G4VDH8_SCHMA Loading...

Putative cassette chromosome recombinase b

AlphaFold DB , UniProt , Accession G4VDH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 492 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M32.2Very low32.7Very low244 Ų244148.2 Ų148.2100%1.20284%0.839SS**  0129.60-79.1173.783.500107
2F31.9Very low33.3Very low200 Ų200141.3 Ų141.388%0.87782%0.815SS**  trans-50.6140.8167.9-70.4-98.2000110.6
3D33.8Very low33.8Very low153 Ų153140.1 Ų140.182%0.81880%0.803SS**  -175.7144.1101-107.9-19.9000113.2
4D31.2Very low34.4Very low145 Ų145136.9 Ų136.978%0.77578%0.776SS**  trans-61.1142.4172.8-74-50.6000112.8
5S35.7Very low35Very low119 Ų119137.8 Ų137.883%0.83277%0.771SS**  trans-146.595.1142.248.60000110
6V33.3Very low35.5Very low122 Ų122136.7 Ų136.774%0.73976%0.761SS**  trans-72.3127.5158.3174.70000107.6
7S33.8Very low35.6Very low102 Ų102136.1 Ų136.171%0.71376%0.755SS**  trans-15991.6148.754.40000110.6
8D28.9Very low35.6Very low143 Ų143138.1 Ų138.177%0.76576%0.758SS**  5689.8125.9-59.1-25.9000119.7
9V31.5Very low35.4Very low143 Ų143135.4 Ų135.487%0.86775%0.75SS**  trans-135.993.4140.6-175.70000109.4L11V9-L11 PolarHBondContact O-N 2.84Å
10A32Very low35.3Very low94 Ų94134.4 Ų134.478%0.77775%0.75SS**  trans-3.5101.9164.100000117.2A12A10-A12 PolarHBondContact O-N 3.09Å
11L35Very low34.9Very low165 Ų165132.8 Ų132.886%0.86475%0.747SS**  trans-60.8106.9141.3-95.2134.3000106.3V9 D13V9-L11 PolarHBondContact O-N 2.84Å; L11-D13 PolarHBondContact O-N 3.5Å
12A40.2Very low34.8Very low66 Ų66126.7 Ų126.755%0.54572%0.723SS.*  trans-52.7127.9171.900000109A10 F14A10-A12 PolarHBondContact O-N 3.09Å; A12-F14 WeakPolarHBondContact O-CD2 3.4Å; A12-F14 PolarHBondContact O-N 3.27Å
13D40.4Very low34.8Very low125 Ų125124.6 Ų124.667%0.66872%0.721SS**  trans-55.896.7-178.1-66.8-53.1000111.4L11L11-D13 PolarHBondContact O-N 3.5Å
14F42.5Very low34.9Very low95 Ų95123 Ų12342%0.41772%0.717SS.*  trans-9289.4159.9-63.3-78.3000107.1A12 L34 V79 V83A12-F14 WeakPolarHBondContact O-CD2 3.4Å; A12-F14 PolarHBondContact O-N 3.27Å; F14-L34 HydrophobicContact CE1-CD2 3.65Å; F14-L34 HydrophobicContact CE1-CG 4.34Å; F14-L34 HydrophobicContact CZ-CD2 4Å; F14-V79 HydrophobicContact CE1-CG1 4.39Å; F14-V79 HydrophobicContact CZ-CG1 3.79Å; F14-V83 HydrophobicContact CE1-CG2 4Å
15Q42.4Very low35.2Very low151 Ų151121.2 Ų121.271%0.70671%0.713SS**  trans-77127.1165.2-84.3179.9-1400109.1L17Q15-L17 VanDerWaalsContact C-N 3.35Å; Q15-L17 PolarHBondContact O-N 2.99Å; Q15-L17 VanDerWaalsContact O-N 3.08Å
16I43.2Very low35.5Very low120 Ų120124.9 Ų124.962%0.61571%0.714SS**  trans-67.1102.7156.9-61172.3000104.7E18 F32I16-E18 HydrophobicContact CG2-CG 4.38Å; I16-E18 PolarHBondContact O-N 3.13Å; I16-F32 HydrophobicContact CD1-CZ 4.5Å; I16-F32 HydrophobicContact CG1-CE1 3.88Å; I16-F32 HydrophobicContact CG1-CZ 4.24Å
17L37.8Very low36Very low126 Ų126126.4 Ų126.466%0.6672%0.718SS**  trans-68.990.1167-95.7146.3000107.1Q15 S19Q15-L17 VanDerWaalsContact C-N 3.35Å; Q15-L17 PolarHBondContact O-N 2.99Å; Q15-L17 VanDerWaalsContact O-N 3.08Å; L17-S19 PolarHBondContact O-N 3.07Å
18E34.9Very low36.4Very low173 Ų173131.3 Ų131.381%0.80872%0.721SS**  trans-65.186.3150.5-71.6-172.4170.400105.8I16 P20I16-E18 HydrophobicContact CG2-CG 4.38Å; I16-E18 PolarHBondContact O-N 3.13Å; E18-P20 WeakPolarHBondContact O-CD 3.2Å; E18-P20 VanDerWaalsContact O-N 3.08Å
19S32.4Very low37.6Very low87 Ų87125.6 Ų125.661%0.60870%0.696SS**  trans-56.4111.1173.7169.10000108.7L17 C21L17-S19 PolarHBondContact O-N 3.07Å; S19-C21 PolarHBondContact O-N 3.46Å
20P33Very low38.7Very low115 Ų115123.2 Ų123.275%0.74768%0.683SS**  trans-88.791.816529.2-12.5000105E18E18-P20 WeakPolarHBondContact O-CD 3.2Å; E18-P20 VanDerWaalsContact O-N 3.08Å
21C27.5Very low39.6Very low101 Ų101123.4 Ų123.468%0.68267%0.668SS**SBendtrans166.2114.2151.7-87.70000111S19S19-C21 PolarHBondContact O-N 3.46Å
22V29.5Very low40.5Very low116 Ų116118.1 Ų118.170%0.70364%0.638SS**SBendtrans65.2111.6136.1-168.20000117.9
23D32Very low41.1Very low156 Ų156120.3 Ų120.383%0.83464%0.637SS**  trans50.274.8153.9-58.5-30.8000118
24V36.4Very low41.8Very low120 Ų120116 Ų11673%0.72761%0.613SS**  trans-113.9124.5155.1-170.90000107.7F26V24-F26 PolarHBondContact O-N 3.22Å
25P37.3Very low42.4Very low107 Ų107114.8 Ų114.870%0.69561%0.612SS**  trans-59.4133.318023.6-32000110D27P25-D27 PolarHBondContact O-N 3.44Å
26F42.2Very low43Very low196 Ų196109.4 Ų109.486%0.8659%0.587SS**SBendtrans-56.513.1-171.6-106.9-92000117V24V24-F26 PolarHBondContact O-N 3.22Å
27D42.9Very low43.6Very low153 Ų153108.3 Ų108.382%0.81858%0.58SS**SBendtrans-95.48.5-172-86.1-13.9000114.8P25P25-D27 PolarHBondContact O-N 3.44Å
28R43.3Very low44.4Very low206 Ų206102.3 Ų102.378%0.77755%0.548SS*.SBendtrans-137.497.1170.2-63.2-174.6-174.5-176.23.8108.7
29G52.6Low45.4Very low22 Ų22103.1 Ų103.123%0.22754%0.544CS..  trans-53.1176.2171.500000113.7Q31G29-Q31 PolarHBondContact O-N 3.41Å
30P55.4Low46.4Very low94 Ų94102.6 Ų102.661%0.6154%0.537SS*.  trans-56.5123.2-16921.6-32000112.1I90P30-I90 HydrophobicContact CG-CG2 4.26Å
31Q50.2Low47.8Very low97 Ų97100.2 Ų100.245%0.45352%0.522SS..  trans-110.9131.2175.2-70.1-173.87.100110.7G29G29-Q31 PolarHBondContact O-N 3.41Å
32F53.9Low49.2Very low55 Ų55102 Ų10224%0.24152%0.521CS..  trans-82.2131.8171.3-70.9-88.7000110.4I16 V83 L86 N87 I90I16-F32 HydrophobicContact CD1-CZ 4.5Å; I16-F32 HydrophobicContact CG1-CE1 3.88Å; I16-F32 HydrophobicContact CG1-CZ 4.24Å; F32-V83 HydrophobicContact CB-CG1 3.9Å; F32-V83 WeakPolarHBondContact O-CG1 3.23Å; F32-L86 HydrophobicContact CD2-CD2 3.71Å; F32-L86 HydrophobicContact CE2-CD2 3.64Å; F32-L86 HydrophobicContact CG-CD2 4.36Å; F32-L86 HydrophobicContact CZ-CD2 4.2Å; F32-N87 PolarHBondContact N-OD1 3.35Å; F32-N87 PolarHBondContact O-ND2 2.98Å; F32-I90 HydrophobicContact CD2-CD1 3.91Å; F32-I90 HydrophobicContact CE2-CD1 3.54Å
33H53.9Low50.4Low111 Ų11198.4 Ų98.451%0.51450%0.501SS..  trans-119.6148.3174.4-66.4-83.9000111
34L53.8Low51.6Low34 Ų3496.2 Ų96.218%0.17848%0.484CS..  trans-87.9105.2175.3-84158.4000110.1F14 V79 R80 V83F14-L34 HydrophobicContact CE1-CD2 3.65Å; F14-L34 HydrophobicContact CE1-CG 4.34Å; F14-L34 HydrophobicContact CZ-CD2 4Å; L34-V79 HydrophobicContact CD1-CB 4.4Å; L34-V79 HydrophobicContact CD1-CG1 3.99Å; L34-V79 HydrophobicContact CD2-CB 4.44Å; L34-V79 HydrophobicContact CD2-CG1 3.47Å; L34-V79 VanDerWaalsContact CD2-CG1 3.47Å; L34-V79 HydrophobicContact CG-CG1 4.21Å; L34-R80 HydrophobicContact CD1-CB 3.96Å; L34-V83 HydrophobicContact CD1-CG2 4.44Å; L34-V83 HydrophobicContact CG-CG2 4.28Å
35N56.3Low52.4Low71 Ų7195.4 Ų95.438%0.3847%0.471SS..  trans-86.5109170-76.3-22.9000109.4F44N35-F44 HydrophobicContact CB-CB 4.36Å; N35-F44 HydrophobicContact CB-CD1 4.09Å
36L54.8Low53Low37 Ų3797 Ų9719%0.19447%0.469CS..EExtended strand (participates in β ladder)trans-96.6128.2175.8-68.9163.3000109.2C38 K45 F48 I76L36-C38 PolarHBondContact O-N 2.92Å; L36-K45 PolarHBondContact N-O 3.26Å; L36-K45 PolarHBondContact O-N 3.13Å; L36-F48 HydrophobicContact CD1-CD2 3.73Å; L36-F48 HydrophobicContact CD1-CE2 3.75Å; L36-F48 HydrophobicContact CD2-CE2 3.81Å; L36-F48 HydrophobicContact CD2-CZ 4.37Å; L36-F48 HydrophobicContact CG-CE2 4.29Å; L36-I76 HydrophobicContact CD1-CG1 4.45Å
37Q56.4Low53.3Low97 Ų9791.4 Ų91.445%0.45345%0.451SS..EExtended strand (participates in β ladder)trans-73.6125.1178.7-161-179.114.300110.2R39 E42 F44Q37-R39 PolarHBondContact O-N 2.81Å; Q37-E42 HydrophobicContact CG-CB 4.43Å; Q37-E42 WeakPolarHBondContact CG-O 3.45Å; Q37-F44 HydrophobicContact CB-CD1 4.12Å; Q37-F44 HydrophobicContact CB-CE1 3.83Å; Q37-F44 HydrophobicContact CB-CZ 4.33Å; Q37-F44 HydrophobicContact CG-CD1 4.42Å; Q37-F44 HydrophobicContact CG-CE1 4.04Å; Q37-F44 HydrophobicContact CG-CE2 4.43Å; Q37-F44 HydrophobicContact CG-CZ 4.04Å
38C54.2Low53.6Low1 Ų187.3 Ų87.31%0.00743%0.426CS..PPolyproline II helixtrans-65.6118.7174.5179.20000109.7L36 T40 C41 E42 S43 C50L36-C38 PolarHBondContact O-N 2.92Å; C38-T40 PolarHBondContact O-N 3.5Å; C38-C41 PolarHBondContact O-N 3.04Å; C38-C41 VanDerWaalsContact SG-SG 3.63Å; C38-E42 WeakPolarHBondContact O-CA 3.36Å; C38-E42 PolarHBondContact O-N 3.23Å; C38-S43 VanDerWaalsContact CB-O 3.23Å; C38-S43 WeakPolarHBondContact CB-O 3.42Å; C38-S43 PolarHBondContact N-O 3.35Å; C38-C50 HydrophobicContact CB-CB 4.42Å; C38-C50 PolarHBondContact SG-N 2.9Å; C38-C50 VanDerWaalsContact SG-N 3.41Å
39R55.8Low54Low189 Ų18980.2 Ų80.271%0.71341%0.405SS*.THydrogen-bonded Turntrans-65.2-11-177.7-75.8-168.3174-169.2-1115.3Q37Q37-R39 PolarHBondContact O-N 2.81Å
40T53.4Low54.3Low77 Ų7779.3 Ų79.347%0.47240%0.395SS..THydrogen-bonded Turntrans-99.1-33.1-175.8-380000112.7C38 C53C38-T40 PolarHBondContact O-N 3.5Å; T40-C53 HydrophobicContact CG2-CB 4.3Å
41C62.2Low54.2Low64 Ų6478.8 Ų78.843%0.43239%0.393SS..THydrogen-bonded Turntrans-135.68.7-17665.20000113.9C38 S43 C53C38-C41 PolarHBondContact O-N 3.04Å; C38-C41 VanDerWaalsContact SG-SG 3.63Å; C41-S43 PolarHBondContact O-N 3.49Å; C41-S43 PolarHBondContact SG-OG 3.17Å; C41-C53 VanDerWaalsContact SG-SG 3.62Å
42E57.5Low54.4Low140 Ų14078.3 Ų78.365%0.65439%0.394SS*.  trans604.9178.3-62.7-177.4172.600115.8Q37 C38Q37-E42 HydrophobicContact CG-CB 4.43Å; Q37-E42 WeakPolarHBondContact CG-O 3.45Å; C38-E42 WeakPolarHBondContact O-CA 3.36Å; C38-E42 PolarHBondContact O-N 3.23Å
43S53.7Low54.4Low39 Ų3976.5 Ų76.527%0.27339%0.387SS..  trans-71133.2176.5710000111.8C38 C41 K45C38-S43 VanDerWaalsContact CB-O 3.23Å; C38-S43 WeakPolarHBondContact CB-O 3.42Å; C38-S43 PolarHBondContact N-O 3.35Å; C41-S43 PolarHBondContact O-N 3.49Å; C41-S43 PolarHBondContact SG-OG 3.17Å; S43-K45 PolarHBondContact O-N 3.13Å
44F57.1Low54.5Low110 Ų11075.1 Ų75.148%0.48239%0.387SS..EExtended strand (participates in β ladder)trans-79.7116.2175.3-68-86.4000111.1N35 Q37N35-F44 HydrophobicContact CB-CB 4.36Å; N35-F44 HydrophobicContact CB-CD1 4.09Å; Q37-F44 HydrophobicContact CB-CD1 4.12Å; Q37-F44 HydrophobicContact CB-CE1 3.83Å; Q37-F44 HydrophobicContact CB-CZ 4.33Å; Q37-F44 HydrophobicContact CG-CD1 4.42Å; Q37-F44 HydrophobicContact CG-CE1 4.04Å; Q37-F44 HydrophobicContact CG-CE2 4.43Å; Q37-F44 HydrophobicContact CG-CZ 4.04Å
45K52.8Low54.5Low104 Ų10483.3 Ų83.345%0.45242%0.415SS..EExtended strand (participates in β ladder)trans-144.1167.4173.3-69.2-159.5176.7-175.20110.8L36 S43 T47 C50L36-K45 PolarHBondContact N-O 3.26Å; L36-K45 PolarHBondContact O-N 3.13Å; S43-K45 PolarHBondContact O-N 3.13Å; K45-T47 PolarHBondContact O-N 3.37Å; K45-T47 VanDerWaalsContact O-N 3.13Å; K45-C50 HydrophobicContact CD-CB 4.28Å
46E50.8Low54.1Low140 Ų14088 Ų8865%0.65443%0.432SS*.SBendtrans-64.2-13.4-177.5-73.9-172.9137.400114.9
47T48Very low53.4Low79 Ų7993.5 Ų93.549%0.48546%0.462SS..SBendtrans-120.9143.6-177.450.20000112.2K45 V49K45-T47 PolarHBondContact O-N 3.37Å; K45-T47 VanDerWaalsContact O-N 3.13Å; T47-V49 PolarHBondContact O-N 3.43Å; T47-V49 PolarHBondContact OG1-O 2.97Å
48F49.9Very low52.7Low67 Ų6792 Ų9229%0.29446%0.463SS..SBendtrans-56.3-21.1-173-115-95.7000115.3L36 N72 I76L36-F48 HydrophobicContact CD1-CD2 3.73Å; L36-F48 HydrophobicContact CD1-CE2 3.75Å; L36-F48 HydrophobicContact CD2-CE2 3.81Å; L36-F48 HydrophobicContact CD2-CZ 4.37Å; L36-F48 HydrophobicContact CG-CE2 4.29Å; F48-N72 WeakPolarHBondContact CE1-ND2 3.36Å; F48-N72 WeakPolarHBondContact CZ-ND2 3.47Å; F48-I76 HydrophobicContact CD2-CD1 3.49Å; F48-I76 VanDerWaalsContact CD2-CD1 3.49Å; F48-I76 HydrophobicContact CD2-CG1 4.43Å; F48-I76 HydrophobicContact CE2-CD1 3.1Å; F48-I76 HydrophobicContact CE2-CG1 3.69Å; F48-I76 HydrophobicContact CZ-CD1 4.06Å
49V51.7Low52Low56 Ų5697.1 Ų97.134%0.33949%0.489SS..SBendtrans-136.2128174-1730000107.2T47 C53 V54T47-V49 PolarHBondContact O-N 3.43Å; T47-V49 PolarHBondContact OG1-O 2.97Å; V49-C53 HydrophobicContact CG1-CB 3.72Å; V49-V54 HydrophobicContact CB-CG2 4.13Å; V49-V54 HydrophobicContact CG1-CG2 3.76Å
50C57.8Low51Low3 Ų398.4 Ų98.42%0.0250%0.5CS..  trans-70.5151.8179.776.70000110.9C38 K45 D52 C53 V54C38-C50 HydrophobicContact CB-CB 4.42Å; C38-C50 PolarHBondContact SG-N 2.9Å; C38-C50 VanDerWaalsContact SG-N 3.41Å; K45-C50 HydrophobicContact CD-CB 4.28Å; C50-D52 PolarHBondContact O-N 3.32Å; C50-C53 PolarHBondContact O-N 3.03Å; C50-C53 PolarHBondContact SG-SG 3.3Å; C50-V54 PolarHBondContact O-N 3.37Å; C50-V54 VanDerWaalsContact O-N 3.13Å
51C54.8Low50.3Low83 Ų83100.7 Ų100.756%0.56152%0.519SS*.Hα-helixtrans-56.9-26.7-177.3-59.80000113.6R55C51-R55 WeakPolarHBondContact O-CG 3.37Å; C51-R55 PolarHBondContact O-N 3.49Å
52D52.8Low48.9Very low88 Ų88107.2 Ų107.247%0.47154%0.54SS..Hα-helixtrans-75.2-32.4177.8-60.8-42.6000112.7C50 R55C50-D52 PolarHBondContact O-N 3.32Å; D52-R55 PolarHBondContact O-N 3.06Å
53C55.1Low47.7Very low16 Ų16110.1 Ų110.111%0.10855%0.55CS.*Hα-helixtrans-78-29.1175.1-70.80000112.2T40 C41 V49 C50 R55T40-C53 HydrophobicContact CG2-CB 4.3Å; C41-C53 VanDerWaalsContact SG-SG 3.62Å; V49-C53 HydrophobicContact CG1-CB 3.72Å; C50-C53 PolarHBondContact O-N 3.03Å; C50-C53 PolarHBondContact SG-SG 3.3Å; C53-R55 VanDerWaalsContact C-N 3.3Å
54V55.7Low47Very low82 Ų82114.1 Ų114.150%0.49758%0.578SS.*Hα-helixtrans-67.9-31.6171.1176.60000111.5V49 C50V49-V54 HydrophobicContact CB-CG2 4.13Å; V49-V54 HydrophobicContact CG1-CG2 3.76Å; C50-V54 PolarHBondContact O-N 3.37Å; C50-V54 VanDerWaalsContact O-N 3.13Å
55R54.1Low46.1Very low206 Ų206112.2 Ų112.278%0.77759%0.59SS**THydrogen-bonded Turntrans-80.1-8.5-179.5-78177.1177.3165.2-1.8115.1C51 D52 C53C51-R55 WeakPolarHBondContact O-CG 3.37Å; C51-R55 PolarHBondContact O-N 3.49Å; D52-R55 PolarHBondContact O-N 3.06Å; C53-R55 VanDerWaalsContact C-N 3.3Å
56K48.5Very low45.5Very low169 Ų169116 Ų11674%0.73561%0.607SS**THydrogen-bonded Turntrans-108.812.7-171.6-78.1-173.8176.3-178.70115.5S58K56-S58 PolarHBondContact O-N 3.4Å
57D38.3Very low45.4Very low153 Ų153113.3 Ų113.382%0.81860%0.596SS**THydrogen-bonded Turntrans4721.8177.2-82.9-12.9000116.2I59D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 PolarHBondContact O-N 3.3Å; D57-I59 VanDerWaalsContact O-N 3.09Å
58S41.9Very low45.5Very low67 Ų67112.3 Ų112.347%0.46959%0.592SS.*  trans-8963.5175.663.60000109.9K56K56-S58 PolarHBondContact O-N 3.4Å
59I39.1Very low45.7Very low108 Ų108117.9 Ų117.955%0.55462%0.617SS**  trans-126.448.1178.1-42.2-179.5000111.1D57D57-I59 VanDerWaalsContact C-N 3.27Å; D57-I59 PolarHBondContact O-N 3.3Å; D57-I59 VanDerWaalsContact O-N 3.09Å
60F35.6Very low45.9Very low215 Ų215119 Ų11994%0.94363%0.625SS**  trans-154.796.5158.2-71.4-70.3000111.4
61S38.6Very low45.9Very low126 Ų126124.1 Ų124.188%0.88165%0.649SS**  trans-155.3118.4154.9-175.60000111
62K32.4Very low46Very low201 Ų201121.7 Ų121.787%0.87463%0.63SS**  trans-71.6131.3178.9-75.9172.2173.2173.20110.2
63K33.8Very low46.2Very low200 Ų200120 Ų12087%0.8763%0.625SS**  trans-171139.9132.9-105.8166.6-174.1-176.60112.9
64S37.5Very low46.7Very low123 Ų123124.4 Ų124.486%0.8665%0.647SS**  trans75.2122.8169.277.60000117.2
65G39.1Very low47Very low71 Ų71128 Ų12873%0.73265%0.652SS**  trans-71.4150-172.700000114
66K40Very low47.4Very low183 Ų183120 Ų12080%0.79662%0.624SS**  trans169.3124.4143.5-94.8163.9-176.3-1770108.9
67I48.8Very low48.4Very low83 Ų83115.7 Ų115.743%0.42661%0.612SS.*  trans73.9125.4163.2-51.1168.7000114.9Q71I67-Q71 HydrophobicContact CG2-CB 3.43Å; I67-Q71 VanDerWaalsContact CG2-CB 3.43Å
68S50.9Low50Low59 Ų59111 Ų11141%0.41360%0.595SS.*  trans-73.1150.4176.565.20000111P70 Q71 N72S68-P70 VanDerWaalsContact C-N 3.3Å; S68-Q71 WeakPolarHBondContact O-CB 3.06Å; S68-Q71 PolarHBondContact O-N 3.35Å; S68-Q71 WeakPolarHBondContact OG-CG 3.5Å; S68-N72 PolarHBondContact O-N 3.19Å
69F53.9Low51.2Low184 Ų184110.3 Ų110.381%0.80759%0.587SS**Hα-helixtrans-49.2-40179.3-174.4-93.9000114.5Q71 N72 S73F69-Q71 PolarHBondContact O-N 3.49Å; F69-N72 PolarHBondContact O-N 3.46Å; F69-S73 PolarHBondContact O-N 3.44Å; F69-S73 VanDerWaalsContact O-N 3.13Å
70P56.4Low52.6Low80 Ų80111.6 Ų111.652%0.51959%0.585SS.*Hα-helixtrans-60.8-40.7174.9-21.732.7000113.4S68 N72 S73 D74S68-P70 VanDerWaalsContact C-N 3.3Å; P70-N72 VanDerWaalsContact C-N 3.33Å; P70-N72 PolarHBondContact O-N 2.94Å; P70-S73 WeakPolarHBondContact O-CB 3.5Å; P70-S73 PolarHBondContact O-N 3.17Å; P70-D74 PolarHBondContact O-N 2.82Å
71Q57.2Low54.4Low110 Ų110108.6 Ų108.651%0.51457%0.572SS.*Hα-helixtrans-68.6-31.2-178.3-72.4175.3-16.900112.7I67 S68 F69 R75I67-Q71 HydrophobicContact CG2-CB 3.43Å; I67-Q71 VanDerWaalsContact CG2-CB 3.43Å; S68-Q71 WeakPolarHBondContact O-CB 3.06Å; S68-Q71 PolarHBondContact O-N 3.35Å; S68-Q71 WeakPolarHBondContact OG-CG 3.5Å; F69-Q71 PolarHBondContact O-N 3.49Å; Q71-R75 WeakPolarHBondContact O-CG 3.22Å; Q71-R75 PolarHBondContact O-N 3.4Å
72N56.3Low56.1Low32 Ų32106.3 Ų106.317%0.17156%0.556CS.*Hα-helixtrans-74.3-39.1173.9-114.59.7000111.7F48 S68 F69 P70 D74 R75 I76F48-N72 WeakPolarHBondContact CE1-ND2 3.36Å; F48-N72 WeakPolarHBondContact CZ-ND2 3.47Å; S68-N72 PolarHBondContact O-N 3.19Å; F69-N72 PolarHBondContact O-N 3.46Å; P70-N72 VanDerWaalsContact C-N 3.33Å; P70-N72 PolarHBondContact O-N 2.94Å; N72-D74 PolarHBondContact O-N 3.49Å; N72-R75 PolarHBondContact O-N 3.03Å; N72-I76 WeakPolarHBondContact O-CD1 3.42Å; N72-I76 WeakPolarHBondContact O-CG1 3.45Å; N72-I76 PolarHBondContact O-N 3.35Å
73S57Low58Low51 Ų5197.4 Ų97.436%0.35752%0.518SS..Hα-helixtrans-55-49.9172.3157.70000111.7F69 P70 R75 I76 V77F69-S73 PolarHBondContact O-N 3.44Å; F69-S73 VanDerWaalsContact O-N 3.13Å; P70-S73 WeakPolarHBondContact O-CB 3.5Å; P70-S73 PolarHBondContact O-N 3.17Å; S73-R75 VanDerWaalsContact C-N 3.35Å; S73-R75 PolarHBondContact O-N 2.93Å; S73-I76 PolarHBondContact O-N 2.74Å; S73-V77 WeakPolarHBondContact O-CG2 3.13Å; S73-V77 PolarHBondContact O-N 3.24Å
74D66.4Low59.8Low109 Ų10992.5 Ų92.558%0.58350%0.501SS*.Hα-helixtrans-64.9-38-178.3-69-19.5000112.4P70 N72 V77 A78P70-D74 PolarHBondContact O-N 2.82Å; N72-D74 PolarHBondContact O-N 3.49Å; D74-V77 PolarHBondContact O-N 2.98Å; D74-A78 WeakPolarHBondContact O-CB 3.18Å; D74-A78 PolarHBondContact O-N 2.92Å
75R61.7Low61.7Low159 Ų15991 Ų9160%0.648%0.481SS*.Hα-helixtrans-63.3-41.4173.7-75.7-178.188.4178.15.6111.9Q71 N72 S73 V77 A78 V79Q71-R75 WeakPolarHBondContact O-CG 3.22Å; Q71-R75 PolarHBondContact O-N 3.4Å; N72-R75 PolarHBondContact O-N 3.03Å; S73-R75 VanDerWaalsContact C-N 3.35Å; S73-R75 PolarHBondContact O-N 2.93Å; R75-V77 VanDerWaalsContact C-N 3.35Å; R75-V77 PolarHBondContact O-N 3Å; R75-A78 PolarHBondContact O-N 2.92Å; R75-V79 WeakPolarHBondContact O-CB 3.19Å; R75-V79 WeakPolarHBondContact O-CG2 3.45Å; R75-V79 PolarHBondContact O-N 3.41Å
76I62.7Low63.4Low37 Ų3791.8 Ų91.819%0.1947%0.468CS..Hα-helixtrans-63.5-43.1177.1-61.1155.6000110.6L36 F48 N72 S73 V79 R80L36-I76 HydrophobicContact CD1-CG1 4.45Å; F48-I76 HydrophobicContact CD2-CD1 3.49Å; F48-I76 VanDerWaalsContact CD2-CD1 3.49Å; F48-I76 HydrophobicContact CD2-CG1 4.43Å; F48-I76 HydrophobicContact CE2-CD1 3.1Å; F48-I76 HydrophobicContact CE2-CG1 3.69Å; F48-I76 HydrophobicContact CZ-CD1 4.06Å; N72-I76 WeakPolarHBondContact O-CD1 3.42Å; N72-I76 WeakPolarHBondContact O-CG1 3.45Å; N72-I76 PolarHBondContact O-N 3.35Å; S73-I76 PolarHBondContact O-N 2.74Å; I76-V79 PolarHBondContact O-N 3.4Å; I76-R80 WeakPolarHBondContact O-CB 3.39Å; I76-R80 PolarHBondContact O-N 3.21Å
77V69.6Low64.9Low79 Ų7984.4 Ų84.448%0.47944%0.437SS..Hα-helixtrans-64.3-43.2179.1174.20000111S73 D74 R75 R80 K81S73-V77 WeakPolarHBondContact O-CG2 3.13Å; S73-V77 PolarHBondContact O-N 3.24Å; D74-V77 PolarHBondContact O-N 2.98Å; R75-V77 VanDerWaalsContact C-N 3.35Å; R75-V77 PolarHBondContact O-N 3Å; V77-R80 PolarHBondContact O-N 2.91Å; V77-K81 PolarHBondContact O-N 3.41Å
78A71.4Confident66.2Low55 Ų5588.8 Ų88.846%0.45545%0.448SS..Hα-helixtrans-62.1-47.7176.500000111.7D74 R75 R80 K81 S82D74-A78 WeakPolarHBondContact O-CB 3.18Å; D74-A78 PolarHBondContact O-N 2.92Å; R75-A78 PolarHBondContact O-N 2.92Å; A78-R80 PolarHBondContact O-N 2.87Å; A78-K81 WeakPolarHBondContact O-CB 3.19Å; A78-K81 PolarHBondContact O-N 2.91Å; A78-S82 PolarHBondContact O-N 3.24Å; A78-S82 PolarHBondContact O-OG 2.96Å
79V67.6Low67.4Low52 Ų5291.5 Ų91.532%0.31545%0.453SS..Hα-helixtrans-67.2-38.7179.6-179.50000111.1F14 L34 R75 I76 K81 S82 V83F14-V79 HydrophobicContact CE1-CG1 4.39Å; F14-V79 HydrophobicContact CZ-CG1 3.79Å; L34-V79 HydrophobicContact CD1-CB 4.4Å; L34-V79 HydrophobicContact CD1-CG1 3.99Å; L34-V79 HydrophobicContact CD2-CB 4.44Å; L34-V79 HydrophobicContact CD2-CG1 3.47Å; L34-V79 VanDerWaalsContact CD2-CG1 3.47Å; L34-V79 HydrophobicContact CG-CG1 4.21Å; R75-V79 WeakPolarHBondContact O-CB 3.19Å; R75-V79 WeakPolarHBondContact O-CG2 3.45Å; R75-V79 PolarHBondContact O-N 3.41Å; I76-V79 PolarHBondContact O-N 3.4Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 2.89Å; V79-S82 PolarHBondContact O-N 3.27Å; V79-S82 VanDerWaalsContact O-N 3.15Å; V79-V83 HydrophobicContact CG1-CG2 4.34Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.08Å
80R68.5Low68.1Low134 Ų13485 Ų8551%0.50643%0.426SS..Hα-helixtrans-62.8-37.3175-171.4177.2-78.9-179.5-6.1111.6L34 I76 V77 A78 N84L34-R80 HydrophobicContact CD1-CB 3.96Å; I76-R80 WeakPolarHBondContact O-CB 3.39Å; I76-R80 PolarHBondContact O-N 3.21Å; V77-R80 PolarHBondContact O-N 2.91Å; A78-R80 PolarHBondContact O-N 2.87Å; R80-N84 WeakPolarHBondContact O-CB 3.49Å; R80-N84 PolarHBondContact O-N 3.15Å; R80-N84 PolarHBondContact O-ND2 2.95Å
81K73.6Confident68.7Low153 Ų15388.1 Ų88.167%0.66543%0.431SS*.Hα-helixtrans-63.1-45.8170.7-82.9-174.9177.3-179.60112V77 A78 V79 V83 N84 E85V77-K81 PolarHBondContact O-N 3.41Å; A78-K81 WeakPolarHBondContact O-CB 3.19Å; A78-K81 PolarHBondContact O-N 2.91Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 2.89Å; K81-V83 PolarHBondContact O-N 3.45Å; K81-N84 PolarHBondContact O-N 3.37Å; K81-E85 WeakPolarHBondContact O-CB 3.35Å; K81-E85 PolarHBondContact O-N 3.32Å
82S73.6Confident69.4Low78 Ų7887.2 Ų87.255%0.54543%0.433SS..Hα-helixtrans-61.6-42.1178-62.20000112.5A78 V79 E85 L86A78-S82 PolarHBondContact O-N 3.24Å; A78-S82 PolarHBondContact O-OG 2.96Å; V79-S82 PolarHBondContact O-N 3.27Å; V79-S82 VanDerWaalsContact O-N 3.15Å; S82-E85 PolarHBondContact O-N 3.48Å; S82-L86 PolarHBondContact O-N 3.01Å
83V71.5Confident69.8Low14 Ų1492.7 Ų92.79%0.08545%0.452CS..Hα-helixtrans-64.6-43.2176.4169.40000111.2F14 F32 L34 V79 K81 E85 L86 N87F14-V83 HydrophobicContact CE1-CG2 4Å; F32-V83 HydrophobicContact CB-CG1 3.9Å; F32-V83 WeakPolarHBondContact O-CG1 3.23Å; L34-V83 HydrophobicContact CD1-CG2 4.44Å; L34-V83 HydrophobicContact CG-CG2 4.28Å; V79-V83 HydrophobicContact CG1-CG2 4.34Å; V79-V83 WeakPolarHBondContact O-CG2 3.49Å; V79-V83 PolarHBondContact O-N 3.08Å; K81-V83 PolarHBondContact O-N 3.45Å; V83-E85 VanDerWaalsContact C-N 3.33Å; V83-E85 PolarHBondContact O-N 3.29Å; V83-L86 PolarHBondContact O-N 3.37Å; V83-N87 WeakPolarHBondContact O-CB 3.39Å; V83-N87 PolarHBondContact O-N 3.37Å
84N72.7Confident70Confident96 Ų9693.4 Ų93.451%0.51345%0.45SS..Hα-helixtrans-63.9-38.6176.5-73.9-14000112.4R80 K81 R88R80-N84 WeakPolarHBondContact O-CB 3.49Å; R80-N84 PolarHBondContact O-N 3.15Å; R80-N84 PolarHBondContact O-ND2 2.95Å; K81-N84 PolarHBondContact O-N 3.37Å; N84-R88 WeakPolarHBondContact O-CB 3.48Å; N84-R88 PolarHBondContact O-N 3.34Å
85E77.6Confident69.8Low91 Ų9192.1 Ų92.143%0.42545%0.448SS..Hα-helixtrans-66.8-38.5175.2-173.660.3-160.200111.7K81 S82 V83 R88 K89K81-E85 WeakPolarHBondContact O-CB 3.35Å; K81-E85 PolarHBondContact O-N 3.32Å; S82-E85 PolarHBondContact O-N 3.48Å; V83-E85 VanDerWaalsContact C-N 3.33Å; V83-E85 PolarHBondContact O-N 3.29Å; E85-R88 PolarHBondContact O-N 2.95Å; E85-K89 WeakPolarHBondContact O-CG 3.45Å; E85-K89 PolarHBondContact O-N 3.34Å
86L73.4Confident70.1Confident89 Ų8989.6 Ų89.647%0.46645%0.445SS..Hα-helixtrans-63.9-48.2175.3-141.6102000111.3F32 S82 V83 R88 K89 I90F32-L86 HydrophobicContact CD2-CD2 3.71Å; F32-L86 HydrophobicContact CE2-CD2 3.64Å; F32-L86 HydrophobicContact CG-CD2 4.36Å; F32-L86 HydrophobicContact CZ-CD2 4.2Å; S82-L86 PolarHBondContact O-N 3.01Å; V83-L86 PolarHBondContact O-N 3.37Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.36Å; L86-K89 PolarHBondContact O-N 3.15Å; L86-K89 VanDerWaalsContact O-N 3.14Å; L86-I90 HydrophobicContact CD2-CD1 4.33Å; L86-I90 WeakPolarHBondContact O-CG1 3.37Å; L86-I90 PolarHBondContact O-N 2.98Å
87N73.1Confident70Confident28 Ų2893.2 Ų93.215%0.1546%0.464CS..Hα-helixtrans-59.8-37.7176.1-75.2-21.2000111.3F32 V83 K91F32-N87 PolarHBondContact N-OD1 3.35Å; F32-N87 PolarHBondContact O-ND2 2.98Å; V83-N87 WeakPolarHBondContact O-CB 3.39Å; V83-N87 PolarHBondContact O-N 3.37Å; N87-K91 PolarHBondContact O-N 3.01Å; N87-K91 VanDerWaalsContact O-N 3.15Å
88R74.2Confident69.6Low174 Ų17495.2 Ų95.266%0.65747%0.466SS*.Hα-helixtrans-65.4-42.7175.1-176.6-178156.9161.2-4.4112.1N84 E85 L86 K91 V92N84-R88 WeakPolarHBondContact O-CB 3.48Å; N84-R88 PolarHBondContact O-N 3.34Å; E85-R88 PolarHBondContact O-N 2.95Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.36Å; R88-K91 PolarHBondContact O-N 3.14Å; R88-V92 PolarHBondContact O-N 3.21Å
89K76Confident69.1Low117 Ų117100.8 Ų100.851%0.50948%0.48SS..Hα-helixtrans-63-43.1176.9-74.9179.4-179.6-179.90111.8E85 L86 K91 V92 Y93E85-K89 WeakPolarHBondContact O-CG 3.45Å; E85-K89 PolarHBondContact O-N 3.34Å; L86-K89 PolarHBondContact O-N 3.15Å; L86-K89 VanDerWaalsContact O-N 3.14Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 3.34Å; K89-V92 PolarHBondContact O-N 3.22Å; K89-V92 VanDerWaalsContact O-N 3.08Å; K89-Y93 WeakPolarHBondContact O-CD2 3.38Å; K89-Y93 PolarHBondContact O-N 3.18Å
90I70Confident68.8Low48 Ų48101.3 Ų101.325%0.24649%0.486CS..Hα-helixtrans-58.7-43.6177.5-69165000110.9P30 F32 L86 V92 Y93 E94P30-I90 HydrophobicContact CG-CG2 4.26Å; F32-I90 HydrophobicContact CD2-CD1 3.91Å; F32-I90 HydrophobicContact CE2-CD1 3.54Å; L86-I90 HydrophobicContact CD2-CD1 4.33Å; L86-I90 WeakPolarHBondContact O-CG1 3.37Å; L86-I90 PolarHBondContact O-N 2.98Å; I90-V92 PolarHBondContact O-N 3.37Å; I90-Y93 PolarHBondContact O-N 3.17Å; I90-Y93 VanDerWaalsContact O-N 3.09Å; I90-E94 PolarHBondContact O-N 3.33Å; I90-E94 VanDerWaalsContact O-N 3.14Å
91K68.7Low68.5Low145 Ų14598.3 Ų98.363%0.6348%0.483SS*.Hα-helixtrans-61.2-25.4177.7-133.5177.4-174.9-177.80114.2N87 R88 K89N87-K91 PolarHBondContact O-N 3.01Å; N87-K91 VanDerWaalsContact O-N 3.15Å; R88-K91 PolarHBondContact O-N 3.14Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 3.34Å
92V71Confident67.8Low90 Ų9097.7 Ų97.755%0.54548%0.48SS..Hα-helixtrans-81-31176.9174.70000111.8R88 K89 I90 P95R88-V92 PolarHBondContact O-N 3.21Å; K89-V92 PolarHBondContact O-N 3.22Å; K89-V92 VanDerWaalsContact O-N 3.08Å; I90-V92 PolarHBondContact O-N 3.37Å; V92-P95 WeakPolarHBondContact O-CD 3.46Å
93Y65.5Low67.3Low147 Ų147100.3 Ų100.358%0.57648%0.484SS*.Hα-helixtrans-87.1-20.2-178-74.2-70.4000114.2K89 I90 I96 L97K89-Y93 WeakPolarHBondContact O-CD2 3.38Å; K89-Y93 PolarHBondContact O-N 3.18Å; I90-Y93 PolarHBondContact O-N 3.17Å; I90-Y93 VanDerWaalsContact O-N 3.09Å; Y93-I96 HydrophobicContact CD1-CD1 4.42Å; Y93-I96 PolarHBondContact O-N 3.14Å; Y93-L97 PolarHBondContact O-N 3.09Å
94E62.2Low66.9Low67 Ų67103.5 Ų103.531%0.31350%0.504SS..Hα-helixtrans-53.5-46-179.4-172.3173.5-154.800114.2I90 I96 F98I90-E94 PolarHBondContact O-N 3.33Å; I90-E94 VanDerWaalsContact O-N 3.14Å; E94-I96 VanDerWaalsContact C-N 3.32Å; E94-I96 PolarHBondContact O-N 3.18Å; E94-F98 PolarHBondContact O-N 3.08Å
95P62.1Low66.4Low82 Ų82105.2 Ų105.253%0.53251%0.507SS..Hα-helixtrans-70.9-26.8-180-15.530.7000113.6V92 K99V92-P95 WeakPolarHBondContact O-CD 3.46Å; P95-K99 PolarHBondContact O-N 3.38Å
96I66.9Low66Low106 Ų106102.6 Ų102.654%0.54450%0.504SS..Hα-helixtrans-75.5-41.5-177.2-59.4174.5000109.8Y93 E94 S100Y93-I96 HydrophobicContact CD1-CD1 4.42Å; Y93-I96 PolarHBondContact O-N 3.14Å; E94-I96 VanDerWaalsContact C-N 3.32Å; E94-I96 PolarHBondContact O-N 3.18Å; I96-S100 PolarHBondContact O-N 3.36Å; I96-S100 PolarHBondContact O-OG 3.34Å
97L60.5Low66.1Low112 Ų112106.8 Ų106.859%0.58651%0.514SS*.Hα-helixtrans-67.1-39.6175.5-74.9163.7000111.8Y93 S100 V101Y93-L97 PolarHBondContact O-N 3.09Å; L97-S100 PolarHBondContact O-OG 3.27Å; L97-S100 VanDerWaalsContact O-OG 3.07Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.31Å
98F60.5Low66.3Low121 Ų121109.6 Ų109.653%0.53153%0.528SS..Hα-helixtrans-63.7-43.3177.5-111.9-94.9000112.4E94 S100 F102E94-F98 PolarHBondContact O-N 3.08Å; F98-S100 PolarHBondContact O-N 3.33Å; F98-F102 AromaticContact CD1-CD2 3.94Å; F98-F102 HydrophobicContact CD1-CD2 3.94Å; F98-F102 AromaticContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CE1-CD2 4.44Å; F98-F102 AromaticContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CZ 4.44Å; F98-F102 WeakPolarHBondContact O-CD2 3.28Å; F98-F102 PolarHBondContact O-N 3.29Å
99K61.2Low66.5Low172 Ų172107.9 Ų107.975%0.74853%0.528SS*.Hα-helixtrans-65.1-38.9179.5-95.4-177.1175.6178.80113.9P95 H103P95-K99 PolarHBondContact O-N 3.38Å; K99-H103 PolarHBondContact O-N 3.35Å
100S62.1Low66.6Low63 Ų63107.4 Ų107.444%0.44153%0.527SS..Hα-helixtrans-70.6-38.3-178.561.50000112.2I96 L97 F98 T104I96-S100 PolarHBondContact O-N 3.36Å; I96-S100 PolarHBondContact O-OG 3.34Å; L97-S100 PolarHBondContact O-OG 3.27Å; L97-S100 VanDerWaalsContact O-OG 3.07Å; F98-S100 PolarHBondContact O-N 3.33Å; S100-T104 PolarHBondContact O-N 3.48Å; S100-T104 PolarHBondContact O-OG1 2.91Å
101V61.4Low67.3Low72 Ų72110 Ų11044%0.43654%0.541SS..Hα-helixtrans-65.8-48.6179.8173.90000111.1L97 H103 T104 F105L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.31Å; V101-H103 PolarHBondContact O-N 3.26Å; V101-T104 WeakPolarHBondContact O-CB 3.19Å; V101-T104 PolarHBondContact O-N 3.18Å; V101-T104 VanDerWaalsContact O-N 3.14Å; V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.51Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å; V101-F105 PolarHBondContact O-N 3.14Å
102F60.3Low68.1Low139 Ų139107.2 Ų107.261%0.6153%0.533SS*.Hα-helixtrans-63.4-37.3-179.9-88.2-87.3000113.7F98 T104 F105 G106F98-F102 AromaticContact CD1-CD2 3.94Å; F98-F102 HydrophobicContact CD1-CD2 3.94Å; F98-F102 AromaticContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CD1-CE2 3.53Å; F98-F102 HydrophobicContact CE1-CD2 4.44Å; F98-F102 AromaticContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CE2 3.6Å; F98-F102 HydrophobicContact CE1-CZ 4.44Å; F98-F102 WeakPolarHBondContact O-CD2 3.28Å; F98-F102 PolarHBondContact O-N 3.29Å; F102-T104 PolarHBondContact O-N 3.07Å; F102-F105 PolarHBondContact O-N 3.47Å; F102-G106 PolarHBondContact O-N 3.48Å
103H62.1Low69Low134 Ų134107.9 Ų107.962%0.6254%0.537SS*.Hα-helixtrans-68.3-25.7177.9-140.9-46.3000112.8K99 V101K99-H103 PolarHBondContact O-N 3.35Å; V101-H103 PolarHBondContact O-N 3.26Å
104T62.6Low70.1Confident81 Ų81108.3 Ų108.350%0.49754%0.537SS..Hα-helixtrans-75.9-40.5176.4-46.30000110.7S100 V101 F102 R107 I108S100-T104 PolarHBondContact O-N 3.48Å; S100-T104 PolarHBondContact O-OG1 2.91Å; V101-T104 WeakPolarHBondContact O-CB 3.19Å; V101-T104 PolarHBondContact O-N 3.18Å; V101-T104 VanDerWaalsContact O-N 3.14Å; F102-T104 PolarHBondContact O-N 3.07Å; T104-R107 PolarHBondContact O-N 3.3Å; T104-I108 HydrophobicContact CG2-CD1 4.34Å; T104-I108 WeakPolarHBondContact O-CG1 3.48Å; T104-I108 PolarHBondContact O-N 3.36Å; T104-I108 VanDerWaalsContact O-N 3.17Å
105F63.6Low71.5Confident131 Ų131108.4 Ų108.458%0.57554%0.54SS*.Hα-helixtrans-60.3-46.5175.2-83.3-73.1000113.1V101 F102 R107 I108 E109V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.51Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.43Å; V101-F105 PolarHBondContact O-N 3.14Å; F102-F105 PolarHBondContact O-N 3.47Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.24Å; F105-I108 WeakPolarHBondContact O-CB 3.33Å; F105-I108 PolarHBondContact O-N 3.01Å; F105-I108 VanDerWaalsContact O-N 3.08Å; F105-E109 PolarHBondContact O-N 3.17Å; F105-E109 VanDerWaalsContact O-N 3.11Å
106G69.6Low72.9Confident37 Ų37107.7 Ų107.738%0.38154%0.537SS..Hα-helixtrans-62.9-33.917900000113.9F102 E110F102-G106 PolarHBondContact O-N 3.48Å; G106-E110 PolarHBondContact O-N 2.72Å
107R74.2Confident74.2Confident177 Ų177106.1 Ų106.167%0.66854%0.535SS*.Hα-helixtrans-68.6-35.4173.5-75.3-175.5177.8-174.11112.3T104 F105 L111T104-R107 PolarHBondContact O-N 3.3Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.24Å; R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 PolarHBondContact O-N 3.33Å; R107-L111 VanDerWaalsContact O-N 3.07Å
108I76.8Confident75.8Confident86 Ų86105.9 Ų105.944%0.44153%0.534SS..Hα-helixtrans-66.6-42.5177.9-68.6165.6000110.6T104 F105 L111 N112T104-I108 HydrophobicContact CG2-CD1 4.34Å; T104-I108 WeakPolarHBondContact O-CG1 3.48Å; T104-I108 PolarHBondContact O-N 3.36Å; T104-I108 VanDerWaalsContact O-N 3.17Å; F105-I108 WeakPolarHBondContact O-CB 3.33Å; F105-I108 PolarHBondContact O-N 3.01Å; F105-I108 VanDerWaalsContact O-N 3.08Å; I108-L111 PolarHBondContact O-N 3.11Å; I108-N112 PolarHBondContact O-N 3.08Å; I108-N112 PolarHBondContact O-ND2 2.83Å
109E78.3Confident77.4Confident139 Ų139105.9 Ų105.965%0.6554%0.535SS*.Hα-helixtrans-61.9-45.9175.7-84.6179.5157.200112.5F105 L111 N112 V113F105-E109 PolarHBondContact O-N 3.17Å; F105-E109 VanDerWaalsContact O-N 3.11Å; E109-L111 VanDerWaalsContact C-N 3.27Å; E109-L111 PolarHBondContact O-N 3.33Å; E109-N112 PolarHBondContact O-N 3.04Å; E109-V113 WeakPolarHBondContact O-CG2 3.45Å; E109-V113 PolarHBondContact O-N 3.36Å
110E79.9Confident78.9Confident106 Ų106104.1 Ų104.150%0.49553%0.53SS..Hα-helixtrans-62.2-37.4177.6-160.6-172.5164.800111.7G106 V113 R114G106-E110 PolarHBondContact O-N 2.72Å; E110-V113 PolarHBondContact O-N 2.92Å; E110-R114 WeakPolarHBondContact O-CG 3.5Å; E110-R114 PolarHBondContact O-N 3.41Å; E110-R114 VanDerWaalsContact O-N 3.11Å; E110-R114 IonicContact OE1-CZ 3.51Å; E110-R114 IonicContact OE1-NE 3.71Å; E110-R114 IonicContact OE1-NH2 2.73Å; E110-R114 PolarHBondContact OE1-NH2 3.37Å
111L83.3Confident80.5Confident104 Ų104104.4 Ų104.455%0.54553%0.529SS..Hα-helixtrans-65.4-42.4175.1-132.2128.4000111.6R107 I108 E109 V113 R114 I115R107-L111 WeakPolarHBondContact O-CB 3.46Å; R107-L111 PolarHBondContact O-N 3.33Å; R107-L111 VanDerWaalsContact O-N 3.07Å; I108-L111 PolarHBondContact O-N 3.11Å; E109-L111 VanDerWaalsContact C-N 3.27Å; E109-L111 PolarHBondContact O-N 3.33Å; L111-V113 PolarHBondContact O-N 3.41Å; L111-R114 PolarHBondContact O-N 3.17Å; L111-I115 HydrophobicContact CD2-CD1 3.83Å; L111-I115 HydrophobicContact CD2-CG1 4.4Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3Å
112N85.9Confident82.1Confident86 Ų86105.9 Ų105.946%0.4653%0.533SS..Hα-helixtrans-62.9-39.9177.1-76.5-21.8000112.3I108 E109 I115 S116I108-N112 PolarHBondContact O-N 3.08Å; I108-N112 PolarHBondContact O-ND2 2.83Å; E109-N112 PolarHBondContact O-N 3.04Å; N112-I115 PolarHBondContact O-N 3.47Å; N112-S116 WeakPolarHBondContact O-CB 3.48Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 2.73Å
113V89.2Confident83.7Confident103 Ų103105.5 Ų105.562%0.62453%0.533SS*.Hα-helixtrans-64-42.2174.9174.20000110.9E109 E110 L111 S116 S117E109-V113 WeakPolarHBondContact O-CG2 3.45Å; E109-V113 PolarHBondContact O-N 3.36Å; E110-V113 PolarHBondContact O-N 2.92Å; L111-V113 PolarHBondContact O-N 3.41Å; V113-S116 PolarHBondContact O-N 3.48Å; V113-S117 WeakPolarHBondContact O-CB 3.47Å; V113-S117 PolarHBondContact O-N 2.98Å
114R90Very high85.3Confident156 Ų156105.3 Ų105.359%0.58953%0.531SS*.Hα-helixtrans-66.8-40.4176.2-72.5179.2-171.2-171.55.1112.6E110 L111 S117 L118E110-R114 WeakPolarHBondContact O-CG 3.5Å; E110-R114 PolarHBondContact O-N 3.41Å; E110-R114 VanDerWaalsContact O-N 3.11Å; E110-R114 IonicContact OE1-CZ 3.51Å; E110-R114 IonicContact OE1-NE 3.71Å; E110-R114 IonicContact OE1-NH2 2.73Å; E110-R114 PolarHBondContact OE1-NH2 3.37Å; L111-R114 PolarHBondContact O-N 3.17Å; R114-S117 PolarHBondContact O-N 3.43Å; R114-L118 WeakPolarHBondContact O-CB 3.27Å; R114-L118 WeakPolarHBondContact O-CG 3.46Å; R114-L118 PolarHBondContact O-N 3.4Å
115I91.3Very high86.9Confident70 Ų70105.5 Ų105.536%0.35953%0.528SS..Hα-helixtrans-58.8-49.8173.7-72.5167.4000109.5L111 N112 S117 L118 E119L111-I115 HydrophobicContact CD2-CD1 3.83Å; L111-I115 HydrophobicContact CD2-CG1 4.4Å; L111-I115 VanDerWaalsContact O-CG1 3.3Å; L111-I115 WeakPolarHBondContact O-CG1 3.42Å; L111-I115 PolarHBondContact O-N 3Å; N112-I115 PolarHBondContact O-N 3.47Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 2.83Å; I115-L118 WeakPolarHBondContact O-CB 3.46Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.1Å; I115-E119 HydrophobicContact CG2-CG 4.27Å; I115-E119 WeakPolarHBondContact O-CG 3.3Å; I115-E119 PolarHBondContact O-N 2.99Å
116S91.9Very high88.4Confident67 Ų67103.4 Ų103.447%0.46953%0.526SS..Hα-helixtrans-59.8-40.4179.8-55.70000112.2N112 V113 E119 H120N112-S116 WeakPolarHBondContact O-CB 3.48Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 2.73Å; V113-S116 PolarHBondContact O-N 3.48Å; S116-E119 PolarHBondContact O-N 3.48Å; S116-H120 PolarHBondContact O-N 3.07Å
117S93.9Very high89.7Confident73 Ų73108.1 Ų108.151%0.5154%0.536SS..Hα-helixtrans-65.4-41.3175.2179.90000112.6V113 R114 I115 H120 T121V113-S117 WeakPolarHBondContact O-CB 3.47Å; V113-S117 PolarHBondContact O-N 2.98Å; R114-S117 PolarHBondContact O-N 3.43Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 2.83Å; S117-H120 PolarHBondContact O-N 3.26Å; S117-T121 WeakPolarHBondContact O-CB 3.49Å; S117-T121 PolarHBondContact O-N 3.1Å; S117-T121 PolarHBondContact O-OG1 2.93Å
118L92.9Very high90.7Very high107 Ų107102.9 Ų102.956%0.5652%0.52SS*.Hα-helixtrans-64.9-43.3175-82.8164.9000111.7R114 I115 H120 T121 I122R114-L118 WeakPolarHBondContact O-CB 3.27Å; R114-L118 WeakPolarHBondContact O-CG 3.46Å; R114-L118 PolarHBondContact O-N 3.4Å; I115-L118 WeakPolarHBondContact O-CB 3.46Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.1Å; L118-H120 VanDerWaalsContact C-N 3.34Å; L118-H120 PolarHBondContact O-N 2.9Å; L118-T121 PolarHBondContact O-N 3.32Å; L118-I122 WeakPolarHBondContact O-CB 3.49Å; L118-I122 VanDerWaalsContact O-CG1 3.27Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.22Å
119E93.8Very high91.6Very high120 Ų120102.8 Ų102.856%0.56152%0.521SS*.Hα-helixtrans-58.4-46.5175.6-73.917616100111.1I115 S116 T121 I122 E123I115-E119 HydrophobicContact CG2-CG 4.27Å; I115-E119 WeakPolarHBondContact O-CG 3.3Å; I115-E119 PolarHBondContact O-N 2.99Å; S116-E119 PolarHBondContact O-N 3.48Å; E119-T121 VanDerWaalsContact C-N 3.32Å; E119-T121 PolarHBondContact O-N 2.8Å; E119-I122 PolarHBondContact O-N 3.47Å; E119-E123 WeakPolarHBondContact O-CB 3.33Å; E119-E123 PolarHBondContact O-N 3.44Å
120H94.2Very high92.4Very high136 Ų13698.6 Ų98.663%0.6351%0.506SS*.Hα-helixtrans-63.8-37.8177.5-152.461.3000112.4S116 S117 L118 E123 F124S116-H120 PolarHBondContact O-N 3.07Å; S117-H120 PolarHBondContact O-N 3.26Å; L118-H120 VanDerWaalsContact C-N 3.34Å; L118-H120 PolarHBondContact O-N 2.9Å; H120-E123 PolarHBondContact O-N 2.83Å; H120-F124 WeakPolarHBondContact O-CB 3.49Å; H120-F124 PolarHBondContact O-N 2.84Å
121T94.7Very high93.2Very high69 Ų6998 Ų9842%0.42350%0.504SS..Hα-helixtrans-67.3-42.4176.1-54.50000111.5S117 L118 E119 E123 F124 L125S117-T121 WeakPolarHBondContact O-CB 3.49Å; S117-T121 PolarHBondContact O-N 3.1Å; S117-T121 PolarHBondContact O-OG1 2.93Å; L118-T121 PolarHBondContact O-N 3.32Å; E119-T121 VanDerWaalsContact C-N 3.32Å; E119-T121 PolarHBondContact O-N 2.8Å; T121-E123 VanDerWaalsContact C-N 3.34Å; T121-F124 PolarHBondContact O-N 3.29Å; T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.45Å; T121-L125 WeakPolarHBondContact O-CB 3.42Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.46Å; T121-L125 PolarHBondContact O-N 2.93Å
122I94.8Very high93.8Very high102 Ų10299 Ų9952%0.52350%0.504SS..Hα-helixtrans-60.7-46.7175.1-71.6166.7000109.4L118 E119 F124 L125 T126L118-I122 WeakPolarHBondContact O-CB 3.49Å; L118-I122 VanDerWaalsContact O-CG1 3.27Å; L118-I122 WeakPolarHBondContact O-CG1 3.37Å; L118-I122 PolarHBondContact O-N 3.22Å; E119-I122 PolarHBondContact O-N 3.47Å; I122-F124 PolarHBondContact O-N 2.97Å; I122-L125 PolarHBondContact O-N 3.44Å; I122-T126 WeakPolarHBondContact O-CB 3.31Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 3.34Å
123E94.8Very high94.3Very high132 Ų132103.8 Ų103.862%0.61752%0.515SS*.Hα-helixtrans-60.9-46179.5-165.2176.3-16600111.8E119 H120 T121 T126 K127E119-E123 WeakPolarHBondContact O-CB 3.33Å; E119-E123 PolarHBondContact O-N 3.44Å; H120-E123 PolarHBondContact O-N 2.83Å; T121-E123 VanDerWaalsContact C-N 3.34Å; E123-T126 PolarHBondContact O-N 3.29Å; E123-K127 PolarHBondContact O-N 2.94Å
124F95.8Very high94.6Very high129 Ų129104.8 Ų104.857%0.56651%0.511SS*.Hα-helixtrans-59-50175.1177.1-98.1000112.4H120 T121 I122 T126 K127 M128H120-F124 WeakPolarHBondContact O-CB 3.49Å; H120-F124 PolarHBondContact O-N 2.84Å; T121-F124 PolarHBondContact O-N 3.29Å; I122-F124 PolarHBondContact O-N 2.97Å; F124-T126 VanDerWaalsContact C-N 3.28Å; F124-T126 PolarHBondContact O-N 2.59Å; F124-K127 PolarHBondContact O-N 3.47Å; F124-M128 HydrophobicContact CE1-SD 4.29Å; F124-M128 HydrophobicContact CZ-SD 4.4Å; F124-M128 WeakPolarHBondContact O-CB 3.45Å; F124-M128 PolarHBondContact O-N 3.44Å
125L95.3Very high94.9Very high85 Ų85103.8 Ų103.845%0.44551%0.511SS..Hα-helixtrans-63.2-36179-72.4176.2000111.9T121 I122 M128 N129T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.45Å; T121-L125 WeakPolarHBondContact O-CB 3.42Å; T121-L125 VanDerWaalsContact O-CG 3.31Å; T121-L125 WeakPolarHBondContact O-CG 3.46Å; T121-L125 PolarHBondContact O-N 2.93Å; I122-L125 PolarHBondContact O-N 3.44Å; L125-M128 PolarHBondContact O-N 3.36Å; L125-N129 VanDerWaalsContact O-CB 3.32Å; L125-N129 WeakPolarHBondContact O-CB 3.39Å; L125-N129 PolarHBondContact O-N 3.08Å
126T95.8Very high95.1Very high87 Ų87104.5 Ų104.553%0.53452%0.515SS..Hα-helixtrans-65.4-45.6177.5-510000110.5I122 E123 F124 N129 S130I122-T126 WeakPolarHBondContact O-CB 3.31Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 3.34Å; E123-T126 PolarHBondContact O-N 3.29Å; F124-T126 VanDerWaalsContact C-N 3.28Å; F124-T126 PolarHBondContact O-N 2.59Å; T126-N129 PolarHBondContact O-N 2.86Å; T126-S130 PolarHBondContact O-N 3.02Å
127K95.9Very high95.3Very high137 Ų137106.9 Ų106.960%0.59652%0.519SS*.Hα-helixtrans-61-47.5175.1-172177-179.9179.40111.2E123 F124 N129 S130 E131E123-K127 PolarHBondContact O-N 2.94Å; F124-K127 PolarHBondContact O-N 3.47Å; K127-N129 PolarHBondContact O-N 3.43Å; K127-S130 WeakPolarHBondContact O-CB 3.41Å; K127-S130 PolarHBondContact O-N 3.45Å; K127-S130 VanDerWaalsContact O-N 3.12Å; K127-S130 PolarHBondContact O-OG 2.96Å; K127-E131 PolarHBondContact O-N 3.44Å; K127-E131 VanDerWaalsContact O-N 3.08Å
128M96.5Very high95.5Very high66 Ų66111.2 Ų111.233%0.32552%0.524SS..Hα-helixtrans-65.5-38.2-178.9-150.8-165.555.200112.3F124 L125 E131 K132F124-M128 HydrophobicContact CE1-SD 4.29Å; F124-M128 HydrophobicContact CZ-SD 4.4Å; F124-M128 WeakPolarHBondContact O-CB 3.45Å; F124-M128 PolarHBondContact O-N 3.44Å; L125-M128 PolarHBondContact O-N 3.36Å; M128-E131 PolarHBondContact O-N 3.42Å; M128-K132 PolarHBondContact O-N 3.02Å
129N94.5Very high95.6Very high85 Ų85110.4 Ų110.446%0.45552%0.523SS..Hα-helixtrans-64-39171.9-94-26.7000112.2L125 T126 K127 E131 K132 R133L125-N129 VanDerWaalsContact O-CB 3.32Å; L125-N129 WeakPolarHBondContact O-CB 3.39Å; L125-N129 PolarHBondContact O-N 3.08Å; T126-N129 PolarHBondContact O-N 2.86Å; K127-N129 PolarHBondContact O-N 3.43Å; N129-E131 VanDerWaalsContact C-N 3.31Å; N129-E131 PolarHBondContact O-N 3.37Å; N129-K132 PolarHBondContact O-N 2.87Å; N129-R133 WeakPolarHBondContact O-CB 3.45Å; N129-R133 WeakPolarHBondContact O-CG 3.33Å; N129-R133 PolarHBondContact O-N 3.14Å
130S95.8Very high95.8Very high50 Ų50112.4 Ų112.435%0.3553%0.526SS..Hα-helixtrans-61.8-40176.385.40000111.8T126 K127 R133 K134T126-S130 PolarHBondContact O-N 3.02Å; K127-S130 WeakPolarHBondContact O-CB 3.41Å; K127-S130 PolarHBondContact O-N 3.45Å; K127-S130 VanDerWaalsContact O-N 3.12Å; K127-S130 PolarHBondContact O-OG 2.96Å; S130-R133 PolarHBondContact O-N 2.66Å; S130-K134 WeakPolarHBondContact O-CG 3.47Å; S130-K134 PolarHBondContact O-N 3.12Å
131E96.4Very high95.9Very high94 Ų94110.3 Ų110.344%0.43952%0.516SS..Hα-helixtrans-68.8-42.9176.9-71.4-178-177.900112.1K127 M128 N129 R133 K134 K135K127-E131 PolarHBondContact O-N 3.44Å; K127-E131 VanDerWaalsContact O-N 3.08Å; M128-E131 PolarHBondContact O-N 3.42Å; N129-E131 VanDerWaalsContact C-N 3.31Å; N129-E131 PolarHBondContact O-N 3.37Å; E131-R133 VanDerWaalsContact C-N 3.34Å; E131-R133 PolarHBondContact O-N 3.37Å; E131-K134 PolarHBondContact O-N 3.26Å; E131-K135 PolarHBondContact O-N 3.48Å
132K95.8Very high96Very high125 Ų125109.7 Ų109.754%0.54352%0.518SS..Hα-helixtrans-60.9-42174.3-76.4-173.3177.7-1780111.6M128 N129 K135 L136M128-K132 PolarHBondContact O-N 3.02Å; N129-K132 PolarHBondContact O-N 2.87Å; K132-K135 PolarHBondContact O-N 2.91Å; K132-L136 WeakPolarHBondContact O-CB 3.32Å; K132-L136 PolarHBondContact O-N 2.9Å
133R95.9Very high96Very high186 Ų186111.3 Ų111.370%0.70253%0.525SS*.Hα-helixtrans-61.2-43.8174.6-74.6178.7-176.7-175.62.1111.9N129 S130 E131 L136 Q137N129-R133 WeakPolarHBondContact O-CB 3.45Å; N129-R133 WeakPolarHBondContact O-CG 3.33Å; N129-R133 PolarHBondContact O-N 3.14Å; S130-R133 PolarHBondContact O-N 2.66Å; E131-R133 VanDerWaalsContact C-N 3.34Å; E131-R133 PolarHBondContact O-N 3.37Å; R133-L136 PolarHBondContact O-N 3.3Å; R133-Q137 PolarHBondContact O-N 2.92Å
134K96.5Very high96Very high124 Ų124109.2 Ų109.254%0.53952%0.522SS..Hα-helixtrans-61.2-44174.8-73.8175.1-177.6176.90112S130 E131 Q137 R138S130-K134 WeakPolarHBondContact O-CG 3.47Å; S130-K134 PolarHBondContact O-N 3.12Å; E131-K134 PolarHBondContact O-N 3.26Å; K134-Q137 PolarHBondContact O-N 2.95Å; K134-R138 WeakPolarHBondContact O-CG 3.35Å; K134-R138 PolarHBondContact O-N 3.35Å; K134-R138 VanDerWaalsContact O-N 3.14Å
135K96.7Very high96.1Very high136 Ų136111.3 Ų111.359%0.59153%0.526SS*.Hα-helixtrans-62-46.2175.8-75.1-178.6-180178.30111.5E131 K132 Q137 R138 V139E131-K135 PolarHBondContact O-N 3.48Å; K132-K135 PolarHBondContact O-N 2.91Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 2.91Å; K135-R138 PolarHBondContact O-N 3.42Å; K135-V139 WeakPolarHBondContact O-CG2 3.5Å; K135-V139 PolarHBondContact O-N 3.47Å
136L95.3Very high96.1Very high84 Ų84111.4 Ų111.444%0.4453%0.533SS..Hα-helixtrans-58.9-41.7176.9-176.966.4000111.8K132 R133 R138 V139 R140K132-L136 WeakPolarHBondContact O-CB 3.32Å; K132-L136 PolarHBondContact O-N 2.9Å; R133-L136 PolarHBondContact O-N 3.3Å; L136-R138 PolarHBondContact O-N 2.91Å; L136-V139 PolarHBondContact O-N 3.17Å; L136-R140 WeakPolarHBondContact O-CG 3.44Å; L136-R140 PolarHBondContact O-N 2.97Å
137Q96.4Very high96.1Very high117 Ų117112.7 Ų112.755%0.54753%0.532SS..Hα-helixtrans-63.4-39.6177.4-168.4174.84.600112.3R133 K134 K135 R140 Q141R133-Q137 PolarHBondContact O-N 2.92Å; K134-Q137 PolarHBondContact O-N 2.95Å; K135-Q137 VanDerWaalsContact C-N 3.3Å; K135-Q137 PolarHBondContact O-N 2.91Å; Q137-R140 PolarHBondContact O-N 3.38Å; Q137-Q141 WeakPolarHBondContact O-CG 3.4Å; Q137-Q141 PolarHBondContact O-N 3.32Å
138R97.1Very high96.1Very high165 Ų165109.5 Ų109.562%0.62352%0.524SS*.Hα-helixtrans-64.3-42.8174.3-66.2180-151.5170.93.4112.1K134 K135 L136 Q141 A142K134-R138 WeakPolarHBondContact O-CG 3.35Å; K134-R138 PolarHBondContact O-N 3.35Å; K134-R138 VanDerWaalsContact O-N 3.14Å; K135-R138 PolarHBondContact O-N 3.42Å; L136-R138 PolarHBondContact O-N 2.91Å; R138-Q141 PolarHBondContact O-N 3.3Å; R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.03Å
139V96.2Very high96.1Very high90 Ų90109.2 Ų109.255%0.54553%0.529SS..Hα-helixtrans-62.8-43.9176.71740000110.6K135 L136 Q141 A142 M143K135-V139 WeakPolarHBondContact O-CG2 3.5Å; K135-V139 PolarHBondContact O-N 3.47Å; L136-V139 PolarHBondContact O-N 3.17Å; V139-Q141 PolarHBondContact O-N 2.95Å; V139-A142 PolarHBondContact O-N 3.27Å; V139-M143 WeakPolarHBondContact O-CB 3.46Å; V139-M143 PolarHBondContact O-N 3.42Å
140R96.6Very high96.2Very high161 Ų161107.9 Ų107.961%0.60853%0.526SS*.Hα-helixtrans-59.1-45.8174.8-74.5177.5178.2173-2.2111.8L136 Q137 A142 M143 T144L136-R140 WeakPolarHBondContact O-CG 3.44Å; L136-R140 PolarHBondContact O-N 2.97Å; Q137-R140 PolarHBondContact O-N 3.38Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 3.05Å; R140-M143 WeakPolarHBondContact O-CB 3.49Å; R140-M143 PolarHBondContact O-N 2.93Å; R140-T144 PolarHBondContact O-N 3.24Å; R140-T144 PolarHBondContact O-OG1 3.46Å
141Q97Very high96.1Very high93 Ų93109.5 Ų109.544%0.43553%0.528SS..Hα-helixtrans-61.4-40.6175.7-74174.8-6.800112.5Q137 R138 V139 T144 R145Q137-Q141 WeakPolarHBondContact O-CG 3.4Å; Q137-Q141 PolarHBondContact O-N 3.32Å; R138-Q141 PolarHBondContact O-N 3.3Å; V139-Q141 PolarHBondContact O-N 2.95Å; Q141-T144 PolarHBondContact O-N 2.86Å; Q141-R145 WeakPolarHBondContact O-CG 3.45Å; Q141-R145 PolarHBondContact O-N 2.98Å
142A96.4Very high96.1Very high56 Ų56110.5 Ų110.546%0.46353%0.533SS..Hα-helixtrans-64.6-41.6175.600000111.7R138 V139 R140 R145 C146R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.03Å; V139-A142 PolarHBondContact O-N 3.27Å; R140-A142 VanDerWaalsContact C-N 3.34Å; R140-A142 PolarHBondContact O-N 3.05Å; A142-R145 PolarHBondContact O-N 2.93Å; A142-C146 WeakPolarHBondContact O-CB 3.38Å; A142-C146 PolarHBondContact O-N 3.47Å
143M94.6Very high96.1Very high135 Ų135109.8 Ų109.867%0.66554%0.535SS*.Hα-helixtrans-62.1-43.1175.6-173.3176.9-88.100111.3V139 R140 R145 C146 H147V139-M143 WeakPolarHBondContact O-CB 3.46Å; V139-M143 PolarHBondContact O-N 3.42Å; R140-M143 WeakPolarHBondContact O-CB 3.49Å; R140-M143 PolarHBondContact O-N 2.93Å; M143-R145 PolarHBondContact O-N 3.29Å; M143-C146 PolarHBondContact O-N 2.8Å; M143-H147 WeakPolarHBondContact O-CB 3.48Å; M143-H147 PolarHBondContact O-N 3.42Å
144T96.1Very high96.1Very high89 Ų89105.1 Ų105.155%0.54652%0.523SS..Hα-helixtrans-60.8-44.5174.5-45.90000111.7R140 Q141 C146 H147 T148R140-T144 PolarHBondContact O-N 3.24Å; R140-T144 PolarHBondContact O-OG1 3.46Å; Q141-T144 PolarHBondContact O-N 2.86Å; T144-C146 PolarHBondContact O-N 2.91Å; T144-H147 PolarHBondContact O-N 3.44Å; T144-T148 PolarHBondContact O-N 3.2Å; T144-T148 PolarHBondContact O-OG1 3.45Å
145R96.7Very high96Very high173 Ų173106 Ų10665%0.65353%0.527SS*.Hα-helixtrans-62.9-42177-70.2175.7-168.7175.62.9112.5Q141 A142 M143 H147 T148 S149Q141-R145 WeakPolarHBondContact O-CG 3.45Å; Q141-R145 PolarHBondContact O-N 2.98Å; A142-R145 PolarHBondContact O-N 2.93Å; M143-R145 PolarHBondContact O-N 3.29Å; R145-H147 VanDerWaalsContact C-N 3.35Å; R145-T148 PolarHBondContact O-N 3.49Å; R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.4Å; R145-S149 PolarHBondContact O-OG 3.04Å
146C95.7Very high95.9Very high87 Ų87105 Ų10559%0.58852%0.524SS*.Hα-helixtrans-61.2-46.3175.8-172.50000110.5A142 M143 T144 T148 S149 S150A142-C146 WeakPolarHBondContact O-CB 3.38Å; A142-C146 PolarHBondContact O-N 3.47Å; M143-C146 PolarHBondContact O-N 2.8Å; T144-C146 PolarHBondContact O-N 2.91Å; C146-T148 PolarHBondContact O-N 3.19Å; C146-S149 PolarHBondContact O-N 2.9Å; C146-S150 WeakPolarHBondContact O-CB 3.47Å; C146-S150 PolarHBondContact O-N 2.95Å
147H95.8Very high95.9Very high113 Ų113106.8 Ų106.852%0.52353%0.53SS..Hα-helixtrans-59.8-45.7176.5-172.177.3000112.1M143 T144 R145 S149 S150 Q151M143-H147 WeakPolarHBondContact O-CB 3.48Å; M143-H147 PolarHBondContact O-N 3.42Å; T144-H147 PolarHBondContact O-N 3.44Å; R145-H147 VanDerWaalsContact C-N 3.35Å; H147-S149 VanDerWaalsContact C-N 3.33Å; H147-S149 PolarHBondContact O-N 3.33Å; H147-S150 PolarHBondContact O-N 3.08Å; H147-Q151 WeakPolarHBondContact O-CG 3.49Å; H147-Q151 PolarHBondContact O-N 3.48Å
148T96.6Very high95.7Very high70 Ų70103.4 Ų103.443%0.42952%0.522SS..Hα-helixtrans-60.8-41.3175.4-50.40000112.3T144 R145 C146 Q151 Q152T144-T148 PolarHBondContact O-N 3.2Å; T144-T148 PolarHBondContact O-OG1 3.45Å; R145-T148 PolarHBondContact O-N 3.49Å; C146-T148 PolarHBondContact O-N 3.19Å; T148-Q151 PolarHBondContact O-N 2.88Å; T148-Q152 WeakPolarHBondContact O-CG 3.5Å; T148-Q152 PolarHBondContact O-N 2.95Å
149S96.2Very high95.5Very high60 Ų6099.4 Ų99.442%0.4251%0.513SS..Hα-helixtrans-66.1-40.8178.4-53.70000111.4R145 C146 H147 Q152 L153R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.4Å; R145-S149 PolarHBondContact O-OG 3.04Å; C146-S149 PolarHBondContact O-N 2.9Å; H147-S149 VanDerWaalsContact C-N 3.33Å; H147-S149 PolarHBondContact O-N 3.33Å; S149-Q152 WeakPolarHBondContact O-CB 3.42Å; S149-Q152 PolarHBondContact O-N 3.25Å; S149-L153 WeakPolarHBondContact O-CG 3.48Å; S149-L153 PolarHBondContact O-N 3.39Å
150S95.8Very high95.3Very high57 Ų5799.8 Ų99.840%0.39951%0.512SS..Hα-helixtrans-60.2-45.8174.3-1780000111.8C146 H147 Q152 L153 L154C146-S150 WeakPolarHBondContact O-CB 3.47Å; C146-S150 PolarHBondContact O-N 2.95Å; H147-S150 PolarHBondContact O-N 3.08Å; S150-Q152 VanDerWaalsContact C-N 3.3Å; S150-Q152 PolarHBondContact O-N 3.05Å; S150-L153 PolarHBondContact O-N 3.18Å; S150-L154 WeakPolarHBondContact O-CG 3.44Å; S150-L154 PolarHBondContact O-N 3.35Å
151Q95.1Very high95.1Very high84 Ų8496 Ų9639%0.39351%0.506SS..Hα-helixtrans-61.8-35.9175.5-69.2-67.5-12.700112.8H147 T148 K155H147-Q151 WeakPolarHBondContact O-CG 3.49Å; H147-Q151 PolarHBondContact O-N 3.48Å; T148-Q151 PolarHBondContact O-N 2.88Å; Q151-K155 WeakPolarHBondContact O-CG 3.36Å; Q151-K155 PolarHBondContact O-N 3Å; Q151-K155 VanDerWaalsContact O-N 3.12Å
152Q96.5Very high94.9Very high116 Ų11698.5 Ų98.554%0.54251%0.512SS..Hα-helixtrans-67-42.2174.3-73.4177-9.600112.1T148 S149 S150 K155 Q156T148-Q152 WeakPolarHBondContact O-CG 3.5Å; T148-Q152 PolarHBondContact O-N 2.95Å; S149-Q152 WeakPolarHBondContact O-CB 3.42Å; S149-Q152 PolarHBondContact O-N 3.25Å; S150-Q152 VanDerWaalsContact C-N 3.3Å; S150-Q152 PolarHBondContact O-N 3.05Å; Q152-K155 PolarHBondContact O-N 3.35Å; Q152-Q156 WeakPolarHBondContact O-CG 3.41Å; Q152-Q156 PolarHBondContact O-N 3.22Å
153L96Very high94.7Very high110 Ų110101.4 Ų101.458%0.57652%0.515SS*.Hα-helixtrans-61.5-42.9175.3-73.8170.6000111.6S149 S150 K155 Q156 Q157S149-L153 WeakPolarHBondContact O-CG 3.48Å; S149-L153 PolarHBondContact O-N 3.39Å; S150-L153 PolarHBondContact O-N 3.18Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 2.96Å; L153-Q156 PolarHBondContact O-N 3.01Å; L153-Q157 WeakPolarHBondContact O-CB 3.44Å; L153-Q157 PolarHBondContact O-N 3.12Å
154L94.4Very high94.5Very high87 Ų87101.2 Ų101.246%0.45551%0.511SS..Hα-helixtrans-59.9-41.7175.1-72172000112S150 Q157 A158S150-L154 WeakPolarHBondContact O-CG 3.44Å; S150-L154 PolarHBondContact O-N 3.35Å; L154-Q157 PolarHBondContact O-N 2.98Å; L154-A158 PolarHBondContact O-N 2.98Å
155K95Very high94.3Very high143 Ų143101.1 Ų101.162%0.62251%0.506SS*.Hα-helixtrans-63.8-41.6174.5-72.9177.3-178.4-176.60112.3Q151 Q152 L153 A158 N159Q151-K155 WeakPolarHBondContact O-CG 3.36Å; Q151-K155 PolarHBondContact O-N 3Å; Q151-K155 VanDerWaalsContact O-N 3.12Å; Q152-K155 PolarHBondContact O-N 3.35Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 2.96Å; K155-A158 PolarHBondContact O-N 3.3Å; K155-N159 PolarHBondContact O-N 3.09Å; K155-N159 PolarHBondContact O-ND2 2.93Å
156Q95Very high94.1Very high115 Ų11595.7 Ų95.754%0.53749%0.493SS..Hα-helixtrans-65.3-41.8176.3-73.4-179.5-9.300111.9Q152 L153 A158 N159 L160Q152-Q156 WeakPolarHBondContact O-CG 3.41Å; Q152-Q156 PolarHBondContact O-N 3.22Å; L153-Q156 PolarHBondContact O-N 3.01Å; Q156-A158 VanDerWaalsContact C-N 3.34Å; Q156-A158 PolarHBondContact O-N 3.13Å; Q156-N159 WeakPolarHBondContact O-CB 3.45Å; Q156-N159 PolarHBondContact O-N 3.39Å; Q156-N159 VanDerWaalsContact O-N 3.16Å; Q156-L160 PolarHBondContact O-N 3.15Å
157Q93.8Very high93.9Very high122 Ų12294.9 Ų94.957%0.5749%0.485SS*.Hα-helixtrans-59.1-45.3174.4-173.4-178.76.500111L153 L154 N159 L160 V161L153-Q157 WeakPolarHBondContact O-CB 3.44Å; L153-Q157 PolarHBondContact O-N 3.12Å; L154-Q157 PolarHBondContact O-N 2.98Å; Q157-N159 VanDerWaalsContact C-N 3.31Å; Q157-N159 PolarHBondContact O-N 3.03Å; Q157-L160 WeakPolarHBondContact O-CB 3.42Å; Q157-L160 PolarHBondContact O-N 3.2Å; Q157-V161 WeakPolarHBondContact O-CG2 3.37Å; Q157-V161 PolarHBondContact O-N 3.4Å
158A92.2Very high93.5Very high45 Ų4592.4 Ų92.437%0.37248%0.483SS..Hα-helixtrans-62.9-35.717600000113L154 K155 Q156 R162L154-A158 PolarHBondContact O-N 2.98Å; K155-A158 PolarHBondContact O-N 3.3Å; Q156-A158 VanDerWaalsContact C-N 3.34Å; Q156-A158 PolarHBondContact O-N 3.13Å; A158-R162 PolarHBondContact O-N 3.49Å; A158-R162 VanDerWaalsContact O-N 3.14Å; A158-R162 PolarHBondContact O-NE 3.18Å
159N93.5Very high93.2Very high82 Ų8294.6 Ų94.644%0.43949%0.489SS..Hα-helixtrans-66-43.8173.2-72.9-24.8000111.6K155 Q156 Q157 R162 H163K155-N159 PolarHBondContact O-N 3.09Å; K155-N159 PolarHBondContact O-ND2 2.93Å; Q156-N159 WeakPolarHBondContact O-CB 3.45Å; Q156-N159 PolarHBondContact O-N 3.39Å; Q156-N159 VanDerWaalsContact O-N 3.16Å; Q157-N159 VanDerWaalsContact C-N 3.31Å; Q157-N159 PolarHBondContact O-N 3.03Å; N159-R162 PolarHBondContact O-N 3.41Å; N159-R162 PolarHBondContact OD1-NH1 3.09Å; N159-R162 PolarHBondContact OD1-NH2 3.41Å; N159-H163 PolarHBondContact O-N 3.12Å
160L92.2Very high92.9Very high98 Ų9899.8 Ų99.851%0.51350%0.499SS..Hα-helixtrans-60.6-46.9177-102.2152.7000111.6Q156 Q157 R162 H163 F164Q156-L160 PolarHBondContact O-N 3.15Å; Q157-L160 WeakPolarHBondContact O-CB 3.42Å; Q157-L160 PolarHBondContact O-N 3.2Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 2.83Å; L160-H163 WeakPolarHBondContact O-CB 3.47Å; L160-H163 PolarHBondContact O-N 3.27Å; L160-H163 VanDerWaalsContact O-N 3.13Å; L160-F164 HydrophobicContact CD2-CD2 4.35Å; L160-F164 HydrophobicContact CD2-CE2 3.73Å; L160-F164 HydrophobicContact CD2-CZ 4.49Å; L160-F164 WeakPolarHBondContact O-CD2 3.46Å; L160-F164 PolarHBondContact O-N 3.46Å
161V92.8Very high92.6Very high81 Ų81104.1 Ų104.149%0.49151%0.511SS..Hα-helixtrans-59-44.7176.4172.60000111Q157 H163 F164 I165Q157-V161 WeakPolarHBondContact O-CG2 3.37Å; Q157-V161 PolarHBondContact O-N 3.4Å; V161-H163 VanDerWaalsContact C-N 3.34Å; V161-H163 PolarHBondContact O-N 3.45Å; V161-F164 PolarHBondContact O-N 3.22Å; V161-I165 HydrophobicContact CG1-CD1 4.12Å; V161-I165 WeakPolarHBondContact O-CG1 3.21Å; V161-I165 PolarHBondContact O-N 3.21Å
162R92.5Very high92Very high146 Ų146108 Ų10855%0.55153%0.527SS*.Hα-helixtrans-59.9-43174.6-84.4-177.6-84.7134.9-5112.2A158 N159 L160 I165 T166A158-R162 PolarHBondContact O-N 3.49Å; A158-R162 VanDerWaalsContact O-N 3.14Å; A158-R162 PolarHBondContact O-NE 3.18Å; N159-R162 PolarHBondContact O-N 3.41Å; N159-R162 PolarHBondContact OD1-NH1 3.09Å; N159-R162 PolarHBondContact OD1-NH2 3.41Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 2.83Å; R162-I165 PolarHBondContact O-N 3Å; R162-T166 PolarHBondContact O-N 2.91Å; R162-T166 VanDerWaalsContact O-N 3.07Å; R162-T166 PolarHBondContact O-OG1 3.16Å
163H92.3Very high91.7Very high116 Ų116108 Ų10854%0.53753%0.53SS..Hα-helixtrans-62-44.8177.2-172.673.9000112.2N159 L160 V161 I165 T166 V167N159-H163 PolarHBondContact O-N 3.12Å; L160-H163 WeakPolarHBondContact O-CB 3.47Å; L160-H163 PolarHBondContact O-N 3.27Å; L160-H163 VanDerWaalsContact O-N 3.13Å; V161-H163 VanDerWaalsContact C-N 3.34Å; V161-H163 PolarHBondContact O-N 3.45Å; H163-I165 VanDerWaalsContact C-N 3.31Å; H163-I165 PolarHBondContact O-N 3.22Å; H163-T166 WeakPolarHBondContact O-CB 3.44Å; H163-T166 PolarHBondContact O-N 3.31Å; H163-T166 VanDerWaalsContact O-N 3.12Å; H163-V167 WeakPolarHBondContact O-CG2 3.36Å; H163-V167 PolarHBondContact O-N 3.14Å
164F90.6Very high91.2Very high131 Ų131108.4 Ų108.458%0.57553%0.532SS*.Hα-helixtrans-59.7-40175.8-82.3-65.2000112.6L160 V161 T166 V167 A168L160-F164 HydrophobicContact CD2-CD2 4.35Å; L160-F164 HydrophobicContact CD2-CE2 3.73Å; L160-F164 HydrophobicContact CD2-CZ 4.49Å; L160-F164 WeakPolarHBondContact O-CD2 3.46Å; L160-F164 PolarHBondContact O-N 3.46Å; V161-F164 PolarHBondContact O-N 3.22Å; F164-T166 VanDerWaalsContact C-N 3.35Å; F164-T166 PolarHBondContact O-N 2.93Å; F164-V167 PolarHBondContact O-N 3.39Å; F164-A168 WeakPolarHBondContact O-CB 3.43Å; F164-A168 PolarHBondContact O-N 3.09Å
165I90.8Very high90.5Very high88 Ų88107.3 Ų107.345%0.45153%0.528SS..Hα-helixtrans-61.2-44.6174.7-67.3165.9000110.5V161 R162 H163 V167 A168 Q169V161-I165 HydrophobicContact CG1-CD1 4.12Å; V161-I165 WeakPolarHBondContact O-CG1 3.21Å; V161-I165 PolarHBondContact O-N 3.21Å; R162-I165 PolarHBondContact O-N 3Å; H163-I165 VanDerWaalsContact C-N 3.31Å; H163-I165 PolarHBondContact O-N 3.22Å; I165-V167 PolarHBondContact O-N 2.66Å; I165-A168 PolarHBondContact O-N 2.92Å; I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 3Å
166T93.8Very high89.8Confident59 Ų59102.6 Ų102.636%0.36252%0.516SS..Hα-helixtrans-62.6-42.2176.9-54.50000112.3R162 H163 F164 Q169 R170R162-T166 PolarHBondContact O-N 2.91Å; R162-T166 VanDerWaalsContact O-N 3.07Å; R162-T166 PolarHBondContact O-OG1 3.16Å; H163-T166 WeakPolarHBondContact O-CB 3.44Å; H163-T166 PolarHBondContact O-N 3.31Å; H163-T166 VanDerWaalsContact O-N 3.12Å; F164-T166 VanDerWaalsContact C-N 3.35Å; F164-T166 PolarHBondContact O-N 2.93Å; T166-Q169 PolarHBondContact O-N 3.4Å; T166-R170 WeakPolarHBondContact O-CG 3.45Å; T166-R170 PolarHBondContact O-N 3.14Å
167V90.6Very high89.2Confident70 Ų70101.3 Ų101.342%0.42451%0.513SS..Hα-helixtrans-62.7-44.1176.4172.50000110.9H163 F164 I165 Q169 R170 K171H163-V167 WeakPolarHBondContact O-CG2 3.36Å; H163-V167 PolarHBondContact O-N 3.14Å; F164-V167 PolarHBondContact O-N 3.39Å; I165-V167 PolarHBondContact O-N 2.66Å; V167-Q169 VanDerWaalsContact C-N 3.33Å; V167-Q169 PolarHBondContact O-N 2.87Å; V167-R170 PolarHBondContact O-N 2.92Å; V167-K171 PolarHBondContact O-N 3.12Å
168A87.6Confident88.5Confident60 Ų6099.2 Ų99.250%0.49651%0.506SS..Hα-helixtrans-62.1-39.8176.900000112.3F164 I165 K171 K172F164-A168 WeakPolarHBondContact O-CB 3.43Å; F164-A168 PolarHBondContact O-N 3.09Å; I165-A168 PolarHBondContact O-N 2.92Å; A168-K171 PolarHBondContact O-N 3.07Å; A168-K172 PolarHBondContact O-N 2.94Å
169Q89.7Confident87.9Confident117 Ų11799 Ų9955%0.54750%0.498SS..Hα-helixtrans-64.3-45.1174.5-73.7173.7-11.200112I165 T166 V167 K171 K172 L173I165-Q169 WeakPolarHBondContact O-CG 3.45Å; I165-Q169 PolarHBondContact O-N 3Å; T166-Q169 PolarHBondContact O-N 3.4Å; V167-Q169 VanDerWaalsContact C-N 3.33Å; V167-Q169 PolarHBondContact O-N 2.87Å; Q169-K171 PolarHBondContact O-N 3.49Å; Q169-K172 WeakPolarHBondContact O-CB 3.49Å; Q169-K172 PolarHBondContact O-N 3.09Å; Q169-L173 PolarHBondContact O-N 3.13Å
170R91.4Very high87.3Confident169 Ų16998.7 Ų98.764%0.63850%0.496SS*.Hα-helixtrans-61.1-43.2175.7-74.6-179.7178.1-176.9-1112.1T166 V167 K172 L173 L174T166-R170 WeakPolarHBondContact O-CG 3.45Å; T166-R170 PolarHBondContact O-N 3.14Å; V167-R170 PolarHBondContact O-N 2.92Å; R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 3.5Å; R170-L173 PolarHBondContact O-N 3.33Å; R170-L174 WeakPolarHBondContact O-CG 3.48Å; R170-L174 PolarHBondContact O-N 3.16Å
171K87.8Confident86.7Confident147 Ų14797.2 Ų97.264%0.63949%0.491SS*.Hα-helixtrans-56.5-44.8173.7-179.7-178.4176.5178.90111.2V167 A168 Q169 L173 L174 V175V167-K171 PolarHBondContact O-N 3.12Å; A168-K171 PolarHBondContact O-N 3.07Å; Q169-K171 PolarHBondContact O-N 3.49Å; K171-L173 VanDerWaalsContact C-N 3.34Å; K171-L173 PolarHBondContact O-N 3.44Å; K171-L174 PolarHBondContact O-N 2.93Å; K171-V175 VanDerWaalsContact O-CG2 3.31Å; K171-V175 WeakPolarHBondContact O-CG2 3.44Å; K171-V175 PolarHBondContact O-N 2.98Å
172K83.5Confident86Confident166 Ų16694.2 Ų94.272%0.72247%0.472SS*.Hα-helixtrans-61.9-40.7178.8-171.1-178.9178.5-176.20112.3A168 Q169 R170 A176A168-K172 PolarHBondContact O-N 2.94Å; Q169-K172 WeakPolarHBondContact O-CB 3.49Å; Q169-K172 PolarHBondContact O-N 3.09Å; R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 3.5Å; K172-A176 PolarHBondContact O-N 3.38Å; K172-A176 VanDerWaalsContact O-N 3.14Å
173L89.9Confident85.4Confident116 Ų11694 Ų9461%0.60747%0.471SS*.Hα-helixtrans-64.6-47.3175.4-68.9172000111.5Q169 R170 K171 V175 A176 D177Q169-L173 PolarHBondContact O-N 3.13Å; R170-L173 PolarHBondContact O-N 3.33Å; K171-L173 VanDerWaalsContact C-N 3.34Å; K171-L173 PolarHBondContact O-N 3.44Å; L173-V175 VanDerWaalsContact C-N 3.3Å; L173-V175 PolarHBondContact O-N 3.29Å; L173-A176 WeakPolarHBondContact O-CA 3.35Å; L173-A176 WeakPolarHBondContact O-CB 3.44Å; L173-A176 PolarHBondContact O-N 3.42Å; L173-D177 PolarHBondContact O-N 3.07Å
174L84.9Confident84.8Confident118 Ų11894.2 Ų94.262%0.61847%0.472SS*.Hα-helixtrans-60.8-37.7178.2-72.3170000112.9R170 K171 A176 D177 L178R170-L174 WeakPolarHBondContact O-CG 3.48Å; R170-L174 PolarHBondContact O-N 3.16Å; K171-L174 PolarHBondContact O-N 2.93Å; L174-A176 VanDerWaalsContact C-N 3.34Å; L174-D177 PolarHBondContact O-N 3.32Å; L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.05Å
175V80.2Confident84.3Confident64 Ų6490.6 Ų90.639%0.38846%0.458SS..Hα-helixtrans-63.7-41.4173.6170.90000110.9K171 L173 D177 L178 D179K171-V175 VanDerWaalsContact O-CG2 3.31Å; K171-V175 WeakPolarHBondContact O-CG2 3.44Å; K171-V175 PolarHBondContact O-N 2.98Å; L173-V175 VanDerWaalsContact C-N 3.3Å; L173-V175 PolarHBondContact O-N 3.29Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 2.88Å; V175-L178 PolarHBondContact O-N 3.22Å; V175-D179 PolarHBondContact O-N 3.39Å
176A81Confident83.8Confident44 Ų4488 Ų8836%0.36444%0.444SS..Hα-helixtrans-66.6-34.8176.600000112.7K172 L173 L174 D179 I180K172-A176 PolarHBondContact O-N 3.38Å; K172-A176 VanDerWaalsContact O-N 3.14Å; L173-A176 WeakPolarHBondContact O-CA 3.35Å; L173-A176 WeakPolarHBondContact O-CB 3.44Å; L173-A176 PolarHBondContact O-N 3.42Å; L174-A176 VanDerWaalsContact C-N 3.34Å; A176-D179 WeakPolarHBondContact O-CB 3.31Å; A176-D179 PolarHBondContact O-N 3.01Å; A176-I180 WeakPolarHBondContact O-CG1 3.39Å; A176-I180 PolarHBondContact O-N 2.9Å
177D81.5Confident83.2Confident89 Ų8991.3 Ų91.348%0.47646%0.455SS..Hα-helixtrans-68.1-42.4174.1-67.8-23.7000111L173 L174 V175 D179 I180 V181L173-D177 PolarHBondContact O-N 3.07Å; L174-D177 PolarHBondContact O-N 3.32Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 2.88Å; D177-D179 VanDerWaalsContact C-N 3.26Å; D177-D179 PolarHBondContact O-N 2.96Å; D177-I180 WeakPolarHBondContact O-CB 3.32Å; D177-I180 PolarHBondContact O-N 2.95Å; D177-V181 PolarHBondContact O-N 3.43Å
178L80.3Confident82.8Confident78 Ų7891 Ų9141%0.40845%0.453SS..Hα-helixtrans-59.4-38.3174.3-174.266.8000111.6L174 V175 I180 V181 N182L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.05Å; V175-L178 PolarHBondContact O-N 3.22Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.28Å; L178-V181 PolarHBondContact O-N 2.97Å; L178-N182 WeakPolarHBondContact O-CB 3.45Å; L178-N182 VanDerWaalsContact O-CG 3.29Å; L178-N182 PolarHBondContact O-N 3.15Å; L178-N182 PolarHBondContact O-ND2 2.85Å
179D78.4Confident82.6Confident41 Ų4190.3 Ų90.322%0.21944%0.439CS..Hα-helixtrans-61.8-35.5173.3-86.4-36.4000113.7V175 A176 D177 R183 Y346V175-D179 PolarHBondContact O-N 3.39Å; A176-D179 WeakPolarHBondContact O-CB 3.31Å; A176-D179 PolarHBondContact O-N 3.01Å; D177-D179 VanDerWaalsContact C-N 3.26Å; D177-D179 PolarHBondContact O-N 2.96Å; D179-R183 VanDerWaalsContact O-CG 3.32Å; D179-R183 WeakPolarHBondContact O-CG 3.37Å; D179-R183 PolarHBondContact O-N 3.24Å; D179-R183 PolarHBondContact O-NE 2.94Å; D179-R183 VanDerWaalsContact O-NE 3.09Å; D179-Y346 WeakPolarHBondContact OD1-CE1 3.14Å; D179-Y346 PolarHBondContact OD1-OH 3.49Å; D179-Y346 PolarHBondContact OD2-OH 3.47Å
180I81Confident82.3Confident75 Ų7585.7 Ų85.739%0.38542%0.418SS..Hα-helixtrans-69.9-47176.5-66.4165.2000109.5A176 D177 L178 R183 Q184A176-I180 WeakPolarHBondContact O-CG1 3.39Å; A176-I180 PolarHBondContact O-N 2.9Å; D177-I180 WeakPolarHBondContact O-CB 3.32Å; D177-I180 PolarHBondContact O-N 2.95Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.28Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.33Å; I180-Q184 WeakPolarHBondContact O-CG 3.43Å; I180-Q184 PolarHBondContact O-N 3.37Å
181V79.9Confident81.9Confident67 Ų6780.7 Ų80.741%0.40641%0.407SS..Hα-helixtrans-63-44.4179176.70000111.3D177 L178 R183 Q184 I185D177-V181 PolarHBondContact O-N 3.43Å; L178-V181 PolarHBondContact O-N 2.97Å; V181-R183 VanDerWaalsContact C-N 3.27Å; V181-R183 PolarHBondContact O-N 3.06Å; V181-Q184 WeakPolarHBondContact O-CB 3.45Å; V181-Q184 PolarHBondContact O-N 3.33Å; V181-I185 HydrophobicContact CG1-CD1 3.91Å; V181-I185 HydrophobicContact CG1-CG1 4.34Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 2.91Å
182N78.9Confident81.8Confident17 Ų1777.2 Ų77.29%0.09139%0.39CS..Hα-helixtrans-59.5-38.3176.4-77.8-26000112.1L178 K186 Y346L178-N182 WeakPolarHBondContact O-CB 3.45Å; L178-N182 VanDerWaalsContact O-CG 3.29Å; L178-N182 PolarHBondContact O-N 3.15Å; L178-N182 PolarHBondContact O-ND2 2.85Å; N182-K186 VanDerWaalsContact O-CB 3.3Å; N182-K186 WeakPolarHBondContact O-CB 2.82Å; N182-K186 PolarHBondContact O-N 3.06Å; N182-Y346 WeakPolarHBondContact ND2-CD1 3.44Å
183R78.9Confident82Confident143 Ų14369.3 Ų69.354%0.5436%0.356SS..Hα-helixtrans-65.3-39.2174-78.8-178.1-77.4169.5-6.5112.3D179 I180 V181 H187 T344D179-R183 VanDerWaalsContact O-CG 3.32Å; D179-R183 WeakPolarHBondContact O-CG 3.37Å; D179-R183 PolarHBondContact O-N 3.24Å; D179-R183 PolarHBondContact O-NE 2.94Å; D179-R183 VanDerWaalsContact O-NE 3.09Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.33Å; V181-R183 VanDerWaalsContact C-N 3.27Å; V181-R183 PolarHBondContact O-N 3.06Å; R183-H187 WeakPolarHBondContact O-CB 3.41Å; R183-H187 PolarHBondContact O-N 3.4Å; R183-T344 HydrophobicContact CG-CG2 4.31Å
184Q81Confident81.7Confident119 Ų11969 Ų6956%0.55635%0.351SS*.Hα-helixtrans-66.1-46.9175.8-70.3175.8-12.200111.9I180 V181 K186 H187 V188I180-Q184 WeakPolarHBondContact O-CG 3.43Å; I180-Q184 PolarHBondContact O-N 3.37Å; V181-Q184 WeakPolarHBondContact O-CB 3.45Å; V181-Q184 PolarHBondContact O-N 3.33Å; Q184-K186 VanDerWaalsContact C-N 3.3Å; Q184-K186 PolarHBondContact O-N 3.33Å; Q184-H187 WeakPolarHBondContact O-CB 3.44Å; Q184-H187 PolarHBondContact O-N 2.9Å; Q184-V188 WeakPolarHBondContact O-CG2 3.28Å; Q184-V188 PolarHBondContact O-N 3.03Å
185I79.6Confident81.7Confident56 Ų5664.5 Ų64.529%0.28733%0.327SS..Hα-helixtrans-57.9-46.8176.3-68.2171000110.1V181 H187 V188 H189 F347V181-I185 HydrophobicContact CG1-CD1 3.91Å; V181-I185 HydrophobicContact CG1-CG1 4.34Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 2.91Å; I185-H187 VanDerWaalsContact C-N 3.34Å; I185-H187 PolarHBondContact O-N 3.33Å; I185-V188 PolarHBondContact O-N 3.18Å; I185-H189 PolarHBondContact O-CD2 3.46Å; I185-H189 PolarHBondContact O-N 2.72Å; I185-F347 HydrophobicContact CG2-CE2 4.22Å
186K80.1Confident82.2Confident34 Ų3461.5 Ų61.515%0.14831%0.309CS..Hα-helixtrans-58.8-46176.5-179.8177.9173.8-1790111.8N182 Q184 V188 H189 D190 N340 S343N182-K186 VanDerWaalsContact O-CB 3.3Å; N182-K186 WeakPolarHBondContact O-CB 2.82Å; N182-K186 PolarHBondContact O-N 3.06Å; Q184-K186 VanDerWaalsContact C-N 3.3Å; Q184-K186 PolarHBondContact O-N 3.33Å; K186-V188 VanDerWaalsContact C-N 3.32Å; K186-V188 PolarHBondContact O-N 2.97Å; K186-H189 PolarHBondContact O-N 2.94Å; K186-D190 WeakPolarHBondContact O-CB 3.37Å; K186-D190 PolarHBondContact O-N 2.89Å; K186-N340 PolarHBondContact NZ-O 3.02Å; K186-S343 PolarHBondContact NZ-O 3.34Å
187H81.2Confident82.6Confident127 Ų12759.6 Ų59.659%0.58829%0.293SS*.Hα-helixtrans-59.2-44.2177.7-176.955.6000111.9R183 Q184 I185 D190 T191R183-H187 WeakPolarHBondContact O-CB 3.41Å; R183-H187 PolarHBondContact O-N 3.4Å; Q184-H187 WeakPolarHBondContact O-CB 3.44Å; Q184-H187 PolarHBondContact O-N 2.9Å; I185-H187 VanDerWaalsContact C-N 3.34Å; I185-H187 PolarHBondContact O-N 3.33Å; H187-D190 PolarHBondContact O-N 3.46Å; H187-T191 PolarHBondContact O-N 3.33Å; H187-T191 PolarHBondContact O-OG1 3.32Å; H187-T191 VanDerWaalsContact O-OG1 3.1Å
188V82.3Confident82.8Confident65 Ų6557.2 Ų57.239%0.39429%0.289SS..Hα-helixtrans-62.7-441761710000111.5Q184 I185 K186 D190 T191 Y192Q184-V188 WeakPolarHBondContact O-CG2 3.28Å; Q184-V188 PolarHBondContact O-N 3.03Å; I185-V188 PolarHBondContact O-N 3.18Å; K186-V188 VanDerWaalsContact C-N 3.32Å; K186-V188 PolarHBondContact O-N 2.97Å; V188-D190 VanDerWaalsContact C-N 3.29Å; V188-D190 PolarHBondContact O-N 3.14Å; V188-T191 PolarHBondContact O-N 2.94Å; V188-Y192 HydrophobicContact CG1-CD2 3.83Å; V188-Y192 HydrophobicContact CG1-CE2 3.27Å; V188-Y192 WeakPolarHBondContact O-CD2 3.39Å; V188-Y192 PolarHBondContact O-N 3.09Å
189H83Confident83Confident44 Ų4457.1 Ų57.120%0.20429%0.292CS..Hα-helixtrans-60.4-41.8174.7-71.2-172.6000111.1I185 K186 T191 Y192 F193 L254I185-H189 PolarHBondContact O-CD2 3.46Å; I185-H189 PolarHBondContact O-N 2.72Å; K186-H189 PolarHBondContact O-N 2.94Å; H189-T191 VanDerWaalsContact C-N 3.35Å; H189-T191 PolarHBondContact O-N 3.41Å; H189-Y192 PolarHBondContact O-N 3.14Å; H189-F193 WeakPolarHBondContact O-CD2 3.39Å; H189-F193 PolarHBondContact O-N 3.31Å; H189-L254 PolarHBondContact CE1-O 3.34Å; H189-L254 PolarHBondContact ND1-O 2.86Å; H189-L254 PolarHBondContact NE2-O 3.11Å
190D82.9Confident83.3Confident20 Ų2056.7 Ų56.711%0.10729%0.287CS..Hα-helixtrans-62.3-43.8179.7-66.9-14.4000111K186 H187 V188 Y192 F193 E194 R301 V337K186-D190 WeakPolarHBondContact O-CB 3.37Å; K186-D190 PolarHBondContact O-N 2.89Å; H187-D190 PolarHBondContact O-N 3.46Å; V188-D190 VanDerWaalsContact C-N 3.29Å; V188-D190 PolarHBondContact O-N 3.14Å; D190-Y192 PolarHBondContact O-N 3.27Å; D190-F193 PolarHBondContact O-N 2.88Å; D190-E194 WeakPolarHBondContact O-CB 3.3Å; D190-E194 PolarHBondContact O-N 3.23Å; D190-R301 IonicContact OD1-CZ 3.39Å; D190-R301 IonicContact OD1-NE 2.7Å; D190-R301 IonicContact OD1-NH2 3.18Å; D190-R301 PolarHBondContact OD1-NH2 3.32Å; D190-R301 IonicContact OD2-NH2 3.93Å; D190-V337 HydrophobicContact CB-CG1 3.47Å; D190-V337 VanDerWaalsContact CB-CG1 3.47Å; D190-V337 WeakPolarHBondContact O-CG1 3.5Å; D190-V337 WeakPolarHBondContact OD1-CG1 3.42Å
191T83.9Confident83.8Confident64 Ų6453.1 Ų53.139%0.39327%0.269SS..Hα-helixtrans-60.9-42.6172.9-52.50000112.3H187 V188 H189 F193 E194 E195H187-T191 PolarHBondContact O-N 3.33Å; H187-T191 PolarHBondContact O-OG1 3.32Å; H187-T191 VanDerWaalsContact O-OG1 3.1Å; V188-T191 PolarHBondContact O-N 2.94Å; H189-T191 VanDerWaalsContact C-N 3.35Å; H189-T191 PolarHBondContact O-N 3.41Å; T191-F193 VanDerWaalsContact C-N 3.33Å; T191-F193 PolarHBondContact O-N 3.14Å; T191-E194 PolarHBondContact O-N 3.09Å; T191-E195 WeakPolarHBondContact O-CB 3.14Å; T191-E195 PolarHBondContact O-N 3.11Å
192Y85.9Confident84.3Confident75 Ų7552.3 Ų52.329%0.29426%0.264SS..Hα-helixtrans-65.7-35.6176.9-69.1-34.9000112.8V188 H189 D190 L196 L254 P470 L471V188-Y192 HydrophobicContact CG1-CD2 3.83Å; V188-Y192 HydrophobicContact CG1-CE2 3.27Å; V188-Y192 WeakPolarHBondContact O-CD2 3.39Å; V188-Y192 PolarHBondContact O-N 3.09Å; H189-Y192 PolarHBondContact O-N 3.14Å; D190-Y192 PolarHBondContact O-N 3.27Å; Y192-L196 WeakPolarHBondContact O-CB 3.41Å; Y192-L196 PolarHBondContact O-N 3.05Å; Y192-L254 HydrophobicContact CD2-CD2 3.77Å; Y192-L254 HydrophobicContact CG-CD2 4.19Å; Y192-P470 HydrophobicContact CD1-CB 4.12Å; Y192-P470 HydrophobicContact CD1-CG 3.73Å; Y192-P470 HydrophobicContact CE1-CB 3.5Å; Y192-P470 VanDerWaalsContact CE1-CB 3.5Å; Y192-P470 HydrophobicContact CE1-CG 3.36Å; Y192-L471 VanDerWaalsContact O-CD1 3.26Å; Y192-L471 WeakPolarHBondContact O-CD1 3.24Å
193F86.9Confident84.9Confident0 Ų051.9 Ų51.90%026%0.262CS..Hα-helixtrans-70.9-41.1176.1-94-79.8000112.3H189 D190 T191 E195 L196 L197 S251 L254 L255 V337H189-F193 WeakPolarHBondContact O-CD2 3.39Å; H189-F193 PolarHBondContact O-N 3.31Å; D190-F193 PolarHBondContact O-N 2.88Å; T191-F193 VanDerWaalsContact C-N 3.33Å; T191-F193 PolarHBondContact O-N 3.14Å; F193-E195 VanDerWaalsContact C-N 3.32Å; F193-L196 PolarHBondContact O-N 3.04Å; F193-L197 HydrophobicContact CD1-CD1 3.94Å; F193-L197 HydrophobicContact CE1-CD1 4.43Å; F193-L197 PolarHBondContact O-N 3.05Å; F193-S251 WeakPolarHBondContact CE1-OG 3.47Å; F193-L254 HydrophobicContact CD2-CD1 4.43Å; F193-L254 HydrophobicContact CE2-CB 3.92Å; F193-L254 HydrophobicContact CE2-CD1 4.2Å; F193-L254 HydrophobicContact CZ-CB 4.36Å; F193-L255 HydrophobicContact CD2-CD2 4.38Å; F193-L255 HydrophobicContact CE2-CD1 3.86Å; F193-L255 HydrophobicContact CE2-CD2 3.49Å; F193-L255 VanDerWaalsContact CE2-CD2 3.49Å; F193-L255 HydrophobicContact CE2-CG 3.45Å; F193-L255 VanDerWaalsContact CE2-CG 3.45Å; F193-L255 HydrophobicContact CZ-CD1 3.56Å; F193-L255 HydrophobicContact CZ-CD2 4.09Å; F193-L255 HydrophobicContact CZ-CG 3.54Å; F193-V337 HydrophobicContact CB-CB 4.44Å; F193-V337 HydrophobicContact CB-CG1 3.92Å; F193-V337 HydrophobicContact CB-CG2 4.08Å; F193-V337 HydrophobicContact CG-CG2 4.38Å
194E84.2Confident85.4Confident110 Ų11048.6 Ų48.651%0.51426%0.255SS..Iπ-helixtrans-60.6-43.6173.5-172.6176.7-177.300110.6D190 T191 G198 V199D190-E194 WeakPolarHBondContact O-CB 3.3Å; D190-E194 PolarHBondContact O-N 3.23Å; T191-E194 PolarHBondContact O-N 3.09Å; E194-G198 WeakPolarHBondContact O-CA 3.36Å; E194-G198 PolarHBondContact O-N 3.44Å; E194-V199 PolarHBondContact O-N 3.23Å
195E85.5Confident85.8Confident22 Ų2244.6 Ų44.610%0.10324%0.237CC..Iπ-helixtrans-65.7-45.9174.2-161.9-163.6177.700111.7T191 F193 V199 Y200 G469 P470 L471T191-E195 WeakPolarHBondContact O-CB 3.14Å; T191-E195 PolarHBondContact O-N 3.11Å; F193-E195 VanDerWaalsContact C-N 3.32Å; E195-V199 VanDerWaalsContact O-CB 3.29Å; E195-V199 WeakPolarHBondContact O-CB 3.48Å; E195-V199 PolarHBondContact O-N 3.33Å; E195-Y200 HydrophobicContact CG-CD2 4.19Å; E195-Y200 HydrophobicContact CG-CE2 3.63Å; E195-Y200 WeakPolarHBondContact O-CD2 3.29Å; E195-Y200 PolarHBondContact O-N 3.35Å; E195-Y200 WeakPolarHBondContact OE1-CE2 3.37Å; E195-Y200 PolarHBondContact OE1-OH 3.35Å; E195-G469 WeakPolarHBondContact OE1-CA 3.24Å; E195-P470 WeakPolarHBondContact OE2-CD 3.49Å; E195-P470 WeakPolarHBondContact OE2-CG 3.46Å; E195-L471 PolarHBondContact OE1-N 2.82Å; E195-L471 PolarHBondContact OE2-N 3.14Å; E195-L471 VanDerWaalsContact OE2-N 3.16Å
196L89.8Confident86.1Confident1 Ų143.7 Ų43.71%0.00524%0.236CC..Iπ-helixtrans-62.5-54.3-177-177.367.2000111.8Y192 F193 Y200 F201 V250 L254 L471Y192-L196 WeakPolarHBondContact O-CB 3.41Å; Y192-L196 PolarHBondContact O-N 3.05Å; F193-L196 PolarHBondContact O-N 3.04Å; L196-Y200 PolarHBondContact O-N 3.49Å; L196-F201 HydrophobicContact CD1-CD2 3.5Å; L196-F201 HydrophobicContact CD1-CE2 3.72Å; L196-F201 HydrophobicContact CG-CD2 4.18Å; L196-F201 WeakPolarHBondContact O-CA 3.48Å; L196-F201 WeakPolarHBondContact O-CB 3.49Å; L196-F201 PolarHBondContact O-N 3.42Å; L196-V250 HydrophobicContact CD1-CB 4.15Å; L196-V250 HydrophobicContact CD1-CG1 3.89Å; L196-V250 HydrophobicContact CD2-CB 4Å; L196-V250 HydrophobicContact CD2-CG1 3.89Å; L196-L254 HydrophobicContact CD2-CD1 4.31Å; L196-L471 HydrophobicContact CB-CD1 3.67Å; L196-L471 HydrophobicContact CD1-CD1 4.11Å; L196-L471 HydrophobicContact CG-CD1 4.41Å
197L90.3Very high86Confident5 Ų548.6 Ų48.63%0.02627%0.269CS..Iπ-helixtrans-98.4-22.1-170.3-63.8177.3000113F193 F201 V202 A247 L330 L333F193-L197 HydrophobicContact CD1-CD1 3.94Å; F193-L197 HydrophobicContact CE1-CD1 4.43Å; F193-L197 PolarHBondContact O-N 3.05Å; L197-F201 HydrophobicContact CD2-CB 4.17Å; L197-F201 CarbonylContact O-C 3.51Å; L197-V202 WeakPolarHBondContact O-CA 3.45Å; L197-A247 HydrophobicContact CD2-CB 4.28Å; L197-L330 HydrophobicContact CD2-CD2 4.3Å; L197-L333 HydrophobicContact CD1-CB 3.55Å
198G83.9Confident85.8Confident39 Ų3947.3 Ų47.340%0.40227%0.266SS..Iπ-helixtrans-89.9-26.6176.600000113.7E194 V202E194-G198 WeakPolarHBondContact O-CA 3.36Å; E194-G198 PolarHBondContact O-N 3.44Å; G198-V202 WeakPolarHBondContact O-CG2 3.41Å
199V84.8Confident85.3Confident76 Ų7649 Ų4946%0.46128%0.281SS..Iπ-helixtrans-112.4-50.8-177.8-1740000112.7E194 E195E194-V199 PolarHBondContact O-N 3.23Å; E195-V199 VanDerWaalsContact O-CB 3.29Å; E195-V199 WeakPolarHBondContact O-CB 3.48Å; E195-V199 PolarHBondContact O-N 3.33Å
200Y86.4Confident85Confident31 Ų3155 Ų5512%0.12231%0.314CS..Iπ-helixtrans-92.9-44.5-173-61.8-58.9000113.9E195 L196 L471 S472 W475E195-Y200 HydrophobicContact CG-CD2 4.19Å; E195-Y200 HydrophobicContact CG-CE2 3.63Å; E195-Y200 WeakPolarHBondContact O-CD2 3.29Å; E195-Y200 PolarHBondContact O-N 3.35Å; E195-Y200 WeakPolarHBondContact OE1-CE2 3.37Å; E195-Y200 PolarHBondContact OE1-OH 3.35Å; L196-Y200 PolarHBondContact O-N 3.49Å; Y200-L471 HydrophobicContact CD2-CB 4.2Å; Y200-L471 HydrophobicContact CE2-CB 3.91Å; Y200-S472 WeakPolarHBondContact OH-CA 3.24Å; Y200-S472 WeakPolarHBondContact OH-CB 3.49Å; Y200-W475 HydrophobicContact CD1-CB 3.62Å; Y200-W475 AromaticContact CD1-CD1 3.54Å; Y200-W475 AromaticContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CE3 4.48Å; Y200-W475 AromaticContact CD1-CG 3.37Å; Y200-W475 HydrophobicContact CD1-CG 3.37Å; Y200-W475 AromaticContact CD1-NE1 3.97Å; Y200-W475 HydrophobicContact CD2-CB 4.38Å; Y200-W475 HydrophobicContact CE1-CB 4Å; Y200-W475 AromaticContact CE1-CD1 3.82Å; Y200-W475 AromaticContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CG-CB 3.85Å; Y200-W475 HydrophobicContact CG-CD2 4.17Å; Y200-W475 HydrophobicContact CG-CE3 4.45Å; Y200-W475 AromaticContact CG-CG 3.94Å; Y200-W475 HydrophobicContact CG-CG 3.94Å; Y200-W475 WeakPolarHBondContact O-CH2 3.23Å; Y200-W475 WeakPolarHBondContact O-CZ3 3.45Å
201F90.7Very high85.2Confident1 Ų156 Ų560%0.00432%0.322CS..SBendtrans-11357.4-175.1-68.6-90.2000111.6L196 L197 F215 V216 Y243 V246 A247 W475 A478L196-F201 HydrophobicContact CD1-CD2 3.5Å; L196-F201 HydrophobicContact CD1-CE2 3.72Å; L196-F201 HydrophobicContact CG-CD2 4.18Å; L196-F201 WeakPolarHBondContact O-CA 3.48Å; L196-F201 WeakPolarHBondContact O-CB 3.49Å; L196-F201 PolarHBondContact O-N 3.42Å; L197-F201 HydrophobicContact CD2-CB 4.17Å; L197-F201 CarbonylContact O-C 3.51Å; F201-F215 HydrophobicContact CB-CE1 4.35Å; F201-F215 HydrophobicContact CB-CE2 4.3Å; F201-F215 HydrophobicContact CB-CZ 3.71Å; F201-F215 AromaticContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CZ 4.14Å; F201-F215 HydrophobicContact CG-CZ 4.38Å; F201-F215 VanDerWaalsContact O-CE2 3.25Å; F201-F215 WeakPolarHBondContact O-CE2 3.3Å; F201-V216 HydrophobicContact CB-CG2 4.32Å; F201-V216 HydrophobicContact CD1-CG2 3.84Å; F201-V216 HydrophobicContact CG-CG2 4.44Å; F201-Y243 HydrophobicContact CD1-CD1 4.42Å; F201-Y243 AromaticContact CE1-CD1 3.89Å; F201-Y243 HydrophobicContact CE1-CD1 3.89Å; F201-V246 HydrophobicContact CE1-CB 4.11Å; F201-V246 HydrophobicContact CE1-CG1 4.17Å; F201-V246 HydrophobicContact CZ-CB 4.12Å; F201-V246 HydrophobicContact CZ-CG1 3.66Å; F201-A247 HydrophobicContact CB-CB 4.19Å; F201-A247 HydrophobicContact CD1-CB 3.94Å; F201-A247 HydrophobicContact CE1-CB 4.42Å; F201-A247 HydrophobicContact CG-CB 3.98Å; F201-W475 HydrophobicContact CD1-CZ3 4.44Å; F201-W475 HydrophobicContact CD2-CE3 4.45Å; F201-W475 HydrophobicContact CE1-CZ3 4.28Å; F201-W475 HydrophobicContact CE2-CE3 4.02Å; F201-W475 HydrophobicContact CE2-CZ3 4.44Å; F201-W475 HydrophobicContact CZ-CE3 4.06Å; F201-W475 HydrophobicContact CZ-CZ3 4.27Å; F201-A478 HydrophobicContact CE1-CB 4.49Å; F201-A478 HydrophobicContact CZ-CB 3.88Å
202V89.7Confident85.4Confident49 Ų4954.4 Ų54.430%0.29731%0.313SS..  trans-65.4135.1-173.3-172.10000111.3L197 G198 V216L197-V202 WeakPolarHBondContact O-CA 3.45Å; G198-V202 WeakPolarHBondContact O-CG2 3.41Å; V202-V216 PolarHBondContact O-N 3.25Å
203T92Very high85.6Confident9 Ų951.3 Ų51.36%0.05530%0.301CS..EExtended strand (participates in β ladder)trans-105.5118.7172.7-50.90000109.4L205 F215 L327 Y331T203-L205 HydrophobicContact CG2-CD2 3.88Å; T203-L205 HydrophobicContact CG2-CG 4.48Å; T203-F215 HydrophobicContact CG2-CD2 4.38Å; T203-F215 VanDerWaalsContact OG1-CD2 3.27Å; T203-F215 WeakPolarHBondContact OG1-CD2 3.35Å; T203-F215 VanDerWaalsContact OG1-CE2 3.3Å; T203-F215 WeakPolarHBondContact OG1-CE2 3.32Å; T203-L327 HydrophobicContact CG2-CB 3.87Å; T203-L327 HydrophobicContact CG2-CD2 4.4Å; T203-Y331 HydrophobicContact CG2-CD2 4.45Å; T203-Y331 WeakPolarHBondContact O-CD2 3.16Å
204D89.7Confident85.9Confident73 Ų7357.3 Ų57.339%0.3932%0.324SS..EExtended strand (participates in β ladder)trans-107.9111.6176.7-55.7-47.8000108.9R214D204-R214 HydrophobicContact CB-CB 4.26Å; D204-R214 PolarHBondContact N-O 2.96Å; D204-R214 PolarHBondContact O-N 3.29Å
205L88.9Confident86.4Confident36 Ų3652 Ų5219%0.18830%0.299CS..  trans-88.1130.7177.6-58-178.3000109.6T203 D213 L309 I314 L327 F328 Y331T203-L205 HydrophobicContact CG2-CD2 3.88Å; T203-L205 HydrophobicContact CG2-CG 4.48Å; L205-D213 HydrophobicContact CD2-CB 4.26Å; L205-L309 HydrophobicContact CD1-CD2 4.44Å; L205-I314 HydrophobicContact CD1-CD1 3.62Å; L205-L327 HydrophobicContact CD2-CB 4.14Å; L205-F328 HydrophobicContact CD1-CD1 3.75Å; L205-F328 HydrophobicContact CD1-CE1 4.05Å; L205-F328 HydrophobicContact CD2-CD1 3.72Å; L205-F328 HydrophobicContact CD2-CE1 3.93Å; L205-F328 HydrophobicContact CG-CD1 4.37Å; L205-Y331 HydrophobicContact CD1-CD1 3.57Å; L205-Y331 HydrophobicContact CD1-CD2 3.96Å; L205-Y331 HydrophobicContact CD1-CE1 4.04Å; L205-Y331 HydrophobicContact CD1-CE2 4.4Å; L205-Y331 HydrophobicContact CD1-CG 3.52Å; L205-Y331 HydrophobicContact CG-CD1 4.46Å; L205-Y331 HydrophobicContact CG-CD2 3.97Å; L205-Y331 HydrophobicContact CG-CE2 4.43Å; L205-Y331 HydrophobicContact CG-CG 3.99Å
206S85.8Confident86.6Confident36 Ų3652 Ų5225%0.25230%0.301SS..  trans-78135.7178.8-178.80000111.4D208 S211 D213S206-D208 VanDerWaalsContact C-N 3.32Å; S206-D208 PolarHBondContact OG-N 3.42Å; S206-D208 VanDerWaalsContact OG-N 3.08Å; S206-D208 PolarHBondContact OG-O 3.33Å; S206-S211 PolarHBondContact OG-OG 3.34Å; S206-D213 PolarHBondContact N-OD1 2.95Å
207T77.7Confident86.6Confident137 Ų13756.6 Ų56.684%0.8433%0.332SS*.SBendtrans-75.5-23.1170.354.10000112.6
208D77.9Confident86.7Confident101 Ų10157.3 Ų57.354%0.5434%0.337SS..SBendtrans-97.4138.6-173.5-58.2-20.3000110.8S206 L210 S211 K224S206-D208 VanDerWaalsContact C-N 3.32Å; S206-D208 PolarHBondContact OG-N 3.42Å; S206-D208 VanDerWaalsContact OG-N 3.08Å; S206-D208 PolarHBondContact OG-O 3.33Å; D208-L210 PolarHBondContact O-N 3.34Å; D208-S211 PolarHBondContact O-N 2.86Å; D208-K224 PolarHBondContact O-NZ 2.85Å; D208-K224 VanDerWaalsContact O-NZ 3.11Å
209S71.8Confident87.1Confident101 Ų10156.9 Ų56.971%0.70633%0.327SS*.SBendtrans-62.8-29.2-179.456.90000112.9K224S209-K224 PolarHBondContact O-NZ 3.24Å
210L77.1Confident87.5Confident169 Ų16953.3 Ų53.389%0.88531%0.305SS*.SBendtrans-82.9-27.7-175-69.7166.1000114.3D208D208-L210 PolarHBondContact O-N 3.34Å
211S85.4Confident87.7Confident41 Ų4154.3 Ų54.329%0.28731%0.311SS..SBendtrans-92.4141.3-178.646.40000111.2S206 D208 K224S206-S211 PolarHBondContact OG-OG 3.34Å; D208-S211 PolarHBondContact O-N 2.86Å; S211-K224 PolarHBondContact O-NZ 2.99Å
212P89.1Confident87.6Confident31 Ų3155.3 Ų55.320%0.20132%0.316CS..PPolyproline II helixtrans-73.6147.7177.530.6-36.1000110.9P219P212-P219 HydrophobicContact CB-CB 4.24Å; P212-P219 HydrophobicContact CG-CB 3.67Å; P212-P219 HydrophobicContact CG-CG 4.48Å
213D90.9Very high87.3Confident9 Ų956.3 Ų56.35%0.04832%0.32CS..PPolyproline II helixtrans-63.5150.5166.1-62.7-33000109.5L205 S206 L220 N325 L327L205-D213 HydrophobicContact CD2-CB 4.26Å; S206-D213 PolarHBondContact N-OD1 2.95Å; D213-L220 PolarHBondContact O-N 3.23Å; D213-N325 PolarHBondContact OD2-ND2 3.49Å; D213-L327 HydrophobicContact CB-CD1 3.56Å
214R93.2Very high86.6Confident126 Ų12659.4 Ų59.448%0.47533%0.333SS..EExtended strand (participates in β ladder)trans-119.7145.6-177.2-55.4-179177.4-173.6-2.4111.2D204 S218 P219D204-R214 HydrophobicContact CB-CB 4.26Å; D204-R214 PolarHBondContact N-O 2.96Å; D204-R214 PolarHBondContact O-N 3.29Å; R214-S218 WeakPolarHBondContact CA-O 3.36Å; R214-P219 HydrophobicContact CG-CG 4.4Å
215F92.9Very high86Confident0 Ų061.9 Ų61.90%034%0.342CS..EExtended strand (participates in β ladder)trans-127.2121.4169.4-168.1-110.8000108.7F201 T203 C217 S218 A240 C244 A247 L327 L330F201-F215 HydrophobicContact CB-CE1 4.35Å; F201-F215 HydrophobicContact CB-CE2 4.3Å; F201-F215 HydrophobicContact CB-CZ 3.71Å; F201-F215 AromaticContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CE1 3.99Å; F201-F215 HydrophobicContact CD1-CZ 4.14Å; F201-F215 HydrophobicContact CG-CZ 4.38Å; F201-F215 VanDerWaalsContact O-CE2 3.25Å; F201-F215 WeakPolarHBondContact O-CE2 3.3Å; T203-F215 HydrophobicContact CG2-CD2 4.38Å; T203-F215 VanDerWaalsContact OG1-CD2 3.27Å; T203-F215 WeakPolarHBondContact OG1-CD2 3.35Å; T203-F215 VanDerWaalsContact OG1-CE2 3.3Å; T203-F215 WeakPolarHBondContact OG1-CE2 3.32Å; F215-C217 VanDerWaalsContact C-N 3.32Å; F215-C217 PolarHBondContact O-N 3.24Å; F215-S218 PolarHBondContact N-O 2.95Å; F215-S218 VanDerWaalsContact O-CB 3.32Å; F215-S218 WeakPolarHBondContact O-CB 3.31Å; F215-S218 PolarHBondContact O-N 2.98Å; F215-A240 HydrophobicContact CB-CB 4.37Å; F215-C244 HydrophobicContact CD1-CB 4.49Å; F215-C244 WeakPolarHBondContact CD1-SG 3.41Å; F215-C244 HydrophobicContact CE1-CB 4.3Å; F215-A247 HydrophobicContact CE1-CB 4.31Å; F215-A247 HydrophobicContact CZ-CB 3.86Å; F215-L327 HydrophobicContact CB-CD2 3.81Å; F215-L327 HydrophobicContact CD2-CD2 4.01Å; F215-L327 HydrophobicContact CG-CD2 4.06Å; F215-L330 HydrophobicContact CD2-CD1 4.2Å; F215-L330 HydrophobicContact CE2-CB 4.45Å; F215-L330 HydrophobicContact CE2-CD1 3.71Å; F215-L330 HydrophobicContact CZ-CD1 3.96Å
216V90.7Very high85.6Confident22 Ų2263.9 Ų63.913%0.13335%0.353CS..THydrogen-bonded Turntrans52.652.9-173.3-164.70000110.9F201 V202 S218 Y243 W475F201-V216 HydrophobicContact CB-CG2 4.32Å; F201-V216 HydrophobicContact CD1-CG2 3.84Å; F201-V216 HydrophobicContact CG-CG2 4.44Å; V202-V216 PolarHBondContact O-N 3.25Å; V216-S218 PolarHBondContact O-N 3.38Å; V216-S218 PolarHBondContact O-OG 2.99Å; V216-Y243 HydrophobicContact CB-CD2 3.87Å; V216-Y243 HydrophobicContact CB-CE2 4.23Å; V216-Y243 HydrophobicContact CB-CG 4.07Å; V216-Y243 HydrophobicContact CG1-CD1 4.44Å; V216-Y243 HydrophobicContact CG1-CD2 4.22Å; V216-Y243 HydrophobicContact CG1-CE1 4.34Å; V216-Y243 HydrophobicContact CG1-CE2 4.13Å; V216-Y243 HydrophobicContact CG1-CG 4.4Å; V216-Y243 HydrophobicContact CG2-CD1 4.32Å; V216-Y243 HydrophobicContact CG2-CD2 4.24Å; V216-Y243 HydrophobicContact CG2-CG 3.93Å; V216-W475 HydrophobicContact CG1-CH2 3.62Å; V216-W475 HydrophobicContact CG1-CZ3 4.11Å
217C89.5Confident85.5Confident97 Ų9762.4 Ų62.466%0.65534%0.342SS*.THydrogen-bonded Turntrans572.7-175.6-52.50000115.7F215 P219F215-C217 VanDerWaalsContact C-N 3.32Å; F215-C217 PolarHBondContact O-N 3.24Å; C217-P219 WeakPolarHBondContact O-CD 3.41Å
218S92.1Very high85.8Confident20 Ų2058.8 Ų58.814%0.1432%0.315CS..EExtended strand (participates in β ladder)trans-96.7119.4-178-58.60000110R214 F215 V216 L220 T239R214-S218 WeakPolarHBondContact CA-O 3.36Å; F215-S218 PolarHBondContact N-O 2.95Å; F215-S218 VanDerWaalsContact O-CB 3.32Å; F215-S218 WeakPolarHBondContact O-CB 3.31Å; F215-S218 PolarHBondContact O-N 2.98Å; V216-S218 PolarHBondContact O-N 3.38Å; V216-S218 PolarHBondContact O-OG 2.99Å; S218-L220 PolarHBondContact O-N 3.26Å; S218-T239 WeakPolarHBondContact OG-CG2 3.49Å
219P93.4Very high86.1Confident30 Ų3057 Ų5720%0.19531%0.314CS..EExtended strand (participates in β ladder)trans-59.5128.6176.1-28.937.9000113.4P212 R214 C217 H221 S236 S237P212-P219 HydrophobicContact CB-CB 4.24Å; P212-P219 HydrophobicContact CG-CB 3.67Å; P212-P219 HydrophobicContact CG-CG 4.48Å; R214-P219 HydrophobicContact CG-CG 4.4Å; C217-P219 WeakPolarHBondContact O-CD 3.41Å; P219-H221 WeakPolarHBondContact CB-NE2 3.28Å; P219-S236 CarbonylContact O-C 3.27Å; P219-S236 WeakPolarHBondContact O-CB 3.47Å; P219-S237 PolarHBondContact O-N 3.19Å
220L92.5Very high86.7Confident0 Ų052.7 Ų52.70%029%0.286CS..  trans-102.1104.6168.6-176.562.7000109.1D213 S218 I222 P231 A240 L241 L327D213-L220 PolarHBondContact O-N 3.23Å; S218-L220 PolarHBondContact O-N 3.26Å; L220-I222 HydrophobicContact CD2-CG2 4.46Å; L220-I222 HydrophobicContact CG-CG2 4.12Å; L220-I222 PolarHBondContact O-N 3.15Å; L220-P231 HydrophobicContact CD1-CB 4.06Å; L220-A240 HydrophobicContact CB-CB 4.15Å; L220-A240 HydrophobicContact CD1-CB 4.32Å; L220-L241 HydrophobicContact CD1-CD2 3.95Å; L220-L241 HydrophobicContact CD1-CG 4.11Å; L220-L241 HydrophobicContact CD2-CD2 4.31Å; L220-L327 HydrophobicContact CB-CD1 3.95Å; L220-L327 HydrophobicContact CD2-CD1 3.87Å; L220-L327 HydrophobicContact CD2-CD2 4.28Å; L220-L327 HydrophobicContact CD2-CG 3.94Å
221H90.6Very high87.3Confident52 Ų5245.4 Ų45.424%0.24125%0.249CC..  trans-83.7105.9-178.1-62.5-96000109.7P219 P231 E232 S236 S237P219-H221 WeakPolarHBondContact CB-NE2 3.28Å; H221-P231 CarbonylContact O-C 3.17Å; H221-P231 VanDerWaalsContact O-CA 3.23Å; H221-P231 WeakPolarHBondContact O-CA 3.45Å; H221-E232 HydrophobicContact CB-CB 3.91Å; H221-E232 HydrophobicContact CB-CG 4.02Å; H221-E232 IonicContact CG-OE2 3.82Å; H221-E232 PolarHBondContact O-N 3.46Å; H221-S236 PolarHBondContact CD2-OG 3.43Å; H221-S236 PolarHBondContact NE2-OG 2.98Å; H221-S237 PolarHBondContact N-OG 3.02Å
222I88.4Confident87.5Confident22 Ų2248.6 Ų48.611%0.11326%0.259CS..BIsolated β-bridgetrans-127.7147.3177.750.7169.7000110.5L220 K224 P231 Y287 N325L220-I222 HydrophobicContact CD2-CG2 4.46Å; L220-I222 HydrophobicContact CG-CG2 4.12Å; L220-I222 PolarHBondContact O-N 3.15Å; I222-K224 PolarHBondContact O-N 3.24Å; I222-P231 HydrophobicContact CG2-CB 4.05Å; I222-Y287 HydrophobicContact CG2-CE2 3.89Å; I222-N325 HydrophobicContact CD1-CB 4.47Å
223D83.9Confident87.3Confident71 Ų7150.7 Ų50.738%0.3827%0.273SS..  trans-67.9110.3168.9-177.5-10.4000109.5E225 N226 I227D223-E225 PolarHBondContact O-N 3.08Å; D223-E225 WeakPolarHBondContact OD1-CA 3.39Å; D223-E225 WeakPolarHBondContact OD1-CB 3.41Å; D223-E225 PolarHBondContact OD1-N 3.5Å; D223-N226 CarbonylContact O-C 3.46Å; D223-N226 VanDerWaalsContact O-C 3.27Å; D223-N226 PolarHBondContact O-N 2.96Å; D223-N226 PolarHBondContact OD1-N 3.4Å; D223-N226 VanDerWaalsContact OD1-N 3.14Å; D223-I227 WeakPolarHBondContact O-CA 3.24Å; D223-I227 WeakPolarHBondContact O-CG1 3.3Å; D223-I227 PolarHBondContact O-N 3.02Å
224K78Confident87.2Confident74 Ų7452 Ų5232%0.32228%0.281SS..SBendtrans-67.6-19.4179.7-67.3-177.1179.4173.90112.4D208 S209 S211 I222D208-K224 PolarHBondContact O-NZ 2.85Å; D208-K224 VanDerWaalsContact O-NZ 3.11Å; S209-K224 PolarHBondContact O-NZ 3.24Å; S211-K224 PolarHBondContact O-NZ 2.99Å; I222-K224 PolarHBondContact O-N 3.24Å
225E75.8Confident87Confident124 Ų12450.8 Ų50.858%0.57929%0.29SS*.SBendtrans-87.2-42.8175.7-51.4-151.4131.800111.7D223 R320D223-E225 PolarHBondContact O-N 3.08Å; D223-E225 WeakPolarHBondContact OD1-CA 3.39Å; D223-E225 WeakPolarHBondContact OD1-CB 3.41Å; D223-E225 PolarHBondContact OD1-N 3.5Å; E225-R320 VanDerWaalsContact CD-NH1 3.27Å; E225-R320 VanDerWaalsContact CG-NH1 3.35Å; E225-R320 IonicContact OE1-CZ 3.5Å; E225-R320 IonicContact OE1-NH1 3.87Å; E225-R320 PolarHBondContact OE1-NH1 2.99Å; E225-R320 IonicContact OE1-NH2 2.63Å; E225-R320 PolarHBondContact OE1-NH2 3.35Å
226N81.3Confident86.9Confident78 Ų7852.3 Ų52.342%0.41730%0.3SS..  trans-122.378.4178.5-172.513.9000112.3D223 F228 A229D223-N226 CarbonylContact O-C 3.46Å; D223-N226 VanDerWaalsContact O-C 3.27Å; D223-N226 PolarHBondContact O-N 2.96Å; D223-N226 PolarHBondContact OD1-N 3.4Å; D223-N226 VanDerWaalsContact OD1-N 3.14Å; N226-F228 PolarHBondContact O-N 3.14Å; N226-A229 HydrophobicContact CB-CB 4.34Å; N226-A229 WeakPolarHBondContact O-CB 3.41Å; N226-A229 PolarHBondContact O-N 2.88Å
227I82.5Confident86.9Confident5 Ų551.3 Ų51.33%0.02629%0.294CS..G310 helixtrans-57.8-24.2179.9-78170.3000113.5D223 A229 Y287 I291 H321 T322 N325D223-I227 WeakPolarHBondContact O-CA 3.24Å; D223-I227 WeakPolarHBondContact O-CG1 3.3Å; D223-I227 PolarHBondContact O-N 3.02Å; I227-A229 VanDerWaalsContact C-N 3.32Å; I227-Y287 WeakPolarHBondContact CG2-OH 3.39Å; I227-Y287 WeakPolarHBondContact O-CE1 3.34Å; I227-Y287 PolarHBondContact O-OH 3.44Å; I227-I291 HydrophobicContact CG2-CD1 4.45Å; I227-H321 VanDerWaalsContact CD1-O 3.29Å; I227-H321 WeakPolarHBondContact CD1-O 3.48Å; I227-T322 HydrophobicContact CD1-CG2 4.39Å; I227-N325 HydrophobicContact CD1-CB 4.1Å
228F84.7Confident86.9Confident61 Ų6149 Ų4927%0.26827%0.273SS..G310 helixtrans-85-1.8177.1-56.4-55.8000113.6N226 G230 F288 H321 Y324N226-F228 PolarHBondContact O-N 3.14Å; F228-G230 PolarHBondContact O-N 3.22Å; F228-F288 HydrophobicContact CB-CE1 4.24Å; F228-F288 HydrophobicContact CB-CZ 4.49Å; F228-F288 AromaticContact CD1-CE1 3.97Å; F228-F288 HydrophobicContact CD1-CE1 3.97Å; F228-F288 VanDerWaalsContact O-CZ 3.25Å; F228-F288 WeakPolarHBondContact O-CZ 3.45Å; F228-H321 HydrophobicContact CD2-CB 4.3Å; F228-H321 HydrophobicContact CE2-CB 3.65Å; F228-H321 AromaticContact CE2-CD2 3.77Å; F228-H321 AromaticContact CE2-CG 3.4Å; F228-H321 AromaticContact CE2-ND1 3.58Å; F228-H321 HydrophobicContact CZ-CB 4.14Å; F228-Y324 HydrophobicContact CE1-CG 4.27Å; F228-Y324 HydrophobicContact CZ-CD1 4.49Å; F228-Y324 AromaticContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CE2 4.41Å; F228-Y324 AromaticContact CZ-CG 3.91Å; F228-Y324 HydrophobicContact CZ-CG 3.91Å
229A84.1Confident86.7Confident64 Ų6449.9 Ų49.953%0.52928%0.278SS..G310 helixtrans-64.9-21.7167.300000111.9N226 I227N226-A229 HydrophobicContact CB-CB 4.34Å; N226-A229 WeakPolarHBondContact O-CB 3.41Å; N226-A229 PolarHBondContact O-N 2.88Å; I227-A229 VanDerWaalsContact C-N 3.32Å
230G84.8Confident86.6Confident10 Ų1048.4 Ų48.410%0.10327%0.269CS..  trans87177.4-174.700000112.5F228F228-G230 PolarHBondContact O-N 3.22Å
231P90.5Very high86.5Confident17 Ų1748.4 Ų48.411%0.1127%0.269CS..BIsolated β-bridgetrans-82.2152.8-177.534.2-35.3000111.7L220 H221 I222 L241 M283 Y287L220-P231 HydrophobicContact CD1-CB 4.06Å; H221-P231 CarbonylContact O-C 3.17Å; H221-P231 VanDerWaalsContact O-CA 3.23Å; H221-P231 WeakPolarHBondContact O-CA 3.45Å; I222-P231 HydrophobicContact CG2-CB 4.05Å; P231-L241 HydrophobicContact CG-CD1 4.14Å; P231-M283 HydrophobicContact CB-CE 4.5Å; P231-M283 HydrophobicContact CG-CE 3.95Å; P231-Y287 HydrophobicContact CG-CD2 4.38Å; P231-Y287 HydrophobicContact CG-CG 4.21Å
232E88.4Confident86.3Confident107 Ų10746.1 Ų46.150%0.526%0.258SS..  trans-62.7138.4168.8-61.2-175.7165.500109.9H221 T234 S237H221-E232 HydrophobicContact CB-CB 3.91Å; H221-E232 HydrophobicContact CB-CG 4.02Å; H221-E232 IonicContact CG-OE2 3.82Å; H221-E232 PolarHBondContact O-N 3.46Å; E232-T234 HydrophobicContact CB-CG2 4.11Å; E232-T234 PolarHBondContact O-N 3.01Å; E232-S237 WeakPolarHBondContact O-CB 3.37Å; E232-S237 PolarHBondContact O-OG 2.86Å
233P85.9Confident86.4Confident76 Ų7645.4 Ų45.449%0.49425%0.254SS..  trans-78.954.1-175.134-37.3000112.1R280P233-R280 PolarHBondContact O-NE 3.48Å; P233-R280 PolarHBondContact O-NH2 3.16Å
234T88.9Confident86.7Confident36 Ų3642 Ų4222%0.22124%0.236CC..  trans-92.5154.6176.5620000111.2E232 S236 S237 H238E232-T234 HydrophobicContact CB-CG2 4.11Å; E232-T234 PolarHBondContact O-N 3.01Å; T234-S236 PolarHBondContact O-N 3.05Å; T234-S236 PolarHBondContact OG1-OG 3.05Å; T234-S237 PolarHBondContact O-N 3.34Å; T234-S237 WeakPolarHBondContact OG1-CB 3.33Å; T234-S237 PolarHBondContact OG1-N 3.14Å; T234-S237 PolarHBondContact OG1-OG 3.39Å; T234-S237 VanDerWaalsContact OG1-OG 3.05Å; T234-H238 PolarHBondContact O-N 3.42Å
235P87.9Confident87.2Confident101 Ų10138.9 Ų38.966%0.65622%0.223SC*.Hα-helixtrans-58.8-34.1174.3-24.634.6000113.3H238 T239P235-H238 PolarHBondContact O-N 2.93Å; P235-T239 WeakPolarHBondContact O-CB 3.39Å; P235-T239 PolarHBondContact O-N 3.28Å; P235-T239 PolarHBondContact O-OG1 3.26Å
236S90.8Very high87.7Confident32 Ų3233.7 Ų33.722%0.22420%0.2CC..Hα-helixtrans-64.8-48.8177.149.80000111.9P219 H221 T234 H238 T239 A240P219-S236 CarbonylContact O-C 3.27Å; P219-S236 WeakPolarHBondContact O-CB 3.47Å; H221-S236 PolarHBondContact CD2-OG 3.43Å; H221-S236 PolarHBondContact NE2-OG 2.98Å; T234-S236 PolarHBondContact O-N 3.05Å; T234-S236 PolarHBondContact OG1-OG 3.05Å; S236-H238 VanDerWaalsContact C-N 3.3Å; S236-H238 PolarHBondContact O-N 3.35Å; S236-T239 PolarHBondContact O-N 3.11Å; S236-A240 WeakPolarHBondContact O-CB 3.5Å; S236-A240 PolarHBondContact O-N 3Å
237S91Very high88.2Confident0 Ų030 Ų300%018%0.18CC..Hα-helixtrans-60.4-41.4176-67.60000111.5P219 H221 E232 T234 A240 L241 M283P219-S237 PolarHBondContact O-N 3.19Å; H221-S237 PolarHBondContact N-OG 3.02Å; E232-S237 WeakPolarHBondContact O-CB 3.37Å; E232-S237 PolarHBondContact O-OG 2.86Å; T234-S237 PolarHBondContact O-N 3.34Å; T234-S237 WeakPolarHBondContact OG1-CB 3.33Å; T234-S237 PolarHBondContact OG1-N 3.14Å; T234-S237 PolarHBondContact OG1-OG 3.39Å; T234-S237 VanDerWaalsContact OG1-OG 3.05Å; S237-A240 PolarHBondContact O-N 3.41Å; S237-L241 WeakPolarHBondContact O-CG 3.43Å; S237-L241 PolarHBondContact O-N 2.98Å; S237-M283 VanDerWaalsContact C-CE 3.47Å
238H88.6Confident88.6Confident48 Ų4829.8 Ų29.822%0.22218%0.179CC..Hα-helixtrans-62.3-44.6177.2175.3-89.3000112.5T234 P235 S236 L241 T242 P278 M283T234-H238 PolarHBondContact O-N 3.42Å; P235-H238 PolarHBondContact O-N 2.93Å; S236-H238 VanDerWaalsContact C-N 3.3Å; S236-H238 PolarHBondContact O-N 3.35Å; H238-L241 PolarHBondContact O-N 3.4Å; H238-T242 WeakPolarHBondContact O-CB 3.33Å; H238-T242 PolarHBondContact O-N 2.96Å; H238-T242 PolarHBondContact O-OG1 3.23Å; H238-P278 PolarHBondContact NE2-O 3.12Å; H238-M283 VanDerWaalsContact CA-CE 3.47Å; H238-M283 VanDerWaalsContact CA-SD 3.54Å; H238-M283 HydrophobicContact CB-CE 4.09Å; H238-M283 HydrophobicContact CB-SD 3.81Å
239T88.1Confident88.7Confident39 Ų3928.5 Ų28.524%0.23917%0.173CC..Hα-helixtrans-61.6-47.4175.5-57.40000110.9S218 P235 S236 L241 T242 Y243 I482S218-T239 WeakPolarHBondContact OG-CG2 3.49Å; P235-T239 WeakPolarHBondContact O-CB 3.39Å; P235-T239 PolarHBondContact O-N 3.28Å; P235-T239 PolarHBondContact O-OG1 3.26Å; S236-T239 PolarHBondContact O-N 3.11Å; T239-L241 PolarHBondContact O-N 3.07Å; T239-T242 WeakPolarHBondContact O-CB 2.97Å; T239-T242 PolarHBondContact O-N 3.17Å; T239-Y243 HydrophobicContact CG2-CD2 3.85Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact O-CD2 3.25Å; T239-Y243 WeakPolarHBondContact O-CD2 3.43Å; T239-Y243 PolarHBondContact O-N 3.25Å; T239-I482 HydrophobicContact CG2-CG2 4.33Å
240A91Very high88.8Confident0 Ų025.9 Ų25.90%015%0.15CC..Hα-helixtrans-58.6-47.8178.100000112.2F215 L220 S236 S237 T242 Y243 C244F215-A240 HydrophobicContact CB-CB 4.37Å; L220-A240 HydrophobicContact CB-CB 4.15Å; L220-A240 HydrophobicContact CD1-CB 4.32Å; S236-A240 WeakPolarHBondContact O-CB 3.5Å; S236-A240 PolarHBondContact O-N 3Å; S237-A240 PolarHBondContact O-N 3.41Å; A240-T242 VanDerWaalsContact C-N 3.3Å; A240-T242 PolarHBondContact O-N 3.41Å; A240-Y243 PolarHBondContact O-N 3.48Å; A240-C244 PolarHBondContact O-N 3.43Å; A240-C244 PolarHBondContact O-SG 3.46Å
241L90.7Very high89Confident0 Ų025.4 Ų25.40%015%0.145CC..Hα-helixtrans-66.2-31.7177.9-69.2-167.6000113.7L220 P231 S237 H238 T239 C244 S245 M283 V286 Y287L220-L241 HydrophobicContact CD1-CD2 3.95Å; L220-L241 HydrophobicContact CD1-CG 4.11Å; L220-L241 HydrophobicContact CD2-CD2 4.31Å; P231-L241 HydrophobicContact CG-CD1 4.14Å; S237-L241 WeakPolarHBondContact O-CG 3.43Å; S237-L241 PolarHBondContact O-N 2.98Å; H238-L241 PolarHBondContact O-N 3.4Å; T239-L241 PolarHBondContact O-N 3.07Å; L241-C244 PolarHBondContact O-N 2.89Å; L241-S245 PolarHBondContact O-N 3.08Å; L241-S245 PolarHBondContact O-OG 3.45Å; L241-M283 HydrophobicContact CB-CE 4.46Å; L241-M283 HydrophobicContact CD1-CE 3.4Å; L241-M283 HydrophobicContact CD1-SD 3.77Å; L241-M283 HydrophobicContact CG-CE 3.95Å; L241-V286 HydrophobicContact CB-CG1 4.24Å; L241-V286 HydrophobicContact CD1-CB 4.47Å; L241-V286 HydrophobicContact CD1-CG1 4.24Å; L241-Y287 HydrophobicContact CD2-CD2 4.11Å
242T87.5Confident88.8Confident3 Ų325.4 Ų25.42%0.01815%0.145CC..Hα-helixtrans-64.9-46.6175.3-58.30000110.1H238 T239 A240 C244 S245 V246 L277 I482H238-T242 WeakPolarHBondContact O-CB 3.33Å; H238-T242 PolarHBondContact O-N 2.96Å; H238-T242 PolarHBondContact O-OG1 3.23Å; T239-T242 WeakPolarHBondContact O-CB 2.97Å; T239-T242 PolarHBondContact O-N 3.17Å; A240-T242 VanDerWaalsContact C-N 3.3Å; A240-T242 PolarHBondContact O-N 3.41Å; T242-C244 PolarHBondContact O-N 3.04Å; T242-S245 PolarHBondContact O-N 2.96Å; T242-V246 PolarHBondContact O-N 3.38Å; T242-L277 HydrophobicContact CG2-CB 4.38Å; T242-L277 HydrophobicContact CG2-CD1 4.45Å; T242-L277 HydrophobicContact CG2-CD2 3.35Å; T242-L277 HydrophobicContact CG2-CG 4.25Å; T242-I482 HydrophobicContact CG2-CD1 3.75Å; T242-I482 HydrophobicContact CG2-CG1 3.69Å
243Y89.2Confident88.6Confident8 Ų825.7 Ų25.73%0.03115%0.148CC..Hα-helixtrans-61.2-42.1171.8-74.1-61000112.1F201 V216 T239 A240 S245 V246 A247 I482 T484F201-Y243 HydrophobicContact CD1-CD1 4.42Å; F201-Y243 AromaticContact CE1-CD1 3.89Å; F201-Y243 HydrophobicContact CE1-CD1 3.89Å; V216-Y243 HydrophobicContact CB-CD2 3.87Å; V216-Y243 HydrophobicContact CB-CE2 4.23Å; V216-Y243 HydrophobicContact CB-CG 4.07Å; V216-Y243 HydrophobicContact CG1-CD1 4.44Å; V216-Y243 HydrophobicContact CG1-CD2 4.22Å; V216-Y243 HydrophobicContact CG1-CE1 4.34Å; V216-Y243 HydrophobicContact CG1-CE2 4.13Å; V216-Y243 HydrophobicContact CG1-CG 4.4Å; V216-Y243 HydrophobicContact CG2-CD1 4.32Å; V216-Y243 HydrophobicContact CG2-CD2 4.24Å; V216-Y243 HydrophobicContact CG2-CG 3.93Å; T239-Y243 HydrophobicContact CG2-CD2 3.85Å; T239-Y243 HydrophobicContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact CG2-CE2 3.48Å; T239-Y243 VanDerWaalsContact O-CD2 3.25Å; T239-Y243 WeakPolarHBondContact O-CD2 3.43Å; T239-Y243 PolarHBondContact O-N 3.25Å; A240-Y243 PolarHBondContact O-N 3.48Å; Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 2.98Å; Y243-V246 PolarHBondContact O-N 3.23Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; Y243-A247 PolarHBondContact O-N 3.44Å; Y243-I482 HydrophobicContact CD1-CD1 3.32Å; Y243-I482 HydrophobicContact CD2-CD1 4.28Å; Y243-I482 HydrophobicContact CE1-CD1 3.19Å; Y243-I482 HydrophobicContact CE1-CG1 4.44Å; Y243-I482 HydrophobicContact CE2-CD1 4.16Å; Y243-I482 HydrophobicContact CE2-CG2 4.36Å; Y243-I482 HydrophobicContact CG-CD1 3.88Å; Y243-T484 WeakPolarHBondContact OH-CG2 3.33Å
244C91.5Very high88.5Confident0 Ų023.3 Ų23.30%013%0.132CC..Hα-helixtrans-57.2-41.9176.8-720000111.6F215 A240 L241 T242 V246 A247 I248 V290F215-C244 HydrophobicContact CD1-CB 4.49Å; F215-C244 WeakPolarHBondContact CD1-SG 3.41Å; F215-C244 HydrophobicContact CE1-CB 4.3Å; A240-C244 PolarHBondContact O-N 3.43Å; A240-C244 PolarHBondContact O-SG 3.46Å; L241-C244 PolarHBondContact O-N 2.89Å; T242-C244 PolarHBondContact O-N 3.04Å; C244-V246 VanDerWaalsContact C-N 3.31Å; C244-V246 PolarHBondContact O-N 2.87Å; C244-A247 PolarHBondContact O-N 3.21Å; C244-I248 WeakPolarHBondContact O-CB 3.45Å; C244-I248 WeakPolarHBondContact O-CD1 3.31Å; C244-I248 VanDerWaalsContact O-CG1 3.25Å; C244-I248 WeakPolarHBondContact O-CG1 3.09Å; C244-I248 PolarHBondContact O-N 3.21Å; C244-V290 HydrophobicContact CB-CG1 4.11Å; C244-V290 HydrophobicContact CB-CG2 4.08Å
245S88.7Confident88Confident8 Ų822.5 Ų22.56%0.05613%0.126CC..Hα-helixtrans-62.1-40.1179.3-58.30000111.5L241 T242 Y243 R249L241-S245 PolarHBondContact O-N 3.08Å; L241-S245 PolarHBondContact O-OG 3.45Å; T242-S245 PolarHBondContact O-N 2.96Å; Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 2.98Å; S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 PolarHBondContact O-N 3.33Å
246V86.5Confident87.6Confident15 Ų1523.2 Ų23.29%0.09112%0.124CC..Hα-helixtrans-67-47.2174.7-178.30000111F201 T242 Y243 C244 I248 R249 V250 F273 A478F201-V246 HydrophobicContact CE1-CB 4.11Å; F201-V246 HydrophobicContact CE1-CG1 4.17Å; F201-V246 HydrophobicContact CZ-CB 4.12Å; F201-V246 HydrophobicContact CZ-CG1 3.66Å; T242-V246 PolarHBondContact O-N 3.38Å; Y243-V246 PolarHBondContact O-N 3.23Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; C244-V246 VanDerWaalsContact C-N 3.31Å; C244-V246 PolarHBondContact O-N 2.87Å; V246-I248 VanDerWaalsContact C-N 3.32Å; V246-I248 PolarHBondContact O-N 2.96Å; V246-R249 WeakPolarHBondContact O-CB 2.97Å; V246-R249 PolarHBondContact O-N 3.06Å; V246-R249 VanDerWaalsContact O-N 3.16Å; V246-V250 HydrophobicContact CG1-CG2 4.48Å; V246-V250 VanDerWaalsContact O-CG2 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.08Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-F273 HydrophobicContact CG1-CE1 4.41Å; V246-A478 HydrophobicContact CG1-CB 3.91Å
247A90.3Very high87.2Confident0 Ų022.3 Ų22.30%012%0.117CC..Hα-helixtrans-59-43.6178.500000111.7L197 F201 F215 Y243 C244 V250 S251L197-A247 HydrophobicContact CD2-CB 4.28Å; F201-A247 HydrophobicContact CB-CB 4.19Å; F201-A247 HydrophobicContact CD1-CB 3.94Å; F201-A247 HydrophobicContact CE1-CB 4.42Å; F201-A247 HydrophobicContact CG-CB 3.98Å; F215-A247 HydrophobicContact CE1-CB 4.31Å; F215-A247 HydrophobicContact CZ-CB 3.86Å; Y243-A247 PolarHBondContact O-N 3.44Å; C244-A247 PolarHBondContact O-N 3.21Å; A247-V250 PolarHBondContact O-N 3.16Å; A247-S251 VanDerWaalsContact O-CB 3.3Å; A247-S251 WeakPolarHBondContact O-CB 3.16Å; A247-S251 PolarHBondContact O-N 2.82Å; A247-S251 PolarHBondContact O-OG 3.09Å
248I90.9Very high86.7Confident0 Ų030.3 Ų30.30%015%0.148CC..Hα-helixtrans-62.8-44.6175.7-71.2161.6000110.8C244 V246 V250 S251 T252 L259 L267 V290 A293 V294 L297C244-I248 WeakPolarHBondContact O-CB 3.45Å; C244-I248 WeakPolarHBondContact O-CD1 3.31Å; C244-I248 VanDerWaalsContact O-CG1 3.25Å; C244-I248 WeakPolarHBondContact O-CG1 3.09Å; C244-I248 PolarHBondContact O-N 3.21Å; V246-I248 VanDerWaalsContact C-N 3.32Å; V246-I248 PolarHBondContact O-N 2.96Å; I248-V250 VanDerWaalsContact C-N 3.28Å; I248-V250 PolarHBondContact O-N 2.99Å; I248-S251 PolarHBondContact O-N 3.39Å; I248-T252 HydrophobicContact CG2-CG2 4.1Å; I248-T252 VanDerWaalsContact O-CG2 3.28Å; I248-T252 WeakPolarHBondContact O-CG2 3.18Å; I248-T252 PolarHBondContact O-N 2.89Å; I248-T252 PolarHBondContact O-OG1 3.21Å; I248-L259 HydrophobicContact CG2-CD1 4.16Å; I248-L267 HydrophobicContact CD1-CD1 4.32Å; I248-L267 HydrophobicContact CG2-CD1 3.83Å; I248-V290 HydrophobicContact CD1-CB 4.06Å; I248-V290 HydrophobicContact CD1-CG1 3.93Å; I248-V290 HydrophobicContact CD1-CG2 3.86Å; I248-A293 HydrophobicContact CD1-CB 4.07Å; I248-A293 HydrophobicContact CG1-CB 4.42Å; I248-A293 HydrophobicContact CG2-CB 3.64Å; I248-V294 HydrophobicContact CD1-CG2 4.08Å; I248-V294 HydrophobicContact CG1-CG2 4.25Å; I248-L297 HydrophobicContact CG1-CD1 4.43Å; I248-L297 HydrophobicContact CG2-CD1 4.36Å
249R86.8Confident86.4Confident35 Ų3528.2 Ų28.213%0.13214%0.138CC..Hα-helixtrans-55.3-46.1178.2-173.3169.4176.7156.43.2111.9S245 V246 T252 I253 L269 G271 S272 F273S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 PolarHBondContact O-N 3.33Å; V246-R249 WeakPolarHBondContact O-CB 2.97Å; V246-R249 PolarHBondContact O-N 3.06Å; V246-R249 VanDerWaalsContact O-N 3.16Å; R249-T252 PolarHBondContact O-OG1 2.8Å; R249-I253 HydrophobicContact CG-CD1 4.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.26Å; R249-I253 VanDerWaalsContact O-CG1 3.28Å; R249-I253 WeakPolarHBondContact O-CG1 3.15Å; R249-I253 PolarHBondContact O-N 2.67Å; R249-L269 HydrophobicContact CB-CD2 3.51Å; R249-L269 HydrophobicContact CG-CD2 3.8Å; R249-G271 PolarHBondContact NH2-O 2.8Å; R249-S272 PolarHBondContact NH1-O 2.97Å; R249-F273 HydrophobicContact CG-CE1 4.45Å; R249-F273 HydrophobicContact CG-CZ 4.46Å
250V86.7Confident86.3Confident8 Ų827.9 Ų27.95%0.04814%0.137CC..Hα-helixtrans-70.2-43.7-179.2-177.50000109.6L196 V246 A247 I248 T252 I253 L254 F273 L471 V474L196-V250 HydrophobicContact CD1-CB 4.15Å; L196-V250 HydrophobicContact CD1-CG1 3.89Å; L196-V250 HydrophobicContact CD2-CB 4Å; L196-V250 HydrophobicContact CD2-CG1 3.89Å; V246-V250 HydrophobicContact CG1-CG2 4.48Å; V246-V250 VanDerWaalsContact O-CG2 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.08Å; V246-V250 PolarHBondContact O-N 3.38Å; A247-V250 PolarHBondContact O-N 3.16Å; I248-V250 VanDerWaalsContact C-N 3.28Å; I248-V250 PolarHBondContact O-N 2.99Å; V250-T252 VanDerWaalsContact C-N 3.32Å; V250-T252 PolarHBondContact O-N 3.04Å; V250-I253 PolarHBondContact O-N 3.2Å; V250-I253 VanDerWaalsContact O-N 3.15Å; V250-L254 HydrophobicContact CG1-CD1 4.07Å; V250-L254 HydrophobicContact CG1-CG 4.3Å; V250-L254 WeakPolarHBondContact O-CG 3.45Å; V250-L254 PolarHBondContact O-N 3.42Å; V250-F273 HydrophobicContact CG2-CE1 4.5Å; V250-F273 HydrophobicContact CG2-CZ 4.47Å; V250-L471 HydrophobicContact CG1-CD2 4.45Å; V250-V474 HydrophobicContact CG2-CG1 3.43Å; V250-V474 VanDerWaalsContact CG2-CG1 3.43Å
251S89.3Confident85.7Confident0 Ų030.8 Ų30.80%015%0.154CC..Hα-helixtrans-59.4-39.7177.3-59.40000112.7F193 A247 I248 L254 L255F193-S251 WeakPolarHBondContact CE1-OG 3.47Å; A247-S251 VanDerWaalsContact O-CB 3.3Å; A247-S251 WeakPolarHBondContact O-CB 3.16Å; A247-S251 PolarHBondContact O-N 2.82Å; A247-S251 PolarHBondContact O-OG 3.09Å; I248-S251 PolarHBondContact O-N 3.39Å; S251-L254 PolarHBondContact O-N 3.28Å; S251-L255 PolarHBondContact O-N 3.35Å
252T86.9Confident85.3Confident18 Ų1834.2 Ų34.211%0.1118%0.178CC..Hα-helixtrans-70.8-33.2178.358.40000112.2I248 R249 V250 D256 V257 L259 L297I248-T252 HydrophobicContact CG2-CG2 4.1Å; I248-T252 VanDerWaalsContact O-CG2 3.28Å; I248-T252 WeakPolarHBondContact O-CG2 3.18Å; I248-T252 PolarHBondContact O-N 2.89Å; I248-T252 PolarHBondContact O-OG1 3.21Å; R249-T252 PolarHBondContact O-OG1 2.8Å; V250-T252 VanDerWaalsContact C-N 3.32Å; V250-T252 PolarHBondContact O-N 3.04Å; T252-D256 WeakPolarHBondContact O-CA 3.45Å; T252-D256 PolarHBondContact O-N 3.32Å; T252-D256 VanDerWaalsContact O-N 3.08Å; T252-V257 PolarHBondContact O-N 2.96Å; T252-L259 HydrophobicContact CG2-CD1 3.56Å; T252-L259 HydrophobicContact CG2-CD2 4.29Å; T252-L259 HydrophobicContact CG2-CG 3.75Å; T252-L297 HydrophobicContact CG2-CD2 3.98Å
253I83.6Confident85.2Confident112 Ų11234.8 Ų34.857%0.57418%0.181SC*.Hα-helixtrans-68.9-44.8173.5-67.4165.8000110.2R249 V250 L255 D256R249-I253 HydrophobicContact CG-CD1 4.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.26Å; R249-I253 VanDerWaalsContact O-CG1 3.28Å; R249-I253 WeakPolarHBondContact O-CG1 3.15Å; R249-I253 PolarHBondContact O-N 2.67Å; V250-I253 PolarHBondContact O-N 3.2Å; V250-I253 VanDerWaalsContact O-N 3.15Å; I253-L255 VanDerWaalsContact C-N 3.32Å; I253-L255 PolarHBondContact O-N 2.9Å; I253-D256 PolarHBondContact O-N 3.04Å
254L83.3Confident84.9Confident27 Ų2738 Ų3814%0.14119%0.193CC..Hα-helixtrans-63.1-37.3-179.9-71.4175.2000112.7H189 Y192 F193 L196 V250 S251 L471H189-L254 PolarHBondContact CE1-O 3.34Å; H189-L254 PolarHBondContact ND1-O 2.86Å; H189-L254 PolarHBondContact NE2-O 3.11Å; Y192-L254 HydrophobicContact CD2-CD2 3.77Å; Y192-L254 HydrophobicContact CG-CD2 4.19Å; F193-L254 HydrophobicContact CD2-CD1 4.43Å; F193-L254 HydrophobicContact CE2-CB 3.92Å; F193-L254 HydrophobicContact CE2-CD1 4.2Å; F193-L254 HydrophobicContact CZ-CB 4.36Å; L196-L254 HydrophobicContact CD2-CD1 4.31Å; V250-L254 HydrophobicContact CG1-CD1 4.07Å; V250-L254 HydrophobicContact CG1-CG 4.3Å; V250-L254 WeakPolarHBondContact O-CG 3.45Å; V250-L254 PolarHBondContact O-N 3.42Å; S251-L254 PolarHBondContact O-N 3.28Å; L254-L471 HydrophobicContact CD1-CD1 4.42Å
255L79.1Confident84.5Confident19 Ų1946.3 Ų46.310%0.09922%0.224CC..THydrogen-bonded Turntrans-94.81-179.5-63.1-179.6000114.3F193 S251 I253 V257 L297 R301 Y351F193-L255 HydrophobicContact CD2-CD2 4.38Å; F193-L255 HydrophobicContact CE2-CD1 3.86Å; F193-L255 HydrophobicContact CE2-CD2 3.49Å; F193-L255 VanDerWaalsContact CE2-CD2 3.49Å; F193-L255 HydrophobicContact CE2-CG 3.45Å; F193-L255 VanDerWaalsContact CE2-CG 3.45Å; F193-L255 HydrophobicContact CZ-CD1 3.56Å; F193-L255 HydrophobicContact CZ-CD2 4.09Å; F193-L255 HydrophobicContact CZ-CG 3.54Å; S251-L255 PolarHBondContact O-N 3.35Å; I253-L255 VanDerWaalsContact C-N 3.32Å; I253-L255 PolarHBondContact O-N 2.9Å; L255-V257 HydrophobicContact CB-CG2 3.6Å; L255-V257 PolarHBondContact O-N 3.32Å; L255-L297 HydrophobicContact CD1-CD2 3.93Å; L255-R301 HydrophobicContact CD1-CG 3.83Å; L255-Y351 PolarHBondContact O-OH 3.09Å
256D80.2Confident84.3Confident115 Ų11548.7 Ų48.762%0.61524%0.236SC*.THydrogen-bonded Turntrans47.542.3-171.4-160.927.9000113.4T252 I253T252-D256 WeakPolarHBondContact O-CA 3.45Å; T252-D256 PolarHBondContact O-N 3.32Å; T252-D256 VanDerWaalsContact O-N 3.08Å; I253-D256 PolarHBondContact O-N 3.04Å
257V81.6Confident84.1Confident13 Ų1348.2 Ų48.28%0.07923%0.233CC..  trans-90120.3-177.4174.40000110.1T252 L255 L259 L297 C300 Y351T252-V257 PolarHBondContact O-N 2.96Å; L255-V257 HydrophobicContact CB-CG2 3.6Å; L255-V257 PolarHBondContact O-N 3.32Å; V257-L259 HydrophobicContact CG1-CD2 4.41Å; V257-L259 PolarHBondContact O-N 3.45Å; V257-L297 HydrophobicContact CB-CD2 4.44Å; V257-L297 HydrophobicContact CG2-CD2 4.37Å; V257-C300 HydrophobicContact CG2-CB 4Å; V257-Y351 HydrophobicContact CG2-CE1 4.05Å
258W81Confident83.6Confident169 Ų16950.8 Ų50.864%0.6425%0.245SC*.  trans-76.7114.2172.7-167.189.7000111.6V261W258-V261 HydrophobicContact CH2-CG2 4.33Å; W258-V261 HydrophobicContact CZ2-CG2 4.25Å
259L82.1Confident82.8Confident3 Ų352 Ų522%0.01625%0.251CS..  trans-87.9139.5172.9-69-177000111.9I248 T252 V257 I263 R264 L267 L269 A293 L296I248-L259 HydrophobicContact CG2-CD1 4.16Å; T252-L259 HydrophobicContact CG2-CD1 3.56Å; T252-L259 HydrophobicContact CG2-CD2 4.29Å; T252-L259 HydrophobicContact CG2-CG 3.75Å; V257-L259 HydrophobicContact CG1-CD2 4.41Å; V257-L259 PolarHBondContact O-N 3.45Å; L259-I263 HydrophobicContact CB-CG2 4.49Å; L259-I263 HydrophobicContact CD1-CG2 4.03Å; L259-R264 HydrophobicContact CB-CG 3.6Å; L259-R264 WeakPolarHBondContact O-CD 3.48Å; L259-R264 PolarHBondContact O-NE 3.42Å; L259-L267 HydrophobicContact CD1-CD1 4.42Å; L259-L269 HydrophobicContact CD1-CD1 3.7Å; L259-A293 HydrophobicContact CD1-CB 4.05Å; L259-A293 HydrophobicContact CD2-CB 4.24Å; L259-L296 HydrophobicContact CD2-CB 4.43Å; L259-L296 HydrophobicContact CD2-CD1 3.89Å
260P85Confident81.9Confident33 Ų3354.8 Ų54.821%0.21427%0.272CS..  trans-47.7142.9170.1-29.834.4000113.2S262 I263 R264P260-S262 PolarHBondContact O-N 3.45Å; P260-I263 HydrophobicContact CB-CD1 4.23Å; P260-I263 HydrophobicContact CB-CG1 4.41Å; P260-I263 HydrophobicContact CG-CD1 4.01Å; P260-I263 PolarHBondContact O-N 3.33Å; P260-R264 PolarHBondContact O-N 2.97Å
261V79.6Confident80.8Confident60 Ų6056.6 Ų56.636%0.36429%0.293SS..Hα-helixtrans-55.7-38.8-175.2177.20000112.2W258 R264 R265W258-V261 HydrophobicContact CH2-CG2 4.33Å; W258-V261 HydrophobicContact CZ2-CG2 4.25Å; V261-R264 PolarHBondContact O-N 2.91Å; V261-R265 HydrophobicContact CG1-CG 4.36Å; V261-R265 WeakPolarHBondContact O-CB 3.47Å; V261-R265 VanDerWaalsContact O-CG 3.32Å; V261-R265 WeakPolarHBondContact O-CG 3.33Å; V261-R265 PolarHBondContact O-N 3.16Å
262S81.6Confident79.4Confident73 Ų7360.5 Ų60.551%0.5132%0.32SS..Hα-helixtrans-61.1-45.6177.148.80000112.4P260 R265 N266P260-S262 PolarHBondContact O-N 3.45Å; S262-R265 PolarHBondContact O-N 3.43Å; S262-N266 VanDerWaalsContact O-CG 3.29Å; S262-N266 PolarHBondContact O-N 3.46Å
263I86.1Confident77.9Confident14 Ų1462.7 Ų62.77%0.07233%0.328CS..Hα-helixtrans-65.3-46.3177.2-64.3173000110L259 P260 R265 N266 L267 A289 Y292 A293 L296L259-I263 HydrophobicContact CB-CG2 4.49Å; L259-I263 HydrophobicContact CD1-CG2 4.03Å; P260-I263 HydrophobicContact CB-CD1 4.23Å; P260-I263 HydrophobicContact CB-CG1 4.41Å; P260-I263 HydrophobicContact CG-CD1 4.01Å; P260-I263 PolarHBondContact O-N 3.33Å; I263-R265 VanDerWaalsContact C-N 3.3Å; I263-R265 PolarHBondContact O-N 3.3Å; I263-N266 PolarHBondContact O-N 3.5Å; I263-L267 HydrophobicContact CG2-CD1 3.73Å; I263-L267 HydrophobicContact CG2-CG 4.3Å; I263-L267 WeakPolarHBondContact O-CB 3.38Å; I263-L267 WeakPolarHBondContact O-CG 3.16Å; I263-L267 PolarHBondContact O-N 2.96Å; I263-A289 HydrophobicContact CG2-CB 4.24Å; I263-Y292 VanDerWaalsContact CD1-CB 3.49Å; I263-Y292 HydrophobicContact CD1-CG 4.19Å; I263-A293 HydrophobicContact CG2-CB 4.12Å; I263-L296 HydrophobicContact CD1-CD1 4.21Å
264R83Confident76.4Confident75 Ų7563.7 Ų63.728%0.28333%0.334SS..Hα-helixtrans-60.3-38178.2-70.9-168-72.3152.5-0.4113L259 P260 V261 H268 L269 V270L259-R264 HydrophobicContact CB-CG 3.6Å; L259-R264 WeakPolarHBondContact O-CD 3.48Å; L259-R264 PolarHBondContact O-NE 3.42Å; P260-R264 PolarHBondContact O-N 2.97Å; V261-R264 PolarHBondContact O-N 2.91Å; R264-H268 PolarHBondContact O-N 3.15Å; R264-L269 HydrophobicContact CB-CB 4.31Å; R264-L269 HydrophobicContact CG-CB 4.48Å; R264-L269 HydrophobicContact CG-CD1 4.3Å; R264-L269 PolarHBondContact O-N 3.22Å; R264-V270 HydrophobicContact CB-CG2 4.06Å
265R83.1Confident75.1Confident175 Ų17563.9 Ų63.966%0.6634%0.338SS*.Hα-helixtrans-66.8-49.1175.8-76.5177.4-178172.11.5111.3V261 S262 I263 L267 H268V261-R265 HydrophobicContact CG1-CG 4.36Å; V261-R265 WeakPolarHBondContact O-CB 3.47Å; V261-R265 VanDerWaalsContact O-CG 3.32Å; V261-R265 WeakPolarHBondContact O-CG 3.33Å; V261-R265 PolarHBondContact O-N 3.16Å; S262-R265 PolarHBondContact O-N 3.43Å; I263-R265 VanDerWaalsContact C-N 3.3Å; I263-R265 PolarHBondContact O-N 3.3Å; R265-L267 VanDerWaalsContact C-N 3.3Å; R265-L267 PolarHBondContact O-N 2.99Å; R265-H268 PolarHBondContact O-N 3.01Å
266N83.8Confident74Confident58 Ų5865.8 Ų65.831%0.3136%0.356SS..Hα-helixtrans-64.9-34.8-178.9-69.1-7.7000112.6S262 I263 H268 V286 A289S262-N266 VanDerWaalsContact O-CG 3.29Å; S262-N266 PolarHBondContact O-N 3.46Å; I263-N266 PolarHBondContact O-N 3.5Å; N266-H268 PolarHBondContact O-N 3.42Å; N266-H268 PolarHBondContact O-ND1 3.05Å; N266-H268 VanDerWaalsContact O-ND1 3.14Å; N266-V286 WeakPolarHBondContact O-CG2 3.25Å; N266-A289 HydrophobicContact CB-CB 3.65Å
267L82.7Confident73.3Confident5 Ų563.2 Ų63.23%0.02634%0.342CS..THydrogen-bonded Turntrans-83.13174.8-67.1-179.7000113.4I248 L259 I263 R265 L269 V286 A289 V290 A293I248-L267 HydrophobicContact CD1-CD1 4.32Å; I248-L267 HydrophobicContact CG2-CD1 3.83Å; L259-L267 HydrophobicContact CD1-CD1 4.42Å; I263-L267 HydrophobicContact CG2-CD1 3.73Å; I263-L267 HydrophobicContact CG2-CG 4.3Å; I263-L267 WeakPolarHBondContact O-CB 3.38Å; I263-L267 WeakPolarHBondContact O-CG 3.16Å; I263-L267 PolarHBondContact O-N 2.96Å; R265-L267 VanDerWaalsContact C-N 3.3Å; R265-L267 PolarHBondContact O-N 2.99Å; L267-L269 HydrophobicContact CB-CD1 3.88Å; L267-L269 HydrophobicContact CB-CD2 4.01Å; L267-L269 HydrophobicContact CB-CG 3.55Å; L267-L269 HydrophobicContact CD1-CD1 3.93Å; L267-L269 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact O-N 3.14Å; L267-V286 HydrophobicContact CD2-CG1 4.34Å; L267-A289 HydrophobicContact CD1-CB 4.49Å; L267-A289 HydrophobicContact CD2-CB 3.9Å; L267-A289 HydrophobicContact CG-CB 3.79Å; L267-V290 HydrophobicContact CD2-CB 4.49Å; L267-V290 HydrophobicContact CD2-CG2 3.54Å; L267-A293 HydrophobicContact CD1-CB 3.91Å
268H78.4Confident72.5Confident55 Ų5562.9 Ų62.926%0.25534%0.34SS..THydrogen-bonded Turntrans52.236.3-178.4-59.184.2000113.3R264 R265 N266 V270 S275 A276R264-H268 PolarHBondContact O-N 3.15Å; R265-H268 PolarHBondContact O-N 3.01Å; N266-H268 PolarHBondContact O-N 3.42Å; N266-H268 PolarHBondContact O-ND1 3.05Å; N266-H268 VanDerWaalsContact O-ND1 3.14Å; H268-V270 VanDerWaalsContact C-N 3.27Å; H268-V270 PolarHBondContact O-N 2.99Å; H268-S275 PolarHBondContact O-OG 3.31Å; H268-A276 WeakPolarHBondContact CB-O 3.45Å; H268-A276 PolarHBondContact CD2-O 2.98Å; H268-A276 VanDerWaalsContact CD2-O 3.24Å
269L75.4Confident72Confident24 Ų2460.4 Ų60.413%0.12634%0.336CS..  trans-79.8-11.8-178.7-56.9-178.3000112.8R249 L259 R264 L267R249-L269 HydrophobicContact CB-CD2 3.51Å; R249-L269 HydrophobicContact CG-CD2 3.8Å; L259-L269 HydrophobicContact CD1-CD1 3.7Å; R264-L269 HydrophobicContact CB-CB 4.31Å; R264-L269 HydrophobicContact CG-CB 4.48Å; R264-L269 HydrophobicContact CG-CD1 4.3Å; R264-L269 PolarHBondContact O-N 3.22Å; L267-L269 HydrophobicContact CB-CD1 3.88Å; L267-L269 HydrophobicContact CB-CD2 4.01Å; L267-L269 HydrophobicContact CB-CG 3.55Å; L267-L269 HydrophobicContact CD1-CD1 3.93Å; L267-L269 PolarHBondContact O-N 3.02Å; L267-L269 VanDerWaalsContact O-N 3.14Å
270V66.7Low71.3Confident94 Ų9468 Ų6857%0.5736%0.364SS*.SBendtrans-90.3102.4179.2-174.70000108.7R264 H268R264-V270 HydrophobicContact CB-CG2 4.06Å; H268-V270 VanDerWaalsContact C-N 3.27Å; H268-V270 PolarHBondContact O-N 2.99Å
271G64.4Low70.5Confident47 Ų4773.4 Ų73.449%0.48539%0.391SS..SBendtrans137.5-173178.200000113.6R249R249-G271 PolarHBondContact NH2-O 2.8Å
272S59Low70.6Confident81 Ų8172.6 Ų72.657%0.56639%0.385SS*.  trans-61.9158.517049.50000111.3R249 L274 S275R249-S272 PolarHBondContact NH1-O 2.97Å; S272-L274 PolarHBondContact O-N 3.03Å; S272-S275 PolarHBondContact O-N 3Å; S272-S275 PolarHBondContact O-OG 2.98Å
273F57.2Low70.7Confident65 Ų6569.4 Ų69.429%0.28536%0.362SS..THydrogen-bonded Turntrans-52.8-23175-93-88.5000113.7V246 R249 V250 I481V246-F273 HydrophobicContact CG1-CE1 4.41Å; R249-F273 HydrophobicContact CG-CE1 4.45Å; R249-F273 HydrophobicContact CG-CZ 4.46Å; V250-F273 HydrophobicContact CG2-CE1 4.5Å; V250-F273 HydrophobicContact CG2-CZ 4.47Å; F273-I481 HydrophobicContact CB-CD1 4.13Å; F273-I481 WeakPolarHBondContact O-CD1 3.43Å
274L51.7Low70.7Confident132 Ų13270.2 Ų70.269%0.69137%0.373SS*.THydrogen-bonded Turntrans-85.92.5179.8-53.7179.2000114.8S272 I481S272-L274 PolarHBondContact O-N 3.03Å; L274-I481 HydrophobicContact CD2-CD1 3.94Å; L274-I481 HydrophobicContact CD2-CG1 3.54Å
275S54.7Low71Confident32 Ų3274 Ų7422%0.22439%0.388CS..SBendtrans-64.3149.3177.351.40000111.2H268 S272 L277H268-S275 PolarHBondContact O-OG 3.31Å; S272-S275 PolarHBondContact O-N 3Å; S272-S275 PolarHBondContact O-OG 2.98Å; S275-L277 PolarHBondContact O-N 3.4Å
276A57.3Low71.3Confident59 Ų5965.8 Ų65.849%0.48836%0.357SS..  trans-36.7118.9-169.800000113.3H268H268-A276 WeakPolarHBondContact CB-O 3.45Å; H268-A276 PolarHBondContact CD2-O 2.98Å; H268-A276 VanDerWaalsContact CD2-O 3.24Å
277L64.6Low71.7Confident60 Ų6063 Ų6331%0.31434%0.342SS..  trans-58.1157172.5-66.1169.3000109.8T242 S275 Q279 I481T242-L277 HydrophobicContact CG2-CB 4.38Å; T242-L277 HydrophobicContact CG2-CD1 4.45Å; T242-L277 HydrophobicContact CG2-CD2 3.35Å; T242-L277 HydrophobicContact CG2-CG 4.25Å; S275-L277 PolarHBondContact O-N 3.4Å; L277-Q279 PolarHBondContact O-N 3.2Å; L277-I481 HydrophobicContact CD1-CG2 3.89Å; L277-I481 HydrophobicContact CD2-CG2 3.4Å; L277-I481 VanDerWaalsContact CD2-CG2 3.4Å; L277-I481 HydrophobicContact CG-CG2 3.93Å
278P64.9Low72Confident7 Ų766.2 Ų66.25%0.04536%0.356CS..  trans-40.7128.8167.7-31.838.5000110.3H238 V286H238-P278 PolarHBondContact NE2-O 3.12Å; P278-V286 HydrophobicContact CB-CG1 4.24Å; P278-V286 HydrophobicContact CB-CG2 3.95Å; P278-V286 HydrophobicContact CG-CG1 3.96Å; P278-V286 HydrophobicContact CG-CG2 4.28Å
279Q71.1Confident72.6Confident116 Ų11663.7 Ų63.754%0.54235%0.345SS..  trans-87.7155.3170.9-66.5-173-3.600109.2L277 D281 D282 M283L277-Q279 PolarHBondContact O-N 3.2Å; Q279-D281 PolarHBondContact O-N 3.48Å; Q279-D281 VanDerWaalsContact O-N 3.14Å; Q279-D282 PolarHBondContact O-N 3.16Å; Q279-M283 PolarHBondContact O-N 3.12Å
280R66.4Low73.5Confident162 Ų16262.6 Ų62.661%0.61134%0.339SS*.G310 helixtrans-55.1-34.2-179.9-168.1179.4-176.8-176.5-0.6112.2P233 D282 M283P233-R280 PolarHBondContact O-NE 3.48Å; P233-R280 PolarHBondContact O-NH2 3.16Å; R280-D282 VanDerWaalsContact C-N 3.34Å; R280-M283 WeakPolarHBondContact O-CB 3.42Å; R280-M283 WeakPolarHBondContact O-CG 3.43Å
281D69.1Low74.7Confident147 Ų14758.3 Ų58.379%0.78631%0.313SS*.G310 helixtrans-77.3-19.2-177-57.6-23.3000113.3Q279Q279-D281 PolarHBondContact O-N 3.48Å; Q279-D281 VanDerWaalsContact O-N 3.14Å
282D81Confident75.9Confident43 Ų4360 Ų6023%0.2331%0.305CS..G310 helixtrans-100.34.8179.9-76.9-47.6000113.3Q279 R280 G284 R285 V286Q279-D282 PolarHBondContact O-N 3.16Å; R280-D282 VanDerWaalsContact C-N 3.34Å; D282-G284 VanDerWaalsContact C-N 3.28Å; D282-G284 PolarHBondContact O-N 2.94Å; D282-G284 VanDerWaalsContact O-N 3.15Å; D282-R285 PolarHBondContact O-N 3.48Å; D282-R285 IonicContact OD1-NH1 3.26Å; D282-R285 PolarHBondContact OD1-NH1 3.19Å; D282-V286 HydrophobicContact CB-CG2 4.4Å; D282-V286 WeakPolarHBondContact O-CG2 3.34Å; D282-V286 PolarHBondContact O-N 3.1Å
283M83.5Confident77.5Confident7 Ų756.1 Ų56.13%0.03428%0.278CS..Hα-helixtrans-49-44.8-175.8-82-67.8-69.100113.8P231 S237 H238 L241 Q279 R280 V286 Y287P231-M283 HydrophobicContact CB-CE 4.5Å; P231-M283 HydrophobicContact CG-CE 3.95Å; S237-M283 VanDerWaalsContact C-CE 3.47Å; H238-M283 VanDerWaalsContact CA-CE 3.47Å; H238-M283 VanDerWaalsContact CA-SD 3.54Å; H238-M283 HydrophobicContact CB-CE 4.09Å; H238-M283 HydrophobicContact CB-SD 3.81Å; L241-M283 HydrophobicContact CB-CE 4.46Å; L241-M283 HydrophobicContact CD1-CE 3.4Å; L241-M283 HydrophobicContact CD1-SD 3.77Å; L241-M283 HydrophobicContact CG-CE 3.95Å; Q279-M283 PolarHBondContact O-N 3.12Å; R280-M283 WeakPolarHBondContact O-CB 3.42Å; R280-M283 WeakPolarHBondContact O-CG 3.43Å; M283-V286 PolarHBondContact O-N 3.44Å; M283-Y287 VanDerWaalsContact O-CB 3.26Å; M283-Y287 WeakPolarHBondContact O-CB 3.47Å; M283-Y287 PolarHBondContact O-N 2.98Å
284G87.2Confident79.2Confident30 Ų3053 Ų5331%0.30927%0.265SS..Hα-helixtrans-61.8-45.4177.500000112.5D282 V286 Y287 F288D282-G284 VanDerWaalsContact C-N 3.28Å; D282-G284 PolarHBondContact O-N 2.94Å; D282-G284 VanDerWaalsContact O-N 3.15Å; G284-V286 PolarHBondContact O-N 2.92Å; G284-Y287 PolarHBondContact O-N 3Å; G284-F288 WeakPolarHBondContact O-CD2 3.43Å; G284-F288 PolarHBondContact O-N 3.42Å
285R88Confident81Confident156 Ų15649 Ų4959%0.58924%0.242SC*.Hα-helixtrans-65.7-40.9179.8-67.1177.1177.3168.4-3.4112D282 A289D282-R285 PolarHBondContact O-N 3.48Å; D282-R285 IonicContact OD1-NH1 3.26Å; D282-R285 PolarHBondContact OD1-NH1 3.19Å; R285-A289 WeakPolarHBondContact O-CB 3.48Å; R285-A289 PolarHBondContact O-N 3.22Å
286V89.5Confident82.6Confident1 Ų148 Ų481%0.00623%0.234CC..Hα-helixtrans-63.3-48.1176.3175.40000109.4L241 N266 L267 P278 D282 M283 G284 F288 A289 V290L241-V286 HydrophobicContact CB-CG1 4.24Å; L241-V286 HydrophobicContact CD1-CB 4.47Å; L241-V286 HydrophobicContact CD1-CG1 4.24Å; N266-V286 WeakPolarHBondContact O-CG2 3.25Å; L267-V286 HydrophobicContact CD2-CG1 4.34Å; P278-V286 HydrophobicContact CB-CG1 4.24Å; P278-V286 HydrophobicContact CB-CG2 3.95Å; P278-V286 HydrophobicContact CG-CG1 3.96Å; P278-V286 HydrophobicContact CG-CG2 4.28Å; D282-V286 HydrophobicContact CB-CG2 4.4Å; D282-V286 WeakPolarHBondContact O-CG2 3.34Å; D282-V286 PolarHBondContact O-N 3.1Å; M283-V286 PolarHBondContact O-N 3.44Å; G284-V286 PolarHBondContact O-N 2.92Å; V286-F288 PolarHBondContact O-N 3.47Å; V286-A289 CarbonylContact O-C 3.56Å; V286-A289 WeakPolarHBondContact O-CB 3.26Å; V286-A289 PolarHBondContact O-N 3.34Å; V286-A289 VanDerWaalsContact O-N 3.12Å; V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 WeakPolarHBondContact O-CG2 3.25Å; V286-V290 PolarHBondContact O-N 3.47Å
287Y92.1Very high84.1Confident0 Ų045.1 Ų45.10%021%0.211CC..Hα-helixtrans-56.8-48.3177.3172.6-104.6000112.8I222 I227 P231 L241 M283 G284 A289 V290 I291 P326I222-Y287 HydrophobicContact CG2-CE2 3.89Å; I227-Y287 WeakPolarHBondContact CG2-OH 3.39Å; I227-Y287 WeakPolarHBondContact O-CE1 3.34Å; I227-Y287 PolarHBondContact O-OH 3.44Å; P231-Y287 HydrophobicContact CG-CD2 4.38Å; P231-Y287 HydrophobicContact CG-CG 4.21Å; L241-Y287 HydrophobicContact CD2-CD2 4.11Å; M283-Y287 VanDerWaalsContact O-CB 3.26Å; M283-Y287 WeakPolarHBondContact O-CB 3.47Å; M283-Y287 PolarHBondContact O-N 2.98Å; G284-Y287 PolarHBondContact O-N 3Å; Y287-A289 VanDerWaalsContact C-N 3.33Å; Y287-A289 PolarHBondContact O-N 3.42Å; Y287-V290 WeakPolarHBondContact O-CB 3.48Å; Y287-V290 PolarHBondContact O-N 3.4Å; Y287-I291 HydrophobicContact CD1-CD1 3.96Å; Y287-I291 HydrophobicContact CE1-CD1 3.39Å; Y287-I291 HydrophobicContact CE1-CG1 4.36Å; Y287-I291 HydrophobicContact CE2-CD1 4.25Å; Y287-I291 HydrophobicContact CE2-CG1 4.48Å; Y287-I291 WeakPolarHBondContact O-CG1 3.17Å; Y287-I291 PolarHBondContact O-N 3.49Å; Y287-P326 HydrophobicContact CD2-CG 4.32Å; Y287-P326 HydrophobicContact CE2-CG 3.8Å
288F90.9Very high85.2Confident72 Ų7242.4 Ų42.432%0.31620%0.196SC..Hα-helixtrans-61.3-42.8175.4-75.8-67.4000111.8F228 G284 V286 V290 I291 Y292F228-F288 HydrophobicContact CB-CE1 4.24Å; F228-F288 HydrophobicContact CB-CZ 4.49Å; F228-F288 AromaticContact CD1-CE1 3.97Å; F228-F288 HydrophobicContact CD1-CE1 3.97Å; F228-F288 VanDerWaalsContact O-CZ 3.25Å; F228-F288 WeakPolarHBondContact O-CZ 3.45Å; G284-F288 WeakPolarHBondContact O-CD2 3.43Å; G284-F288 PolarHBondContact O-N 3.42Å; V286-F288 PolarHBondContact O-N 3.47Å; F288-V290 VanDerWaalsContact C-N 3.29Å; F288-V290 PolarHBondContact O-N 3.27Å; F288-I291 HydrophobicContact CD1-CD1 4.46Å; F288-I291 WeakPolarHBondContact O-CB 3.27Å; F288-I291 PolarHBondContact O-N 2.94Å; F288-Y292 HydrophobicContact CB-CE2 4.36Å; F288-Y292 WeakPolarHBondContact O-CD2 3.45Å; F288-Y292 PolarHBondContact O-N 3.24Å
289A90.7Very high86.1Confident3 Ų345.1 Ų45.13%0.02521%0.209CC..Hα-helixtrans-62.6-36.717700000112.4I263 N266 L267 R285 V286 Y287 Y292 A293I263-A289 HydrophobicContact CG2-CB 4.24Å; N266-A289 HydrophobicContact CB-CB 3.65Å; L267-A289 HydrophobicContact CD1-CB 4.49Å; L267-A289 HydrophobicContact CD2-CB 3.9Å; L267-A289 HydrophobicContact CG-CB 3.79Å; R285-A289 WeakPolarHBondContact O-CB 3.48Å; R285-A289 PolarHBondContact O-N 3.22Å; V286-A289 CarbonylContact O-C 3.56Å; V286-A289 WeakPolarHBondContact O-CB 3.26Å; V286-A289 PolarHBondContact O-N 3.34Å; V286-A289 VanDerWaalsContact O-N 3.12Å; Y287-A289 VanDerWaalsContact C-N 3.33Å; Y287-A289 PolarHBondContact O-N 3.42Å; A289-Y292 PolarHBondContact O-N 3.5Å; A289-A293 WeakPolarHBondContact O-CB 3.03Å; A289-A293 PolarHBondContact O-N 2.82Å
290V93.2Very high86.4Confident0 Ų040.4 Ų40.40%019%0.188CC..Hα-helixtrans-61.2-48.5172.3165.10000110.2C244 I248 L267 V286 Y287 F288 Y292 A293 V294 P326C244-V290 HydrophobicContact CB-CG1 4.11Å; C244-V290 HydrophobicContact CB-CG2 4.08Å; I248-V290 HydrophobicContact CD1-CB 4.06Å; I248-V290 HydrophobicContact CD1-CG1 3.93Å; I248-V290 HydrophobicContact CD1-CG2 3.86Å; L267-V290 HydrophobicContact CD2-CB 4.49Å; L267-V290 HydrophobicContact CD2-CG2 3.54Å; V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 WeakPolarHBondContact O-CG2 3.25Å; V286-V290 PolarHBondContact O-N 3.47Å; Y287-V290 WeakPolarHBondContact O-CB 3.48Å; Y287-V290 PolarHBondContact O-N 3.4Å; F288-V290 VanDerWaalsContact C-N 3.29Å; F288-V290 PolarHBondContact O-N 3.27Å; V290-Y292 PolarHBondContact O-N 3.4Å; V290-A293 PolarHBondContact O-N 2.93Å; V290-V294 HydrophobicContact CG1-CG2 4.3Å; V290-V294 WeakPolarHBondContact O-CB 3.01Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.15Å; V290-V294 PolarHBondContact O-N 3.34Å; V290-P326 HydrophobicContact CG1-CB 3.55Å; V290-P326 HydrophobicContact CG1-CG 4.03Å
291I92.6Very high87Confident5 Ų533.4 Ų33.43%0.02616%0.162CC..Hα-helixtrans-52.8-54.1175.6-69.1173.3000110.5I227 Y287 F288 A293 V294 H295 P326I227-I291 HydrophobicContact CG2-CD1 4.45Å; Y287-I291 HydrophobicContact CD1-CD1 3.96Å; Y287-I291 HydrophobicContact CE1-CD1 3.39Å; Y287-I291 HydrophobicContact CE1-CG1 4.36Å; Y287-I291 HydrophobicContact CE2-CD1 4.25Å; Y287-I291 HydrophobicContact CE2-CG1 4.48Å; Y287-I291 WeakPolarHBondContact O-CG1 3.17Å; Y287-I291 PolarHBondContact O-N 3.49Å; F288-I291 HydrophobicContact CD1-CD1 4.46Å; F288-I291 WeakPolarHBondContact O-CB 3.27Å; F288-I291 PolarHBondContact O-N 2.94Å; I291-A293 PolarHBondContact O-N 2.83Å; I291-V294 PolarHBondContact O-N 2.63Å; I291-H295 PolarHBondContact O-N 3.28Å; I291-H295 PolarHBondContact O-ND1 3.25Å; I291-P326 HydrophobicContact CG1-CB 4.15Å; I291-P326 HydrophobicContact CG1-CG 4.03Å
292Y90.2Very high87.4Confident82 Ų8228.6 Ų28.632%0.32215%0.147SC..Hα-helixtrans-61.2-45.4-177.6-72.7-68.2000112.6I263 F288 A289 V290 H295 L296 F359I263-Y292 VanDerWaalsContact CD1-CB 3.49Å; I263-Y292 HydrophobicContact CD1-CG 4.19Å; F288-Y292 HydrophobicContact CB-CE2 4.36Å; F288-Y292 WeakPolarHBondContact O-CD2 3.45Å; F288-Y292 PolarHBondContact O-N 3.24Å; A289-Y292 PolarHBondContact O-N 3.5Å; V290-Y292 PolarHBondContact O-N 3.4Å; Y292-H295 PolarHBondContact O-N 2.9Å; Y292-L296 WeakPolarHBondContact O-CB 3.35Å; Y292-L296 WeakPolarHBondContact O-CG 3.09Å; Y292-L296 PolarHBondContact O-N 2.92Å; Y292-F359 AromaticContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD1 3.44Å; Y292-F359 VanDerWaalsContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD2 4.06Å; Y292-F359 AromaticContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE1 3.42Å; Y292-F359 VanDerWaalsContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE2 4.03Å; Y292-F359 AromaticContact CE1-CG 3.76Å; Y292-F359 HydrophobicContact CE1-CG 3.76Å; Y292-F359 AromaticContact CE1-CZ 3.71Å; Y292-F359 HydrophobicContact CE1-CZ 3.71Å; Y292-F359 AromaticContact CZ-CD1 3.84Å; Y292-F359 AromaticContact CZ-CE1 3.65Å; Y292-F359 VanDerWaalsContact OH-CD1 3.31Å; Y292-F359 WeakPolarHBondContact OH-CD1 3.29Å; Y292-F359 WeakPolarHBondContact OH-CE1 3.37Å
293A92Very high87.5Confident0 Ų027.1 Ų27.10%014%0.139CC..Hα-helixtrans-64.7-43-178.500000111.8I248 L259 I263 L267 A289 V290 I291 L296 L297I248-A293 HydrophobicContact CD1-CB 4.07Å; I248-A293 HydrophobicContact CG1-CB 4.42Å; I248-A293 HydrophobicContact CG2-CB 3.64Å; L259-A293 HydrophobicContact CD1-CB 4.05Å; L259-A293 HydrophobicContact CD2-CB 4.24Å; I263-A293 HydrophobicContact CG2-CB 4.12Å; L267-A293 HydrophobicContact CD1-CB 3.91Å; A289-A293 WeakPolarHBondContact O-CB 3.03Å; A289-A293 PolarHBondContact O-N 2.82Å; V290-A293 PolarHBondContact O-N 2.93Å; I291-A293 PolarHBondContact O-N 2.83Å; A293-L296 WeakPolarHBondContact O-CB 3.5Å; A293-L296 PolarHBondContact O-N 3.28Å; A293-L297 VanDerWaalsContact O-CG 3.24Å; A293-L297 WeakPolarHBondContact O-CG 3.25Å; A293-L297 PolarHBondContact O-N 3.27Å
294V92.8Very high87.6Confident0 Ų030.9 Ų30.90%016%0.159CC..Hα-helixtrans-62.5-45.6177.5172.20000110.9I248 V290 I291 L296 L297 C298 P326 G329 L330 L333I248-V294 HydrophobicContact CD1-CG2 4.08Å; I248-V294 HydrophobicContact CG1-CG2 4.25Å; V290-V294 HydrophobicContact CG1-CG2 4.3Å; V290-V294 WeakPolarHBondContact O-CB 3.01Å; V290-V294 VanDerWaalsContact O-CG2 3.27Å; V290-V294 WeakPolarHBondContact O-CG2 3.15Å; V290-V294 PolarHBondContact O-N 3.34Å; I291-V294 PolarHBondContact O-N 2.63Å; V294-L296 VanDerWaalsContact C-N 3.33Å; V294-L296 PolarHBondContact O-N 3.15Å; V294-L297 PolarHBondContact O-N 3.32Å; V294-L297 VanDerWaalsContact O-N 3.16Å; V294-C298 PolarHBondContact O-N 2.72Å; V294-C298 PolarHBondContact O-SG 3.04Å; V294-P326 HydrophobicContact CG2-CB 4.37Å; V294-G329 VanDerWaalsContact CG1-CA 3.5Å; V294-L330 HydrophobicContact CG1-CG 4.35Å; V294-L330 HydrophobicContact CG2-CD1 4.33Å; V294-L330 HydrophobicContact CG2-CD2 3.85Å; V294-L330 HydrophobicContact CG2-CG 3.8Å; V294-L333 HydrophobicContact CG1-CD1 4.41Å
295H89.6Confident87.6Confident47 Ų4730.1 Ų30.122%0.21815%0.148CC..Hα-helixtrans-64-39178.4-74.873.1000112.1I291 Y292 C298 Q299 L323 Y324I291-H295 PolarHBondContact O-N 3.28Å; I291-H295 PolarHBondContact O-ND1 3.25Å; Y292-H295 PolarHBondContact O-N 2.9Å; H295-C298 PolarHBondContact O-N 3.08Å; H295-Q299 WeakPolarHBondContact O-CB 3.45Å; H295-Q299 PolarHBondContact O-N 2.77Å; H295-L323 PolarHBondContact NE2-O 3.07Å; H295-Y324 AromaticContact CE1-CD1 3.93Å; H295-Y324 AromaticContact NE2-CD1 3.51Å
296L88.2Confident87.5Confident10 Ų1027.2 Ų27.25%0.05214%0.139CC..Hα-helixtrans-60-47.2172.2-84.9159.2000111.1L259 I263 Y292 A293 V294 Q299 C300 I353L259-L296 HydrophobicContact CD2-CB 4.43Å; L259-L296 HydrophobicContact CD2-CD1 3.89Å; I263-L296 HydrophobicContact CD1-CD1 4.21Å; Y292-L296 WeakPolarHBondContact O-CB 3.35Å; Y292-L296 WeakPolarHBondContact O-CG 3.09Å; Y292-L296 PolarHBondContact O-N 2.92Å; A293-L296 WeakPolarHBondContact O-CB 3.5Å; A293-L296 PolarHBondContact O-N 3.28Å; V294-L296 VanDerWaalsContact C-N 3.33Å; V294-L296 PolarHBondContact O-N 3.15Å; L296-Q299 PolarHBondContact O-N 3.42Å; L296-C300 WeakPolarHBondContact O-CB 3.25Å; L296-C300 PolarHBondContact O-N 3.27Å; L296-C300 PolarHBondContact O-SG 3.01Å; L296-I353 HydrophobicContact CD2-CD1 3.81Å; L296-I353 HydrophobicContact CD2-CG1 4.25Å; L296-I353 HydrophobicContact CD2-CG2 4.22Å
297L88.6Confident87.2Confident0 Ų030.4 Ų30.40%016%0.156CC..Hα-helixtrans-62-45.5178.4-69.7167.5000111.8I248 T252 L255 V257 A293 V294 Q299 C300 R301 L333I248-L297 HydrophobicContact CG1-CD1 4.43Å; I248-L297 HydrophobicContact CG2-CD1 4.36Å; T252-L297 HydrophobicContact CG2-CD2 3.98Å; L255-L297 HydrophobicContact CD1-CD2 3.93Å; V257-L297 HydrophobicContact CB-CD2 4.44Å; V257-L297 HydrophobicContact CG2-CD2 4.37Å; A293-L297 VanDerWaalsContact O-CG 3.24Å; A293-L297 WeakPolarHBondContact O-CG 3.25Å; A293-L297 PolarHBondContact O-N 3.27Å; V294-L297 PolarHBondContact O-N 3.32Å; V294-L297 VanDerWaalsContact O-N 3.16Å; L297-Q299 PolarHBondContact O-N 2.86Å; L297-C300 WeakPolarHBondContact O-CB 3.3Å; L297-C300 PolarHBondContact O-N 3.48Å; L297-R301 PolarHBondContact O-N 3.39Å; L297-R301 VanDerWaalsContact O-N 3.09Å; L297-L333 HydrophobicContact CB-CD1 3.86Å
298C87.8Confident86.8Confident2 Ų230.5 Ų30.51%0.01416%0.157CC..Hα-helixtrans-57.9-47.7174.2-66.60000111.3V294 H295 C300 R301 G302 I303 I305V294-C298 PolarHBondContact O-N 2.72Å; V294-C298 PolarHBondContact O-SG 3.04Å; H295-C298 PolarHBondContact O-N 3.08Å; C298-C300 VanDerWaalsContact C-N 3.33Å; C298-C300 PolarHBondContact O-N 3.22Å; C298-R301 CarbonylContact O-C 3.59Å; C298-R301 PolarHBondContact O-N 2.96Å; C298-R301 VanDerWaalsContact O-N 3.11Å; C298-G302 PolarHBondContact O-N 3.14Å; C298-I303 HydrophobicContact CB-CB 4.26Å; C298-I303 PolarHBondContact O-N 2.71Å; C298-I305 HydrophobicContact CB-CD1 4.4Å; C298-I305 HydrophobicContact CB-CG1 4.16Å
299Q83.2Confident86.6Confident65 Ų6527.1 Ų27.130%0.30414%0.142SC..Hα-helixtrans-63.5-39.1178.9-171.8174.518.500112H295 L296 L297 R301 G302 K354H295-Q299 WeakPolarHBondContact O-CB 3.45Å; H295-Q299 PolarHBondContact O-N 2.77Å; L296-Q299 PolarHBondContact O-N 3.42Å; L297-Q299 PolarHBondContact O-N 2.86Å; Q299-R301 PolarHBondContact O-N 3.34Å; Q299-G302 PolarHBondContact O-N 3.06Å; Q299-K354 PolarHBondContact NE2-O 2.88Å
300C78.7Confident86.4Confident17 Ų1731.6 Ų31.612%0.11516%0.163CC..Hα-helixtrans-61-34.1175.2-69.60000112V257 L296 L297 C298 G302 Y351V257-C300 HydrophobicContact CG2-CB 4Å; L296-C300 WeakPolarHBondContact O-CB 3.25Å; L296-C300 PolarHBondContact O-N 3.27Å; L296-C300 PolarHBondContact O-SG 3.01Å; L297-C300 WeakPolarHBondContact O-CB 3.3Å; L297-C300 PolarHBondContact O-N 3.48Å; C298-C300 VanDerWaalsContact C-N 3.33Å; C298-C300 PolarHBondContact O-N 3.22Å; C300-G302 VanDerWaalsContact C-N 3.35Å; C300-Y351 HydrophobicContact CB-CD1 4.42Å; C300-Y351 HydrophobicContact CB-CE1 3.84Å; C300-Y351 WeakPolarHBondContact SG-CD1 3.35Å; C300-Y351 WeakPolarHBondContact SG-CE1 3.34Å
301R79.1Confident85.9Confident15 Ų1538.3 Ų38.36%0.05719%0.194CC..Hα-helixtrans-85.2-4.5175.2-70.1-66.9-75.195.4-3.2113.9D190 L255 L297 C298 Q299 I303 L333 V337 N340D190-R301 IonicContact OD1-CZ 3.39Å; D190-R301 IonicContact OD1-NE 2.7Å; D190-R301 IonicContact OD1-NH2 3.18Å; D190-R301 PolarHBondContact OD1-NH2 3.32Å; D190-R301 IonicContact OD2-NH2 3.93Å; L255-R301 HydrophobicContact CD1-CG 3.83Å; L297-R301 PolarHBondContact O-N 3.39Å; L297-R301 VanDerWaalsContact O-N 3.09Å; C298-R301 CarbonylContact O-C 3.59Å; C298-R301 PolarHBondContact O-N 2.96Å; C298-R301 VanDerWaalsContact O-N 3.11Å; Q299-R301 PolarHBondContact O-N 3.34Å; R301-I303 VanDerWaalsContact C-N 3.33Å; R301-I303 HydrophobicContact CB-CD1 3.88Å; R301-I303 HydrophobicContact CB-CG1 3.98Å; R301-L333 HydrophobicContact CB-CD2 4.45Å; R301-L333 HydrophobicContact CG-CD2 4.1Å; R301-V337 PolarHBondContact NH2-O 2.86Å; R301-V337 VanDerWaalsContact NH2-O 3.08Å; R301-N340 PolarHBondContact O-ND2 2.89Å
302G77.5Confident85.5Confident45 Ų4540.6 Ų40.646%0.46421%0.206SC..THydrogen-bonded Turntrans69.231.4-174.700000112.9C298 Q299 C300 N340C298-G302 PolarHBondContact O-N 3.14Å; Q299-G302 PolarHBondContact O-N 3.06Å; C300-G302 VanDerWaalsContact C-N 3.35Å; G302-N340 PolarHBondContact O-ND2 3.47Å
303I83.5Confident85.1Confident12 Ų1239.6 Ų39.66%0.06222%0.221CC..  trans-98116.1176.7-60.8172000108C298 R301 C332 L333 L336C298-I303 HydrophobicContact CB-CB 4.26Å; C298-I303 PolarHBondContact O-N 2.71Å; R301-I303 VanDerWaalsContact C-N 3.33Å; R301-I303 HydrophobicContact CB-CD1 3.88Å; R301-I303 HydrophobicContact CB-CG1 3.98Å; I303-C332 HydrophobicContact CG2-CB 4.03Å; I303-L333 HydrophobicContact CD1-CD2 3.99Å; I303-L336 HydrophobicContact CD1-CB 4.43Å; I303-L336 HydrophobicContact CG2-CD1 4.19Å
304D84.9Confident84.6Confident87 Ų8741.7 Ų41.747%0.46523%0.232SC..  trans-84115.2162.9-177.6-30000107.5K306 N307 G308D304-K306 PolarHBondContact O-N 2.86Å; D304-K306 WeakPolarHBondContact OD1-CB 3.39Å; D304-K306 PolarHBondContact OD1-N 3.03Å; D304-N307 HydrophobicContact CB-CB 4.16Å; D304-N307 PolarHBondContact O-N 3.47Å; D304-N307 PolarHBondContact OD2-ND2 3.43Å; D304-G308 PolarHBondContact O-N 3.25Å
305I86.3Confident83.7Confident13 Ų1348.8 Ų48.87%0.06727%0.27CS..Hα-helixtrans-58.6-37.9-175.7-62.1173.2000110.7C298 G308 L309 F328C298-I305 HydrophobicContact CB-CD1 4.4Å; C298-I305 HydrophobicContact CB-CG1 4.16Å; I305-G308 PolarHBondContact O-N 3.35Å; I305-L309 HydrophobicContact CG2-CD1 3.85Å; I305-L309 HydrophobicContact CG2-CG 4.26Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 VanDerWaalsContact O-CG 3.24Å; I305-L309 WeakPolarHBondContact O-CG 3.47Å; I305-L309 PolarHBondContact O-N 2.95Å; I305-F328 HydrophobicContact CG2-CB 4.08Å
306K85.6Confident82.6Confident95 Ų9547.8 Ų47.841%0.41327%0.267SS..Hα-helixtrans-62.9-55.5179.7-176.2-173.5174-164.70110.6D304 G308 L309 E310 L323D304-K306 PolarHBondContact O-N 2.86Å; D304-K306 WeakPolarHBondContact OD1-CB 3.39Å; D304-K306 PolarHBondContact OD1-N 3.03Å; K306-G308 PolarHBondContact O-N 3.12Å; K306-L309 PolarHBondContact O-N 3.39Å; K306-E310 VanDerWaalsContact CE-OE1 3.23Å; K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 WeakPolarHBondContact O-CG 2.86Å; K306-E310 PolarHBondContact O-N 3.14Å; K306-E310 VanDerWaalsContact O-N 3.1Å; K306-L323 HydrophobicContact CB-CD1 4.14Å; K306-L323 HydrophobicContact CB-CD2 3.58Å; K306-L323 HydrophobicContact CD-CD1 4.3Å; K306-L323 HydrophobicContact CG-CD1 4.24Å; K306-L323 HydrophobicContact CG-CD2 3.91Å
307N83.5Confident81.5Confident69 Ų6953.2 Ų53.237%0.36929%0.294SS..Hα-helixtrans-64.8-32.6-179.4-58.7-26000111D304 E310 Q311D304-N307 HydrophobicContact CB-CB 4.16Å; D304-N307 PolarHBondContact O-N 3.47Å; D304-N307 PolarHBondContact OD2-ND2 3.43Å; N307-E310 PolarHBondContact O-N 3.06Å; N307-Q311 WeakPolarHBondContact O-CB 3.42Å; N307-Q311 VanDerWaalsContact O-CG 3.24Å; N307-Q311 WeakPolarHBondContact O-CG 3.49Å; N307-Q311 PolarHBondContact O-N 3.48Å
308G84.9Confident79.7Confident2 Ų259 Ų592%0.02133%0.332CS..Hα-helixtrans-65.8-45.7177.800000112.9D304 I305 K306 Q311 L312D304-G308 PolarHBondContact O-N 3.25Å; I305-G308 PolarHBondContact O-N 3.35Å; K306-G308 PolarHBondContact O-N 3.12Å; G308-Q311 PolarHBondContact O-N 2.81Å; G308-L312 VanDerWaalsContact O-CG 3.32Å; G308-L312 WeakPolarHBondContact O-CG 3.27Å; G308-L312 PolarHBondContact O-N 3.2Å
309L86.2Confident78.1Confident0 Ų062.9 Ų62.90%037%0.373CS..Hα-helixtrans-63.5-42.6174.8-69.1167.7000111.3L205 I305 K306 Q311 L312 G313 I314 V316 L323 F328 Y331L205-L309 HydrophobicContact CD1-CD2 4.44Å; I305-L309 HydrophobicContact CG2-CD1 3.85Å; I305-L309 HydrophobicContact CG2-CG 4.26Å; I305-L309 WeakPolarHBondContact O-CB 3.39Å; I305-L309 VanDerWaalsContact O-CG 3.24Å; I305-L309 WeakPolarHBondContact O-CG 3.47Å; I305-L309 PolarHBondContact O-N 2.95Å; K306-L309 PolarHBondContact O-N 3.39Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.93Å; L309-L312 CarbonylContact O-C 3.45Å; L309-L312 PolarHBondContact O-N 3.4Å; L309-L312 VanDerWaalsContact O-N 3.09Å; L309-G313 PolarHBondContact O-N 3.28Å; L309-I314 CarbonylContact C-O 3.52Å; L309-I314 HydrophobicContact CB-CB 4.21Å; L309-I314 HydrophobicContact CD2-CB 4.29Å; L309-I314 HydrophobicContact CD2-CD1 4.04Å; L309-I314 HydrophobicContact CD2-CG2 4.32Å; L309-I314 PolarHBondContact O-N 2.92Å; L309-V316 HydrophobicContact CB-CG2 3.89Å; L309-V316 HydrophobicContact CD1-CG2 3.35Å; L309-V316 HydrophobicContact CG-CG2 4.27Å; L309-L323 HydrophobicContact CD1-CD2 4.36Å; L309-F328 HydrophobicContact CD1-CB 3.9Å; L309-F328 HydrophobicContact CD1-CD2 3.68Å; L309-F328 HydrophobicContact CD1-CE2 4.4Å; L309-F328 HydrophobicContact CD1-CG 3.87Å; L309-F328 HydrophobicContact CD2-CB 4.17Å; L309-F328 HydrophobicContact CD2-CD1 4.47Å; L309-F328 HydrophobicContact CD2-CG 4.25Å; L309-Y331 HydrophobicContact CD2-CD1 4.47Å
310E85.3Confident76.9Confident97 Ų9765.6 Ų65.645%0.45338%0.38SS..Hα-helixtrans-59.5-41.5175.2-71.7174.1-172.800111.7K306 N307 L312 G313K306-E310 VanDerWaalsContact CE-OE1 3.23Å; K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 WeakPolarHBondContact O-CG 2.86Å; K306-E310 PolarHBondContact O-N 3.14Å; K306-E310 VanDerWaalsContact O-N 3.1Å; N307-E310 PolarHBondContact O-N 3.06Å; E310-L312 VanDerWaalsContact C-N 3.29Å; E310-L312 PolarHBondContact O-N 3.2Å; E310-G313 PolarHBondContact O-N 3.41Å; E310-G313 VanDerWaalsContact O-N 3.09Å
311Q83.9Confident76.5Confident141 Ų14169.4 Ų69.466%0.65940%0.396SS*.Hα-helixtrans-63.8-33.3174.8-76.8172.516.500113N307 G308 L309 G313 L336N307-Q311 WeakPolarHBondContact O-CB 3.42Å; N307-Q311 VanDerWaalsContact O-CG 3.24Å; N307-Q311 WeakPolarHBondContact O-CG 3.49Å; N307-Q311 PolarHBondContact O-N 3.48Å; G308-Q311 PolarHBondContact O-N 2.81Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.93Å; Q311-G313 PolarHBondContact O-N 2.78Å; Q311-L336 HydrophobicContact CB-CD2 4.38Å
312L83.5Confident76.2Confident54 Ų5469.7 Ų69.728%0.28340%0.4SS..THydrogen-bonded Turntrans-83.46.3176-63.1172000112.7G308 L309 E310 I314 Y331 N335 L336G308-L312 VanDerWaalsContact O-CG 3.32Å; G308-L312 WeakPolarHBondContact O-CG 3.27Å; G308-L312 PolarHBondContact O-N 3.2Å; L309-L312 CarbonylContact O-C 3.45Å; L309-L312 PolarHBondContact O-N 3.4Å; L309-L312 VanDerWaalsContact O-N 3.09Å; E310-L312 VanDerWaalsContact C-N 3.29Å; E310-L312 PolarHBondContact O-N 3.2Å; L312-I314 VanDerWaalsContact C-N 3.3Å; L312-I314 PolarHBondContact O-N 3.06Å; L312-Y331 HydrophobicContact CB-CE1 4.35Å; L312-Y331 HydrophobicContact CD1-CD1 3.73Å; L312-Y331 HydrophobicContact CD1-CE1 3.51Å; L312-Y331 HydrophobicContact CG-CE1 4.47Å; L312-N335 HydrophobicContact CD1-CB 3.92Å; L312-N335 HydrophobicContact CD2-CB 4.01Å; L312-L336 HydrophobicContact CD1-CD1 4.16Å; L312-L336 HydrophobicContact CD1-CD2 4.26Å; L312-L336 HydrophobicContact CD1-CG 3.98Å; L312-L336 HydrophobicContact CD2-CD2 3.84Å; L312-L336 HydrophobicContact CD2-CG 4.34Å; L312-L336 HydrophobicContact CG-CD1 4.49Å; L312-L336 HydrophobicContact CG-CD2 3.9Å; L312-L336 HydrophobicContact CG-CG 4.19Å
313G82.6Confident76.3Confident61 Ų6170 Ų7063%0.62939%0.391SS*.THydrogen-bonded Turntrans7613.8178.800000114.6L309 E310 Q311L309-G313 PolarHBondContact O-N 3.28Å; E310-G313 PolarHBondContact O-N 3.41Å; E310-G313 VanDerWaalsContact O-N 3.09Å; Q311-G313 PolarHBondContact O-N 2.78Å
314I81.2Confident76.4Confident44 Ų4472.1 Ų72.123%0.22640%0.398CS..  trans-95.3106.5179.6-57.2178.7000108.8L205 L309 L312 V316 Y331L205-I314 HydrophobicContact CD1-CD1 3.62Å; L309-I314 CarbonylContact C-O 3.52Å; L309-I314 HydrophobicContact CB-CB 4.21Å; L309-I314 HydrophobicContact CD2-CB 4.29Å; L309-I314 HydrophobicContact CD2-CD1 4.04Å; L309-I314 HydrophobicContact CD2-CG2 4.32Å; L309-I314 PolarHBondContact O-N 2.92Å; L312-I314 VanDerWaalsContact C-N 3.3Å; L312-I314 PolarHBondContact O-N 3.06Å; I314-V316 PolarHBondContact O-N 2.89Å; I314-Y331 HydrophobicContact CD1-CD1 4.03Å; I314-Y331 HydrophobicContact CD1-CE1 3.5Å; I314-Y331 VanDerWaalsContact CD1-CE1 3.5Å
315N72.8Confident76.5Confident148 Ų14868.2 Ų68.279%0.79138%0.377SS*.  trans-76.6108.2178-74.2-29.3000110.7
316V68.2Low76.7Confident27 Ų2767.6 Ų67.616%0.16437%0.374CS..PPolyproline II helixtrans-83126.3172.3-169.90000109.2L309 I314 P318 T322 L323L309-V316 HydrophobicContact CB-CG2 3.89Å; L309-V316 HydrophobicContact CD1-CG2 3.35Å; L309-V316 HydrophobicContact CG-CG2 4.27Å; I314-V316 PolarHBondContact O-N 2.89Å; V316-P318 WeakPolarHBondContact O-CD 3.45Å; V316-T322 WeakPolarHBondContact CG1-OG1 3.27Å; V316-L323 HydrophobicContact CB-CD2 4.34Å; V316-L323 HydrophobicContact CG1-CD2 3.97Å; V316-L323 HydrophobicContact CG1-CG 4.15Å; V316-L323 HydrophobicContact CG2-CD2 4.14Å
317I64.4Low77.1Confident123 Ų12363 Ų6363%0.63135%0.354SS*.PPolyproline II helixtrans-60.6119.1176.1-58.4171.8000108.8
318P51.4Low77.4Confident121 Ų12161.1 Ų61.179%0.78634%0.343SS*.THydrogen-bonded Turntrans-65.9138.4179.6-2.611.2000110.9V316V316-P318 WeakPolarHBondContact O-CD 3.45Å
319G52.5Low77.7Confident85 Ų8561 Ų6188%0.87634%0.342SS*.THydrogen-bonded Turntrans100.46.5169.600000116.4
320R59.3Low78Confident121 Ų12161 Ų6146%0.45734%0.342SS..SBendtrans-123.1154.2170.2-69.1-175.8173.5-169.6-8110.1E225 T322E225-R320 VanDerWaalsContact CD-NH1 3.27Å; E225-R320 VanDerWaalsContact CG-NH1 3.35Å; E225-R320 IonicContact OE1-CZ 3.5Å; E225-R320 IonicContact OE1-NH1 3.87Å; E225-R320 PolarHBondContact OE1-NH1 2.99Å; E225-R320 IonicContact OE1-NH2 2.63Å; E225-R320 PolarHBondContact OE1-NH2 3.35Å; R320-T322 HydrophobicContact CB-CG2 3.95Å; R320-T322 PolarHBondContact O-N 3.28Å; R320-T322 PolarHBondContact O-OG1 3.23Å; R320-T322 VanDerWaalsContact O-OG1 3.12Å
321H69.5Low78.2Confident97 Ų9759.3 Ų59.345%0.44933%0.331SS..G310 helixtrans-66.319.4179.8-63-71.3000113.7I227 F228 L323 Y324I227-H321 VanDerWaalsContact CD1-O 3.29Å; I227-H321 WeakPolarHBondContact CD1-O 3.48Å; F228-H321 HydrophobicContact CD2-CB 4.3Å; F228-H321 HydrophobicContact CE2-CB 3.65Å; F228-H321 AromaticContact CE2-CD2 3.77Å; F228-H321 AromaticContact CE2-CG 3.4Å; F228-H321 AromaticContact CE2-ND1 3.58Å; F228-H321 HydrophobicContact CZ-CB 4.14Å; H321-L323 PolarHBondContact O-N 2.97Å; H321-Y324 HydrophobicContact CB-CD2 3.95Å; H321-Y324 AromaticContact ND1-CE2 3.88Å; H321-Y324 WeakPolarHBondContact O-CB 3.43Å; H321-Y324 PolarHBondContact O-N 2.76Å
322T73.7Confident78.5Confident22 Ų2252.6 Ų52.614%0.13530%0.3CS..G310 helixtrans-52.1-36178.247.50000113.2I227 V316 R320 Y324 N325 F328I227-T322 HydrophobicContact CD1-CG2 4.39Å; V316-T322 WeakPolarHBondContact CG1-OG1 3.27Å; R320-T322 HydrophobicContact CB-CG2 3.95Å; R320-T322 PolarHBondContact O-N 3.28Å; R320-T322 PolarHBondContact O-OG1 3.23Å; R320-T322 VanDerWaalsContact O-OG1 3.12Å; T322-Y324 PolarHBondContact O-N 3.46Å; T322-Y324 VanDerWaalsContact O-N 3.16Å; T322-N325 VanDerWaalsContact O-CB 3.3Å; T322-N325 WeakPolarHBondContact O-CB 3.44Å; T322-N325 PolarHBondContact O-N 3.19Å; T322-F328 VanDerWaalsContact O-CD2 3.24Å; T322-F328 WeakPolarHBondContact O-CD2 3.45Å; T322-F328 WeakPolarHBondContact O-CE2 3.23Å
323L78.9Confident78.7Confident51 Ų5150 Ų5027%0.26729%0.287SS..G310 helixtrans-60.8-21.8175.3-66.2165.6000113.8H295 K306 L309 V316 H321 N325H295-L323 PolarHBondContact NE2-O 3.07Å; K306-L323 HydrophobicContact CB-CD1 4.14Å; K306-L323 HydrophobicContact CB-CD2 3.58Å; K306-L323 HydrophobicContact CD-CD1 4.3Å; K306-L323 HydrophobicContact CG-CD1 4.24Å; K306-L323 HydrophobicContact CG-CD2 3.91Å; L309-L323 HydrophobicContact CD1-CD2 4.36Å; V316-L323 HydrophobicContact CB-CD2 4.34Å; V316-L323 HydrophobicContact CG1-CD2 3.97Å; V316-L323 HydrophobicContact CG1-CG 4.15Å; V316-L323 HydrophobicContact CG2-CD2 4.14Å; H321-L323 PolarHBondContact O-N 2.97Å; L323-N325 VanDerWaalsContact C-N 3.3Å
324Y85.3Confident78.8Confident56 Ų5647.5 Ų47.522%0.2226%0.261CS..G310 helixtrans-85.71177.9-65.2-81.3000113.6F228 H295 H321 T322 P326 F359F228-Y324 HydrophobicContact CE1-CG 4.27Å; F228-Y324 HydrophobicContact CZ-CD1 4.49Å; F228-Y324 AromaticContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CD2 3.87Å; F228-Y324 HydrophobicContact CZ-CE2 4.41Å; F228-Y324 AromaticContact CZ-CG 3.91Å; F228-Y324 HydrophobicContact CZ-CG 3.91Å; H295-Y324 AromaticContact CE1-CD1 3.93Å; H295-Y324 AromaticContact NE2-CD1 3.51Å; H321-Y324 HydrophobicContact CB-CD2 3.95Å; H321-Y324 AromaticContact ND1-CE2 3.88Å; H321-Y324 WeakPolarHBondContact O-CB 3.43Å; H321-Y324 PolarHBondContact O-N 2.76Å; T322-Y324 PolarHBondContact O-N 3.46Å; T322-Y324 VanDerWaalsContact O-N 3.16Å; Y324-P326 WeakPolarHBondContact O-CD 3.21Å; Y324-F359 HydrophobicContact CE1-CE2 4.38Å; Y324-F359 HydrophobicContact CE1-CZ 4.48Å
325N88Confident78.9Confident5 Ų548.4 Ų48.43%0.02727%0.266CS..  trans-59.6119.4171.2-179.2-8.8000109D213 I222 I227 T322 L323 L327 F328D213-N325 PolarHBondContact OD2-ND2 3.49Å; I222-N325 HydrophobicContact CD1-CB 4.47Å; I227-N325 HydrophobicContact CD1-CB 4.1Å; T322-N325 VanDerWaalsContact O-CB 3.3Å; T322-N325 WeakPolarHBondContact O-CB 3.44Å; T322-N325 PolarHBondContact O-N 3.19Å; L323-N325 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.31Å; N325-L327 WeakPolarHBondContact OD1-CB 3.44Å; N325-L327 PolarHBondContact OD1-N 3.32Å; N325-F328 HydrophobicContact CB-CB 4.44Å; N325-F328 HydrophobicContact CB-CD1 4.46Å; N325-F328 HydrophobicContact CB-CD2 3.8Å; N325-F328 HydrophobicContact CB-CE2 4.11Å; N325-F328 HydrophobicContact CB-CG 3.99Å; N325-F328 WeakPolarHBondContact O-CB 3.41Å; N325-F328 PolarHBondContact O-N 3.18Å; N325-F328 VanDerWaalsContact O-N 3.14Å
326P90.8Very high79.1Confident0 Ų041.7 Ų41.70%023%0.23CC..Hα-helixtrans-64.4-26.7-176.425.4-32.7000112.9Y287 V290 I291 V294 Y324 F328 G329 L330Y287-P326 HydrophobicContact CD2-CG 4.32Å; Y287-P326 HydrophobicContact CE2-CG 3.8Å; V290-P326 HydrophobicContact CG1-CB 3.55Å; V290-P326 HydrophobicContact CG1-CG 4.03Å; I291-P326 HydrophobicContact CG1-CB 4.15Å; I291-P326 HydrophobicContact CG1-CG 4.03Å; V294-P326 HydrophobicContact CG2-CB 4.37Å; Y324-P326 WeakPolarHBondContact O-CD 3.21Å; P326-F328 VanDerWaalsContact C-N 3.31Å; P326-F328 PolarHBondContact O-N 2.82Å; P326-G329 PolarHBondContact O-N 2.87Å; P326-L330 WeakPolarHBondContact O-CG 3.21Å; P326-L330 PolarHBondContact O-N 2.76Å
327L92.5Very high79Confident0 Ų040.5 Ų40.50%022%0.223CC..Hα-helixtrans-69.2-32.1178-61.4-171.5000111.8T203 L205 D213 F215 L220 N325 G329 L330 Y331T203-L327 HydrophobicContact CG2-CB 3.87Å; T203-L327 HydrophobicContact CG2-CD2 4.4Å; L205-L327 HydrophobicContact CD2-CB 4.14Å; D213-L327 HydrophobicContact CB-CD1 3.56Å; F215-L327 HydrophobicContact CB-CD2 3.81Å; F215-L327 HydrophobicContact CD2-CD2 4.01Å; F215-L327 HydrophobicContact CG-CD2 4.06Å; L220-L327 HydrophobicContact CB-CD1 3.95Å; L220-L327 HydrophobicContact CD2-CD1 3.87Å; L220-L327 HydrophobicContact CD2-CD2 4.28Å; L220-L327 HydrophobicContact CD2-CG 3.94Å; N325-L327 PolarHBondContact O-N 3.31Å; N325-L327 WeakPolarHBondContact OD1-CB 3.44Å; N325-L327 PolarHBondContact OD1-N 3.32Å; L327-G329 VanDerWaalsContact C-N 3.34Å; L327-G329 PolarHBondContact O-N 3.29Å; L327-L330 HydrophobicContact CD2-CD1 4.18Å; L327-L330 PolarHBondContact O-N 3.45Å; L327-Y331 WeakPolarHBondContact O-CB 3.2Å; L327-Y331 PolarHBondContact O-N 3.46Å
328F90.9Very high78.6Confident29 Ų2937.8 Ų37.813%0.12722%0.215CC..Hα-helixtrans-63.4-42.4173-70.4-7.9000111.9L205 I305 L309 T322 N325 P326 Y331 C332L205-F328 HydrophobicContact CD1-CD1 3.75Å; L205-F328 HydrophobicContact CD1-CE1 4.05Å; L205-F328 HydrophobicContact CD2-CD1 3.72Å; L205-F328 HydrophobicContact CD2-CE1 3.93Å; L205-F328 HydrophobicContact CG-CD1 4.37Å; I305-F328 HydrophobicContact CG2-CB 4.08Å; L309-F328 HydrophobicContact CD1-CB 3.9Å; L309-F328 HydrophobicContact CD1-CD2 3.68Å; L309-F328 HydrophobicContact CD1-CE2 4.4Å; L309-F328 HydrophobicContact CD1-CG 3.87Å; L309-F328 HydrophobicContact CD2-CB 4.17Å; L309-F328 HydrophobicContact CD2-CD1 4.47Å; L309-F328 HydrophobicContact CD2-CG 4.25Å; T322-F328 VanDerWaalsContact O-CD2 3.24Å; T322-F328 WeakPolarHBondContact O-CD2 3.45Å; T322-F328 WeakPolarHBondContact O-CE2 3.23Å; N325-F328 HydrophobicContact CB-CB 4.44Å; N325-F328 HydrophobicContact CB-CD1 4.46Å; N325-F328 HydrophobicContact CB-CD2 3.8Å; N325-F328 HydrophobicContact CB-CE2 4.11Å; N325-F328 HydrophobicContact CB-CG 3.99Å; N325-F328 WeakPolarHBondContact O-CB 3.41Å; N325-F328 PolarHBondContact O-N 3.18Å; N325-F328 VanDerWaalsContact O-N 3.14Å; P326-F328 VanDerWaalsContact C-N 3.31Å; P326-F328 PolarHBondContact O-N 2.82Å; F328-Y331 PolarHBondContact O-N 3.45Å; F328-C332 WeakPolarHBondContact O-CB 3.36Å; F328-C332 PolarHBondContact O-N 2.98Å; F328-C332 PolarHBondContact O-SG 2.89Å
329G90.3Very high78.6Confident0 Ų038.5 Ų38.50%021%0.207CC..Hα-helixtrans-66.1-41.2176.300000112.8V294 P326 L327 C332 L333V294-G329 VanDerWaalsContact CG1-CA 3.5Å; P326-G329 PolarHBondContact O-N 2.87Å; L327-G329 VanDerWaalsContact C-N 3.34Å; L327-G329 PolarHBondContact O-N 3.29Å; G329-C332 PolarHBondContact O-N 3.15Å; G329-L333 WeakPolarHBondContact O-CB 3.19Å; G329-L333 WeakPolarHBondContact O-CG 3.49Å; G329-L333 PolarHBondContact O-N 3.01Å
330L92.3Very high78.5Confident0 Ų036.6 Ų36.60%018%0.177CC..Hα-helixtrans-64.3-41.2174.6-71.5173.1000112.1L197 F215 V294 P326 L327 L333 G334L197-L330 HydrophobicContact CD2-CD2 4.3Å; F215-L330 HydrophobicContact CD2-CD1 4.2Å; F215-L330 HydrophobicContact CE2-CB 4.45Å; F215-L330 HydrophobicContact CE2-CD1 3.71Å; F215-L330 HydrophobicContact CZ-CD1 3.96Å; V294-L330 HydrophobicContact CG1-CG 4.35Å; V294-L330 HydrophobicContact CG2-CD1 4.33Å; V294-L330 HydrophobicContact CG2-CD2 3.85Å; V294-L330 HydrophobicContact CG2-CG 3.8Å; P326-L330 WeakPolarHBondContact O-CG 3.21Å; P326-L330 PolarHBondContact O-N 2.76Å; L327-L330 HydrophobicContact CD2-CD1 4.18Å; L327-L330 PolarHBondContact O-N 3.45Å; L330-L333 PolarHBondContact O-N 2.93Å; L330-G334 PolarHBondContact O-N 2.91Å
331Y90.6Very high77.8Confident60 Ų6037.6 Ų37.624%0.23519%0.192CC..Hα-helixtrans-62-44.6174.7-174-99.6000111.7T203 L205 L309 L312 I314 L327 F328 G334 N335T203-Y331 HydrophobicContact CG2-CD2 4.45Å; T203-Y331 WeakPolarHBondContact O-CD2 3.16Å; L205-Y331 HydrophobicContact CD1-CD1 3.57Å; L205-Y331 HydrophobicContact CD1-CD2 3.96Å; L205-Y331 HydrophobicContact CD1-CE1 4.04Å; L205-Y331 HydrophobicContact CD1-CE2 4.4Å; L205-Y331 HydrophobicContact CD1-CG 3.52Å; L205-Y331 HydrophobicContact CG-CD1 4.46Å; L205-Y331 HydrophobicContact CG-CD2 3.97Å; L205-Y331 HydrophobicContact CG-CE2 4.43Å; L205-Y331 HydrophobicContact CG-CG 3.99Å; L309-Y331 HydrophobicContact CD2-CD1 4.47Å; L312-Y331 HydrophobicContact CB-CE1 4.35Å; L312-Y331 HydrophobicContact CD1-CD1 3.73Å; L312-Y331 HydrophobicContact CD1-CE1 3.51Å; L312-Y331 HydrophobicContact CG-CE1 4.47Å; I314-Y331 HydrophobicContact CD1-CD1 4.03Å; I314-Y331 HydrophobicContact CD1-CE1 3.5Å; I314-Y331 VanDerWaalsContact CD1-CE1 3.5Å; L327-Y331 WeakPolarHBondContact O-CB 3.2Å; L327-Y331 PolarHBondContact O-N 3.46Å; F328-Y331 PolarHBondContact O-N 3.45Å; Y331-G334 PolarHBondContact O-N 3.39Å; Y331-N335 VanDerWaalsContact CD2-ND2 3.27Å; Y331-N335 WeakPolarHBondContact CD2-ND2 3.32Å; Y331-N335 WeakPolarHBondContact CE2-ND2 3.38Å; Y331-N335 WeakPolarHBondContact O-CB 3.44Å; Y331-N335 PolarHBondContact O-N 3.26Å; Y331-N335 PolarHBondContact O-ND2 3.42Å
332C89.2Confident76.5Confident0 Ų042.6 Ų42.60%021%0.212CC..Hα-helixtrans-63.3-40174-740000112.3I303 F328 G329 G334 N335 L336I303-C332 HydrophobicContact CG2-CB 4.03Å; F328-C332 WeakPolarHBondContact O-CB 3.36Å; F328-C332 PolarHBondContact O-N 2.98Å; F328-C332 PolarHBondContact O-SG 2.89Å; G329-C332 PolarHBondContact O-N 3.15Å; C332-G334 VanDerWaalsContact C-N 3.34Å; C332-N335 PolarHBondContact O-N 3.3Å; C332-L336 HydrophobicContact CB-CD1 3.9Å; C332-L336 VanDerWaalsContact O-CB 3.27Å; C332-L336 WeakPolarHBondContact O-CB 3.37Å; C332-L336 PolarHBondContact O-N 2.82Å
333L88.3Confident75.1Confident0 Ų043 Ų430%022%0.216CC..Hα-helixtrans-64.7-36.2175.2-77.3164.4000112.1L197 V294 L297 R301 I303 G329 L330 V337L197-L333 HydrophobicContact CD1-CB 3.55Å; V294-L333 HydrophobicContact CG1-CD1 4.41Å; L297-L333 HydrophobicContact CB-CD1 3.86Å; R301-L333 HydrophobicContact CB-CD2 4.45Å; R301-L333 HydrophobicContact CG-CD2 4.1Å; I303-L333 HydrophobicContact CD1-CD2 3.99Å; G329-L333 WeakPolarHBondContact O-CB 3.19Å; G329-L333 WeakPolarHBondContact O-CG 3.49Å; G329-L333 PolarHBondContact O-N 3.01Å; L330-L333 PolarHBondContact O-N 2.93Å; L333-V337 WeakPolarHBondContact O-CB 3.11Å; L333-V337 WeakPolarHBondContact O-CG2 3.27Å
334G85.4Confident73.4Confident8 Ų843.9 Ų43.98%0.08222%0.223CC..Hα-helixtrans-70.6-39.417600000113L330 Y331 C332L330-G334 PolarHBondContact O-N 2.91Å; Y331-G334 PolarHBondContact O-N 3.39Å; C332-G334 VanDerWaalsContact C-N 3.34Å
335N83.2Confident71.5Confident63 Ų6345.2 Ų45.234%0.33723%0.228SC..Hα-helixtrans-104.3-19.6-165.6-65.6-53.7000115.5L312 Y331 C332L312-N335 HydrophobicContact CD1-CB 3.92Å; L312-N335 HydrophobicContact CD2-CB 4.01Å; Y331-N335 VanDerWaalsContact CD2-ND2 3.27Å; Y331-N335 WeakPolarHBondContact CD2-ND2 3.32Å; Y331-N335 WeakPolarHBondContact CE2-ND2 3.38Å; Y331-N335 WeakPolarHBondContact O-CB 3.44Å; Y331-N335 PolarHBondContact O-N 3.26Å; Y331-N335 PolarHBondContact O-ND2 3.42Å; C332-N335 PolarHBondContact O-N 3.3Å
336L77.2Confident69.5Low8 Ų848.8 Ų48.84%0.04224%0.242CC..SBendtrans-104.9-1.8-178.1-63.2167.5000113.7I303 Q311 L312 C332 S338 H339I303-L336 HydrophobicContact CD1-CB 4.43Å; I303-L336 HydrophobicContact CG2-CD1 4.19Å; Q311-L336 HydrophobicContact CB-CD2 4.38Å; L312-L336 HydrophobicContact CD1-CD1 4.16Å; L312-L336 HydrophobicContact CD1-CD2 4.26Å; L312-L336 HydrophobicContact CD1-CG 3.98Å; L312-L336 HydrophobicContact CD2-CD2 3.84Å; L312-L336 HydrophobicContact CD2-CG 4.34Å; L312-L336 HydrophobicContact CG-CD1 4.49Å; L312-L336 HydrophobicContact CG-CD2 3.9Å; L312-L336 HydrophobicContact CG-CG 4.19Å; C332-L336 HydrophobicContact CB-CD1 3.9Å; C332-L336 VanDerWaalsContact O-CB 3.27Å; C332-L336 WeakPolarHBondContact O-CB 3.37Å; C332-L336 PolarHBondContact O-N 2.82Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.25Å; L336-H339 PolarHBondContact O-N 3.38Å; L336-H339 VanDerWaalsContact O-N 3.15Å
337V65.8Low67.3Low2 Ų255.1 Ų55.11%0.01227%0.269CS..G310 helixtrans-60.5-37.1-176.8148.70000111.9D190 F193 R301 L333D190-V337 HydrophobicContact CB-CG1 3.47Å; D190-V337 VanDerWaalsContact CB-CG1 3.47Å; D190-V337 WeakPolarHBondContact O-CG1 3.5Å; D190-V337 WeakPolarHBondContact OD1-CG1 3.42Å; F193-V337 HydrophobicContact CB-CB 4.44Å; F193-V337 HydrophobicContact CB-CG1 3.92Å; F193-V337 HydrophobicContact CB-CG2 4.08Å; F193-V337 HydrophobicContact CG-CG2 4.38Å; R301-V337 PolarHBondContact NH2-O 2.86Å; R301-V337 VanDerWaalsContact NH2-O 3.08Å; L333-V337 WeakPolarHBondContact O-CB 3.11Å; L333-V337 WeakPolarHBondContact O-CG2 3.27Å
338S55.3Low64.8Low66 Ų6662 Ų6246%0.46231%0.307SS..G310 helixtrans-77.7-16.4178.234.10000114.7L336L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.25Å
339H51.7Low62.2Low135 Ų13565.8 Ų65.863%0.62533%0.325SS*.G310 helixtrans-92.9-12.4-176.2-73.5-61.4000114.6L336 N341L336-H339 PolarHBondContact O-N 3.38Å; L336-H339 VanDerWaalsContact O-N 3.15Å; H339-N341 VanDerWaalsContact C-N 3.35Å; H339-N341 PolarHBondContact O-N 3.37Å
340N51.3Low59.6Low46 Ų4668.9 Ų68.925%0.24635%0.345CS..  trans-89.663.9-168.6-123.2-6.6000113K186 R301 G302 K342K186-N340 PolarHBondContact NZ-O 3.02Å; R301-N340 PolarHBondContact O-ND2 2.89Å; G302-N340 PolarHBondContact O-ND2 3.47Å; N340-K342 PolarHBondContact O-N 2.87Å; N340-K342 VanDerWaalsContact O-N 3.14Å
341N43.6Very low57.2Low142 Ų14273.6 Ų73.676%0.75936%0.364SS*.THydrogen-bonded Turntrans-63-16179.6-82.4-20.2000114.8H339H339-N341 VanDerWaalsContact C-N 3.35Å; H339-N341 PolarHBondContact O-N 3.37Å
342K41.9Very low54.6Low201 Ų20174.6 Ų74.687%0.87438%0.38SS*.THydrogen-bonded Turntrans-95-15.4-172.6-71-177.6179176.60115.6N340 T344N340-K342 PolarHBondContact O-N 2.87Å; N340-K342 VanDerWaalsContact O-N 3.14Å; K342-T344 VanDerWaalsContact C-N 3.33Å; K342-T344 PolarHBondContact O-N 3.06Å
343S45.1Very low52.1Low32 Ų3277.1 Ų77.122%0.22439%0.392CS..  trans-9170.8174.8-171.20000109.5K186 R345K186-S343 PolarHBondContact NZ-O 3.34Å; S343-R345 PolarHBondContact O-N 2.8Å
344T43.4Very low49.7Very low68 Ų6885 Ų8542%0.41743%0.427SS..  trans-84.476.9159.746.10000106.5R183 K342 Y346R183-T344 HydrophobicContact CG-CG2 4.31Å; K342-T344 VanDerWaalsContact C-N 3.33Å; K342-T344 PolarHBondContact O-N 3.06Å; T344-Y346 PolarHBondContact O-N 3.02Å
345R45.2Very low47.5Very low84 Ų8486.6 Ų86.632%0.31743%0.433SS..  trans-68129.7161.5-96.4-167.8-179.4167.54107.4S343S343-R345 PolarHBondContact O-N 2.8Å
346Y45.8Very low45.2Very low80 Ų8089 Ų8931%0.31445%0.446SS..  trans-69.2141.2166-65.6-98.6000107.7D179 N182 T344 D348 E349D179-Y346 WeakPolarHBondContact OD1-CE1 3.14Å; D179-Y346 PolarHBondContact OD1-OH 3.49Å; D179-Y346 PolarHBondContact OD2-OH 3.47Å; N182-Y346 WeakPolarHBondContact ND2-CD1 3.44Å; T344-Y346 PolarHBondContact O-N 3.02Å; Y346-D348 PolarHBondContact O-N 3.49Å; Y346-E349 PolarHBondContact O-N 3.22Å
347F43.4Very low43.4Very low133 Ų13392.2 Ų92.258%0.58348%0.482SS*.THydrogen-bonded Turntrans-53.6-21.4-179.2-143.7-90.7000113.1I185I185-F347 HydrophobicContact CG2-CE2 4.22Å
348D40.6Very low42.2Very low146 Ų14697.1 Ų97.178%0.78151%0.507SS*.THydrogen-bonded Turntrans-89.1-6.4-179.9-77.5-22.2000115.8Y346 C350Y346-D348 PolarHBondContact O-N 3.49Å; D348-C350 PolarHBondContact O-N 3.14Å
349E37Very low41.5Very low108 Ų10897.8 Ų97.851%0.50550%0.502SS..  trans-78111.9179.6-77.8-173174.800111.4Y346 Y351Y346-E349 PolarHBondContact O-N 3.22Å; E349-Y351 PolarHBondContact O-N 3.3Å
350C35.7Very low40.8Very low65 Ų6593.6 Ų93.644%0.43950%0.496SS..  trans-53136.3173.3-900000112.3D348 S352 L367D348-C350 PolarHBondContact O-N 3.14Å; C350-S352 PolarHBondContact O-N 3.32Å; C350-L367 HydrophobicContact CB-CD1 4.35Å; C350-L367 WeakPolarHBondContact SG-CD1 3.41Å
351Y41.3Very low39.9Very low99 Ų9999.7 Ų99.739%0.38852%0.52SS..  trans-58.799.1173.8-66.8-88.9000110.5L255 V257 C300 E349 I353L255-Y351 PolarHBondContact O-OH 3.09Å; V257-Y351 HydrophobicContact CG2-CE1 4.05Å; C300-Y351 HydrophobicContact CB-CD1 4.42Å; C300-Y351 HydrophobicContact CB-CE1 3.84Å; C300-Y351 WeakPolarHBondContact SG-CD1 3.35Å; C300-Y351 WeakPolarHBondContact SG-CE1 3.34Å; E349-Y351 PolarHBondContact O-N 3.3Å; Y351-I353 VanDerWaalsContact C-N 3.32Å; Y351-I353 PolarHBondContact O-N 2.79Å; Y351-I353 VanDerWaalsContact O-N 3.11Å
352S35.4Very low39.5Very low81 Ų8196.4 Ų96.457%0.56650%0.501SS*.  trans-79.788.616255.60000108.1C350 K354C350-S352 PolarHBondContact O-N 3.32Å; S352-K354 PolarHBondContact O-N 3.29Å
353I37.9Very low39Very low52 Ų5292.3 Ų92.327%0.26750%0.496SS..  trans-72.296.1172.6-60.5168.7000107.2L296 Y351 L355 I362L296-I353 HydrophobicContact CD2-CD1 3.81Å; L296-I353 HydrophobicContact CD2-CG1 4.25Å; L296-I353 HydrophobicContact CD2-CG2 4.22Å; Y351-I353 VanDerWaalsContact C-N 3.32Å; Y351-I353 PolarHBondContact O-N 2.79Å; Y351-I353 VanDerWaalsContact O-N 3.11Å; I353-L355 HydrophobicContact CG2-CB 3.95Å; I353-L355 HydrophobicContact CG2-CD1 3.29Å; I353-L355 HydrophobicContact CG2-CG 3.32Å; I353-L355 PolarHBondContact O-N 3.07Å; I353-I362 HydrophobicContact CB-CD1 4.44Å; I353-I362 HydrophobicContact CD1-CD1 4.04Å; I353-I362 HydrophobicContact CG2-CD1 4.05Å
354K36.4Very low38.4Very low165 Ų16595.8 Ų95.872%0.71752%0.52SS*.  trans-76.279.8165.3-70.9-175.1179.6-179.70107.8Q299 S352Q299-K354 PolarHBondContact NE2-O 2.88Å; S352-K354 PolarHBondContact O-N 3.29Å
355L40.1Very low37.6Very low43 Ų4399.8 Ų99.823%0.22554%0.538CS..  trans-92.419165.5-82.8166.5000111.5I353 G357 F359 I362I353-L355 HydrophobicContact CG2-CB 3.95Å; I353-L355 HydrophobicContact CG2-CD1 3.29Å; I353-L355 HydrophobicContact CG2-CG 3.32Å; I353-L355 PolarHBondContact O-N 3.07Å; L355-G357 PolarHBondContact O-N 3.26Å; L355-F359 HydrophobicContact CD2-CD2 3.99Å; L355-I362 HydrophobicContact CD1-CD1 3.54Å; L355-I362 HydrophobicContact CD1-CG1 4.2Å
356D34.9Very low36.7Very low112 Ų112101.5 Ų101.560%0.59956%0.558SS**THydrogen-bonded Turntrans-66.9104.4173.9-78.6-29.1000109.1K361D356-K361 WeakPolarHBondContact OD1-CG 3.21Å
357G39.2Very low35.8Very low77 Ų77104 Ų10479%0.79458%0.576SS**THydrogen-bonded Turntrans157.8-39.1170.900000114.6L355L355-G357 PolarHBondContact O-N 3.26Å
358L41.5Very low34.9Very low104 Ų104103.7 Ų103.755%0.54559%0.585SS.*THydrogen-bonded Turntrans-135.1-23.4-174-132.290.1000116
359F40.6Very low34.4Very low80 Ų80101.3 Ų101.335%0.35158%0.58SS.*SBendtrans-127.412.9-165.8-57.8-64.2000115.2Y292 Y324 L355Y292-F359 AromaticContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD1 3.44Å; Y292-F359 VanDerWaalsContact CE1-CD1 3.44Å; Y292-F359 HydrophobicContact CE1-CD2 4.06Å; Y292-F359 AromaticContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE1 3.42Å; Y292-F359 VanDerWaalsContact CE1-CE1 3.42Å; Y292-F359 HydrophobicContact CE1-CE2 4.03Å; Y292-F359 AromaticContact CE1-CG 3.76Å; Y292-F359 HydrophobicContact CE1-CG 3.76Å; Y292-F359 AromaticContact CE1-CZ 3.71Å; Y292-F359 HydrophobicContact CE1-CZ 3.71Å; Y292-F359 AromaticContact CZ-CD1 3.84Å; Y292-F359 AromaticContact CZ-CE1 3.65Å; Y292-F359 VanDerWaalsContact OH-CD1 3.31Å; Y292-F359 WeakPolarHBondContact OH-CD1 3.29Å; Y292-F359 WeakPolarHBondContact OH-CE1 3.37Å; Y324-F359 HydrophobicContact CE1-CE2 4.38Å; Y324-F359 HydrophobicContact CE1-CZ 4.48Å; L355-F359 HydrophobicContact CD2-CD2 3.99Å
360G35.5Very low33.9Very low48 Ų48104.5 Ų104.550%0.49560%0.595SS.*  trans83.3158-18000000113.9I362G360-I362 PolarHBondContact O-N 2.9Å
361K33Very low33.5Very low173 Ų173106.8 Ų106.875%0.75261%0.609SS**  trans-70.1115.3176.9-82.5178.3176.7-177.80110.1D356D356-K361 WeakPolarHBondContact OD1-CG 3.21Å
362I36.1Very low32.7Very low73 Ų73108.2 Ų108.237%0.37463%0.628SS.*PPolyproline II helixtrans-71.3133.1161.3-59.9-173.4000107I353 L355 G360 S364I353-I362 HydrophobicContact CB-CD1 4.44Å; I353-I362 HydrophobicContact CD1-CD1 4.04Å; I353-I362 HydrophobicContact CG2-CD1 4.05Å; L355-I362 HydrophobicContact CD1-CD1 3.54Å; L355-I362 HydrophobicContact CD1-CG1 4.2Å; G360-I362 PolarHBondContact O-N 2.9Å; I362-S364 PolarHBondContact O-N 3.06Å; I362-S364 VanDerWaalsContact O-N 3.11Å
363P31.7Very low32.2Very low116 Ų116109.2 Ų109.275%0.75363%0.63SS**PPolyproline II helixtrans-61.3119.3175.9-13.726.4000108.8L365P363-L365 PolarHBondContact O-N 3.16Å
364S31Very low31.6Very low104 Ų104111.6 Ų111.673%0.72765%0.651SS**PPolyproline II helixtrans-55.9125.3171.8-46.40000108.6I362 T366I362-S364 PolarHBondContact O-N 3.06Å; I362-S364 VanDerWaalsContact O-N 3.11Å; S364-T366 PolarHBondContact O-N 3.5Å
365L27.4Very low31.1Very low152 Ų152112.7 Ų112.780%0.79666%0.657SS**  trans-64.791.6160.7-78.2159.8000106.6P363 L367P363-L365 PolarHBondContact O-N 3.16Å; L365-L367 VanDerWaalsContact C-N 3.29Å; L365-L367 PolarHBondContact O-N 2.92Å
366T25.4Very low30.5Very low121 Ų121115.8 Ų115.874%0.74268%0.682SS**  trans-63.795.3167.140.40000107.1S364 T368S364-T366 PolarHBondContact O-N 3.5Å; T366-T368 VanDerWaalsContact C-N 3.34Å; T366-T368 PolarHBondContact O-N 2.95Å
367L26.9Very low30.2Very low133 Ų133115.1 Ų115.170%0.69669%0.686SS**  trans-59.6111.5150.7-100.894.3000105.6C350 L365 S369C350-L367 HydrophobicContact CB-CD1 4.35Å; C350-L367 WeakPolarHBondContact SG-CD1 3.41Å; L365-L367 VanDerWaalsContact C-N 3.29Å; L365-L367 PolarHBondContact O-N 2.92Å; L367-S369 PolarHBondContact O-N 3.33Å
368T26.3Very low29.9Very low125 Ų125117.2 Ų117.277%0.76769%0.685SS**  trans-47.8107.9170.430.80000109.7T366T366-T368 VanDerWaalsContact C-N 3.34Å; T366-T368 PolarHBondContact O-N 2.95Å
369S28.5Very low29.4Very low96 Ų96117.4 Ų117.467%0.67169%0.694SS**  trans35114.9143.354.90000117.6L367 P371L367-S369 PolarHBondContact O-N 3.33Å; S369-P371 WeakPolarHBondContact O-CD 3.32Å
370Q27.7Very low28.8Very low176 Ų176122.6 Ų122.682%0.82272%0.717SS**  trans-49.2124.6150.8-72.9178.2-17.400108.8T372Q370-T372 PolarHBondContact O-N 3.03Å
371P25.8Very low28.6Very low113 Ų113127 Ų12773%0.73473%0.734SS**  trans-71103.5166.928.4-27.8000106.5S369 V373S369-P371 WeakPolarHBondContact O-CD 3.32Å; P371-V373 PolarHBondContact O-N 2.86Å
372T26.2Very low28.6Very low128 Ų128127 Ų12779%0.78574%0.737SS**  trans-64.190.7159.334.60000107.3Q370 S374Q370-T372 PolarHBondContact O-N 3.03Å; T372-S374 VanDerWaalsContact C-N 3.32Å; T372-S374 PolarHBondContact O-N 3.19Å
373V24.9Very low28.3Very low103 Ų103133.5 Ų133.562%0.62476%0.762SS**  trans-67.898.2164-179.60000106.2P371 F375P371-V373 PolarHBondContact O-N 2.86Å; V373-F375 HydrophobicContact CG1-CD2 4.5Å; V373-F375 HydrophobicContact CG1-CE2 4.4Å; V373-F375 PolarHBondContact O-N 3.26Å; V373-F375 VanDerWaalsContact O-N 3.14Å
374S24.5Very low28.1Very low101 Ų101131.3 Ų131.371%0.70676%0.76SS**  trans-65.9106165.538.90000107.7T372 S376T372-S374 VanDerWaalsContact C-N 3.32Å; T372-S374 PolarHBondContact O-N 3.19Å; S374-S376 PolarHBondContact O-N 3.03Å
375F25.5Very low28Very low189 Ų189135.4 Ų135.483%0.82977%0.768SS**  trans-68.186.7162.9-81.3-85.5000108.2V373 S377V373-F375 HydrophobicContact CG1-CD2 4.5Å; V373-F375 HydrophobicContact CG1-CE2 4.4Å; V373-F375 PolarHBondContact O-N 3.26Å; V373-F375 VanDerWaalsContact O-N 3.14Å; F375-S377 PolarHBondContact O-N 2.91Å; F375-S377 VanDerWaalsContact O-N 3.09Å
376S28.7Very low28Very low108 Ų108137.1 Ų137.176%0.75577%0.772SS**  trans-65.5103.4160.150.70000107.6S374S374-S376 PolarHBondContact O-N 3.03Å
377S27.6Very low28.3Very low98 Ų98137.6 Ų137.669%0.68578%0.775SS**PPolyproline II helixtrans-51.8131.2169.2-176.60000109.6F375 C379F375-S377 PolarHBondContact O-N 2.91Å; F375-S377 VanDerWaalsContact O-N 3.09Å; S377-C379 PolarHBondContact O-N 3.19Å
378P34.1Very low28.4Very low120 Ų120138.1 Ų138.178%0.77978%0.778SS**PPolyproline II helixtrans-66.8124.6167.222.9-21000108.3
379C29.4Very low28.6Very low109 Ų109140.3 Ų140.374%0.73678%0.78SS**PPolyproline II helixtrans-63.6168.8173.2-58.60000111.4S377S377-C379 PolarHBondContact O-N 3.19Å
380F28Very low28.7Very low189 Ų189144.1 Ų144.183%0.82979%0.789SS**  trans97.178.5179.9-69-88.8000115.8
381V31Very low28.9Very low141 Ų141146 Ų14686%0.85580%0.795SS**  trans-99.298.8143.2179.80000105.9K383V381-K383 PolarHBondContact O-N 3.42Å
382E32.9Very low29.2Very low172 Ų172147.8 Ų147.880%0.80480%0.798SS**  trans-63.6128.3159.6-90.6-176.6152.200108
383K29.8Very low29.4Very low210 Ų210148.4 Ų148.491%0.91380%0.796SS**  trans-70127.6171-79.4179171.8179.10108.9V381V381-K383 PolarHBondContact O-N 3.42Å
384G27.6Very low29.8Very low69 Ų69149.4 Ų149.471%0.71181%0.807SS**  trans123.695.3155.600000114
385E29.8Very low30.1Very low190 Ų190151.1 Ų151.189%0.88881%0.809SS**  -172.6130.1110.6-105178.2163.200108.4V387E385-V387 PolarHBondContact O-N 2.92Å
386E26.6Very low30.5Very low188 Ų188149.5 Ų149.588%0.87981%0.809SS**  trans-59.8124.1173.7-68.2166.3156.700109.3
387V32.3Very low30.8Very low132 Ų132150.3 Ų150.380%0.881%0.805SS**  trans-119.882156.6-173.90000106E385E385-V387 PolarHBondContact O-N 2.92Å
388D29.4Very low30.8Very low144 Ų144152.1 Ų152.177%0.7781%0.807SS**  trans-58.6147.4147.8-93.8-29.6000108.4
389E30.5Very low30.6Very low171 Ų171155.1 Ų155.180%0.79982%0.815SS**  trans7784.9171.5-54-178.2177.900117.9
390M30.3Very low30.5Very low176 Ų176155.8 Ų155.887%0.86782%0.816SS**  -179.584.1123.6-109178.2-96.800111.4
391F32.9Very low30.7Very low215 Ų215154.6 Ų154.694%0.94382%0.818SS**  trans-140.270151.3-83.8-73.9000108.6
392D32.3Very low30.6Very low150 Ų150152 Ų15280%0.80281%0.806SS**  trans-99.9105.7157.3-90.8-30.1000109
393L30.3Very low30.4Very low141 Ų141150.1 Ų150.174%0.73880%0.801SS**  trans41.6117.1133.8-56.6170000119.2
394S32.6Very low30.3Very low124 Ų124148.7 Ų148.787%0.86780%0.795SS**  -145.9126.6118.249.40000110.4
395N31.5Very low30.3Very low137 Ų137154.1 Ų154.173%0.73380%0.802SS**  trans-69146173.3-70.6-43000110.2
396D33.8Very low30Very low155 Ų155151.3 Ų151.383%0.82980%0.797SS**  trans-145.8111.5134.2-95.1-24.2000109.1
397D33.5Very low30.1Very low126 Ų126149.1 Ų149.167%0.67479%0.791SS**  trans61104.9139.1-64-14.8000122.8
398N28.6Very low29.8Very low135 Ų135154 Ų15472%0.72280%0.796SS**  60.388.5123.7-67-32000118.9
399L29.7Very low29.6Very low184 Ų184156.9 Ų156.996%0.96380%0.802SS**  trans-143.396.6134.9-94.9166.3000109.1
400T27.1Very low29.3Very low123 Ų123152.9 Ų152.976%0.75580%0.798SS**  trans-92.4117.7166.4390000109.4
401L31.7Very low29Very low164 Ų164152.3 Ų152.386%0.85980%0.797SS**  trans-167.1101.4140.8-106.9142.8000111.3
402S29.5Very low28.6Very low87 Ų87147.8 Ų147.861%0.60879%0.791SS**  trans3.8126.8148.564.40000119.4
403N28.5Very low28.1Very low131 Ų131152.1 Ų152.170%0.70180%0.796SS**  154.5127.792.9-105.9-35.9000111.7
404K27.2Very low27.9Very low181 Ų181150.1 Ų150.179%0.78780%0.8SS**  trans57102.8145.4-63.9175.8179.2177.60118.4
405Q28.2Very low27.6Very low182 Ų182149.4 Ų149.485%0.8580%0.795SS**  -167.1118.396.3-106.7178.4-6.100110.8N407Q405-N407 PolarHBondContact O-N 3.24Å
406V24Very low27.2Very low131 Ų131148.8 Ų148.879%0.79480%0.802SS**  trans-64.4110.5167.3173.30000107.7
407N28.4Very low26.9Very low142 Ų142145.6 Ų145.676%0.75979%0.792SS**  trans-111.1106.5156.9-92.1-19.3000108.9Q405 F409Q405-N407 PolarHBondContact O-N 3.24Å; N407-F409 PolarHBondContact O-N 2.83Å
408R24.8Very low26.6Very low235 Ų235147.1 Ų147.189%0.88780%0.8SS**  trans-66110.9-179.1-154175.8-176.7157.1-1.4108.1A410R408-A410 PolarHBondContact O-N 3.43Å
409F25.9Very low26.3Very low204 Ų204151.5 Ų151.590%0.89581%0.808SS**  trans-76112.1166-80.2-83.5000108.3N407 L411N407-F409 PolarHBondContact O-N 2.83Å; F409-L411 PolarHBondContact O-N 3Å
410A25.3Very low26.3Very low87 Ų87148.9 Ų148.972%0.71980%0.799SS**  trans-68.3117.5172.300000109.1R408 C412R408-A410 PolarHBondContact O-N 3.43Å; A410-C412 PolarHBondContact O-N 2.88Å; A410-C412 VanDerWaalsContact O-N 3.14Å
411L22.8Very low26.3Very low164 Ų164151.6 Ų151.686%0.85980%0.803SS**  trans-74.392.8169.7-164.685.6000108F409 R413F409-L411 PolarHBondContact O-N 3Å; L411-R413 PolarHBondContact O-N 2.98Å; L411-R413 VanDerWaalsContact O-N 3.09Å
412C24.9Very low26.2Very low121 Ų121149.7 Ų149.782%0.81880%0.804SS**  trans-73.699.1169.9-73.10000109.2A410 A414A410-C412 PolarHBondContact O-N 2.88Å; A410-C412 VanDerWaalsContact O-N 3.14Å; C412-A414 PolarHBondContact O-N 2.91Å; C412-A414 VanDerWaalsContact O-N 3.15Å
413R22.9Very low26Very low240 Ų240150.3 Ų150.391%0.90681%0.808SS**  trans-60.2104.7157.8-101.9179.6177.6163.3-0.2107.9L411L411-R413 PolarHBondContact O-N 2.98Å; L411-R413 VanDerWaalsContact O-N 3.09Å
414A25.3Very low25.8Very low100 Ų100151.3 Ų151.383%0.82681%0.813SS**  trans-86.8117.1161.700000108.2C412C412-A414 PolarHBondContact O-N 2.91Å; C412-A414 VanDerWaalsContact O-N 3.15Å
415S26.1Very low26Very low109 Ų109152.3 Ų152.376%0.76282%0.818SS**  trans-68.3136.1177.846.10000111.5S417S415-S417 PolarHBondContact O-N 3.45Å
416S23.4Very low25.8Very low123 Ų123151.7 Ų151.786%0.8682%0.819SS**  trans-76107.4167.456.90000110.4
417S26.6Very low26Very low89 Ų89153.1 Ų153.162%0.62282%0.817SS**  trans-163.8104.415258.10000108.1S415S415-S417 PolarHBondContact O-N 3.45Å
418D26.9Very low25.7Very low158 Ų158155.3 Ų155.385%0.84582%0.823SS**  170.498123.9-78.6-12.6000108.3
419Y24.1Very low25.9Very low227 Ų227151.4 Ų151.489%0.8982%0.815SS**  trans-83.9131.8154.1-100.7-94.7000106.7
420V29.1Very low25.7Very low129 Ų129149.6 Ų149.678%0.78281%0.814SS**  -168.6116.5122.9168.50000109.9
421Q26.3Very low25.8Very low179 Ų179150 Ų15084%0.83681%0.812SS**  trans17.5132143.4-64.3170.1-28.300120.9
422S29.3Very low25.8Very low124 Ų124152.2 Ų152.287%0.86782%0.815SS**  -161.6156101.565.70000111.9
423S26.8Very low25.7Very low100 Ų100152.5 Ų152.570%0.69981%0.812SS**  trans-106.2159.3-154.741.60000114.1
424N24.1Very low25.7Very low152 Ų152143.9 Ų143.981%0.81380%0.799SS**  trans68.6111.7154.1-63.6-12000118.4
425K30Very low25.6Very low202 Ų202146.9 Ų146.988%0.87880%0.8SS**  -160.1131118.2-104.5172.5-175.1-173.20110.6E427K425-E427 PolarHBondContact O-N 3.03Å
426L24Very low25.4Very low170 Ų170149 Ų14989%0.8980%0.798SS**  trans-53.8123.1157.8-112.678.8000108.2
427E28.9Very low25.3Very low161 Ų161148.6 Ų148.675%0.75279%0.794SS**  trans-141.2119.4144.8-74.9-168.4160.500108K425 H429K425-E427 PolarHBondContact O-N 3.03Å; E427-H429 PolarHBondContact O-N 3.32Å
428E23.1Very low25.1Very low188 Ų188154.8 Ų154.888%0.87980%0.804SS**  trans-61.1116.9165.7-70.9169.9146.700108.1
429H28.5Very low24.9Very low153 Ų153155.6 Ų155.671%0.70880%0.802SS**  trans-122.696.4161-91.5-60.3000109E427 S431E427-H429 PolarHBondContact O-N 3.32Å; H429-S431 PolarHBondContact O-N 3.39Å; H429-S431 VanDerWaalsContact O-N 3.08Å
430D21.9Very low24.8Very low166 Ų166153 Ų15389%0.88880%0.803SS**  trans-49.8107.7152.6-83-33000108.6
431S27.7Very low24.4Very low95 Ų95152.3 Ų152.366%0.66480%0.798SS**  trans-130.499159.948.70000108.2H429 V433H429-S431 PolarHBondContact O-N 3.39Å; H429-S431 VanDerWaalsContact O-N 3.08Å; S431-V433 PolarHBondContact O-N 2.95Å
432F22Very low24.2Very low211 Ų211148.3 Ų148.393%0.92579%0.791SS**  trans-49.5106.4159.4-111.3-100.8000108.5G434F432-G434 VanDerWaalsContact C-N 3.33Å; F432-G434 PolarHBondContact O-N 3.43Å; F432-G434 VanDerWaalsContact O-N 3.12Å
433V23.7Very low23.9Very low126 Ų126148.8 Ų148.876%0.76479%0.788SS**  trans-78.991.6165.1179.30000106.4S431 L435S431-V433 PolarHBondContact O-N 2.95Å; V433-L435 PolarHBondContact O-N 2.9Å; V433-L435 VanDerWaalsContact O-N 3.13Å
434G22.1Very low23.7Very low60 Ų60149.7 Ų149.762%0.61979%0.789SS**  trans-61.1108.9167.600000109.4F432 E436F432-G434 VanDerWaalsContact C-N 3.33Å; F432-G434 PolarHBondContact O-N 3.43Å; F432-G434 VanDerWaalsContact O-N 3.12Å; G434-E436 VanDerWaalsContact C-N 3.25Å; G434-E436 PolarHBondContact O-N 2.91Å
435L22.1Very low23.8Very low162 Ų162147.4 Ų147.485%0.84879%0.785SS**  trans-68.987.1160.8-92.1140.9000107.7V433 C437V433-L435 PolarHBondContact O-N 2.9Å; V433-L435 VanDerWaalsContact O-N 3.13Å; L435-C437 VanDerWaalsContact C-N 3.35Å; L435-C437 PolarHBondContact O-N 3.32Å; L435-C437 VanDerWaalsContact O-N 3.09Å
436E22.4Very low23.7Very low154 Ų154143.4 Ų143.472%0.7278%0.78SS**  trans-72.296.9161.5-78.4-174.5167.500108.2G434 W438G434-E436 VanDerWaalsContact C-N 3.25Å; G434-E436 PolarHBondContact O-N 2.91Å; E436-W438 PolarHBondContact O-N 3.48Å; E436-W438 VanDerWaalsContact O-N 3.09Å
437C21.5Very low23.8Very low115 Ų115141.7 Ų141.778%0.77778%0.776SS**  trans-60.6103161.2-74.60000108.7L435 E439L435-C437 VanDerWaalsContact C-N 3.35Å; L435-C437 PolarHBondContact O-N 3.32Å; L435-C437 VanDerWaalsContact O-N 3.09Å; C437-E439 PolarHBondContact O-N 3.06Å
438W23.4Very low23.6Very low219 Ų219141.6 Ų141.683%0.8378%0.776SS**  trans-75.9101.8161.1-71.483.4000107.9E436 L440E436-W438 PolarHBondContact O-N 3.48Å; E436-W438 VanDerWaalsContact O-N 3.09Å; W438-L440 PolarHBondContact O-N 3.01Å; W438-L440 VanDerWaalsContact O-N 3.15Å
439E21.6Very low23.7Very low175 Ų175138.8 Ų138.882%0.81877%0.774SS**  trans-54114.3164.1-87.7-178.3143.800109C437 V441C437-E439 PolarHBondContact O-N 3.06Å; E439-V441 VanDerWaalsContact C-N 3.25Å; E439-V441 PolarHBondContact O-N 3.3Å
440L22.2Very low23.5Very low172 Ų172141.8 Ų141.890%0.90178%0.779SS**  trans-65.191.5161.1-113.2137.8000107W438 S442W438-L440 PolarHBondContact O-N 3.01Å; W438-L440 VanDerWaalsContact O-N 3.15Å; L440-S442 PolarHBondContact O-N 3.2Å
441V21.2Very low23.5Very low114 Ų114142.1 Ų142.169%0.69178%0.78SS**  trans-67.2100.1167.2178.70000107E439 V443E439-V441 VanDerWaalsContact C-N 3.25Å; E439-V441 PolarHBondContact O-N 3.3Å; V441-V443 HydrophobicContact CG1-CG2 4.48Å; V441-V443 PolarHBondContact O-N 3.22Å; V441-V443 VanDerWaalsContact O-N 3.09Å
442S22.2Very low23.4Very low96 Ų96143.4 Ų143.467%0.67179%0.787SS**  trans-65.2103.2168.162.70000108.5L440 T444L440-S442 PolarHBondContact O-N 3.2Å; S442-T444 PolarHBondContact O-N 3.05Å
443V23.1Very low23.4Very low134 Ų134141.9 Ų141.981%0.81278%0.783SS**  trans-78.3101.8162.2-175.10000106.7V441V441-V443 HydrophobicContact CG1-CG2 4.48Å; V441-V443 PolarHBondContact O-N 3.22Å; V441-V443 VanDerWaalsContact O-N 3.09Å
444T22.5Very low23.4Very low119 Ų119142.2 Ų142.273%0.7379%0.786SS**  trans-60.6128.8173.144.10000110.8S442S442-T444 PolarHBondContact O-N 3.05Å
445S25.6Very low23.5Very low104 Ų104144.9 Ų144.973%0.72779%0.79SS**  trans-48.4158165.9-1550000112.3
446P28.8Very low23.5Very low117 Ų117145.9 Ų145.976%0.7679%0.793SS**  -154.1128.476.735.8-13.8000116.1
447V24.8Very low23.6Very low135 Ų135145.1 Ų145.182%0.81879%0.792SS**  trans-144.4120.2142.8-172.70000109.3
448E24.3Very low23.7Very low158 Ų158147.2 Ų147.274%0.73880%0.796SS**  trans-57138.3172.8-62.5171.4148.400111.5R450E448-R450 PolarHBondContact O-N 3.25Å; E448-R450 VanDerWaalsContact O-N 3.14Å
449P26.5Very low23.9Very low129 Ų129141.9 Ų141.984%0.83880%0.798SS**  trans-77.5100.816231-25.8000107.3L451P449-L451 PolarHBondContact O-N 3.18Å
450R24.4Very low24Very low216 Ų216136.1 Ų136.182%0.81579%0.785SS**  trans-60.5125.4162.6-78.2-173.4177.1-178.2-0.8108E448 C452E448-R450 PolarHBondContact O-N 3.25Å; E448-R450 VanDerWaalsContact O-N 3.14Å; R450-C452 PolarHBondContact O-N 3.06Å; R450-C452 VanDerWaalsContact O-N 3.09Å
451L22.5Very low24.2Very low174 Ų174134.2 Ų134.291%0.91179%0.787SS**  trans-47.5110.7166.9-76.4138000109.4P449P449-L451 PolarHBondContact O-N 3.18Å
452C25Very low24.5Very low122 Ų122136 Ų13682%0.82479%0.789SS**  trans-86.2113.9163-77.20000107.8R450 T454R450-C452 PolarHBondContact O-N 3.06Å; R450-C452 VanDerWaalsContact O-N 3.09Å; C452-T454 PolarHBondContact O-N 3.26Å
453E21.8Very low24.9Very low178 Ų178136.4 Ų136.483%0.83278%0.784SS**  trans-57.7126.4169.1-71.6174.9148.100110T455E453-T455 VanDerWaalsContact C-N 3.33Å; E453-T455 PolarHBondContact O-N 3.31Å
454T24.2Very low25.7Very low134 Ų134134.5 Ų134.582%0.82278%0.776SS**  trans-76.182.6175.3-35.90000109.5C452 M456C452-T454 PolarHBondContact O-N 3.26Å; T454-M456 PolarHBondContact O-N 3.05Å
455T23.1Very low26.8Very low115 Ų115134 Ų13471%0.70677%0.773SS**  trans-77.3104.1164.422.10000109.7E453 I457E453-T455 VanDerWaalsContact C-N 3.33Å; E453-T455 PolarHBondContact O-N 3.31Å; T455-I457 PolarHBondContact O-N 2.88Å
456M22.9Very low27.6Very low184 Ų184136.1 Ų136.191%0.90677%0.772SS**  trans-66.2106164.2-71.4-96.9-76.700108.6T454T454-M456 PolarHBondContact O-N 3.05Å
457I24.6Very low28.3Very low137 Ų137139.6 Ų139.670%0.70377%0.771SS**  trans-106.8118.4170.3-57178.5000107.8T455 A459T455-I457 PolarHBondContact O-N 2.88Å; I457-A459 PolarHBondContact O-N 3.34Å
458N23.6Very low30.1Very low160 Ų160137 Ų13786%0.85676%0.757SS**  trans-54.6115.1170.3-87.7-25.9000109.9G460N458-G460 VanDerWaalsContact C-N 3.34Å; N458-G460 PolarHBondContact O-N 2.91Å
459A26.5Very low32Very low107 Ų107130.4 Ų130.488%0.88473%0.731SS**  trans-77.684.2171.600000110I457I457-A459 PolarHBondContact O-N 3.34Å
460G23.4Very low34.4Very low53 Ų53128.3 Ų128.355%0.54672%0.718SS.*  trans-80.4151.1152.700000109.4N458 M462N458-G460 VanDerWaalsContact C-N 3.34Å; N458-G460 PolarHBondContact O-N 2.91Å; G460-M462 PolarHBondContact O-N 3.37Å
461S27.8Very low37.1Very low133 Ų133118.8 Ų118.893%0.9368%0.683SS**  trans-39.4109.2-174.560.70000113.1
462M27.8Very low39.6Very low151 Ų151111.2 Ų111.274%0.74465%0.645SS**  trans-97.3122.3177.4-79.2-153.8161.800110.8G460 S464G460-M462 PolarHBondContact O-N 3.37Å; M462-S464 PolarHBondContact O-N 2.94Å
463D30.8Very low42.1Very low104 Ų104113 Ų11356%0.55664%0.638SS**  trans-61.2119.4168.4-159.9-20.6000109T465 Q466D463-T465 PolarHBondContact O-N 3.33Å; D463-T465 PolarHBondContact OD1-OG1 3.49Å; D463-Q466 PolarHBondContact O-N 3.1Å
464S38Very low44.5Very low94 Ų94106 Ų10666%0.65761%0.607SS**THydrogen-bonded Turntrans-66.1-0.2-170.859.10000114.3M462M462-S464 PolarHBondContact O-N 2.94Å
465T45.5Very low47Very low109 Ų109101.8 Ų101.867%0.66958%0.577SS**THydrogen-bonded Turntrans-88.3-17.2178.955.50000114D463D463-T465 PolarHBondContact O-N 3.33Å; D463-T465 PolarHBondContact OD1-OG1 3.49Å
466Q42.6Very low49.4Very low149 Ų149103.9 Ų103.970%0.69657%0.572SS**SBendtrans-95.9-20-169.4-73.8-175.84.600116.1D463D463-Q466 PolarHBondContact O-N 3.1Å
467Y43.6Very low51.7Low190 Ų19099.4 Ų99.475%0.74555%0.551SS**SBendtrans-137.9111.2170.2-83.2-87.6000109.6G469Y467-G469 PolarHBondContact O-N 2.85Å
468P62.3Low53.9Low80 Ų8092.9 Ų92.952%0.51952%0.518SS..  trans-71.1108178.329.6-30.7000106.9S472P468-S472 WeakPolarHBondContact CB-OG 3.3Å
469G66.1Low56.2Low19 Ų1990 Ų9020%0.19650%0.497CS..  trans-62.7173.1178.400000112E195 Y467 L471 S472E195-G469 WeakPolarHBondContact OE1-CA 3.24Å; Y467-G469 PolarHBondContact O-N 2.85Å; G469-L471 PolarHBondContact O-N 3.17Å; G469-S472 WeakPolarHBondContact O-CB 3.42Å; G469-S472 PolarHBondContact O-N 3.22Å; G469-S472 PolarHBondContact O-OG 3.33Å
470P75.1Confident58.1Low86 Ų8687.9 Ų87.956%0.55849%0.486SS*.THydrogen-bonded Turntrans-56.5-28.3-166.611.2-22.1000114.4Y192 E195Y192-P470 HydrophobicContact CD1-CB 4.12Å; Y192-P470 HydrophobicContact CD1-CG 3.73Å; Y192-P470 HydrophobicContact CE1-CB 3.5Å; Y192-P470 VanDerWaalsContact CE1-CB 3.5Å; Y192-P470 HydrophobicContact CE1-CG 3.36Å; E195-P470 WeakPolarHBondContact OE2-CD 3.49Å; E195-P470 WeakPolarHBondContact OE2-CG 3.46Å
471L80.9Confident59.9Low16 Ų1686.9 Ų86.98%0.08447%0.468CS..THydrogen-bonded Turntrans-94.22.2179.8-61.8178.3000115Y192 E195 L196 Y200 V250 L254 G469 K473 V474 W475Y192-L471 VanDerWaalsContact O-CD1 3.26Å; Y192-L471 WeakPolarHBondContact O-CD1 3.24Å; E195-L471 PolarHBondContact OE1-N 2.82Å; E195-L471 PolarHBondContact OE2-N 3.14Å; E195-L471 VanDerWaalsContact OE2-N 3.16Å; L196-L471 HydrophobicContact CB-CD1 3.67Å; L196-L471 HydrophobicContact CD1-CD1 4.11Å; L196-L471 HydrophobicContact CG-CD1 4.41Å; Y200-L471 HydrophobicContact CD2-CB 4.2Å; Y200-L471 HydrophobicContact CE2-CB 3.91Å; V250-L471 HydrophobicContact CG1-CD2 4.45Å; L254-L471 HydrophobicContact CD1-CD1 4.42Å; G469-L471 PolarHBondContact O-N 3.17Å; L471-K473 VanDerWaalsContact C-N 3.26Å; L471-K473 PolarHBondContact O-N 3.23Å; L471-K473 VanDerWaalsContact O-N 3.12Å; L471-V474 HydrophobicContact CD2-CG2 4.48Å; L471-V474 WeakPolarHBondContact O-CB 3.29Å; L471-V474 PolarHBondContact O-N 2.77Å; L471-W475 PolarHBondContact O-N 3.04Å; L471-W475 VanDerWaalsContact O-N 3.16Å
472S76.9Confident61.4Low15 Ų1582 Ų8211%0.10543%0.431CS..Hα-helixtrans-52.9-35.1-179.358.30000115.3Y200 P468 G469 W475 R476Y200-S472 WeakPolarHBondContact OH-CA 3.24Å; Y200-S472 WeakPolarHBondContact OH-CB 3.49Å; P468-S472 WeakPolarHBondContact CB-OG 3.3Å; G469-S472 WeakPolarHBondContact O-CB 3.42Å; G469-S472 PolarHBondContact O-N 3.22Å; G469-S472 PolarHBondContact O-OG 3.33Å; S472-W475 PolarHBondContact O-N 3.23Å; S472-R476 WeakPolarHBondContact O-CG 3.42Å; S472-R476 PolarHBondContact O-N 3.46Å; S472-R476 VanDerWaalsContact O-N 3.12Å
473K75.6Confident62.4Low159 Ų15977.6 Ų77.669%0.69143%0.425SS*.Hα-helixtrans-67.9-39177-71179.9-1791740112.1L471 W475 R476 L477L471-K473 VanDerWaalsContact C-N 3.26Å; L471-K473 PolarHBondContact O-N 3.23Å; L471-K473 VanDerWaalsContact O-N 3.12Å; K473-W475 VanDerWaalsContact C-N 3.32Å; K473-R476 PolarHBondContact O-N 3.45Å; K473-L477 WeakPolarHBondContact O-CG 3.49Å; K473-L477 PolarHBondContact O-N 3.12Å
474V73.9Confident62.9Low30 Ų3076 Ų7618%0.18242%0.419CS..Hα-helixtrans-64.9-42.4177.8177.80000109.8V250 L471 L477 A478V250-V474 HydrophobicContact CG2-CG1 3.43Å; V250-V474 VanDerWaalsContact CG2-CG1 3.43Å; L471-V474 HydrophobicContact CD2-CG2 4.48Å; L471-V474 WeakPolarHBondContact O-CB 3.29Å; L471-V474 PolarHBondContact O-N 2.77Å; V474-L477 PolarHBondContact O-N 3.09Å; V474-A478 PolarHBondContact O-N 3.23Å
475W75.5Confident62.7Low47 Ų4776.7 Ų76.718%0.17842%0.423CS..Hα-helixtrans-59.1-47.6174.8175.3-122000112.9Y200 F201 V216 L471 S472 K473 L477 A478 K479Y200-W475 HydrophobicContact CD1-CB 3.62Å; Y200-W475 AromaticContact CD1-CD1 3.54Å; Y200-W475 AromaticContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CD2 3.79Å; Y200-W475 HydrophobicContact CD1-CE3 4.48Å; Y200-W475 AromaticContact CD1-CG 3.37Å; Y200-W475 HydrophobicContact CD1-CG 3.37Å; Y200-W475 AromaticContact CD1-NE1 3.97Å; Y200-W475 HydrophobicContact CD2-CB 4.38Å; Y200-W475 HydrophobicContact CE1-CB 4Å; Y200-W475 AromaticContact CE1-CD1 3.82Å; Y200-W475 AromaticContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CE1-CG 3.95Å; Y200-W475 HydrophobicContact CG-CB 3.85Å; Y200-W475 HydrophobicContact CG-CD2 4.17Å; Y200-W475 HydrophobicContact CG-CE3 4.45Å; Y200-W475 AromaticContact CG-CG 3.94Å; Y200-W475 HydrophobicContact CG-CG 3.94Å; Y200-W475 WeakPolarHBondContact O-CH2 3.23Å; Y200-W475 WeakPolarHBondContact O-CZ3 3.45Å; F201-W475 HydrophobicContact CD1-CZ3 4.44Å; F201-W475 HydrophobicContact CD2-CE3 4.45Å; F201-W475 HydrophobicContact CE1-CZ3 4.28Å; F201-W475 HydrophobicContact CE2-CE3 4.02Å; F201-W475 HydrophobicContact CE2-CZ3 4.44Å; F201-W475 HydrophobicContact CZ-CE3 4.06Å; F201-W475 HydrophobicContact CZ-CZ3 4.27Å; V216-W475 HydrophobicContact CG1-CH2 3.62Å; V216-W475 HydrophobicContact CG1-CZ3 4.11Å; L471-W475 PolarHBondContact O-N 3.04Å; L471-W475 VanDerWaalsContact O-N 3.16Å; S472-W475 PolarHBondContact O-N 3.23Å; K473-W475 VanDerWaalsContact C-N 3.32Å; W475-L477 VanDerWaalsContact C-N 3.31Å; W475-L477 PolarHBondContact O-N 3.18Å; W475-A478 WeakPolarHBondContact O-CB 3.34Å; W475-A478 PolarHBondContact O-N 2.84Å; W475-K479 HydrophobicContact CD2-CG 4.46Å; W475-K479 HydrophobicContact CH2-CG 4.5Å; W475-K479 HydrophobicContact CZ2-CD 4.15Å; W475-K479 HydrophobicContact CZ2-CG 4.18Å; W475-K479 PolarHBondContact O-N 2.85Å
476R74.9Confident62Low159 Ų15979.6 Ų79.660%0.643%0.429SS*.Hα-helixtrans-61.3-40.1177.6-69.1179.8-151.6173.64.4112.3S472 K473 G480S472-R476 WeakPolarHBondContact O-CG 3.42Å; S472-R476 PolarHBondContact O-N 3.46Å; S472-R476 VanDerWaalsContact O-N 3.12Å; K473-R476 PolarHBondContact O-N 3.45Å; R476-G480 PolarHBondContact O-N 3.42Å
477L71Confident61.5Low90 Ų9078.2 Ų78.247%0.47143%0.433SS..Hα-helixtrans-63.4-44.9175.3-73.4168.5000111.1K473 V474 W475 K479 G480 I481K473-L477 WeakPolarHBondContact O-CG 3.49Å; K473-L477 PolarHBondContact O-N 3.12Å; V474-L477 PolarHBondContact O-N 3.09Å; W475-L477 VanDerWaalsContact C-N 3.31Å; W475-L477 PolarHBondContact O-N 3.18Å; L477-K479 PolarHBondContact O-N 3.42Å; L477-G480 PolarHBondContact O-N 3.09Å; L477-I481 VanDerWaalsContact O-CD1 3.29Å; L477-I481 WeakPolarHBondContact O-CD1 3.2Å; L477-I481 WeakPolarHBondContact O-CG1 3.48Å; L477-I481 PolarHBondContact O-N 2.88Å
478A71Confident60.6Low0 Ų074.3 Ų74.30%043%0.434CS..Hα-helixtrans-59-47.2177.700000112F201 V246 V474 W475 G480 I481 I482F201-A478 HydrophobicContact CE1-CB 4.49Å; F201-A478 HydrophobicContact CZ-CB 3.88Å; V246-A478 HydrophobicContact CG1-CB 3.91Å; V474-A478 PolarHBondContact O-N 3.23Å; W475-A478 WeakPolarHBondContact O-CB 3.34Å; W475-A478 PolarHBondContact O-N 2.84Å; A478-G480 PolarHBondContact O-N 2.87Å; A478-I481 PolarHBondContact O-N 3.41Å; A478-I482 PolarHBondContact O-N 3.18Å
479K70.4Confident59Low98 Ų9877.6 Ų77.643%0.42645%0.447SS..Hα-helixtrans-59.7-45.1174.7-83.9-160.9169.4-168.50112.6W475 L477 I481 I482 G483W475-K479 HydrophobicContact CD2-CG 4.46Å; W475-K479 HydrophobicContact CH2-CG 4.5Å; W475-K479 HydrophobicContact CZ2-CD 4.15Å; W475-K479 HydrophobicContact CZ2-CG 4.18Å; W475-K479 PolarHBondContact O-N 2.85Å; L477-K479 PolarHBondContact O-N 3.42Å; K479-I481 VanDerWaalsContact C-N 3.29Å; K479-I481 PolarHBondContact O-N 2.87Å; K479-I482 PolarHBondContact O-N 2.7Å; K479-G483 PolarHBondContact O-N 2.88Å
480G67Low57.1Low64 Ų6482.5 Ų82.566%0.6648%0.477SS*.Hα-helixtrans-65.4-30.6-179.600000113.7R476 L477 A478R476-G480 PolarHBondContact O-N 3.42Å; L477-G480 PolarHBondContact O-N 3.09Å; A478-G480 PolarHBondContact O-N 2.87Å
481I61.4Low54.9Low32 Ų3286 Ų8616%0.16449%0.491CS..Hα-helixtrans-73.5-38.9178.6-70.7161000111.8F273 L274 L277 L477 A478 K479 G483F273-I481 HydrophobicContact CB-CD1 4.13Å; F273-I481 WeakPolarHBondContact O-CD1 3.43Å; L274-I481 HydrophobicContact CD2-CD1 3.94Å; L274-I481 HydrophobicContact CD2-CG1 3.54Å; L277-I481 HydrophobicContact CD1-CG2 3.89Å; L277-I481 HydrophobicContact CD2-CG2 3.4Å; L277-I481 VanDerWaalsContact CD2-CG2 3.4Å; L277-I481 HydrophobicContact CG-CG2 3.93Å; L477-I481 VanDerWaalsContact O-CD1 3.29Å; L477-I481 WeakPolarHBondContact O-CD1 3.2Å; L477-I481 WeakPolarHBondContact O-CG1 3.48Å; L477-I481 PolarHBondContact O-N 2.88Å; A478-I481 PolarHBondContact O-N 3.41Å; K479-I481 VanDerWaalsContact C-N 3.29Å; K479-I481 PolarHBondContact O-N 2.87Å; I481-G483 VanDerWaalsContact C-N 3.31Å; I481-G483 PolarHBondContact O-N 3.48Å
482I59.1Low52.5Low31 Ų3197.8 Ų97.816%0.15955%0.546CS..Hα-helixtrans-84.3-10.9-170.8-67.8164.3000112T239 T242 Y243 A478 K479T239-I482 HydrophobicContact CG2-CG2 4.33Å; T242-I482 HydrophobicContact CG2-CD1 3.75Å; T242-I482 HydrophobicContact CG2-CG1 3.69Å; Y243-I482 HydrophobicContact CD1-CD1 3.32Å; Y243-I482 HydrophobicContact CD2-CD1 4.28Å; Y243-I482 HydrophobicContact CE1-CD1 3.19Å; Y243-I482 HydrophobicContact CE1-CG1 4.44Å; Y243-I482 HydrophobicContact CE2-CD1 4.16Å; Y243-I482 HydrophobicContact CE2-CG2 4.36Å; Y243-I482 HydrophobicContact CG-CD1 3.88Å; A478-I482 PolarHBondContact O-N 3.18Å; K479-I482 PolarHBondContact O-N 2.7Å
483G48.3Very low51.3Low58 Ų58102 Ų10260%0.59857%0.568SS**THydrogen-bonded Turntrans57.257.6176.200000110.5K479 I481 S485K479-G483 PolarHBondContact O-N 2.88Å; I481-G483 VanDerWaalsContact C-N 3.31Å; I481-G483 PolarHBondContact O-N 3.48Å; G483-S485 PolarHBondContact O-N 2.57Å
484T42.2Very low50Low71 Ų7198.9 Ų98.944%0.43656%0.561SS.*  trans-68.5103.816953.20000107.5Y243 E486Y243-T484 WeakPolarHBondContact OH-CG2 3.33Å; T484-E486 PolarHBondContact O-N 3.33Å; T484-E486 VanDerWaalsContact O-N 3.07Å
485S33.2Very low48.6Very low108 Ų108102.8 Ų102.876%0.75558%0.582SS**  trans-44.8112.5145.348.10000106.6G483G483-S485 PolarHBondContact O-N 2.57Å
486E30.7Very low47.1Very low169 Ų169106.1 Ų106.179%0.7961%0.606SS**  trans-46.7137.6157.8-71.6175.6155.900106.8T484 S488T484-E486 PolarHBondContact O-N 3.33Å; T484-E486 VanDerWaalsContact O-N 3.07Å; E486-S488 PolarHBondContact O-N 3.47Å
487P31.7Very low45.3Very low120 Ų120102.8 Ų102.878%0.77961%0.607SS**  trans-56.5115.7164.126.5-27.9000104.3D489P487-D489 PolarHBondContact O-N 3.28Å
488S26.4Very low43.6Very low109 Ų109103.6 Ų103.676%0.76262%0.616SS**  trans-45.7132.7166.853.30000106.5E486 C490E486-S488 PolarHBondContact O-N 3.47Å; S488-C490 PolarHBondContact O-N 3.11Å
489D26.7Very low41.7Very low149 Ų149111 Ų11180%0.79766%0.66SS**  trans-29.1130.8171.6-66.6-52.5000110.6P487 D491P487-D489 PolarHBondContact O-N 3.28Å; D489-D491 PolarHBondContact O-N 3.08Å
490C27.6Very low39.5Very low122 Ų122112 Ų11282%0.82468%0.678SS**  trans-45.8109.7167.1-62.30000108.3S488 E492S488-C490 PolarHBondContact O-N 3.11Å; C490-E492 PolarHBondContact O-N 3.23Å
491D28.5Very low37.2Very low159 Ų159116 Ų11685%0.8568%0.679SS**  trans-70.1120.2151.8-80.9-36000106.4D489D489-D491 PolarHBondContact O-N 3.08Å
492E30.2Very low35Very low264 Ų264123.6 Ų123.6100%1.23473%0.726SS**  trans95.60177.2-57.3-170.2168.800118.8C490C490-E492 PolarHBondContact O-N 3.23Å

Retrieved 492 of 492 residues in 1378.9 ms (Link to these results)