; L328-I446 HydrophobicContact CG-CG2 3.93Å; L328-A450 HydrophobicContact CD2-CB 3.4Å; L328-I453 HydrophobicContact CD1-CD1 4.18Å
329A84.9Confident90.3Very high24 Ų2420.7 Ų20.720%0.19812%0.124CC..Hα-helixtrans-59.4-42173.400000110.6S326 S332 T333S326-A329 PolarHBondContact O-N 3.48Å; S326-A329 WeakPolarHBondContact OG-CB 3.48Å; S326-A329 PolarHBondContact OG-N 2.92Å; A329-S332 PolarHBondContact O-N 3.09Å; A329-T333 VanDerWaalsContact O-CB 3.31Å; A329-T333 WeakPolarHBondContact O-CB 3.39Å; A329-T333 PolarHBondContact O-N 3.5Å; A329-T333 PolarHBondContact O-OG1 2.9Å; A329-T333 VanDerWaalsContact O-OG1 3.06Å
330G91.3Very high90.1Very high0 Ų020.8 Ų20.80%012%0.124CC..Hα-helixtrans-57.6-51.3172.300000113.4F323 S326 V327 L328 S332 T333 S334F323-G330 VanDerWaalsContact CZ-C 3.44Å; S326-G330 PolarHBondContact O-N 3.36Å; V327-G330 PolarHBondContact O-N 3.1Å; L328-G330 VanDerWaalsContact C-N 3.26Å; L328-G330 PolarHBondContact O-N 3.48Å; G330-S332 PolarHBondContact O-N 3Å; G330-T333 PolarHBondContact O-N 3.34Å; G330-S334 VanDerWaalsContact O-CB 3.31Å; G330-S334 WeakPolarHBondContact O-CB 3.49Å; G330-S334 PolarHBondContact O-N 3.03Å; G330-S334 PolarHBondContact O-OG 2.94Å
331F90.1Very high89.9Confident80 Ų8020.8 Ų20.835%0.35112%0.124SC..Hα-helixtrans-62.1-40.3176.8-84.5-62.4000113.3Y133 F323 V327 L328 T335 L455Y133-F331 HydrophobicContact CD1-CE2 4.43Å; Y133-F331 AromaticContact CD1-CZ 3.99Å; Y133-F331 HydrophobicContact CD1-CZ 3.99Å; Y133-F331 HydrophobicContact CE1-CZ 4.32Å; F323-F331 HydrophobicContact CE1-CD2 4.36Å; V327-F331 HydrophobicContact CG1-CD2 3.58Å; V327-F331 HydrophobicContact CG1-CE2 3.4Å; V327-F331 WeakPolarHBondContact O-CD2 3.34Å; V327-F331 PolarHBondContact O-N 2.53Å; L328-F331 PolarHBondContact O-N 3.43Å; F331-T335 WeakPolarHBondContact O-CB 3.39Å; F331-T335 PolarHBondContact O-N 3.34Å; F331-T335 PolarHBondContact O-OG1 3.44Å; F331-L455 HydrophobicContact CD2-CD1 4.49Å
332S90.1Very high89.6Confident1 Ų122.2 Ų22.21%0.00713%0.13CC..Hα-helixtrans-61.5-51.9178.1-169.60000111.4Q182 L328 A329 G330 S334 T335 A336Q182-S332 PolarHBondContact NE2-OG 3.12Å; Q182-S332 PolarHBondContact OE1-OG 3.25Å; L328-S332 WeakPolarHBondContact O-CB 3.49Å; L328-S332 PolarHBondContact O-N 3Å; A329-S332 PolarHBondContact O-N 3.09Å; G330-S332 PolarHBondContact O-N 3Å; S332-S334 PolarHBondContact O-N 3.42Å; S332-T335 WeakPolarHBondContact O-CB 3.37Å; S332-T335 PolarHBondContact O-N 3.08Å; S332-T335 VanDerWaalsContact O-N 3.13Å; S332-A336 PolarHBondContact O-N 3.03Å
333T93.3Very high89.4Confident1 Ų122.5 Ų22.51%0.00613%0.132CC..Hα-helixtrans-61.6-44.2179.3-68.30000111.3V318 I319 S322 A329 G330 T335 A336 I337V318-T333 HydrophobicContact CG1-CG2 3.44Å; V318-T333 VanDerWaalsContact CG1-CG2 3.44Å; I319-T333 HydrophobicContact CG1-CG2 4.32Å; S322-T333 PolarHBondContact OG-OG1 3.39Å; A329-T333 VanDerWaalsContact O-CB 3.31Å; A329-T333 WeakPolarHBondContact O-CB 3.39Å; A329-T333 PolarHBondContact O-N 3.5Å; A329-T333 PolarHBondContact O-OG1 2.9Å; A329-T333 VanDerWaalsContact O-OG1 3.06Å; G330-T333 PolarHBondContact O-N 3.34Å; T333-T335 VanDerWaalsContact C-N 3.3Å; T333-T335 PolarHBondContact O-N 3.4Å; T333-A336 WeakPolarHBondContact O-CB 3.08Å; T333-A336 PolarHBondContact O-N 3.48Å; T333-I337 HydrophobicContact CG2-CD1 3.81Å; T333-I337 WeakPolarHBondContact O-CG1 3.46Å; T333-I337 PolarHBondContact O-N 3.06Å
334S95.2Very high89.1Confident7 Ų723.7 Ų23.75%0.04914%0.138CC..Hα-helixtrans-63.2-35.7176-620000112.4A137 G330 S332 V338A137-S334 WeakPolarHBondContact CB-OG 3.31Å; G330-S334 VanDerWaalsContact O-CB 3.31Å; G330-S334 WeakPolarHBondContact O-CB 3.49Å; G330-S334 PolarHBondContact O-N 3.03Å; G330-S334 PolarHBondContact O-OG 2.94Å; S332-S334 PolarHBondContact O-N 3.42Å; S334-V338 WeakPolarHBondContact O-CB 3.29Å; S334-V338 WeakPolarHBondContact O-CG2 3.48Å; S334-V338 PolarHBondContact O-N 3.33Å
335T92.8Very high89.1Confident49 Ų4921.8 Ų21.830%0.30113%0.126SC..Hα-helixtrans-65.9-40.2175.5-59.40000111.1F331 S332 T333 C339 I442F331-T335 WeakPolarHBondContact O-CB 3.39Å; F331-T335 PolarHBondContact O-N 3.34Å; F331-T335 PolarHBondContact O-OG1 3.44Å; S332-T335 WeakPolarHBondContact O-CB 3.37Å; S332-T335 PolarHBondContact O-N 3.08Å; S332-T335 VanDerWaalsContact O-N 3.13Å; T333-T335 VanDerWaalsContact C-N 3.3Å; T333-T335 PolarHBondContact O-N 3.4Å; T335-C339 PolarHBondContact O-N 3.37Å; T335-C339 PolarHBondContact O-SG 2.86Å; T335-I442 HydrophobicContact CG2-CG2 4.07Å
336A93.2Very high89.2Confident0 Ų019.8 Ų19.80%011%0.113CC..Hα-helixtrans-63.1-47.1177.200000111.8N178 S332 T333 C339 E340 I443N178-A336 HydrophobicContact CB-CB 3.81Å; S332-A336 PolarHBondContact O-N 3.03Å; T333-A336 WeakPolarHBondContact O-CB 3.08Å; T333-A336 PolarHBondContact O-N 3.48Å; A336-C339 WeakPolarHBondContact O-CB 3.22Å; A336-C339 PolarHBondContact O-N 3.47Å; A336-E340 PolarHBondContact O-N 2.94Å; A336-I443 HydrophobicContact CB-CD1 4.19Å
337I94.6Very high89.1Confident0 Ų018.9 Ų18.90%011%0.112CC..Hα-helixtrans-65.8-44.2178.8-65.4160000111I141 D315 I319 T333 C339 E340 E341 F400I141-I337 HydrophobicContact CD1-CB 4.28Å; I141-I337 HydrophobicContact CD1-CG2 3.84Å; I141-I337 HydrophobicContact CG1-CG2 4.38Å; I141-I337 HydrophobicContact CG2-CG2 4.26Å; D315-I337 HydrophobicContact CB-CD1 3.96Å; D315-I337 HydrophobicContact CB-CG1 4.31Å; D315-I337 HydrophobicContact CB-CG2 3.9Å; I319-I337 HydrophobicContact CD1-CD1 3.64Å; I319-I337 HydrophobicContact CG1-CD1 3.42Å; I319-I337 VanDerWaalsContact CG1-CD1 3.42Å; T333-I337 HydrophobicContact CG2-CD1 3.81Å; T333-I337 WeakPolarHBondContact O-CG1 3.46Å; T333-I337 PolarHBondContact O-N 3.06Å; I337-C339 PolarHBondContact O-N 2.84Å; I337-C339 VanDerWaalsContact O-N 3.14Å; I337-E340 WeakPolarHBondContact O-CG 3.3Å; I337-E340 PolarHBondContact O-N 3.32Å; I337-E341 HydrophobicContact CG2-CG 3.83Å; I337-E341 WeakPolarHBondContact O-CG 3.23Å; I337-E341 PolarHBondContact O-N 3Å; I337-F400 HydrophobicContact CD1-CZ 3.9Å; I337-F400 HydrophobicContact CG1-CE2 4.15Å; I337-F400 HydrophobicContact CG1-CZ 3.59Å
338V93.2Very high89.1Confident41 Ų4117.8 Ų17.825%0.24811%0.105CC..Hα-helixtrans-53.9-40174.3158.60000111.8I140 I141 S334 E340 F342I140-V338 HydrophobicContact CG2-CG2 4.36Å; I141-V338 HydrophobicContact CB-CG2 4.27Å; I141-V338 HydrophobicContact CD1-CG2 4.31Å; I141-V338 HydrophobicContact CG1-CB 4.38Å; I141-V338 HydrophobicContact CG1-CG2 3.27Å; S334-V338 WeakPolarHBondContact O-CB 3.29Å; S334-V338 WeakPolarHBondContact O-CG2 3.48Å; S334-V338 PolarHBondContact O-N 3.33Å; V338-E340 VanDerWaalsContact C-N 3.33Å; V338-F342 PolarHBondContact O-N 3Å
339C91.8Very high89.2Confident17 Ų1717.4 Ų17.412%0.11510%0.102CC..Hα-helixtrans-71.3-28.5-177.8-68.50000112.6L170 A171 T174 T335 A336 I337 P343L170-C339 HydrophobicContact CD2-CB 4.41Å; L170-C339 HydrophobicContact CG-CB 4.36Å; A171-C339 WeakPolarHBondContact CB-O 3.49Å; T174-C339 HydrophobicContact CG2-CB 4.09Å; T174-C339 WeakPolarHBondContact OG1-CB 3.49Å; T335-C339 PolarHBondContact O-N 3.37Å; T335-C339 PolarHBondContact O-SG 2.86Å; A336-C339 WeakPolarHBondContact O-CB 3.22Å; A336-C339 PolarHBondContact O-N 3.47Å; I337-C339 PolarHBondContact O-N 2.84Å; I337-C339 VanDerWaalsContact O-N 3.14Å; C339-P343 WeakPolarHBondContact O-CD 3.46Å; C339-P343 WeakPolarHBondContact O-CG 3.07Å
340E91.5Very high89Confident2 Ų219.2 Ų19.21%0.00911%0.11CC..Hα-helixtrans-86.9-38177.189.3-174.2120.400113.9A171 L175 A336 I337 V338 F342 P343 H344 I403A171-E340 HydrophobicContact CB-CB 4.07Å; L175-E340 HydrophobicContact CD1-CB 3.61Å; L175-E340 HydrophobicContact CD1-CG 4.25Å; L175-E340 WeakPolarHBondContact CD1-OE2 3.06Å; L175-E340 HydrophobicContact CD2-CB 4.01Å; L175-E340 HydrophobicContact CD2-CG 4.07Å; L175-E340 WeakPolarHBondContact CD2-OE1 3.23Å; L175-E340 WeakPolarHBondContact CD2-OE2 3.49Å; L175-E340 HydrophobicContact CG-CB 3.92Å; L175-E340 HydrophobicContact CG-CG 4.49Å; A336-E340 PolarHBondContact O-N 2.94Å; I337-E340 WeakPolarHBondContact O-CG 3.3Å; I337-E340 PolarHBondContact O-N 3.32Å; V338-E340 VanDerWaalsContact C-N 3.33Å; E340-F342 VanDerWaalsContact C-N 3.26Å; E340-F342 PolarHBondContact O-N 2.69Å; E340-P343 WeakPolarHBondContact O-CD 3.38Å; E340-P343 VanDerWaalsContact O-CG 3.23Å; E340-P343 WeakPolarHBondContact O-CG 3.32Å; E340-H344 VanDerWaalsContact O-CB 3.27Å; E340-H344 WeakPolarHBondContact O-CB 3.5Å; E340-H344 PolarHBondContact O-N 3.38Å; E340-I403 WeakPolarHBondContact OE2-CG2 3.27Å
341E89.3Confident88.6Confident0 Ų022.7 Ų22.70%013%0.128CC..Hα-helixtrans-64.3-36.5-178.5-74.4-46.810900111.3I141 H311 N312 I337 H344 E345I141-E341 HydrophobicContact CG2-CB 4.19Å; I141-E341 HydrophobicContact CG2-CG 3.7Å; H311-E341 IonicContact CE1-OE1 2.69Å; H311-E341 PolarHBondContact CE1-OE1 3.01Å; H311-E341 IonicContact CE1-OE2 3.81Å; H311-E341 IonicContact ND1-OE1 3.95Å; H311-E341 VanDerWaalsContact NE2-CD 3.31Å; H311-E341 IonicContact NE2-OE1 3.97Å; H311-E341 PolarHBondContact NE2-OE1 3.16Å; H311-E341 IonicContact NE2-OE2 3.89Å; H311-E341 PolarHBondContact NE2-OE2 3.23Å; N312-E341 PolarHBondContact OD1-OE2 2.91Å; I337-E341 HydrophobicContact CG2-CG 3.83Å; I337-E341 WeakPolarHBondContact O-CG 3.23Å; I337-E341 PolarHBondContact O-N 3Å; E341-H344 PolarHBondContact O-N 3.37Å; E341-E345 VanDerWaalsContact O-CB 3.26Å; E341-E345 WeakPolarHBondContact O-CB 3.14Å; E341-E345 WeakPolarHBondContact O-CG 3.12Å; E341-E345 PolarHBondContact O-N 2.67Å
342F86.9Confident88.3Confident30 Ų3019 Ų1913%0.13211%0.112CC..Hα-helixtrans-58.2-53.9-179.9176.4-95.3000113.6L151 F167 V338 E340 L346L151-F342 HydrophobicContact CD1-CE1 4.48Å; L151-F342 HydrophobicContact CD1-CE2 3.52Å; L151-F342 HydrophobicContact CD1-CZ 3.25Å; F167-F342 HydrophobicContact CB-CD1 4.03Å; F167-F342 HydrophobicContact CB-CE1 4.12Å; F167-F342 AromaticContact CD1-CD1 3.82Å; F167-F342 HydrophobicContact CD1-CD1 3.82Å; F167-F342 AromaticContact CD1-CE1 3.95Å; F167-F342 HydrophobicContact CD1-CE1 3.95Å; F167-F342 HydrophobicContact CD2-CD1 4.15Å; F167-F342 AromaticContact CD2-CE1 3.5Å; F167-F342 HydrophobicContact CD2-CE1 3.5Å; F167-F342 HydrophobicContact CD2-CZ 4.4Å; F167-F342 HydrophobicContact CE1-CD1 4.29Å; F167-F342 HydrophobicContact CE1-CE1 4.22Å; F167-F342 AromaticContact CE2-CE1 3.79Å; F167-F342 HydrophobicContact CE2-CE1 3.79Å; F167-F342 HydrophobicContact CE2-CZ 4.3Å; F167-F342 AromaticContact CG-CD1 3.75Å; F167-F342 HydrophobicContact CG-CD1 3.75Å; F167-F342 AromaticContact CG-CE1 3.6Å; F167-F342 HydrophobicContact CG-CE1 3.6Å; F167-F342 HydrophobicContact CZ-CE1 4.14Å; V338-F342 PolarHBondContact O-N 3Å; E340-F342 VanDerWaalsContact C-N 3.26Å; E340-F342 PolarHBondContact O-N 2.69Å; F342-L346 WeakPolarHBondContact O-CB 3.25Å; F342-L346 PolarHBondContact O-N 2.9Å
343P85.9Confident88Confident7 Ų721.6 Ų21.65%0.04513%0.125CC..Hα-helixtrans-69.7-37173.825.6-32.4000113.4L164 I168 A171 C339 E340 L346 G347L164-P343 HydrophobicContact CD1-CB 4.38Å; I168-P343 HydrophobicContact CG1-CB 3.75Å; A171-P343 HydrophobicContact CB-CG 3.93Å; C339-P343 WeakPolarHBondContact O-CD 3.46Å; C339-P343 WeakPolarHBondContact O-CG 3.07Å; E340-P343 WeakPolarHBondContact O-CD 3.38Å; E340-P343 VanDerWaalsContact O-CG 3.23Å; E340-P343 WeakPolarHBondContact O-CG 3.32Å; P343-L346 PolarHBondContact O-N 3.04Å; P343-G347 PolarHBondContact O-N 2.9Å; P343-G347 VanDerWaalsContact O-N 3.09Å
344H86.1Confident87.4Confident29 Ų2927.1 Ų27.113%0.13416%0.155CC..Hα-helixtrans-63.8-52.6-177.7-172.5-101.4000111.5D308 H311 E340 E341 L346 G347 D348 D407 M408D308-H344 IonicContact OD1-CE1 3.59Å; D308-H344 PolarHBondContact OD1-CE1 3.14Å; D308-H344 IonicContact OD1-ND1 2.87Å; D308-H344 PolarHBondContact OD1-ND1 3.33Å; H311-H344 AromaticContact CE1-CE1 3.61Å; H311-H344 AromaticContact CE1-CG 3.98Å; H311-H344 AromaticContact CE1-ND1 3.36Å; H311-H344 PolarHBondContact CE1-ND1 3.09Å; H311-H344 AromaticContact ND1-CE1 3.92Å; H311-H344 AromaticContact NE2-ND1 3.7Å; E340-H344 VanDerWaalsContact O-CB 3.27Å; E340-H344 WeakPolarHBondContact O-CB 3.5Å; E340-H344 PolarHBondContact O-N 3.38Å; E341-H344 PolarHBondContact O-N 3.37Å; H344-L346 VanDerWaalsContact C-N 3.25Å; H344-L346 PolarHBondContact O-N 3.35Å; H344-G347 WeakPolarHBondContact O-CA 3.48Å; H344-G347 PolarHBondContact O-N 2.99Å; H344-D348 IonicContact CE1-OD2 2.68Å; H344-D348 PolarHBondContact O-N 3Å; H344-D407 IonicContact CD2-OD2 3.16Å; H344-M408 HydrophobicContact CB-CE 4.36Å
345E85.8Confident86.8Confident3 Ų327.3 Ų27.31%0.01416%0.157CC..Hα-helixtrans-62.4-33.2178.8-76.6-147.3-175.400113.1S145 E341 G347 F349 N366S145-E345 VanDerWaalsContact CA-CD 3.45Å; S145-E345 WeakPolarHBondContact CA-OE2 3.49Å; S145-E345 WeakPolarHBondContact CB-OE1 3.31Å; S145-E345 WeakPolarHBondContact CB-OE2 3.39Å; S145-E345 PolarHBondContact OG-OE1 3.2Å; S145-E345 PolarHBondContact OG-OE2 3.41Å; E341-E345 VanDerWaalsContact O-CB 3.26Å; E341-E345 WeakPolarHBondContact O-CB 3.14Å; E341-E345 WeakPolarHBondContact O-CG 3.12Å; E341-E345 PolarHBondContact O-N 2.67Å; E345-G347 VanDerWaalsContact C-N 3.34Å; E345-F349 VanDerWaalsContact O-CB 3.26Å; E345-F349 WeakPolarHBondContact O-CB 3.5Å; E345-F349 PolarHBondContact O-N 3.35Å; E345-N366 PolarHBondContact OE2-ND2 2.92Å
346L84.4Confident86.2Confident13 Ų1327 Ų277%0.06816%0.164CC..Hα-helixtrans-65.9-39.7175-169.9143.2000111.3L151 F160 L164 F342 P343 H344 V350L151-L346 HydrophobicContact CB-CD1 4.46Å; F160-L346 HydrophobicContact CE1-CD2 4.2Å; F160-L346 HydrophobicContact CE2-CD1 4.23Å; F160-L346 HydrophobicContact CZ-CD1 3.71Å; F160-L346 HydrophobicContact CZ-CD2 3.77Å; F160-L346 HydrophobicContact CZ-CG 4.38Å; L164-L346 HydrophobicContact CD1-CD2 4.11Å; L164-L346 HydrophobicContact CD2-CD2 4.37Å; F342-L346 WeakPolarHBondContact O-CB 3.25Å; F342-L346 PolarHBondContact O-N 2.9Å; P343-L346 PolarHBondContact O-N 3.04Å; H344-L346 VanDerWaalsContact C-N 3.25Å; H344-L346 PolarHBondContact O-N 3.35Å; L346-V350 WeakPolarHBondContact O-CG2 3.35Å; L346-V350 PolarHBondContact O-N 3.14Å
347G82.6Confident85.8Confident30 Ų3027.5 Ų27.531%0.30917%0.166SC..Hα-helixtrans-64.3-50.8174.900000112.1P343 H344 E345 F349 V350 I351P343-G347 PolarHBondContact O-N 2.9Å; P343-G347 VanDerWaalsContact O-N 3.09Å; H344-G347 WeakPolarHBondContact O-CA 3.48Å; H344-G347 PolarHBondContact O-N 2.99Å; E345-G347 VanDerWaalsContact C-N 3.34Å; G347-F349 VanDerWaalsContact C-N 3.32Å; G347-F349 PolarHBondContact O-N 3.15Å; G347-V350 WeakPolarHBondContact O-CB 3.43Å; G347-V350 PolarHBondContact O-N 3.17Å; G347-I351 WeakPolarHBondContact O-CG1 3.25Å; G347-I351 PolarHBondContact O-N 3.32Å
348D84.5Confident85.3Confident14 Ų1429.4 Ų29.48%0.07518%0.179CC..Hα-helixtrans-58.7-43.6179.2-88.33.8000112I304 H344 V350 I351 L352I304-D348 HydrophobicContact CG2-CB 4.4Å; I304-D348 WeakPolarHBondContact CG2-OD1 3.05Å; I304-D348 WeakPolarHBondContact CG2-OD2 3.49Å; H344-D348 IonicContact CE1-OD2 2.68Å; H344-D348 PolarHBondContact O-N 3Å; D348-V350 VanDerWaalsContact C-N 3.32Å; D348-V350 PolarHBondContact O-N 3.45Å; D348-I351 PolarHBondContact O-N 3.39Å; D348-I351 VanDerWaalsContact O-N 3.15Å; D348-L352 WeakPolarHBondContact O-CB 3.27Å; D348-L352 VanDerWaalsContact O-CG 3.28Å; D348-L352 WeakPolarHBondContact O-CG 3.25Å; D348-L352 PolarHBondContact O-N 2.99Å
349F84.9Confident85Confident17 Ų1730.7 Ų30.78%0.07519%0.187CC..Hα-helixtrans-56.2-44.9174.8178.9-99.4000112.4L149 I152 E345 G347 L352 L353 V359 A362 V363L149-F349 HydrophobicContact CD1-CE2 4.21Å; L149-F349 HydrophobicContact CD1-CZ 4.07Å; I152-F349 HydrophobicContact CD1-CD1 4.32Å; I152-F349 HydrophobicContact CD1-CE1 3.29Å; I152-F349 HydrophobicContact CD1-CE2 4.5Å; I152-F349 HydrophobicContact CD1-CZ 3.4Å; I152-F349 HydrophobicContact CG1-CD1 4.5Å; I152-F349 HydrophobicContact CG1-CE1 3.76Å; I152-F349 HydrophobicContact CG1-CZ 4.36Å; E345-F349 VanDerWaalsContact O-CB 3.26Å; E345-F349 WeakPolarHBondContact O-CB 3.5Å; E345-F349 PolarHBondContact O-N 3.35Å; G347-F349 VanDerWaalsContact C-N 3.32Å; G347-F349 PolarHBondContact O-N 3.15Å; F349-L352 PolarHBondContact O-N 2.95Å; F349-L353 HydrophobicContact CD1-CD1 4.09Å; F349-L353 HydrophobicContact CE1-CD1 3.39Å; F349-L353 HydrophobicContact CE1-CG 4.14Å; F349-L353 HydrophobicContact CE2-CD1 4.45Å; F349-L353 HydrophobicContact CE2-CG 4.46Å; F349-L353 HydrophobicContact CZ-CD1 3.61Å; F349-L353 HydrophobicContact CZ-CD2 4.3Å; F349-L353 HydrophobicContact CZ-CG 4.07Å; F349-L353 WeakPolarHBondContact O-CG 3.22Å; F349-L353 PolarHBondContact O-N 3.25Å; F349-L353 VanDerWaalsContact O-N 3.13Å; F349-V359 HydrophobicContact CE2-CG1 4.41Å; F349-V359 HydrophobicContact CZ-CG1 4.07Å; F349-V359 HydrophobicContact CZ-CG2 4.37Å; F349-A362 HydrophobicContact CD2-CB 3.84Å; F349-A362 HydrophobicContact CE2-CB 3.76Å; F349-V363 HydrophobicContact CE2-CG2 3.97Å
350V81.5Confident84.6Confident63 Ų6332.6 Ų32.638%0.38220%0.2SC..Hα-helixtrans-64.9-40.8177.8171.40000111.3L346 G347 D348 L353 N354L346-V350 WeakPolarHBondContact O-CG2 3.35Å; L346-V350 PolarHBondContact O-N 3.14Å; G347-V350 WeakPolarHBondContact O-CB 3.43Å; G347-V350 PolarHBondContact O-N 3.17Å; D348-V350 VanDerWaalsContact C-N 3.32Å; D348-V350 PolarHBondContact O-N 3.45Å; V350-L353 PolarHBondContact O-N 3.27Å; V350-N354 VanDerWaalsContact O-CG 3.32Å; V350-N354 PolarHBondContact O-N 3Å; V350-N354 PolarHBondContact O-ND2 3.04Å
351I82.8Confident84.3Confident72 Ų7232.7 Ų32.737%0.36920%0.2SC..Hα-helixtrans-67.1-41.7179.2-61.9165.2000111.1I304 G347 D348 L353 N354 A355I304-I351 HydrophobicContact CD1-CB 4.28Å; I304-I351 HydrophobicContact CD1-CD1 4.48Å; I304-I351 HydrophobicContact CD1-CG2 3.37Å; G347-I351 WeakPolarHBondContact O-CG1 3.25Å; G347-I351 PolarHBondContact O-N 3.32Å; D348-I351 PolarHBondContact O-N 3.39Å; D348-I351 VanDerWaalsContact O-N 3.15Å; I351-L353 PolarHBondContact O-N 2.98Å; I351-N354 CarbonylContact O-C 3.44Å; I351-N354 PolarHBondContact O-N 3.2Å; I351-N354 VanDerWaalsContact O-N 3.17Å; I351-A355 WeakPolarHBondContact O-CB 3.31Å; I351-A355 PolarHBondContact O-N 3.48Å
352L83.3Confident84.1Confident3 Ų332.7 Ų32.72%0.01620%0.2CC..Hα-helixtrans-62.3-40.5177.3-70.1177000112.1A301 D348 F349 A355 G356 M357 A362A301-L352 HydrophobicContact CB-CD2 3.68Å; D348-L352 WeakPolarHBondContact O-CB 3.27Å; D348-L352 VanDerWaalsContact O-CG 3.28Å; D348-L352 WeakPolarHBondContact O-CG 3.25Å; D348-L352 PolarHBondContact O-N 2.99Å; F349-L352 PolarHBondContact O-N 2.95Å; L352-A355 WeakPolarHBondContact O-CB 3.4Å; L352-A355 PolarHBondContact O-N 3.37Å; L352-G356 PolarHBondContact O-N 3.13Å; L352-M357 HydrophobicContact CB-SD 3.96Å; L352-M357 HydrophobicContact CD1-SD 4.36Å; L352-M357 HydrophobicContact CD2-CE 4.32Å; L352-M357 HydrophobicContact CD2-SD 3.84Å; L352-M357 HydrophobicContact CG-SD 4.27Å; L352-M357 WeakPolarHBondContact O-CB 3.34Å; L352-M357 PolarHBondContact O-N 2.86Å; L352-A362 HydrophobicContact CB-CB 3.93Å; L352-A362 HydrophobicContact CD1-CB 4.33Å
353L83.8Confident84Confident55 Ų5532.4 Ų32.429%0.28820%0.2SC..Hα-helixtrans-62.3-44.7172.5-69.9-176.6000111.7F349 V350 I351 A355 G356 M357 V359 A362F349-L353 HydrophobicContact CD1-CD1 4.09Å; F349-L353 HydrophobicContact CE1-CD1 3.39Å; F349-L353 HydrophobicContact CE1-CG 4.14Å; F349-L353 HydrophobicContact CE2-CD1 4.45Å; F349-L353 HydrophobicContact CE2-CG 4.46Å; F349-L353 HydrophobicContact CZ-CD1 3.61Å; F349-L353 HydrophobicContact CZ-CD2 4.3Å; F349-L353 HydrophobicContact CZ-CG 4.07Å; F349-L353 WeakPolarHBondContact O-CG 3.22Å; F349-L353 PolarHBondContact O-N 3.25Å; F349-L353 VanDerWaalsContact O-N 3.13Å; V350-L353 PolarHBondContact O-N 3.27Å; I351-L353 PolarHBondContact O-N 2.98Å; L353-A355 PolarHBondContact O-N 2.91Å; L353-G356 PolarHBondContact O-N 3.07Å; L353-M357 WeakPolarHBondContact CD2-O 3.45Å; L353-V359 HydrophobicContact CD1-CG2 4.41Å; L353-V359 HydrophobicContact CD2-CB 4.5Å; L353-V359 HydrophobicContact CD2-CG2 3.85Å; L353-A362 HydrophobicContact CD2-CB 4.16Å
354N81.8Confident84Confident118 Ų11835.6 Ų35.663%0.63121%0.214SC*.Hα-helixtrans-67.3-23.4176.8-72.1-21.7000113.1V350 I351 G356V350-N354 VanDerWaalsContact O-CG 3.32Å; V350-N354 PolarHBondContact O-N 3Å; V350-N354 PolarHBondContact O-ND2 3.04Å; I351-N354 CarbonylContact O-C 3.44Å; I351-N354 PolarHBondContact O-N 3.2Å; I351-N354 VanDerWaalsContact O-N 3.17Å; N354-G356 PolarHBondContact O-N 2.94Å
355A82.9Confident84Confident10 Ų1034.9 Ų34.98%0.08321%0.21CC..THydrogen-bonded Turntrans-76.5-9.5172.200000113.3K298 A301 I351 L352 L353K298-A355 HydrophobicContact CB-CB 4.48Å; A301-A355 HydrophobicContact CB-CB 3.94Å; I351-A355 WeakPolarHBondContact O-CB 3.31Å; I351-A355 PolarHBondContact O-N 3.48Å; L352-A355 WeakPolarHBondContact O-CB 3.4Å; L352-A355 PolarHBondContact O-N 3.37Å; L353-A355 PolarHBondContact O-N 2.91Å
356G80.6Confident84Confident43 Ų4335.4 Ų35.444%0.44321%0.213SC..THydrogen-bonded Turntrans104.610.6173.700000115.1L352 L353 N354L352-G356 PolarHBondContact O-N 3.13Å; L353-G356 PolarHBondContact O-N 3.07Å; N354-G356 PolarHBondContact O-N 2.94Å
357M83.4Confident84.1Confident10 Ų1037.8 Ų37.85%0.04923%0.226CC..  trans-72.9149.2172-69.7-173.4161.200111.4I297 A301 L352 L353 Q361 A362 F365I297-M357 HydrophobicContact CD1-CE 3.8Å; I297-M357 HydrophobicContact CD1-CG 4.03Å; I297-M357 HydrophobicContact CG1-CG 4.48Å; I297-M357 HydrophobicContact CG2-CE 4.15Å; I297-M357 HydrophobicContact CG2-CG 4.33Å; A301-M357 HydrophobicContact CB-CE 4.38Å; L352-M357 HydrophobicContact CB-SD 3.96Å; L352-M357 HydrophobicContact CD1-SD 4.36Å; L352-M357 HydrophobicContact CD2-CE 4.32Å; L352-M357 HydrophobicContact CD2-SD 3.84Å; L352-M357 HydrophobicContact CG-SD 4.27Å; L352-M357 WeakPolarHBondContact O-CB 3.34Å; L352-M357 PolarHBondContact O-N 2.86Å; L353-M357 WeakPolarHBondContact CD2-O 3.45Å; M357-Q361 HydrophobicContact CB-CB 4.16Å; M357-A362 HydrophobicContact CB-CB 4.38Å; M357-F365 HydrophobicContact CE-CD2 3.3Å; M357-F365 HydrophobicContact CE-CE2 3.51Å; M357-F365 HydrophobicContact CE-CG 3.92Å; M357-F365 HydrophobicContact CE-CZ 4.26Å; M357-F365 HydrophobicContact SD-CD2 3.92Å; M357-F365 HydrophobicContact SD-CE2 4.5Å
358S85.5Confident84.4Confident40 Ų4040.9 Ų40.928%0.2824%0.235SC..  trans-75.1159.316769.90000110.9Q361 A362S358-Q361 WeakPolarHBondContact O-CB 3.39Å; S358-Q361 PolarHBondContact O-N 3.41Å; S358-Q361 VanDerWaalsContact OG-CG 3.25Å; S358-Q361 WeakPolarHBondContact OG-CG 3.41Å; S358-Q361 PolarHBondContact OG-N 3.15Å; S358-Q361 PolarHBondContact OG-OE1 3.18Å; S358-A362 PolarHBondContact O-N 3.49Å
359V85.3Confident84.7Confident68 Ų6840.3 Ų40.341%0.41223%0.232SC..Hα-helixtrans-52.4-47.8177.2172.50000112.5L149 F349 L353 Q361 A362 V363L149-V359 HydrophobicContact CD1-CG1 4.01Å; F349-V359 HydrophobicContact CE2-CG1 4.41Å; F349-V359 HydrophobicContact CZ-CG1 4.07Å; F349-V359 HydrophobicContact CZ-CG2 4.37Å; L353-V359 HydrophobicContact CD1-CG2 4.41Å; L353-V359 HydrophobicContact CD2-CB 4.5Å; L353-V359 HydrophobicContact CD2-CG2 3.85Å; V359-Q361 VanDerWaalsContact C-N 3.31Å; V359-Q361 PolarHBondContact O-N 3.37Å; V359-A362 PolarHBondContact O-N 3.31Å; V359-V363 HydrophobicContact CG1-CG2 4.48Å; V359-V363 VanDerWaalsContact O-CG2 3.27Å; V359-V363 WeakPolarHBondContact O-CG2 3.46Å; V359-V363 PolarHBondContact O-N 3.16Å
360P84.6Confident84.9Confident58 Ų5839.5 Ų39.538%0.37723%0.228SC..Hα-helixtrans-64-32.8176.9-22.234000113.9W288 F364W288-P360 HydrophobicContact CE3-CB 4.09Å; W288-P360 HydrophobicContact CZ3-CB 4.49Å; P360-F364 WeakPolarHBondContact O-CB 3.23Å; P360-F364 PolarHBondContact O-N 3.39Å; P360-F364 VanDerWaalsContact O-N 3.08Å
361Q84.5Confident85.4Confident3 Ų340.1 Ų40.11%0.01423%0.228CC..Hα-helixtrans-68.6-49.5176.5-74.1173.4-25.400110.7K292 M357 S358 V359 V363 F364 F365K292-Q361 PolarHBondContact O-NE2 3.35Å; M357-Q361 HydrophobicContact CB-CB 4.16Å; S358-Q361 WeakPolarHBondContact O-CB 3.39Å; S358-Q361 PolarHBondContact O-N 3.41Å; S358-Q361 VanDerWaalsContact OG-CG 3.25Å; S358-Q361 WeakPolarHBondContact OG-CG 3.41Å; S358-Q361 PolarHBondContact OG-N 3.15Å; S358-Q361 PolarHBondContact OG-OE1 3.18Å; V359-Q361 VanDerWaalsContact C-N 3.31Å; V359-Q361 PolarHBondContact O-N 3.37Å; Q361-V363 VanDerWaalsContact C-N 3.32Å; Q361-V363 PolarHBondContact O-N 3.47Å; Q361-F364 WeakPolarHBondContact O-CB 3.38Å; Q361-F364 PolarHBondContact O-N 3.42Å; Q361-F364 VanDerWaalsContact O-N 3.12Å; Q361-F365 VanDerWaalsContact O-CD2 3.24Å; Q361-F365 WeakPolarHBondContact O-CD2 3.04Å; Q361-F365 PolarHBondContact O-N 3.11Å
362A85.1Confident86Confident0 Ų037.7 Ų37.70%022%0.217CC..Hα-helixtrans-58.3-44.6178.900000111.4F349 L352 L353 M357 S358 V359 F364 F365 N366F349-A362 HydrophobicContact CD2-CB 3.84Å; F349-A362 HydrophobicContact CE2-CB 3.76Å; L352-A362 HydrophobicContact CB-CB 3.93Å; L352-A362 HydrophobicContact CD1-CB 4.33Å; L353-A362 HydrophobicContact CD2-CB 4.16Å; M357-A362 HydrophobicContact CB-CB 4.38Å; S358-A362 PolarHBondContact O-N 3.49Å; V359-A362 PolarHBondContact O-N 3.31Å; A362-F364 VanDerWaalsContact C-N 3.34Å; A362-F364 PolarHBondContact O-N 2.85Å; A362-F365 PolarHBondContact O-N 2.95Å; A362-N366 PolarHBondContact O-N 2.75Å
363V84.8Confident86.6Confident24 Ų2437.5 Ų37.515%0.14522%0.217CC..Hα-helixtrans-59.7-43.6174.8173.20000112L146 L149 F349 V359 Q361 F365 N366 L367L146-V363 HydrophobicContact CD2-CG1 4.38Å; L149-V363 HydrophobicContact CD1-CG2 3.57Å; L149-V363 HydrophobicContact CD2-CG2 4.04Å; L149-V363 HydrophobicContact CG-CG2 4.37Å; F349-V363 HydrophobicContact CE2-CG2 3.97Å; V359-V363 HydrophobicContact CG1-CG2 4.48Å; V359-V363 VanDerWaalsContact O-CG2 3.27Å; V359-V363 WeakPolarHBondContact O-CG2 3.46Å; V359-V363 PolarHBondContact O-N 3.16Å; Q361-V363 VanDerWaalsContact C-N 3.32Å; Q361-V363 PolarHBondContact O-N 3.47Å; V363-F365 PolarHBondContact O-N 3.31Å; V363-N366 PolarHBondContact O-N 3.11Å; V363-L367 WeakPolarHBondContact O-CB 3.33Å; V363-L367 PolarHBondContact O-N 3.33Å
364F86.6Confident87.2Confident75 Ų7537.5 Ų37.533%0.32921%0.213SC..Hα-helixtrans-62.6-43.5-179.7175.6-97.5000112P360 Q361 A362 L368P360-F364 WeakPolarHBondContact O-CB 3.23Å; P360-F364 PolarHBondContact O-N 3.39Å; P360-F364 VanDerWaalsContact O-N 3.08Å; Q361-F364 WeakPolarHBondContact O-CB 3.38Å; Q361-F364 PolarHBondContact O-N 3.42Å; Q361-F364 VanDerWaalsContact O-N 3.12Å; A362-F364 VanDerWaalsContact C-N 3.34Å; A362-F364 PolarHBondContact O-N 2.85Å; F364-L368 HydrophobicContact CE1-CD2 4.3Å; F364-L368 VanDerWaalsContact O-CB 3.25Å; F364-L368 WeakPolarHBondContact O-CB 3.48Å; F364-L368 PolarHBondContact O-N 2.85Å
365F86.1Confident87.9Confident14 Ų1435.4 Ų35.46%0.06120%0.204CC..Hα-helixtrans-69.4-38.3178.5-79-75.4000112.7W302 M357 Q361 A362 V363 L368 S369W302-F365 AromaticContact CH2-CE1 3.61Å; W302-F365 HydrophobicContact CH2-CE1 3.61Å; W302-F365 AromaticContact CH2-CZ 3.67Å; W302-F365 HydrophobicContact CH2-CZ 3.67Å; W302-F365 HydrophobicContact CZ2-CZ 4.45Å; W302-F365 HydrophobicContact CZ3-CD1 4.34Å; W302-F365 AromaticContact CZ3-CE1 3.52Å; W302-F365 HydrophobicContact CZ3-CE1 3.52Å; W302-F365 HydrophobicContact CZ3-CZ 4.07Å; M357-F365 HydrophobicContact CE-CD2 3.3Å; M357-F365 HydrophobicContact CE-CE2 3.51Å; M357-F365 HydrophobicContact CE-CG 3.92Å; M357-F365 HydrophobicContact CE-CZ 4.26Å; M357-F365 HydrophobicContact SD-CD2 3.92Å; M357-F365 HydrophobicContact SD-CE2 4.5Å; Q361-F365 VanDerWaalsContact O-CD2 3.24Å; Q361-F365 WeakPolarHBondContact O-CD2 3.04Å; Q361-F365 PolarHBondContact O-N 3.11Å; A362-F365 PolarHBondContact O-N 2.95Å; V363-F365 PolarHBondContact O-N 3.31Å; F365-L368 PolarHBondContact O-N 3.41Å; F365-S369 PolarHBondContact O-N 3.45Å
366N85.5Confident88.6Confident14 Ų1434.9 Ų34.98%0.07520%0.2CC..Hα-helixtrans-59.7-50.9172.7-132.247.7000111.1E345 A362 V363 L368 S369 A370E345-N366 PolarHBondContact OE2-ND2 2.92Å; A362-N366 PolarHBondContact O-N 2.75Å; V363-N366 PolarHBondContact O-N 3.11Å; N366-L368 VanDerWaalsContact C-N 3.29Å; N366-L368 PolarHBondContact O-N 3.34Å; N366-S369 WeakPolarHBondContact O-CB 3.47Å; N366-S369 PolarHBondContact O-N 3.07Å; N366-S369 VanDerWaalsContact O-N 3.17Å; N366-A370 PolarHBondContact O-N 3.18Å
367L86.5Confident89.3Confident63 Ų6332.9 Ų32.933%0.3318%0.179SC..Hα-helixtrans-63.1-38.1-179.9-175.565.3000111.7L146 V363 S369 A370 M371L146-L367 HydrophobicContact CD1-CD1 4.27Å; L146-L367 HydrophobicContact CD2-CD1 4.45Å; V363-L367 WeakPolarHBondContact O-CB 3.33Å; V363-L367 PolarHBondContact O-N 3.33Å; L367-S369 VanDerWaalsContact C-N 3.33Å; L367-A370 PolarHBondContact O-N 2.6Å; L367-M371 HydrophobicContact CD1-CE 3.69Å; L367-M371 HydrophobicContact CG-CE 4.27Å; L367-M371 WeakPolarHBondContact O-CG 3.25Å; L367-M371 PolarHBondContact O-N 3.3Å; L367-M371 VanDerWaalsContact O-N 3.09Å
368L88.7Confident89.9Confident94 Ų9434.6 Ų34.649%0.49219%0.19SC..Hα-helixtrans-62.9-41.3177.1-177.964.4000111.5F364 F365 N366 M371F364-L368 HydrophobicContact CE1-CD2 4.3Å; F364-L368 VanDerWaalsContact O-CB 3.25Å; F364-L368 WeakPolarHBondContact O-CB 3.48Å; F364-L368 PolarHBondContact O-N 2.85Å; F365-L368 PolarHBondContact O-N 3.41Å; N366-L368 VanDerWaalsContact C-N 3.29Å; N366-L368 PolarHBondContact O-N 3.34Å; L368-M371 PolarHBondContact O-N 2.93Å
369S90.6Very high90.3Very high3 Ų337.6 Ų37.62%0.02120%0.198CC..Hα-helixtrans-63.2-48.1173.4177.50000111.6D308 A309 N312 F365 N366 L367 M371 S372D308-S369 WeakPolarHBondContact CB-OG 2.93Å; D308-S369 PolarHBondContact O-OG 3.02Å; D308-S369 WeakPolarHBondContact OD2-CB 3.43Å; D308-S369 PolarHBondContact OD2-OG 3.28Å; A309-S369 WeakPolarHBondContact CA-OG 3.47Å; A309-S369 PolarHBondContact N-OG 3.24Å; N312-S369 PolarHBondContact ND2-OG 3.4Å; F365-S369 PolarHBondContact O-N 3.45Å; N366-S369 WeakPolarHBondContact O-CB 3.47Å; N366-S369 PolarHBondContact O-N 3.07Å; N366-S369 VanDerWaalsContact O-N 3.17Å; L367-S369 VanDerWaalsContact C-N 3.33Å; S369-M371 PolarHBondContact O-N 3.43Å; S369-M371 VanDerWaalsContact O-N 3.12Å; S369-S372 WeakPolarHBondContact O-CB 3.46Å; S369-S372 PolarHBondContact O-N 3.32Å; S369-S372 PolarHBondContact O-OG 3Å
370A89.9Confident90.7Very high0 Ų034.4 Ų34.40%018%0.179CC..Hα-helixtrans-59.7-25.2177.800000113.9N142 N366 L367 S372 C373N142-A370 PolarHBondContact ND2-O 3.17Å; N142-A370 VanDerWaalsContact ND2-O 3.1Å; N366-A370 PolarHBondContact O-N 3.18Å; L367-A370 PolarHBondContact O-N 2.6Å; A370-S372 PolarHBondContact O-N 3.12Å; A370-C373 VanDerWaalsContact O-CB 3.27Å; A370-C373 WeakPolarHBondContact O-CB 3.24Å; A370-C373 PolarHBondContact O-N 3.37Å
371M91.6Very high91Very high75 Ų7532 Ų3237%0.36916%0.163SC..Hα-helixtrans-65.7-24.2173.9-68.8-52.895.400113.1N142 L367 L368 S369 C373 Y374N142-M371 WeakPolarHBondContact ND2-CE 3.28Å; L367-M371 HydrophobicContact CD1-CE 3.69Å; L367-M371 HydrophobicContact CG-CE 4.27Å; L367-M371 WeakPolarHBondContact O-CG 3.25Å; L367-M371 PolarHBondContact O-N 3.3Å; L367-M371 VanDerWaalsContact O-N 3.09Å; L368-M371 PolarHBondContact O-N 2.93Å; S369-M371 PolarHBondContact O-N 3.43Å; S369-M371 VanDerWaalsContact O-N 3.12Å; M371-C373 PolarHBondContact O-N 2.8Å; M371-Y374 HydrophobicContact CE-CD2 4.24Å; M371-Y374 HydrophobicContact CE-CE2 3.89Å; M371-Y374 PolarHBondContact O-N 3.2Å; M371-Y374 HydrophobicContact SD-CD2 3.95Å; M371-Y374 HydrophobicContact SD-CE2 3.95Å
372S95.1Very high91.2Very high21 Ų2136 Ų3615%0.14718%0.184CC..Hα-helixtrans-61.7-26.6174.670.80000112.2A309 N312 F313 S369 A370 Y374 V375 G376A309-S372 WeakPolarHBondContact O-CB 3.49Å; A309-S372 PolarHBondContact O-OG 2.96Å; N312-S372 WeakPolarHBondContact CB-OG 3.45Å; F313-S372 PolarHBondContact N-OG 3.17Å; S369-S372 WeakPolarHBondContact O-CB 3.46Å; S369-S372 PolarHBondContact O-N 3.32Å; S369-S372 PolarHBondContact O-OG 3Å; A370-S372 PolarHBondContact O-N 3.12Å; S372-Y374 VanDerWaalsContact C-N 3.34Å; S372-Y374 PolarHBondContact O-N 3.36Å; S372-V375 WeakPolarHBondContact O-CA 3.28Å; S372-V375 WeakPolarHBondContact O-CB 3.49Å; S372-V375 PolarHBondContact O-N 2.93Å; S372-G376 PolarHBondContact O-N 3.45Å
373C95.7Very high91.3Very high0 Ų039 Ų390%020%0.2CC..Hα-helixtrans-62.8-36.9175.7-170.60000112.5V138 N312 G316 A370 M371 V375 G376 L377V138-C373 HydrophobicContact CG1-CB 4Å; N312-C373 HydrophobicContact CB-CB 4.21Å; N312-C373 WeakPolarHBondContact O-CA 3.47Å; N312-C373 VanDerWaalsContact O-CB 3.3Å; N312-C373 WeakPolarHBondContact O-CB 3.42Å; G316-C373 VanDerWaalsContact CA-O 3.3Å; G316-C373 WeakPolarHBondContact CA-O 3.4Å; G316-C373 WeakPolarHBondContact CA-SG 3.5Å; G316-C373 PolarHBondContact N-SG 2.89Å; A370-C373 VanDerWaalsContact O-CB 3.27Å; A370-C373 WeakPolarHBondContact O-CB 3.24Å; A370-C373 PolarHBondContact O-N 3.37Å; M371-C373 PolarHBondContact O-N 2.8Å; C373-V375 VanDerWaalsContact C-N 3.32Å; C373-V375 PolarHBondContact O-N 2.98Å; C373-G376 PolarHBondContact O-N 3.09Å; C373-L377 WeakPolarHBondContact O-CB 3.26Å; C373-L377 PolarHBondContact O-N 3.1Å
374Y96.8Very high91.2Very high55 Ų5538.4 Ų38.422%0.21620%0.198CC..Hα-helixtrans-65.2-37.4172-72.1-68.3000112.5F135 V138 T139 N142 M371 S372 L377 V378F135-Y374 AromaticContact CD1-CD1 3.6Å; F135-Y374 HydrophobicContact CD1-CD1 3.6Å; F135-Y374 AromaticContact CD1-CE1 3.7Å; F135-Y374 HydrophobicContact CD1-CE1 3.7Å; F135-Y374 AromaticContact CE1-CD1 3.68Å; F135-Y374 HydrophobicContact CE1-CD1 3.68Å; F135-Y374 HydrophobicContact CE1-CE1 4.2Å; V138-Y374 HydrophobicContact CB-CD1 4.05Å; V138-Y374 HydrophobicContact CB-CE1 3.84Å; V138-Y374 HydrophobicContact CG1-CD1 3.51Å; V138-Y374 HydrophobicContact CG1-CD2 4.13Å; V138-Y374 HydrophobicContact CG1-CE1 3.47Å; V138-Y374 VanDerWaalsContact CG1-CE1 3.47Å; V138-Y374 HydrophobicContact CG1-CE2 4.11Å; V138-Y374 HydrophobicContact CG1-CG 3.85Å; T139-Y374 WeakPolarHBondContact CA-OH 3.45Å; T139-Y374 PolarHBondContact OG1-OH 3.26Å; N142-Y374 WeakPolarHBondContact ND2-CE2 3.41Å; M371-Y374 HydrophobicContact CE-CD2 4.24Å; M371-Y374 HydrophobicContact CE-CE2 3.89Å; M371-Y374 PolarHBondContact O-N 3.2Å; M371-Y374 HydrophobicContact SD-CD2 3.95Å; M371-Y374 HydrophobicContact SD-CE2 3.95Å; S372-Y374 VanDerWaalsContact C-N 3.34Å; S372-Y374 PolarHBondContact O-N 3.36Å; Y374-L377 PolarHBondContact O-N 3.31Å; Y374-V378 WeakPolarHBondContact O-CG2 3.45Å; Y374-V378 PolarHBondContact O-N 2.92Å; Y374-V378 VanDerWaalsContact O-N 3.15Å
375V96.6Very high90.9Very high73 Ų7337.9 Ų37.944%0.44220%0.199SC..Hα-helixtrans-64.9-47.9176-175.60000109F313 S372 C373 L377 V378 F379F313-V375 HydrophobicContact CD2-CB 4.37Å; F313-V375 HydrophobicContact CD2-CG1 4.34Å; F313-V375 HydrophobicContact CE2-CG1 4.11Å; S372-V375 WeakPolarHBondContact O-CA 3.28Å; S372-V375 WeakPolarHBondContact O-CB 3.49Å; S372-V375 PolarHBondContact O-N 2.93Å; C373-V375 VanDerWaalsContact C-N 3.32Å; C373-V375 PolarHBondContact O-N 2.98Å; V375-L377 VanDerWaalsContact C-N 3.34Å; V375-L377 PolarHBondContact O-N 2.95Å; V375-V378 PolarHBondContact O-N 3.43Å; V375-F379 HydrophobicContact CG1-CD2 3.92Å; V375-F379 HydrophobicContact CG1-CE2 3.86Å; V375-F379 WeakPolarHBondContact O-CD2 3.2Å; V375-F379 PolarHBondContact O-N 2.89Å; V375-F379 VanDerWaalsContact O-N 3.1Å
376G96.6Very high90.3Very high0 Ų041 Ų410%022%0.222CC..Hα-helixtrans-49.9-52.1172.200000112.3F313 G316 L317 S372 C373 V378 F379 G380F313-G376 WeakPolarHBondContact O-CA 3.03Å; G316-G376 CarbonylContact O-C 3.48Å; L317-G376 VanDerWaalsContact CA-O 3.26Å; L317-G376 WeakPolarHBondContact CA-O 3.49Å; L317-G376 PolarHBondContact N-O 2.92Å; S372-G376 PolarHBondContact O-N 3.45Å; C373-G376 PolarHBondContact O-N 3.09Å; G376-V378 VanDerWaalsContact C-N 3.35Å; G376-V378 PolarHBondContact O-N 3.45Å; G376-F379 CarbonylContact O-C 3.57Å; G376-F379 PolarHBondContact O-N 3.43Å; G376-F379 VanDerWaalsContact O-N 3.11Å; G376-G380 PolarHBondContact O-N 2.72Å
377L96.6Very high89.5Confident0 Ų047.2 Ų47.20%025%0.249CC..Hα-helixtrans-53.3-49.117917774.1000112.6G134 F135 V138 G316 I319 C373 Y374 V375 F379 G380 I381G134-L377 VanDerWaalsContact C-CD2 3.46Å; F135-L377 HydrophobicContact CD1-CD2 4.05Å; F135-L377 HydrophobicContact CD2-CD2 4.32Å; F135-L377 HydrophobicContact CE1-CD2 4.32Å; F135-L377 HydrophobicContact CG-CD2 4.02Å; V138-L377 HydrophobicContact CG2-CB 4.13Å; V138-L377 HydrophobicContact CG2-CD1 4.22Å; V138-L377 HydrophobicContact CG2-CD2 3.94Å; V138-L377 HydrophobicContact CG2-CG 4.32Å; G316-L377 WeakPolarHBondContact O-CA 3.22Å; G316-L377 PolarHBondContact O-N 2.89Å; I319-L377 HydrophobicContact CB-CD1 4.38Å; I319-L377 HydrophobicContact CG2-CD1 3.84Å; C373-L377 WeakPolarHBondContact O-CB 3.26Å; C373-L377 PolarHBondContact O-N 3.1Å; Y374-L377 PolarHBondContact O-N 3.31Å; V375-L377 VanDerWaalsContact C-N 3.34Å; V375-L377 PolarHBondContact O-N 2.95Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 3.16Å; L377-G380 PolarHBondContact O-N 3.07Å; L377-G380 VanDerWaalsContact O-N 3.16Å; L377-I381 HydrophobicContact CD1-CD1 4.04Å; L377-I381 HydrophobicContact CD1-CG1 4.41Å; L377-I381 HydrophobicContact CG-CD1 4.07Å; L377-I381 WeakPolarHBondContact O-CG1 3.39Å; L377-I381 PolarHBondContact O-N 3.46Å
378V95.1Very high89.1Confident47 Ų4747.4 Ų47.429%0.28526%0.26SS..Hα-helixtrans-59.3-48.1178.8173.10000110.1W131 F135 Y374 V375 G376 G380 L382W131-V378 HydrophobicContact CH2-CG1 4.36Å; W131-V378 HydrophobicContact CZ3-CG2 4.18Å; F135-V378 HydrophobicContact CZ-CG2 4.45Å; Y374-V378 WeakPolarHBondContact O-CG2 3.45Å; Y374-V378 PolarHBondContact O-N 2.92Å; Y374-V378 VanDerWaalsContact O-N 3.15Å; V375-V378 PolarHBondContact O-N 3.43Å; G376-V378 VanDerWaalsContact C-N 3.35Å; G376-V378 PolarHBondContact O-N 3.45Å; V378-G380 VanDerWaalsContact C-N 3.31Å; V378-G380 PolarHBondContact O-N 3.47Å; V378-L382 HydrophobicContact CG1-CD1 3.85Å; V378-L382 HydrophobicContact CG1-CG 4.44Å; V378-L382 WeakPolarHBondContact O-CB 3.33Å; V378-L382 WeakPolarHBondContact O-CG 3.35Å; V378-L382 PolarHBondContact O-N 2.94Å
379F93.9Very high88.7Confident103 Ų10343.9 Ų43.945%0.45224%0.242SC..Hα-helixtrans-63.7-37.3176.5-83.2-84.6000112.2F313 L317 V375 G376 L377 L382 L383F313-F379 HydrophobicContact CE2-CD2 4.14Å; L317-F379 HydrophobicContact CD1-CB 3.85Å; V375-F379 HydrophobicContact CG1-CD2 3.92Å; V375-F379 HydrophobicContact CG1-CE2 3.86Å; V375-F379 WeakPolarHBondContact O-CD2 3.2Å; V375-F379 PolarHBondContact O-N 2.89Å; V375-F379 VanDerWaalsContact O-N 3.1Å; G376-F379 CarbonylContact O-C 3.57Å; G376-F379 PolarHBondContact O-N 3.43Å; G376-F379 VanDerWaalsContact O-N 3.11Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 3.16Å; F379-L382 PolarHBondContact O-N 3.36Å; F379-L383 WeakPolarHBondContact O-CB 2.71Å; F379-L383 VanDerWaalsContact O-CG 3.24Å; F379-L383 WeakPolarHBondContact O-CG 3.45Å; F379-L383 PolarHBondContact O-N 2.9Å
380G93.4Very high88.6Confident0 Ų046.1 Ų46.10%025%0.254CS..Hα-helixtrans-64.2-45.5-179.200000112.1L317 G376 L377 V378 G384L317-G380 VanDerWaalsContact O-CA 3.24Å; L317-G380 WeakPolarHBondContact O-CA 3.36Å; G376-G380 PolarHBondContact O-N 2.72Å; L377-G380 PolarHBondContact O-N 3.07Å; L377-G380 VanDerWaalsContact O-N 3.16Å; V378-G380 VanDerWaalsContact C-N 3.31Å; V378-G380 PolarHBondContact O-N 3.47Å; G380-G384 PolarHBondContact O-N 3.28Å
381I91.1Very high88.5Confident7 Ų750 Ų504%0.03628%0.279CS..Hα-helixtrans-66.4-47176.2-64.6171000110.6V130 W131 T324 L377 N385V130-I381 HydrophobicContact CG1-CD1 4.2Å; V130-I381 HydrophobicContact CG1-CG1 4.16Å; V130-I381 HydrophobicContact CG1-CG2 4.29Å; W131-I381 HydrophobicContact CD2-CD1 3.94Å; W131-I381 HydrophobicContact CD2-CG2 4.37Å; W131-I381 HydrophobicContact CE3-CD1 3.83Å; W131-I381 HydrophobicContact CG-CD1 4.39Å; W131-I381 HydrophobicContact CH2-CG2 4.41Å; W131-I381 HydrophobicContact CZ2-CB 4.43Å; W131-I381 HydrophobicContact CZ2-CG2 3.78Å; W131-I381 HydrophobicContact CZ3-CD1 4.24Å; T324-I381 HydrophobicContact CG2-CB 4.49Å; T324-I381 HydrophobicContact CG2-CG2 4.29Å; L377-I381 HydrophobicContact CD1-CD1 4.04Å; L377-I381 HydrophobicContact CD1-CG1 4.41Å; L377-I381 HydrophobicContact CG-CD1 4.07Å; L377-I381 WeakPolarHBondContact O-CG1 3.39Å; L377-I381 PolarHBondContact O-N 3.46Å; I381-N385 VanDerWaalsContact O-CB 3.28Å; I381-N385 WeakPolarHBondContact O-CB 3.17Å; I381-N385 PolarHBondContact O-N 3.06Å
382L89.9Confident88.5Confident87 Ų8747.3 Ų47.346%0.45527%0.266SS..Hα-helixtrans-64.9-44.9-178.2-70.1176.8000112.1W131 V378 F379 S386W131-L382 HydrophobicContact CZ2-CD2 4.35Å; V378-L382 HydrophobicContact CG1-CD1 3.85Å; V378-L382 HydrophobicContact CG1-CG 4.44Å; V378-L382 WeakPolarHBondContact O-CB 3.33Å; V378-L382 WeakPolarHBondContact O-CG 3.35Å; V378-L382 PolarHBondContact O-N 2.94Å; F379-L382 PolarHBondContact O-N 3.36Å; L382-S386 VanDerWaalsContact O-CB 3.25Å; L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 2.97Å; L382-S386 VanDerWaalsContact O-N 3.13Å; L382-S386 PolarHBondContact O-OG 3.35Å
383L87.3Confident88.3Confident64 Ų6446.5 Ų46.534%0.33526%0.26SS..Hα-helixtrans-68.2-50.3177.6-70.4175.5000110L317 F379 N385 S386 F387 I392L317-L383 HydrophobicContact CD1-CD1 4.19Å; F379-L383 WeakPolarHBondContact O-CB 2.71Å; F379-L383 VanDerWaalsContact O-CG 3.24Å; F379-L383 WeakPolarHBondContact O-CG 3.45Å; F379-L383 PolarHBondContact O-N 2.9Å; L383-N385 PolarHBondContact O-N 3.47Å; L383-S386 PolarHBondContact O-N 3.24Å; L383-F387 CarbonylContact C-O 3.53Å; L383-F387 HydrophobicContact CD2-CD2 3.81Å; L383-F387 HydrophobicContact CD2-CE2 4.27Å; L383-F387 CarbonylContact O-C 3.42Å; L383-F387 WeakPolarHBondContact O-CA 3.37Å; L383-F387 PolarHBondContact O-N 2.74Å; L383-I392 HydrophobicContact CB-CD1 3.89Å; L383-I392 HydrophobicContact CD1-CD1 4.49Å
384G82.5Confident88.1Confident11 Ų1149 Ų4911%0.11328%0.281CS..Hα-helixtrans-57.2-33.3179.900000114.1G380 F387G380-G384 PolarHBondContact O-N 3.28Å; G384-F387 WeakPolarHBondContact CA-O 3.41Å
385N78.9Confident87.9Confident64 Ų6451.8 Ų51.834%0.34230%0.298SS..Hα-helixtrans-80.3-26.3176.1-166.776.8000113.9P124 I381 L383P124-N385 WeakPolarHBondContact CB-OD1 3.3Å; P124-N385 WeakPolarHBondContact CG-OD1 3.45Å; I381-N385 VanDerWaalsContact O-CB 3.28Å; I381-N385 WeakPolarHBondContact O-CB 3.17Å; I381-N385 PolarHBondContact O-N 3.06Å; L383-N385 PolarHBondContact O-N 3.47Å
386S73.7Confident87.7Confident80 Ų8048.3 Ų48.356%0.55928%0.277SS*.Hα-helixtrans-100.9-27.4-175.2-51.70000113.4L382 L383L382-S386 VanDerWaalsContact O-CB 3.25Å; L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 2.97Å; L382-S386 VanDerWaalsContact O-N 3.13Å; L382-S386 PolarHBondContact O-OG 3.35Å; L383-S386 PolarHBondContact O-N 3.24Å
387F70.1Confident87.6Confident145 Ų14548.3 Ų48.364%0.63628%0.277SS*.SBendtrans-140.4126.8-175.9-60.2-79.1000107L383 G384L383-F387 CarbonylContact C-O 3.53Å; L383-F387 HydrophobicContact CD2-CD2 3.81Å; L383-F387 HydrophobicContact CD2-CE2 4.27Å; L383-F387 CarbonylContact O-C 3.42Å; L383-F387 WeakPolarHBondContact O-CA 3.37Å; L383-F387 PolarHBondContact O-N 2.74Å; G384-F387 WeakPolarHBondContact CA-O 3.41Å
388A76.4Confident87.5Confident67 Ų6750.2 Ų50.255%0.55430%0.297SS*.  trans-42.6133.8-177.600000111.9N390 P391A388-N390 PolarHBondContact O-N 3.05Å; A388-N390 VanDerWaalsContact O-N 3.14Å; A388-P391 WeakPolarHBondContact O-CD 3.49Å
389P82.1Confident87.3Confident19 Ų1950 Ų5012%0.12329%0.294CS..SBendtrans-71.5-9.8-169.128.1-35.3000113.8A321 V325 P391 I392 F393A321-P389 HydrophobicContact CB-CB 4.1Å; V325-P389 HydrophobicContact CG2-CB 4.31Å; V325-P389 HydrophobicContact CG2-CG 3.57Å; P389-P391 VanDerWaalsContact C-CD 3.49Å; P389-I392 WeakPolarHBondContact O-CB 3.2Å; P389-I392 PolarHBondContact O-N 3.22Å; P389-F393 HydrophobicContact CB-CD2 4.28Å; P389-F393 HydrophobicContact CB-CE2 3.6Å; P389-F393 HydrophobicContact CB-CZ 3.88Å; P389-F393 HydrophobicContact CG-CE2 3.79Å; P389-F393 HydrophobicContact CG-CZ 4.33Å; P389-F393 PolarHBondContact O-N 3.19Å
390N86.8Confident87.4Confident51 Ų5145.1 Ų45.127%0.27327%0.272SS..Hα-helixtrans-52.7-42.7-174-51.765.6000114.8E186 A187 A388 I392 F393 A394E186-N390 PolarHBondContact O-ND2 3.35Å; A187-N390 WeakPolarHBondContact CB-O 3.39Å; A388-N390 PolarHBondContact O-N 3.05Å; A388-N390 VanDerWaalsContact O-N 3.14Å; N390-I392 VanDerWaalsContact C-N 3.3Å; N390-I392 PolarHBondContact O-N 3.04Å; N390-F393 PolarHBondContact O-N 3.02Å; N390-A394 PolarHBondContact O-N 2.7Å
391P88.3Confident87.5Confident81 Ų8147.2 Ų47.253%0.52628%0.283SS..Hα-helixtrans-65-32.7177.1-21.335.2000113.3A388 P389 A394 I395A388-P391 WeakPolarHBondContact O-CD 3.49Å; P389-P391 VanDerWaalsContact C-CD 3.49Å; P391-A394 PolarHBondContact O-N 3.13Å; P391-I395 WeakPolarHBondContact O-CG1 3.41Å; P391-I395 PolarHBondContact O-N 2.86Å
392I90.9Very high87.6Confident18 Ų1854.7 Ų54.79%0.09231%0.312CS..Hα-helixtrans-64.3-48175.6-62.3172.1000108.7L317 V318 A321 L383 P389 N390 A394 I395 A396L317-I392 HydrophobicContact CD1-CD1 4.38Å; L317-I392 HydrophobicContact CD2-CG1 4.4Å; L317-I392 HydrophobicContact CD2-CG2 3.91Å; L317-I392 HydrophobicContact CG-CD1 4.36Å; L317-I392 HydrophobicContact CG-CG1 4.48Å; L317-I392 HydrophobicContact CG-CG2 3.8Å; V318-I392 HydrophobicContact CG2-CG2 3.91Å; A321-I392 HydrophobicContact CB-CB 4.18Å; A321-I392 HydrophobicContact CB-CD1 3.9Å; A321-I392 HydrophobicContact CB-CG2 3.82Å; L383-I392 HydrophobicContact CB-CD1 3.89Å; L383-I392 HydrophobicContact CD1-CD1 4.49Å; P389-I392 WeakPolarHBondContact O-CB 3.2Å; P389-I392 PolarHBondContact O-N 3.22Å; N390-I392 VanDerWaalsContact C-N 3.3Å; N390-I392 PolarHBondContact O-N 3.04Å; I392-A394 VanDerWaalsContact C-N 3.32Å; I392-A394 PolarHBondContact O-N 2.99Å; I392-I395 PolarHBondContact O-N 3.18Å; I392-A396 WeakPolarHBondContact O-CB 3.37Å; I392-A396 PolarHBondContact O-N 3.09Å
393F91.2Very high87.7Confident4 Ų451.2 Ų51.22%0.01829%0.294CS..Hα-helixtrans-63.7-34177.9-58.4-41000113.5L183 E186 A187 A321 S322 V325 P389 N390 G397L183-F393 HydrophobicContact CB-CB 4.4Å; L183-F393 HydrophobicContact CD2-CD1 3.75Å; L183-F393 HydrophobicContact CD2-CE1 4.36Å; L183-F393 HydrophobicContact CD2-CG 4.4Å; L183-F393 WeakPolarHBondContact O-CB 3.3Å; E186-F393 HydrophobicContact CB-CD2 3.94Å; E186-F393 HydrophobicContact CB-CE2 4.38Å; E186-F393 HydrophobicContact CG-CD2 3.42Å; E186-F393 VanDerWaalsContact CG-CD2 3.42Å; E186-F393 HydrophobicContact CG-CE2 3.43Å; E186-F393 VanDerWaalsContact CG-CE2 3.43Å; E186-F393 HydrophobicContact CG-CG 4.38Å; E186-F393 HydrophobicContact CG-CZ 4.39Å; A187-F393 HydrophobicContact CB-CB 4.01Å; A321-F393 HydrophobicContact CB-CE1 3.8Å; A321-F393 HydrophobicContact CB-CZ 4.07Å; S322-F393 WeakPolarHBondContact OG-CE1 3.24Å; V325-F393 HydrophobicContact CG2-CE2 3.64Å; V325-F393 HydrophobicContact CG2-CZ 3.65Å; P389-F393 HydrophobicContact CB-CD2 4.28Å; P389-F393 HydrophobicContact CB-CE2 3.6Å; P389-F393 HydrophobicContact CB-CZ 3.88Å; P389-F393 HydrophobicContact CG-CE2 3.79Å; P389-F393 HydrophobicContact CG-CZ 4.33Å; P389-F393 PolarHBondContact O-N 3.19Å; N390-F393 PolarHBondContact O-N 3.02Å; F393-G397 PolarHBondContact O-N 3.05Å
394A92.4Very high88Confident53 Ų5348.2 Ų48.244%0.43828%0.278SS..Hα-helixtrans-63.4-48.817600000111.8A187 N390 P391 I392 G398A187-A394 HydrophobicContact CB-CB 3.87Å; N390-A394 PolarHBondContact O-N 2.7Å; P391-A394 PolarHBondContact O-N 3.13Å; I392-A394 VanDerWaalsContact C-N 3.32Å; I392-A394 PolarHBondContact O-N 2.99Å; A394-G398 PolarHBondContact O-N 2.73Å
395I91.7Very high88.5Confident113 Ų11350.9 Ų50.958%0.57929%0.289SS*.Hα-helixtrans-63.5-45.8178.8-67.3169.1000109.8P391 I392 G398 M399P391-I395 WeakPolarHBondContact O-CG1 3.41Å; P391-I395 PolarHBondContact O-N 2.86Å; I392-I395 PolarHBondContact O-N 3.18Å; I395-G398 PolarHBondContact O-N 3.43Å; I395-M399 PolarHBondContact O-N 3.45Å
396A93.2Very high89.1Confident0 Ų050.1 Ų50.10%029%0.292CS..Hα-helixtrans-63.4-45.1179.600000113.9L183 V318 I392 G398 M399 F400L183-A396 HydrophobicContact CD1-CB 3.98Å; V318-A396 HydrophobicContact CB-CB 4.23Å; V318-A396 HydrophobicContact CG1-CB 4.11Å; V318-A396 HydrophobicContact CG2-CB 3.1Å; I392-A396 WeakPolarHBondContact O-CB 3.37Å; I392-A396 PolarHBondContact O-N 3.09Å; A396-G398 VanDerWaalsContact C-N 3.25Å; A396-G398 PolarHBondContact O-N 3.05Å; A396-M399 PolarHBondContact O-N 2.61Å; A396-M399 VanDerWaalsContact O-N 3.13Å; A396-F400 WeakPolarHBondContact O-CB 3.28Å; A396-F400 WeakPolarHBondContact O-CD1 3.25Å; A396-F400 PolarHBondContact O-N 3.02Å
397G94.1Very high89.9Confident0 Ų049.6 Ų49.60%028%0.283CS..Hα-helixtrans-60.2-38.7177.200000111.7F393 L401F393-G397 PolarHBondContact O-N 3.05Å; G397-L401 WeakPolarHBondContact O-CG 3.29Å; G397-L401 PolarHBondContact O-N 2.8Å; G397-L401 VanDerWaalsContact O-N 3.16Å
398G94.4Very high90.9Very high41 Ų4143.2 Ų43.242%0.42326%0.255SS..Hα-helixtrans-64.9-44.5172.600000113A394 I395 A396 Y402A394-G398 PolarHBondContact O-N 2.73Å; I395-G398 PolarHBondContact O-N 3.43Å; A396-G398 VanDerWaalsContact C-N 3.25Å; A396-G398 PolarHBondContact O-N 3.05Å; G398-Y402 PolarHBondContact O-N 3.21Å; G398-Y402 VanDerWaalsContact O-N 3.07Å
399M92.1Very high91.6Very high43 Ų4341.7 Ų41.721%0.21224%0.236CC..Hα-helixtrans-61.9-49.1176171-179.9-92.800112.1I314 I395 A396 L401 Y402 I403I314-M399 HydrophobicContact CB-CE 3.96Å; I314-M399 HydrophobicContact CB-SD 3.67Å; I314-M399 HydrophobicContact CD1-CE 3.22Å; I314-M399 HydrophobicContact CD1-SD 4.06Å; I314-M399 HydrophobicContact CG1-CE 4.1Å; I314-M399 HydrophobicContact CG1-SD 4.43Å; I314-M399 HydrophobicContact CG2-CE 4.09Å; I314-M399 HydrophobicContact CG2-SD 3.36Å; I314-M399 WeakPolarHBondContact CG2-SD 3.36Å; I395-M399 PolarHBondContact O-N 3.45Å; A396-M399 PolarHBondContact O-N 2.61Å; A396-M399 VanDerWaalsContact O-N 3.13Å; M399-L401 VanDerWaalsContact C-N 3.28Å; M399-L401 PolarHBondContact O-N 3.15Å; M399-Y402 CarbonylContact O-C 3.5Å; M399-Y402 WeakPolarHBondContact O-CA 3.49Å; M399-Y402 WeakPolarHBondContact O-CB 3.45Å; M399-Y402 PolarHBondContact O-N 2.85Å; M399-I403 HydrophobicContact CG-CD1 3.61Å; M399-I403 HydrophobicContact CG-CG1 4.2Å; M399-I403 WeakPolarHBondContact O-CG1 3.37Å; M399-I403 PolarHBondContact O-N 3.1Å; M399-I403 HydrophobicContact SD-CD1 4.19Å
400F94.6Very high92Very high0 Ų043.9 Ų43.90%025%0.25CS..Hα-helixtrans-62.7-37.4-178-78.818.5000111.4L175 N178 A179 L183 D315 V318 I337 A396 A404L175-F400 HydrophobicContact CD2-CD2 3.84Å; L175-F400 HydrophobicContact CD2-CE2 4.08Å; L175-F400 HydrophobicContact CD2-CG 4.07Å; N178-F400 HydrophobicContact CB-CD2 4.47Å; N178-F400 WeakPolarHBondContact ND2-CE2 3.27Å; A179-F400 HydrophobicContact CB-CB 4.01Å; L183-F400 HydrophobicContact CD1-CD2 3.56Å; L183-F400 HydrophobicContact CD1-CE2 3.79Å; L183-F400 HydrophobicContact CD1-CG 4.14Å; D315-F400 WeakPolarHBondContact OD1-CE1 3.41Å; V318-F400 HydrophobicContact CG1-CZ 4.25Å; I337-F400 HydrophobicContact CD1-CZ 3.9Å; I337-F400 HydrophobicContact CG1-CE2 4.15Å; I337-F400 HydrophobicContact CG1-CZ 3.59Å; A396-F400 WeakPolarHBondContact O-CB 3.28Å; A396-F400 WeakPolarHBondContact O-CD1 3.25Å; A396-F400 PolarHBondContact O-N 3.02Å; F400-A404 WeakPolarHBondContact O-CB 3.37Å; F400-A404 PolarHBondContact O-N 2.87Å
401L94.9Very high92.1Very high43 Ų4346 Ų4623%0.22526%0.259CS..Hα-helixtrans-63.3-41.8171.2-78.7175.1000112.2F176 A179 V180 I184 G397 M399 L405F176-L401 HydrophobicContact CD2-CD2 3.69Å; F176-L401 HydrophobicContact CE2-CD2 3.89Å; F176-L401 HydrophobicContact CG-CD2 4.18Å; A179-L401 HydrophobicContact CB-CD2 4.19Å; A179-L401 HydrophobicContact CB-CG 3.8Å; V180-L401 HydrophobicContact CG2-CD2 4.11Å; I184-L401 HydrophobicContact CD1-CD1 3.77Å; G397-L401 WeakPolarHBondContact O-CG 3.29Å; G397-L401 PolarHBondContact O-N 2.8Å; G397-L401 VanDerWaalsContact O-N 3.16Å; M399-L401 VanDerWaalsContact C-N 3.28Å; M399-L401 PolarHBondContact O-N 3.15Å; L401-L405 HydrophobicContact CD2-CD1 4.48Å; L401-L405 VanDerWaalsContact O-CB 3.3Å; L401-L405 WeakPolarHBondContact O-CB 3.27Å; L401-L405 WeakPolarHBondContact O-CG 3.46Å; L401-L405 PolarHBondContact O-N 3.24Å
402Y94.1Very high92.1Very high164 Ų16442.1 Ų42.164%0.64323%0.233SC*.Hα-helixtrans-63.7-49.7177.3-178.7-89.8000111.4G398 M399 A404 L405 A406G398-Y402 PolarHBondContact O-N 3.21Å; G398-Y402 VanDerWaalsContact O-N 3.07Å; M399-Y402 CarbonylContact O-C 3.5Å; M399-Y402 WeakPolarHBondContact O-CA 3.49Å; M399-Y402 WeakPolarHBondContact O-CB 3.45Å; M399-Y402 PolarHBondContact O-N 2.85Å; Y402-A404 PolarHBondContact O-N 2.68Å; Y402-L405 PolarHBondContact O-N 2.93Å; Y402-A406 HydrophobicContact CD1-CB 4.44Å; Y402-A406 HydrophobicContact CD2-CB 3.92Å; Y402-A406 HydrophobicContact CE1-CB 4.31Å; Y402-A406 HydrophobicContact CE2-CB 3.78Å; Y402-A406 HydrophobicContact CG-CB 4.26Å; Y402-A406 WeakPolarHBondContact O-CA 3.43Å; Y402-A406 WeakPolarHBondContact O-CB 2.92Å; Y402-A406 PolarHBondContact O-N 3.36Å
403I91.5Very high91.9Very high15 Ų1542.2 Ų42.28%0.07723%0.234CC..Iπ-helixtrans-60.3-48.1178.9-64.1169.7000110.3L175 E340 M399 L405 D407 M408L175-I403 HydrophobicContact CD1-CB 4.5Å; L175-I403 HydrophobicContact CD1-CG2 3.99Å; E340-I403 WeakPolarHBondContact OE2-CG2 3.27Å; M399-I403 HydrophobicContact CG-CD1 3.61Å; M399-I403 HydrophobicContact CG-CG1 4.2Å; M399-I403 WeakPolarHBondContact O-CG1 3.37Å; M399-I403 PolarHBondContact O-N 3.1Å; M399-I403 HydrophobicContact SD-CD1 4.19Å; I403-L405 PolarHBondContact O-N 2.92Å; I403-D407 WeakPolarHBondContact O-CB 3.08Å; I403-D407 PolarHBondContact O-N 3.41Å; I403-M408 HydrophobicContact CG2-CG 4.21Å; I403-M408 PolarHBondContact O-N 3.2Å
404A94.1Very high91.7Very high0 Ų044.4 Ų44.40%025%0.25CC..Iπ-helixtrans-60.7-45.8-179.700000112.8I172 L175 F176 F400 Y402 F409I172-A404 HydrophobicContact CG2-CB 4.41Å; L175-A404 HydrophobicContact CB-CB 3.95Å; L175-A404 HydrophobicContact CD1-CB 4.28Å; F176-A404 HydrophobicContact CB-CB 4.27Å; F400-A404 WeakPolarHBondContact O-CB 3.37Å; F400-A404 PolarHBondContact O-N 2.87Å; Y402-A404 PolarHBondContact O-N 2.68Å; A404-F409 VanDerWaalsContact O-CB 3.25Å; A404-F409 WeakPolarHBondContact O-CB 3.23Å; A404-F409 PolarHBondContact O-N 2.78Å; A404-F409 VanDerWaalsContact O-N 3.15Å
405L93.4Very high91.3Very high67 Ų6742.7 Ų42.735%0.35123%0.233SC..Iπ-helixtrans-95.3-35.9-169.6-63.2177.4000114.5F176 F208 L401 Y402 I403 P410F176-L405 HydrophobicContact CD2-CD1 4.2Å; F176-L405 HydrophobicContact CD2-CD2 3.83Å; F176-L405 HydrophobicContact CD2-CG 4.1Å; F176-L405 HydrophobicContact CE2-CD1 4.04Å; F176-L405 HydrophobicContact CE2-CD2 4.05Å; F176-L405 HydrophobicContact CE2-CG 4.37Å; F208-L405 HydrophobicContact CD2-CD2 4.06Å; F208-L405 HydrophobicContact CE2-CD2 3.49Å; F208-L405 VanDerWaalsContact CE2-CD2 3.49Å; F208-L405 HydrophobicContact CZ-CD2 3.91Å; L401-L405 HydrophobicContact CD2-CD1 4.48Å; L401-L405 VanDerWaalsContact O-CB 3.3Å; L401-L405 WeakPolarHBondContact O-CB 3.27Å; L401-L405 WeakPolarHBondContact O-CG 3.46Å; L401-L405 PolarHBondContact O-N 3.24Å; Y402-L405 PolarHBondContact O-N 2.93Å; I403-L405 PolarHBondContact O-N 2.92Å; L405-P410 WeakPolarHBondContact O-CD 3.41Å
406A91.7Very high90.9Very high49 Ų4938 Ų3841%0.40521%0.211SC..Iπ-helixtrans-95.3-23.2-174.500000113Y402 P410Y402-A406 HydrophobicContact CD1-CB 4.44Å; Y402-A406 HydrophobicContact CD2-CB 3.92Å; Y402-A406 HydrophobicContact CE1-CB 4.31Å; Y402-A406 HydrophobicContact CE2-CB 3.78Å; Y402-A406 HydrophobicContact CG-CB 4.26Å; Y402-A406 WeakPolarHBondContact O-CA 3.43Å; Y402-A406 WeakPolarHBondContact O-CB 2.92Å; Y402-A406 PolarHBondContact O-N 3.36Å; A406-P410 WeakPolarHBondContact O-CG 3.08Å
407D89.5Confident90.4Very high68 Ų6844.4 Ų44.436%0.36424%0.239SC..Iπ-helixtrans-112.3-65.7-176.1-169.635.2000112.2H344 I403 F409 P410 E411H344-D407 IonicContact CD2-OD2 3.16Å; I403-D407 WeakPolarHBondContact O-CB 3.08Å; I403-D407 PolarHBondContact O-N 3.41Å; D407-F409 PolarHBondContact O-N 2.84Å; D407-P410 WeakPolarHBondContact O-CD 3.35Å; D407-E411 PolarHBondContact O-N 3.1Å
408M90.7Very high89.8Confident12 Ų1251.9 Ų51.96%0.05927%0.274CS..Iπ-helixtrans-68-39-175.5-69.1-63.511500113.4I168 I172 H344 I403 E411 M412I168-M408 HydrophobicContact CG2-CB 4.22Å; I168-M408 WeakPolarHBondContact CG2-O 3.39Å; I168-M408 HydrophobicContact CG2-SD 4.41Å; I172-M408 HydrophobicContact CD1-CB 4.18Å; I172-M408 HydrophobicContact CG1-CB 3.6Å; H344-M408 HydrophobicContact CB-CE 4.36Å; I403-M408 HydrophobicContact CG2-CG 4.21Å; I403-M408 PolarHBondContact O-N 3.2Å; M408-E411 PolarHBondContact O-N 3.18Å; M408-M412 PolarHBondContact O-N 3.15Å
409F91.9Very high89.2Confident35 Ų3552 Ų5215%0.15426%0.264CS..Hα-helixtrans-66.3-46.4-177.5-178.7-81.7000113.6I172 F208 F212 A404 D407 E411 M412 D413I172-F409 HydrophobicContact CD1-CB 3.98Å; I172-F409 HydrophobicContact CD1-CD2 4.32Å; F208-F409 HydrophobicContact CE2-CD2 4.43Å; F208-F409 HydrophobicContact CE2-CE2 4.16Å; F208-F409 AromaticContact CZ-CD2 3.96Å; F208-F409 HydrophobicContact CZ-CD2 3.96Å; F208-F409 AromaticContact CZ-CE2 3.81Å; F208-F409 HydrophobicContact CZ-CE2 3.81Å; F212-F409 AromaticContact CD2-CE2 3.48Å; F212-F409 HydrophobicContact CD2-CE2 3.48Å; F212-F409 VanDerWaalsContact CD2-CE2 3.48Å; F212-F409 AromaticContact CD2-CZ 3.6Å; F212-F409 HydrophobicContact CD2-CZ 3.6Å; F212-F409 AromaticContact CE2-CE2 3.87Å; F212-F409 HydrophobicContact CE2-CE2 3.87Å; F212-F409 HydrophobicContact CE2-CZ 4.15Å; F212-F409 HydrophobicContact CG-CE2 4.34Å; A404-F409 VanDerWaalsContact O-CB 3.25Å; A404-F409 WeakPolarHBondContact O-CB 3.23Å; A404-F409 PolarHBondContact O-N 2.78Å; A404-F409 VanDerWaalsContact O-N 3.15Å; D407-F409 PolarHBondContact O-N 2.84Å; F409-E411 VanDerWaalsContact C-N 3.29Å; F409-E411 PolarHBondContact O-N 3.34Å; F409-M412 HydrophobicContact CD2-CE 4.08Å; F409-M412 HydrophobicContact CE2-CE 4.29Å; F409-M412 WeakPolarHBondContact O-CB 3.3Å; F409-M412 PolarHBondContact O-N 3.49Å; F409-D413 PolarHBondContact O-N 3.25Å; F409-D413 VanDerWaalsContact O-N 3.15Å
410P90.8Very high88.3Confident64 Ų6458.8 Ų58.842%0.41630%0.295SS..Hα-helixtrans-57.8-39.8171-2937.7000113.4L405 A406 D407 D413 S414L405-P410 WeakPolarHBondContact O-CD 3.41Å; A406-P410 WeakPolarHBondContact O-CG 3.08Å; D407-P410 WeakPolarHBondContact O-CD 3.35Å; P410-D413 PolarHBondContact O-N 3.01Å; P410-S414 PolarHBondContact O-N 3.35Å
411E87.7Confident87.7Confident96 Ų9666.6 Ų66.645%0.44933%0.329SS..Hα-helixtrans-65.5-41.6178.1-175.660.4-169.700111.8I168 D407 M408 F409 D413 S414 I415I168-E411 HydrophobicContact CD1-CG 4.26Å; D407-E411 PolarHBondContact O-N 3.1Å; M408-E411 PolarHBondContact O-N 3.18Å; F409-E411 VanDerWaalsContact C-N 3.29Å; F409-E411 PolarHBondContact O-N 3.34Å; E411-D413 PolarHBondContact O-N 2.88Å; E411-S414 PolarHBondContact O-N 3.06Å; E411-S414 PolarHBondContact O-OG 3.32Å; E411-S414 PolarHBondContact OE2-OG 3.15Å; E411-I415 HydrophobicContact CG-CD1 4.47Å; E411-I415 WeakPolarHBondContact O-CG1 3.5Å; E411-I415 PolarHBondContact O-N 3.38Å
412M89.2Confident86.9Confident0 Ų069.2 Ų69.20%035%0.347CS..Hα-helixtrans-58.4-37.9172.9-165.1-178.257.300112.4T165 I168 G169 I172 F212 M408 F409 Q432T165-M412 HydrophobicContact CG2-CG 4.27Å; I168-M412 HydrophobicContact CG2-CB 3.67Å; I168-M412 HydrophobicContact CG2-CG 4.15Å; G169-M412 VanDerWaalsContact CA-SD 3.56Å; I172-M412 HydrophobicContact CD1-CB 4.07Å; I172-M412 HydrophobicContact CD1-CE 3.79Å; I172-M412 HydrophobicContact CD1-CG 4.49Å; I172-M412 HydrophobicContact CD1-SD 3.77Å; F212-M412 HydrophobicContact CE2-CE 4.19Å; F212-M412 HydrophobicContact CZ-CE 4.45Å; M408-M412 PolarHBondContact O-N 3.15Å; F409-M412 HydrophobicContact CD2-CE 4.08Å; F409-M412 HydrophobicContact CE2-CE 4.29Å; F409-M412 WeakPolarHBondContact O-CB 3.3Å; F409-M412 PolarHBondContact O-N 3.49Å; M412-Q432 HydrophobicContact CE-CB 4.27Å; M412-Q432 HydrophobicContact CE-CG 4.21Å; M412-Q432 HydrophobicContact CG-CG 3.77Å; M412-Q432 PolarHBondContact O-NE2 3.31Å; M412-Q432 HydrophobicContact SD-CB 3.9Å; M412-Q432 HydrophobicContact SD-CG 3.65Å
413D87.1Confident86.3Confident20 Ų2065.8 Ų65.811%0.10735%0.347CS..Hα-helixtrans-75.2-33.7178-168.948.1000112.7K216 F409 P410 E411 A416 K417K216-D413 IonicContact NZ-OD1 3.09Å; K216-D413 PolarHBondContact NZ-OD1 2.99Å; K216-D413 IonicContact NZ-OD2 3.01Å; F409-D413 PolarHBondContact O-N 3.25Å; F409-D413 VanDerWaalsContact O-N 3.15Å; P410-D413 PolarHBondContact O-N 3.01Å; E411-D413 PolarHBondContact O-N 2.88Å; D413-A416 PolarHBondContact O-N 2.74Å; D413-K417 WeakPolarHBondContact O-CB 3.17Å; D413-K417 VanDerWaalsContact O-CG 3.32Å; D413-K417 WeakPolarHBondContact O-CG 3.34Å; D413-K417 PolarHBondContact O-N 3.43Å; D413-K417 WeakPolarHBondContact OD2-CE 3.4Å; D413-K417 IonicContact OD2-NZ 3.97Å; D413-K417 PolarHBondContact OD2-NZ 2.81Å
414S86.8Confident86Confident50 Ų5066.3 Ų66.335%0.3535%0.352SS..Hα-helixtrans-62.3-46.7178.6810000110.8P410 E411 A416 K417 E418P410-S414 PolarHBondContact O-N 3.35Å; E411-S414 PolarHBondContact O-N 3.06Å; E411-S414 PolarHBondContact O-OG 3.32Å; E411-S414 PolarHBondContact OE2-OG 3.15Å; S414-A416 VanDerWaalsContact C-N 3.32Å; S414-A416 PolarHBondContact O-N 2.82Å; S414-K417 PolarHBondContact O-N 2.85Å; S414-E418 PolarHBondContact O-N 2.82Å
415I84.4Confident85.6Confident16 Ų1670.4 Ų70.48%0.08237%0.369CS..Hα-helixtrans-62.2-39.3178.8-62.4167.4000111.3P161 L164 I168 E411 F428P161-I415 HydrophobicContact CB-CG2 4.45Å; L164-I415 HydrophobicContact CD2-CD1 4.19Å; I168-I415 HydrophobicContact CD1-CD1 3.51Å; E411-I415 HydrophobicContact CG-CD1 4.47Å; E411-I415 WeakPolarHBondContact O-CG1 3.5Å; E411-I415 PolarHBondContact O-N 3.38Å; I415-F428 HydrophobicContact CG2-CD1 4.44Å; I415-F428 HydrophobicContact CG2-CE1 3.89Å
416A83.5Confident85.4Confident15 Ų1570.8 Ų70.812%0.12437%0.371CS..Hα-helixtrans-72.6-32.9178.600000112.9D413 S414 E418 Q419 F428 Q432D413-A416 PolarHBondContact O-N 2.74Å; S414-A416 VanDerWaalsContact C-N 3.32Å; S414-A416 PolarHBondContact O-N 2.82Å; A416-E418 VanDerWaalsContact C-N 3.34Å; A416-Q419 WeakPolarHBondContact O-CB 3.24Å; A416-Q419 PolarHBondContact O-N 3.43Å; A416-F428 HydrophobicContact CB-CB 4.26Å; A416-Q432 VanDerWaalsContact CB-NE2 3.29Å
417K81.9Confident85.4Confident134 Ų13471 Ų7158%0.58337%0.367SS*.Hα-helixtrans-67.6-32176.9-81.2167.1169.3160.90113D413 S414 Q419D413-K417 WeakPolarHBondContact O-CB 3.17Å; D413-K417 VanDerWaalsContact O-CG 3.32Å; D413-K417 WeakPolarHBondContact O-CG 3.34Å; D413-K417 PolarHBondContact O-N 3.43Å; D413-K417 WeakPolarHBondContact OD2-CE 3.4Å; D413-K417 IonicContact OD2-NZ 3.97Å; D413-K417 PolarHBondContact OD2-NZ 2.81Å; S414-K417 PolarHBondContact O-N 2.85Å; K417-Q419 PolarHBondContact O-N 3.24Å; K417-Q419 VanDerWaalsContact O-N 3.1Å
418E81.5Confident85.5Confident157 Ų15768 Ų6873%0.73435%0.351SS*.THydrogen-bonded Turntrans-63.3-15.5177.4-157.9176.7-175.100112.5S414 A416 Q420S414-E418 PolarHBondContact O-N 2.82Å; A416-E418 VanDerWaalsContact C-N 3.34Å; E418-Q420 PolarHBondContact O-N 2.73Å
419Q81.6Confident85.6Confident45 Ų4568.3 Ų68.321%0.2135%0.352CS..  trans-78.6109.4-179.4-57-55.5-50.700112.6A416 K417 S424 K425 F428A416-Q419 WeakPolarHBondContact O-CB 3.24Å; A416-Q419 PolarHBondContact O-N 3.43Å; K417-Q419 PolarHBondContact O-N 3.24Å; K417-Q419 VanDerWaalsContact O-N 3.1Å; Q419-S424 PolarHBondContact OE1-OG 3.38Å; Q419-K425 HydrophobicContact CB-CG 4.34Å; Q419-K425 WeakPolarHBondContact O-CE 3.4Å; Q419-F428 HydrophobicContact CG-CD2 3.74Å; Q419-F428 HydrophobicContact CG-CE1 4.43Å; Q419-F428 HydrophobicContact CG-CE2 3.62Å; Q419-F428 HydrophobicContact CG-CG 4.18Å; Q419-F428 HydrophobicContact CG-CZ 3.99Å
420Q73.2Confident85.7Confident185 Ų18571.8 Ų71.886%0.86437%0.372SS*.  trans-75.3-31.2-177-154.4177.49.500113.9E418E418-Q420 PolarHBondContact O-N 2.73Å
421K81.3Confident85.9Confident164 Ų16470.3 Ų70.371%0.71336%0.36SS*.SBendtrans-85.4130.8-176.8-69.3-179.1-178.8176.30112S423 S424 K425K421-S423 VanDerWaalsContact C-N 3.3Å; K421-S423 PolarHBondContact O-N 3.41Å; K421-S424 WeakPolarHBondContact O-CA 3.17Å; K421-S424 WeakPolarHBondContact O-CB 3.19Å; K421-S424 PolarHBondContact O-N 3.48Å; K421-K425 PolarHBondContact O-N 3.35Å
422T78.9Confident86.3Confident98 Ų9865.9 Ų65.960%0.60134%0.339SS*.Hα-helixtrans-53.8-41.4175.7-59.20000113.5S424 K425 I426T422-S424 VanDerWaalsContact C-N 3.28Å; T422-S424 PolarHBondContact O-N 3.05Å; T422-K425 PolarHBondContact O-N 3.37Å; T422-I426 HydrophobicContact CG2-CD1 4.49Å; T422-I426 PolarHBondContact O-N 2.97Å
423S82.4Confident86.6Confident91 Ų9166.5 Ų66.564%0.63634%0.343SS*.Hα-helixtrans-63.4-34.5176.5177.10000112.4K421 V427K421-S423 VanDerWaalsContact C-N 3.3Å; K421-S423 PolarHBondContact O-N 3.41Å; S423-V427 WeakPolarHBondContact O-CG2 3.48Å; S423-V427 PolarHBondContact O-N 3.15Å
424S84.8Confident87Confident26 Ų2667.6 Ų67.618%0.18235%0.354CS..Hα-helixtrans-68.2-44.3175-1650000110.5Q419 K421 T422 I426 V427 F428Q419-S424 PolarHBondContact OE1-OG 3.38Å; K421-S424 WeakPolarHBondContact O-CA 3.17Å; K421-S424 WeakPolarHBondContact O-CB 3.19Å; K421-S424 PolarHBondContact O-N 3.48Å; T422-S424 VanDerWaalsContact C-N 3.28Å; T422-S424 PolarHBondContact O-N 3.05Å; S424-I426 VanDerWaalsContact C-N 3.28Å; S424-I426 PolarHBondContact O-N 2.86Å; S424-V427 PolarHBondContact O-N 3.02Å; S424-F428 VanDerWaalsContact O-CD2 3.32Å; S424-F428 WeakPolarHBondContact O-CD2 3.4Å; S424-F428 PolarHBondContact O-N 3.41Å; S424-F428 WeakPolarHBondContact OG-CE2 3.28Å
425K86.1Confident87.5Confident86 Ų8665.2 Ų65.237%0.37434%0.338SS..Hα-helixtrans-55-41.4177.4-64.5-178.6-178.9-177.10112.9M220 Q419 K421 T422 F429M220-K425 HydrophobicContact CE-CB 4.39Å; Q419-K425 HydrophobicContact CB-CG 4.34Å; Q419-K425 WeakPolarHBondContact O-CE 3.4Å; K421-K425 PolarHBondContact O-N 3.35Å; T422-K425 PolarHBondContact O-N 3.37Å; K425-F429 WeakPolarHBondContact O-CB 3.35Å; K425-F429 PolarHBondContact O-N 3.42Å
426I89.2Confident88Confident76 Ų7664.5 Ų64.539%0.3933%0.334SS..Hα-helixtrans-65.3-44.1176.2-64.7166.7000110.9M220 T422 S424 F429 L430M220-I426 HydrophobicContact CE-CG1 4.37Å; M220-I426 HydrophobicContact SD-CG1 3.57Å; M220-I426 VanDerWaalsContact SD-CG1 3.57Å; T422-I426 HydrophobicContact CG2-CD1 4.49Å; T422-I426 PolarHBondContact O-N 2.97Å; S424-I426 VanDerWaalsContact C-N 3.28Å; S424-I426 PolarHBondContact O-N 2.86Å; I426-F429 PolarHBondContact O-N 3.41Å; I426-L430 HydrophobicContact CG2-CD1 4.29Å; I426-L430 WeakPolarHBondContact O-CG 3.33Å; I426-L430 PolarHBondContact O-N 3.31Å
427V91.6Very high88.7Confident54 Ų5467.1 Ų67.133%0.32735%0.346SS..Hα-helixtrans-61.9-47.4178.4172.10000111.1S423 S424 F429 L430 I431S423-V427 WeakPolarHBondContact O-CG2 3.48Å; S423-V427 PolarHBondContact O-N 3.15Å; S424-V427 PolarHBondContact O-N 3.02Å; V427-F429 VanDerWaalsContact C-N 3.34Å; V427-F429 PolarHBondContact O-N 3.3Å; V427-L430 PolarHBondContact O-N 3.25Å; V427-I431 HydrophobicContact CG1-CD1 3.73Å; V427-I431 HydrophobicContact CG1-CG1 4.44Å; V427-I431 VanDerWaalsContact O-CG1 3.27Å; V427-I431 WeakPolarHBondContact O-CG1 3.2Å; V427-I431 PolarHBondContact O-N 2.97Å
428F91.6Very high89.4Confident4 Ų463.1 Ų63.12%0.01833%0.333CS..Hα-helixtrans-62-41.9176.7-83.7-100.1000111.5P161 Q162 T165 I415 A416 Q419 S424 L430 I431 Q432P161-F428 HydrophobicContact CB-CE1 4.23Å; P161-F428 HydrophobicContact CB-CZ 4.06Å; Q162-F428 HydrophobicContact CG-CE2 4.02Å; Q162-F428 HydrophobicContact CG-CZ 3.89Å; T165-F428 HydrophobicContact CG2-CD1 4.06Å; T165-F428 WeakPolarHBondContact OG1-CD1 3.33Å; T165-F428 WeakPolarHBondContact OG1-CE1 3.47Å; I415-F428 HydrophobicContact CG2-CD1 4.44Å; I415-F428 HydrophobicContact CG2-CE1 3.89Å; A416-F428 HydrophobicContact CB-CB 4.26Å; Q419-F428 HydrophobicContact CG-CD2 3.74Å; Q419-F428 HydrophobicContact CG-CE1 4.43Å; Q419-F428 HydrophobicContact CG-CE2 3.62Å; Q419-F428 HydrophobicContact CG-CG 4.18Å; Q419-F428 HydrophobicContact CG-CZ 3.99Å; S424-F428 VanDerWaalsContact O-CD2 3.32Å; S424-F428 WeakPolarHBondContact O-CD2 3.4Å; S424-F428 PolarHBondContact O-N 3.41Å; S424-F428 WeakPolarHBondContact OG-CE2 3.28Å; F428-L430 PolarHBondContact O-N 3.35Å; F428-I431 PolarHBondContact O-N 3.08Å; F428-Q432 VanDerWaalsContact O-CG 3.25Å; F428-Q432 WeakPolarHBondContact O-CG 3.36Å; F428-Q432 PolarHBondContact O-N 3.35Å
429F92.3Very high90Very high19 Ų1955.7 Ų55.78%0.08330%0.298CS..Hα-helixtrans-57.9-45174172.4-105000112.6F213 K216 I217 M220 K425 I426 V427 I431 Q432 N433F213-F429 HydrophobicContact CD2-CE2 4.48Å; F213-F429 AromaticContact CD2-CZ 3.78Å; F213-F429 HydrophobicContact CD2-CZ 3.78Å; F213-F429 HydrophobicContact CE2-CE1 4.19Å; F213-F429 AromaticContact CE2-CZ 3.62Å; F213-F429 HydrophobicContact CE2-CZ 3.62Å; F213-F429 HydrophobicContact CZ-CZ 4.34Å; K216-F429 HydrophobicContact CB-CD2 3.73Å; K216-F429 HydrophobicContact CB-CE2 3.46Å; K216-F429 VanDerWaalsContact CB-CE2 3.46Å; K216-F429 HydrophobicContact CG-CD2 4.11Å; K216-F429 HydrophobicContact CG-CE2 4.03Å; I217-F429 HydrophobicContact CD1-CE1 4.08Å; I217-F429 HydrophobicContact CD1-CZ 3.92Å; I217-F429 HydrophobicContact CG1-CZ 4.21Å; M220-F429 HydrophobicContact CE-CB 3.82Å; M220-F429 HydrophobicContact CE-CG 4.13Å; K425-F429 WeakPolarHBondContact O-CB 3.35Å; K425-F429 PolarHBondContact O-N 3.42Å; I426-F429 PolarHBondContact O-N 3.41Å; V427-F429 VanDerWaalsContact C-N 3.34Å; V427-F429 PolarHBondContact O-N 3.3Å; F429-I431 VanDerWaalsContact C-N 3.33Å; F429-I431 PolarHBondContact O-N 3.18Å; F429-Q432 PolarHBondContact O-N 2.82Å; F429-N433 WeakPolarHBondContact CD2-ND2 3.38Å; F429-N433 WeakPolarHBondContact CE2-ND2 3.32Å; F429-N433 VanDerWaalsContact CZ-ND2 3.3Å; F429-N433 WeakPolarHBondContact CZ-ND2 3.47Å; F429-N433 PolarHBondContact O-N 3.13Å; F429-N433 VanDerWaalsContact O-N 3.1Å; F429-N433 PolarHBondContact O-ND2 3.22Å
430L94.4Very high90.7Very high108 Ų10854.8 Ų54.857%0.56529%0.293SS*.Hα-helixtrans-63.5-40.6176.7-69.6175.2000111.8I426 V427 F428 N433 A434I426-L430 HydrophobicContact CG2-CD1 4.29Å; I426-L430 WeakPolarHBondContact O-CG 3.33Å; I426-L430 PolarHBondContact O-N 3.31Å; V427-L430 PolarHBondContact O-N 3.25Å; F428-L430 PolarHBondContact O-N 3.35Å; L430-N433 PolarHBondContact O-N 3.13Å; L430-A434 WeakPolarHBondContact O-CB 3.37Å; L430-A434 PolarHBondContact O-N 3.34Å
431I95.1Very high91.8Very high32 Ų3247.9 Ų47.916%0.16427%0.268CS..Hα-helixtrans-65.7-43.8178.1-69.3169.5000111.5Q162 T165 V427 F428 F429 N433 A434 G435Q162-I431 HydrophobicContact CB-CD1 3.77Å; Q162-I431 HydrophobicContact CG-CD1 4.03Å; Q162-I431 WeakPolarHBondContact O-CG2 3.44Å; T165-I431 HydrophobicContact CG2-CG2 4.13Å; V427-I431 HydrophobicContact CG1-CD1 3.73Å; V427-I431 HydrophobicContact CG1-CG1 4.44Å; V427-I431 VanDerWaalsContact O-CG1 3.27Å; V427-I431 WeakPolarHBondContact O-CG1 3.2Å; V427-I431 PolarHBondContact O-N 2.97Å; F428-I431 PolarHBondContact O-N 3.08Å; F429-I431 VanDerWaalsContact C-N 3.33Å; F429-I431 PolarHBondContact O-N 3.18Å; I431-N433 VanDerWaalsContact C-N 3.33Å; I431-N433 PolarHBondContact O-N 3.44Å; I431-A434 PolarHBondContact O-N 3.5Å; I431-G435 PolarHBondContact O-N 2.89Å
432Q94.6Very high92.4Very high4 Ų442.7 Ų42.72%0.01925%0.247CC..Hα-helixtrans-57.2-47.3175.8-72.4177.3-17.300110.9T165 F212 M412 A416 F428 F429 G435 L436T165-Q432 HydrophobicContact CG2-CG 3.44Å; T165-Q432 VanDerWaalsContact CG2-CG 3.44Å; F212-Q432 HydrophobicContact CZ-CB 4.45Å; M412-Q432 HydrophobicContact CE-CB 4.27Å; M412-Q432 HydrophobicContact CE-CG 4.21Å; M412-Q432 HydrophobicContact CG-CG 3.77Å; M412-Q432 PolarHBondContact O-NE2 3.31Å; M412-Q432 HydrophobicContact SD-CB 3.9Å; M412-Q432 HydrophobicContact SD-CG 3.65Å; A416-Q432 VanDerWaalsContact CB-NE2 3.29Å; F428-Q432 VanDerWaalsContact O-CG 3.25Å; F428-Q432 WeakPolarHBondContact O-CG 3.36Å; F428-Q432 PolarHBondContact O-N 3.35Å; F429-Q432 PolarHBondContact O-N 2.82Å; Q432-G435 PolarHBondContact O-N 3.44Å; Q432-L436 VanDerWaalsContact O-CB 3.3Å; Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 PolarHBondContact O-N 3.36Å
433N95.3Very high93.1Very high13 Ų1338 Ų387%0.0722%0.218CC..Hα-helixtrans-63.7-41.5176.5-79.6-86.1000112Y209 F429 L430 I431 L436 L437Y209-N433 VanDerWaalsContact CE2-OD1 3.28Å; Y209-N433 WeakPolarHBondContact CE2-OD1 3.08Å; Y209-N433 PolarHBondContact OH-OD1 2.75Å; F429-N433 WeakPolarHBondContact CD2-ND2 3.38Å; F429-N433 WeakPolarHBondContact CE2-ND2 3.32Å; F429-N433 VanDerWaalsContact CZ-ND2 3.3Å; F429-N433 WeakPolarHBondContact CZ-ND2 3.47Å; F429-N433 PolarHBondContact O-N 3.13Å; F429-N433 VanDerWaalsContact O-N 3.1Å; F429-N433 PolarHBondContact O-ND2 3.22Å; L430-N433 PolarHBondContact O-N 3.13Å; I431-N433 VanDerWaalsContact C-N 3.33Å; I431-N433 PolarHBondContact O-N 3.44Å; N433-L436 PolarHBondContact O-N 2.91Å; N433-L437 VanDerWaalsContact O-CB 3.28Å; N433-L437 WeakPolarHBondContact O-CB 3.47Å; N433-L437 VanDerWaalsContact O-CG 3.27Å; N433-L437 WeakPolarHBondContact O-CG 3.25Å; N433-L437 PolarHBondContact O-N 2.87Å
434A96.8Very high93.5Very high43 Ų4335.5 Ų35.536%0.35520%0.198SC..Hα-helixtrans-61-46.4177.700000111.4Y166 L430 I431 T438Y166-A434 HydrophobicContact CD2-CB 4.38Å; Y166-A434 HydrophobicContact CE2-CB 4.28Å; L430-A434 WeakPolarHBondContact O-CB 3.37Å; L430-A434 PolarHBondContact O-N 3.34Å; I431-A434 PolarHBondContact O-N 3.5Å; A434-T438 WeakPolarHBondContact O-CB 3.22Å; A434-T438 PolarHBondContact O-N 3.05Å; A434-T438 PolarHBondContact O-OG1 2.91Å
435G96.3Very high93.7Very high0 Ų038.9 Ų38.90%021%0.213CC..Hα-helixtrans-60.7-55175.700000111.7G169 L170 I431 Q432 L437 T438 G439G169-G435 VanDerWaalsContact C-C 3.44Å; G169-G435 CarbonylContact O-C 3.59Å; L170-G435 WeakPolarHBondContact CA-O 3.38Å; I431-G435 PolarHBondContact O-N 2.89Å; Q432-G435 PolarHBondContact O-N 3.44Å; G435-L437 PolarHBondContact O-N 3.27Å; G435-T438 PolarHBondContact O-N 3.49Å; G435-T438 VanDerWaalsContact O-N 3.17Å; G435-G439 PolarHBondContact O-N 3.05Å
436L96.3Very high93.7Very high0 Ų036.4 Ų36.40%020%0.204CC..Hα-helixtrans-58.1-47.3-176.2-173.470.2000112.7G169 I172 F205 F208 Y209 F212 Q432 N433 G439 F440G169-L436 VanDerWaalsContact O-CA 3.24Å; G169-L436 WeakPolarHBondContact O-CA 3.48Å; G169-L436 PolarHBondContact O-N 3.32Å; I172-L436 HydrophobicContact CB-CD1 4.02Å; I172-L436 HydrophobicContact CG2-CD1 3.62Å; F205-L436 HydrophobicContact CE2-CD1 4.45Å; F205-L436 HydrophobicContact CZ-CD1 4.39Å; F205-L436 HydrophobicContact CZ-CG 4.03Å; F208-L436 HydrophobicContact CE1-CD1 4.24Å; F208-L436 HydrophobicContact CE1-CD2 4.14Å; Y209-L436 HydrophobicContact CD2-CD2 3.75Å; Y209-L436 HydrophobicContact CE2-CD2 4.14Å; F212-L436 HydrophobicContact CD1-CD2 4.14Å; F212-L436 HydrophobicContact CE1-CD2 4.11Å; Q432-L436 VanDerWaalsContact O-CB 3.3Å; Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 PolarHBondContact O-N 3.36Å; N433-L436 PolarHBondContact O-N 2.91Å; L436-G439 PolarHBondContact O-N 3.17Å; L436-F440 PolarHBondContact O-N 3.04Å; L436-F440 VanDerWaalsContact O-N 3.08Å
437L96.8Very high93.5Very high71 Ų7133.1 Ų33.137%0.37219%0.187SC..Hα-helixtrans-70.8-33.9179.1-67.3176.1000112.4F205 Y209 N433 G435 A441F205-L437 HydrophobicContact CE1-CD2 4.42Å; Y209-L437 HydrophobicContact CD2-CD2 4.16Å; Y209-L437 HydrophobicContact CE1-CD2 4.4Å; Y209-L437 HydrophobicContact CE2-CD1 4.45Å; Y209-L437 HydrophobicContact CE2-CD2 3.81Å; Y209-L437 HydrophobicContact CE2-CG 4.09Å; N433-L437 VanDerWaalsContact O-CB 3.28Å; N433-L437 WeakPolarHBondContact O-CB 3.47Å; N433-L437 VanDerWaalsContact O-CG 3.27Å; N433-L437 WeakPolarHBondContact O-CG 3.25Å; N433-L437 PolarHBondContact O-N 2.87Å; G435-L437 PolarHBondContact O-N 3.27Å; L437-A441 WeakPolarHBondContact O-CB 3.46Å; L437-A441 PolarHBondContact O-N 3.14Å
438T96.7Very high93Very high50 Ų5036 Ų3631%0.30720%0.199SC..Hα-helixtrans-65.3-44.9175.4-59.40000110.4L170 A434 G435 A441 I442L170-T438 HydrophobicContact CD1-CG2 3.9Å; A434-T438 WeakPolarHBondContact O-CB 3.22Å; A434-T438 PolarHBondContact O-N 3.05Å; A434-T438 PolarHBondContact O-OG1 2.91Å; G435-T438 PolarHBondContact O-N 3.49Å; G435-T438 VanDerWaalsContact O-N 3.17Å; T438-A441 PolarHBondContact O-N 3.45Å; T438-I442 HydrophobicContact CG2-CD1 3.93Å; T438-I442 HydrophobicContact CG2-CG1 4.46Å; T438-I442 VanDerWaalsContact O-CG1 3.28Å; T438-I442 WeakPolarHBondContact O-CG1 3.38Å; T438-I442 PolarHBondContact O-N 2.87Å
439G95.9Very high92.4Very high0 Ų040.9 Ų40.90%022%0.22CC..Hα-helixtrans-62.2-45.5178.200000112.2G435 L436 A441 I442 I443G435-G439 PolarHBondContact O-N 3.05Å; L436-G439 PolarHBondContact O-N 3.17Å; G439-A441 PolarHBondContact O-N 3.28Å; G439-I442 PolarHBondContact O-N 2.92Å; G439-I443 PolarHBondContact O-N 2.87Å
440F96.2Very high91.2Very high26 Ų2641.9 Ų41.911%0.11423%0.232CC..Hα-helixtrans-59.8-46.1173.5172.1-98.8000112.6S177 L181 V202 F205 L436 I442 I443 L444S177-F440 WeakPolarHBondContact OG-CA 3.35Å; S177-F440 VanDerWaalsContact OG-CD2 3.26Å; S177-F440 WeakPolarHBondContact OG-CD2 3.04Å; L181-F440 HydrophobicContact CD1-CE2 4.26Å; V202-F440 HydrophobicContact CB-CZ 4.43Å; V202-F440 HydrophobicContact CG1-CZ 4.08Å; V202-F440 HydrophobicContact CG2-CZ 4.04Å; F205-F440 HydrophobicContact CB-CD2 3.9Å; F205-F440 HydrophobicContact CB-CE2 3.56Å; F205-F440 HydrophobicContact CB-CZ 4.41Å; F205-F440 HydrophobicContact CD1-CB 4.4Å; F205-F440 HydrophobicContact CD1-CD1 4.16Å; F205-F440 AromaticContact CD1-CD2 3.37Å; F205-F440 HydrophobicContact CD1-CD2 3.37Å; F205-F440 HydrophobicContact CD1-CE1 4.28Å; F205-F440 AromaticContact CD1-CE2 3.55Å; F205-F440 HydrophobicContact CD1-CE2 3.55Å; F205-F440 AromaticContact CD1-CG 3.71Å; F205-F440 HydrophobicContact CD1-CG 3.71Å; F205-F440 AromaticContact CD1-CZ 4Å; F205-F440 HydrophobicContact CD1-CZ 4Å; F205-F440 HydrophobicContact CD2-CB 4.41Å; F205-F440 AromaticContact CD2-CD2 3.47Å; F205-F440 HydrophobicContact CD2-CD2 3.47Å; F205-F440 VanDerWaalsContact CD2-CD2 3.47Å; F205-F440 HydrophobicContact CD2-CE2 4.08Å; F205-F440 HydrophobicContact CD2-CG 4.19Å; F205-F440 HydrophobicContact CE1-CB 3.78Å; F205-F440 AromaticContact CE1-CD1 3.99Å; F205-F440 HydrophobicContact CE1-CD1 3.99Å; F205-F440 AromaticContact CE1-CD2 3.66Å; F205-F440 HydrophobicContact CE1-CD2 3.66Å; F205-F440 HydrophobicContact CE1-CE2 4.25Å; F205-F440 AromaticContact CE1-CG 3.52Å; F205-F440 HydrophobicContact CE1-CG 3.52Å; F205-F440 HydrophobicContact CE2-CB 3.79Å; F205-F440 AromaticContact CE2-CD2 3.75Å; F205-F440 HydrophobicContact CE2-CD2 3.75Å; F205-F440 HydrophobicContact CE2-CG 4.03Å; F205-F440 AromaticContact CG-CD2 3.27Å; F205-F440 HydrophobicContact CG-CD2 3.27Å; F205-F440 AromaticContact CG-CE2 3.44Å; F205-F440 HydrophobicContact CG-CE2 3.44Å; F205-F440 VanDerWaalsContact CG-CE2 3.44Å; F205-F440 HydrophobicContact CG-CG 4.05Å; F205-F440 HydrophobicContact CG-CZ 4.31Å; F205-F440 HydrophobicContact CZ-CB 3.43Å; F205-F440 VanDerWaalsContact CZ-CB 3.43Å; F205-F440 AromaticContact CZ-CD2 3.84Å; F205-F440 HydrophobicContact CZ-CD2 3.84Å; F205-F440 AromaticContact CZ-CG 3.69Å; F205-F440 HydrophobicContact CZ-CG 3.69Å; L436-F440 PolarHBondContact O-N 3.04Å; L436-F440 VanDerWaalsContact O-N 3.08Å; F440-I442 PolarHBondContact O-N 3.5Å; F440-I443 PolarHBondContact O-N 2.94Å; F440-L444 HydrophobicContact CE1-CB 4.5Å; F440-L444 HydrophobicContact CE1-CD2 3.73Å; F440-L444 HydrophobicContact CZ-CD2 3.89Å; F440-L444 VanDerWaalsContact O-CB 3.24Å; F440-L444 WeakPolarHBondContact O-CB 3.49Å; F440-L444 PolarHBondContact O-N 3.42Å
441A95.3Very high89.4Confident40 Ų4038.8 Ų38.833%0.33123%0.226SC..Hα-helixtrans-62.3-41.2179.700000112.1L437 T438 G439 L444 L445L437-A441 WeakPolarHBondContact O-CB 3.46Å; L437-A441 PolarHBondContact O-N 3.14Å; T438-A441 PolarHBondContact O-N 3.45Å; G439-A441 PolarHBondContact O-N 3.28Å; A441-L444 PolarHBondContact O-N 2.96Å; A441-L445 VanDerWaalsContact O-CB 3.32Å; A441-L445 WeakPolarHBondContact O-CB 3.24Å; A441-L445 WeakPolarHBondContact O-CD1 3.47Å; A441-L445 WeakPolarHBondContact O-CG 3.45Å; A441-L445 PolarHBondContact O-N 2.81Å
442I93.8Very high87.7Confident55 Ų5543.1 Ų43.128%0.28225%0.249SC..Hα-helixtrans-57.5-53.4177.1-71.1164.3000110.3L170 T335 T438 G439 F440 L445 I446L170-I442 HydrophobicContact CD1-CD1 4.15Å; T335-I442 HydrophobicContact CG2-CG2 4.07Å; T438-I442 HydrophobicContact CG2-CD1 3.93Å; T438-I442 HydrophobicContact CG2-CG1 4.46Å; T438-I442 VanDerWaalsContact O-CG1 3.28Å; T438-I442 WeakPolarHBondContact O-CG1 3.38Å; T438-I442 PolarHBondContact O-N 2.87Å; G439-I442 PolarHBondContact O-N 2.92Å; F440-I442 PolarHBondContact O-N 3.5Å; I442-L445 PolarHBondContact O-N 2.68Å; I442-I446 HydrophobicContact CG2-CD1 3.86Å; I442-I446 VanDerWaalsContact O-CG1 3.28Å; I442-I446 WeakPolarHBondContact O-CG1 3.12Å; I442-I446 PolarHBondContact O-N 2.76Å
443I92.9Very high85.8Confident0 Ų046.7 Ų46.70%027%0.268CS..Hα-helixtrans-68.5-38.7-177.6-58.9-58.4000111.8T174 N178 L181 A336 G439 F440 L445 I446 T447T174-I443 HydrophobicContact CG2-CG1 4.28Å; N178-I443 HydrophobicContact CB-CG2 4.48Å; L181-I443 HydrophobicContact CD1-CG2 4.25Å; A336-I443 HydrophobicContact CB-CD1 4.19Å; G439-I443 PolarHBondContact O-N 2.87Å; F440-I443 PolarHBondContact O-N 2.94Å; I443-L445 PolarHBondContact O-N 3.1Å; I443-I446 PolarHBondContact O-N 3.01Å; I443-T447 WeakPolarHBondContact O-CB 3.41Å; I443-T447 PolarHBondContact O-N 3.19Å; I443-T447 PolarHBondContact O-OG1 3.46Å
444L91.6Very high83.3Confident39 Ų3953.3 Ų53.320%0.20430%0.304CS..Hα-helixtrans-61.7-44.7176.1-179.963.5000111.4L181 V198 V202 F440 A441 T447 M448L181-L444 HydrophobicContact CD1-CB 4.37Å; L181-L444 HydrophobicContact CD1-CD1 4.27Å; V198-L444 HydrophobicContact CG1-CD1 3.96Å; V202-L444 HydrophobicContact CG2-CD1 3.64Å; V202-L444 HydrophobicContact CG2-CD2 4.38Å; F440-L444 HydrophobicContact CE1-CB 4.5Å; F440-L444 HydrophobicContact CE1-CD2 3.73Å; F440-L444 HydrophobicContact CZ-CD2 3.89Å; F440-L444 VanDerWaalsContact O-CB 3.24Å; F440-L444 WeakPolarHBondContact O-CB 3.49Å; F440-L444 PolarHBondContact O-N 3.42Å; A441-L444 PolarHBondContact O-N 2.96Å; L444-T447 PolarHBondContact O-N 3.22Å; L444-M448 HydrophobicContact CD1-CG 4.04Å; L444-M448 HydrophobicContact CG-CG 4.29Å; L444-M448 WeakPolarHBondContact O-CB 3.09Å; L444-M448 VanDerWaalsContact O-CG 3.23Å; L444-M448 WeakPolarHBondContact O-CG 3.5Å; L444-M448 PolarHBondContact O-N 3.45Å
445L89.7Confident81Confident97 Ų9755.8 Ų55.851%0.50831%0.31SS..Hα-helixtrans-61.8-47.2177-71.5169.5000110.6A441 I442 I443 T447 M448 F449A441-L445 VanDerWaalsContact O-CB 3.32Å; A441-L445 WeakPolarHBondContact O-CB 3.24Å; A441-L445 WeakPolarHBondContact O-CD1 3.47Å; A441-L445 WeakPolarHBondContact O-CG 3.45Å; A441-L445 PolarHBondContact O-N 2.81Å; I442-L445 PolarHBondContact O-N 2.68Å; I443-L445 PolarHBondContact O-N 3.1Å; L445-T447 VanDerWaalsContact C-N 3.3Å; L445-T447 PolarHBondContact O-N 3.49Å; L445-M448 PolarHBondContact O-N 3.07Å; L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CD2-CD2 4.35Å; L445-F449 HydrophobicContact CD2-CE2 3.81Å; L445-F449 WeakPolarHBondContact O-CB 3.37Å; L445-F449 WeakPolarHBondContact O-CD2 3.37Å; L445-F449 PolarHBondContact O-N 3Å
446I86.4Confident78.1Confident34 Ų3462.1 Ų62.117%0.17438%0.376CS..Hα-helixtrans-58.8-44.6177.9-64.7165.3000110.7L328 I442 I443 A450L328-I446 HydrophobicContact CD1-CG2 4.12Å; L328-I446 HydrophobicContact CD2-CG2 4.15Å; L328-I446 HydrophobicContact CG-CG2 3.93Å; I442-I446 HydrophobicContact CG2-CD1 3.86Å; I442-I446 VanDerWaalsContact O-CG1 3.28Å; I442-I446 WeakPolarHBondContact O-CG1 3.12Å; I442-I446 PolarHBondContact O-N 2.76Å; I443-I446 PolarHBondContact O-N 3.01Å; I446-A450 WeakPolarHBondContact O-CA 3.07Å; I446-A450 WeakPolarHBondContact O-CB 3.47Å; I446-A450 PolarHBondContact O-N 2.68Å; I446-A450 VanDerWaalsContact O-N 3.15Å
447T83.9Confident77.2Confident7 Ų765.3 Ų65.34%0.04340%0.395CS..Hα-helixtrans-64.1-44.1178.9-50.80000112.1L181 Q182 V198 I443 L444 L445 A450L181-T447 HydrophobicContact CB-CG2 4.44Å; Q182-T447 PolarHBondContact NE2-OG1 3.47Å; V198-T447 HydrophobicContact CG2-CG2 4.32Å; I443-T447 WeakPolarHBondContact O-CB 3.41Å; I443-T447 PolarHBondContact O-N 3.19Å; I443-T447 PolarHBondContact O-OG1 3.46Å; L444-T447 PolarHBondContact O-N 3.22Å; L445-T447 VanDerWaalsContact C-N 3.3Å; L445-T447 PolarHBondContact O-N 3.49Å; T447-A450 VanDerWaalsContact O-CB 3.26Å; T447-A450 WeakPolarHBondContact O-CB 3.03Å; T447-A450 PolarHBondContact O-N 3.27Å
448M81.9Confident76.2Confident114 Ų11464.9 Ų64.956%0.56240%0.396SS*.Hα-helixtrans-68.7-38.9-178.9-75.7-68.1-61.900112.8V198 L444 L445 A450V198-M448 HydrophobicContact CG1-SD 3.83Å; L444-M448 HydrophobicContact CD1-CG 4.04Å; L444-M448 HydrophobicContact CG-CG 4.29Å; L444-M448 WeakPolarHBondContact O-CB 3.09Å; L444-M448 VanDerWaalsContact O-CG 3.23Å; L444-M448 WeakPolarHBondContact O-CG 3.5Å; L444-M448 PolarHBondContact O-N 3.45Å; L445-M448 PolarHBondContact O-N 3.07Å; M448-A450 PolarHBondContact O-N 3.04Å
449F78.5Confident75.1Confident106 Ų10665.8 Ų65.847%0.46540%0.401SS..THydrogen-bonded Turntrans-85.23.6179.3-71.2-72000112.7L445 G451 N452 I453L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CD2-CD2 4.35Å; L445-F449 HydrophobicContact CD2-CE2 3.81Å; L445-F449 WeakPolarHBondContact O-CB 3.37Å; L445-F449 WeakPolarHBondContact O-CD2 3.37Å; L445-F449 PolarHBondContact O-N 3Å; F449-G451 VanDerWaalsContact C-N 3.29Å; F449-G451 PolarHBondContact O-N 3.08Å; F449-G451 VanDerWaalsContact O-N 3.15Å; F449-N452 PolarHBondContact O-N 3.43Å; F449-I453 HydrophobicContact CB-CD1 3.94Å; F449-I453 HydrophobicContact CB-CG1 4.23Å; F449-I453 WeakPolarHBondContact O-CG1 3.46Å; F449-I453 PolarHBondContact O-N 3.18Å
450A67.3Low73.8Confident41 Ų4169.6 Ų69.634%0.33942%0.424SS..THydrogen-bonded Turntrans-59.8-37.2-165.600000115.6L328 I446 T447 M448L328-A450 HydrophobicContact CD2-CB 3.4Å; I446-A450 WeakPolarHBondContact O-CA 3.07Å; I446-A450 WeakPolarHBondContact O-CB 3.47Å; I446-A450 PolarHBondContact O-N 2.68Å; I446-A450 VanDerWaalsContact O-N 3.15Å; T447-A450 VanDerWaalsContact O-CB 3.26Å; T447-A450 WeakPolarHBondContact O-CB 3.03Å; T447-A450 PolarHBondContact O-N 3.27Å; M448-A450 PolarHBondContact O-N 3.04Å
451G57.2Low72.4Confident43 Ų4372.4 Ų72.444%0.44344%0.444SS..THydrogen-bonded Turntrans-99.715.6177.300000115.2K193 F449K193-G451 PolarHBondContact NZ-O 2.83Å; F449-G451 VanDerWaalsContact C-N 3.29Å; F449-G451 PolarHBondContact O-N 3.08Å; F449-G451 VanDerWaalsContact O-N 3.15Å
452N57.7Low70.9Confident122 Ų12274.5 Ų74.565%0.65245%0.451SS*.THydrogen-bonded Turntrans-111.3-13173.8-70.4-20.1000112.5F449F449-N452 PolarHBondContact O-N 3.43Å
453I56.7Low69.3Low79 Ų7975.9 Ų75.941%0.40546%0.463SS..  trans-96.499.3179.5-52.6170000107.7L328 F449 L455L328-I453 HydrophobicContact CD1-CD1 4.18Å; F449-I453 HydrophobicContact CB-CD1 3.94Å; F449-I453 HydrophobicContact CB-CG1 4.23Å; F449-I453 WeakPolarHBondContact O-CG1 3.46Å; F449-I453 PolarHBondContact O-N 3.18Å; I453-L455 HydrophobicContact CG2-CD1 4.31Å; I453-L455 HydrophobicContact CG2-CD2 3.74Å; I453-L455 HydrophobicContact CG2-CG 3.65Å; I453-L455 PolarHBondContact O-N 3.44Å
454N41.5Very low67.5Low153 Ų15381.8 Ų81.882%0.81850%0.499SS*.  trans-82.890.8173.1-151.66.7000108.5G456N454-G456 PolarHBondContact O-N 2.86Å; N454-G456 VanDerWaalsContact O-N 3.1Å
455L48.3Very low65.5Low94 Ų9485.3 Ų85.349%0.49252%0.524SS..  trans-83.769.4174.9-66.6175.3000109.8V327 F331 I453V327-L455 HydrophobicContact CG1-CD1 3.89Å; F331-L455 HydrophobicContact CD2-CD1 4.49Å; I453-L455 HydrophobicContact CG2-CD1 4.31Å; I453-L455 HydrophobicContact CG2-CD2 3.74Å; I453-L455 HydrophobicContact CG2-CG 3.65Å; I453-L455 PolarHBondContact O-N 3.44Å
456G36.6Very low63.3Low134 Ų13484.3 Ų84.3100%1.38153%0.525SS*.  trans71.30159.800000116.7N454N454-G456 PolarHBondContact O-N 2.86Å; N454-G456 VanDerWaalsContact O-N 3.1Å

Retrieved 456 of 456 residues in 784.4 ms (Link to these results)