A0A087WX61_HUMAN Loading...

CD83 molecule

AlphaFold DB , UniProt , Accession A0A087WX61, Species HUMAN (Homo sapiens, Human), Gene CD83, Length 146 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.1Very low37.3Very low229 Ų229161.3 Ų161.3100%1.12883%0.83SS**  0108.80-154.4143.5-179.300106.6
2E33.5Very low37.4Very low173 Ų173158.6 Ų158.681%0.80881%0.811SS**  trans43.5111.3159.9-66.8166.9127.500121.7
3T41.6Very low37.7Very low138 Ų138158.5 Ų158.585%0.84781%0.805SS**  trans-94144.9148.342.20000110.3
4P45.3Very low37.8Very low120 Ų120158.7 Ų158.778%0.77979%0.793SS**  trans-127.7110152.426.7-8.7000110.8
5Q34.5Very low38.5Very low184 Ų184156.7 Ų156.786%0.8678%0.779SS**  89.880.182.3-168.3158.7-3.800112.4
6E39.8Very low38.4Very low194 Ų194158.5 Ų158.591%0.90779%0.785SS**  trans-83.7119.3155.2-69-165.8121.400108.4
7D37.8Very low38.7Very low141 Ų141161.1 Ų161.175%0.75479%0.791SS**  trans-173.2107.9158.1-120.8-21.8000112.5
8H37.5Very low38.4Very low173 Ų173155.2 Ų155.280%0.80178%0.778SS**  trans-179.743.1137.7-107.179.7000115R10H8-R10 VanDerWaalsContact C-N 3.32Å; H8-R10 PolarHBondContact O-N 3.41Å
9L39.3Very low38.5Very low186 Ų186157 Ų15797%0.97478%0.784SS**  trans-93.464.7161.8-74168.9000109.7G11L9-G11 PolarHBondContact O-N 3.36Å
10R34.5Very low38.7Very low177 Ų177157.7 Ų157.767%0.66879%0.79SS**  trans-86.1110.6176.2-150.8175-150-95.82.4110.4H8H8-R10 VanDerWaalsContact C-N 3.32Å; H8-R10 PolarHBondContact O-N 3.41Å
11G34.5Very low38.9Very low59 Ų59152.4 Ų152.461%0.60878%0.775SS**  trans-45.2132-178.400000114.5L9 H13L9-G11 PolarHBondContact O-N 3.36Å; G11-H13 PolarHBondContact O-N 3.13Å
12Q38.7Very low39.9Very low129 Ų129147.3 Ų147.360%0.60376%0.762SS**  trans-82.593.7174.1-61.8-171.515.200109.2Y14Q12-Y14 HydrophobicContact CB-CD2 4.31Å; Q12-Y14 HydrophobicContact CB-CE2 4.14Å; Q12-Y14 PolarHBondContact O-N 3.25Å; Q12-Y14 VanDerWaalsContact O-N 3.13Å
13H41.4Very low41Very low158 Ų158145 Ų14573%0.73175%0.75SS**  trans-74.6102.8167.3-77.8-83.3000109.4G11 H15G11-H13 PolarHBondContact O-N 3.13Å; H13-H15 PolarHBondContact O-N 2.75Å
14Y38.5Very low41.4Very low161 Ų161146 Ų14663%0.63175%0.75SS**  trans-77.5103166.6-75.4-95.7000108.4Q12 Q16 R36Q12-Y14 HydrophobicContact CB-CD2 4.31Å; Q12-Y14 HydrophobicContact CB-CE2 4.14Å; Q12-Y14 PolarHBondContact O-N 3.25Å; Q12-Y14 VanDerWaalsContact O-N 3.13Å; Y14-Q16 PolarHBondContact O-N 3.36Å; Y14-R36 PolarHBondContact OH-NH1 3.39Å
15H48.4Very low41.9Very low128 Ų128143.2 Ų143.259%0.59374%0.737SS**  trans-90.398.4170.8-76.8-73.6000109.7H13 F23H13-H15 PolarHBondContact O-N 2.75Å; H15-F23 AromaticContact ND1-CE1 3.68Å; H15-F23 AromaticContact ND1-CZ 3.94Å
16Q36.8Very low43.1Very low186 Ų186138 Ų13887%0.86972%0.719SS**  trans-68.5127.5168.3-160.6-173.145.100108.4Y14 G18Y14-Q16 PolarHBondContact O-N 3.36Å; Q16-G18 PolarHBondContact O-N 3.48Å
17K42.8Very low43.9Very low203 Ų203136.8 Ų136.888%0.88372%0.719SS**  trans-74.594.5-175.2-175.7175.3-179.5-177.50110.5
18G33.6Very low44.9Very low55 Ų55138.7 Ų138.757%0.56772%0.723SS**  trans-74.1134.2157.400000109.6Q16 N20Q16-G18 PolarHBondContact O-N 3.48Å; G18-N20 PolarHBondContact O-N 2.88Å
19Q40.6Very low46.3Very low189 Ų189137.5 Ų137.588%0.88371%0.712SS**THydrogen-bonded Turntrans-55.4119.8168.7-69.3167.3-9.300107.6
20N42.8Very low47.8Very low171 Ų171134.3 Ų134.391%0.91470%0.702SS**THydrogen-bonded Turntrans87.629.7174-47.2-16.8000119G18G18-N20 PolarHBondContact O-N 2.88Å
21G42.3Very low49.9Very low46 Ų46133.1 Ų133.147%0.47470%0.699SS.*  trans-93.2102.4165.900000112.3F23G21-F23 WeakPolarHBondContact O-CD2 3.37Å
22S54.1Low52.1Low122 Ų122135.8 Ų135.885%0.85371%0.708SS**  trans-72.9124.4158.2-175.70000107.4
23F56.6Low54.4Low125 Ų125136.5 Ų136.555%0.54872%0.715SS.*  trans-105130.3177.6-70.1-83.5000108.8H15 G21 A25H15-F23 AromaticContact ND1-CE1 3.68Å; H15-F23 AromaticContact ND1-CZ 3.94Å; G21-F23 WeakPolarHBondContact O-CD2 3.37Å; F23-A25 PolarHBondContact O-N 3.13Å
24D49.3Very low56.6Low160 Ų160136.9 Ų136.986%0.85672%0.715SS**  trans-57.6135.4174-70.6-45.4000110.8
25A56.1Low58.9Low60 Ų60131.9 Ų131.950%0.49670%0.698SS.*  trans-60.5131.1-175.300000111.5F23 N27 Y31F23-A25 PolarHBondContact O-N 3.13Å; A25-N27 PolarHBondContact O-N 3.06Å; A25-N27 VanDerWaalsContact O-N 3.13Å; A25-Y31 WeakPolarHBondContact CA-OH 2.93Å; A25-Y31 WeakPolarHBondContact CB-OH 3.16Å
26P58.9Low60.9Low76 Ų76130.3 Ų130.349%0.49469%0.687SS.*  trans-66.1114.7162.4-7.121.8000107.8E28P26-E28 PolarHBondContact O-N 3.19Å
27N57Low63.4Low167 Ų167128.9 Ų128.989%0.89369%0.686SS**THydrogen-bonded Turntrans-61.4-5-172.7-137.2-8.4000114.6A25A25-N27 PolarHBondContact O-N 3.06Å; A25-N27 VanDerWaalsContact O-N 3.13Å
28E59.3Low65.5Low182 Ų182122.5 Ų122.585%0.8566%0.664SS**THydrogen-bonded Turntrans-136-3.6-168.7-65.6-178.817100115.3P26P26-E28 PolarHBondContact O-N 3.19Å
29R65.8Low68.2Low148 Ų148123.1 Ų123.156%0.55866%0.657SS**SBendtrans-133.4140-176.9-67.4-173.7-174.4-164.2-2.4113Y31R29-Y31 PolarHBondContact O-N 3.46Å
30P71.9Confident70.4Confident119 Ų119116.6 Ų116.677%0.77363%0.632SS**  trans-61.2138.7172.626.1-33000110.3S32P30-S32 PolarHBondContact O-N 3.34Å
31Y77.4Confident72.5Confident151 Ų151113.6 Ų113.659%0.59262%0.623SS**  trans-57.5131.2173.1-66.3-82.8000110.3A25 R29A25-Y31 WeakPolarHBondContact CA-OH 2.93Å; A25-Y31 WeakPolarHBondContact CB-OH 3.16Å; R29-Y31 PolarHBondContact O-N 3.46Å
32S81.9Confident74.7Confident115 Ų115113.6 Ų113.680%0.80461%0.612SS**  trans-129.7136.5179.9620000111.4P30P30-S32 PolarHBondContact O-N 3.34Å
33L85.8Confident76.5Confident144 Ų144110 Ų11075%0.75459%0.587SS**  trans-103.1118.4172.8177.265.6000108.7I35 Y46L33-I35 HydrophobicContact CG-CG1 4.39Å; L33-Y46 HydrophobicContact CD2-CD1 4.37Å
34K88.2Confident78.2Confident166 Ų166105.6 Ų105.672%0.72258%0.577SS**  trans-112.5111.9176.4-171.7172.7-176.5173.30110.6
35I88.2Confident80.5Confident56 Ų56102.6 Ų102.629%0.28756%0.564SS.*  trans-93.4117.4172.4-52.2174000107.4L33 T38 Y46 L65L33-I35 HydrophobicContact CG-CG1 4.39Å; I35-T38 HydrophobicContact CB-CG2 3.98Å; I35-T38 HydrophobicContact CG2-CG2 3.69Å; I35-Y46 HydrophobicContact CD1-CE1 3.82Å; I35-L65 HydrophobicContact CD1-CD2 3.96Å
36R89.5Confident82.2Confident95 Ų95103.5 Ų103.536%0.35856%0.555SS.*SBendtrans-90.3152.2177.1-58.8-175.3-170.2-1486.6109.8Y14 T38Y14-R36 PolarHBondContact OH-NH1 3.39Å; R36-T38 PolarHBondContact O-N 3.36Å
37N88.3Confident83.8Confident157 Ų157108.4 Ų108.484%0.8456%0.564SS**SBendtrans50.552.4177.8-58.2-23000113T39N37-T39 PolarHBondContact O-N 3.4Å
38T88.1Confident85.2Confident69 Ų69104.2 Ų104.242%0.42355%0.547SS..  trans-61.7126-17938.60000112I35 R36 N42I35-T38 HydrophobicContact CB-CG2 3.98Å; I35-T38 HydrophobicContact CG2-CG2 3.69Å; R36-T38 PolarHBondContact O-N 3.36Å; T38-N42 HydrophobicContact CG2-CB 4.36Å
39T89.3Confident86.5Confident68 Ų6899.1 Ų99.142%0.41753%0.528SS..  trans-108.2171.6173.667.10000110.2N37 C41 N42 V67N37-T39 PolarHBondContact O-N 3.4Å; T39-C41 PolarHBondContact O-N 3.46Å; T39-C41 VanDerWaalsContact O-N 3.09Å; T39-C41 PolarHBondContact OG1-N 2.81Å; T39-N42 PolarHBondContact N-OD1 3.09Å; T39-N42 WeakPolarHBondContact O-CB 3.42Å; T39-N42 PolarHBondContact O-N 2.95Å; T39-N42 PolarHBondContact O-OD1 2.67Å; T39-N42 PolarHBondContact OG1-OD1 2.79Å; T39-N42 VanDerWaalsContact OG1-OD1 3.07Å; T39-V67 WeakPolarHBondContact O-CG2 3.46Å
40S86.7Confident87.5Confident52 Ų5296.6 Ų96.636%0.36453%0.525SS..G310 helixtrans-52.6-32.817459.20000112.9N42 S43S40-N42 PolarHBondContact O-N 3.26Å; S40-S43 VanDerWaalsContact O-CB 3.29Å; S40-S43 WeakPolarHBondContact O-CB 3.45Å; S40-S43 PolarHBondContact O-N 3.21Å; S40-S43 VanDerWaalsContact O-N 3.07Å; S40-S43 PolarHBondContact O-OG 3.07Å; S40-S43 VanDerWaalsContact O-OG 3.13Å
41C87.5Confident88.1Confident108 Ų10897.7 Ų97.773%0.7352%0.52SS*.G310 helixtrans-67.1-18179.4-57.80000113.8T39 S43T39-C41 PolarHBondContact O-N 3.46Å; T39-C41 VanDerWaalsContact O-N 3.09Å; T39-C41 PolarHBondContact OG1-N 2.81Å; C41-S43 VanDerWaalsContact C-N 3.3Å
42N89.4Confident88.2Confident45 Ų4593.2 Ų93.224%0.24151%0.507CS..G310 helixtrans-82.6-10.7175-58.9109.2000112.3T38 T39 S40 Y46 L65T38-N42 HydrophobicContact CG2-CB 4.36Å; T39-N42 PolarHBondContact N-OD1 3.09Å; T39-N42 WeakPolarHBondContact O-CB 3.42Å; T39-N42 PolarHBondContact O-N 2.95Å; T39-N42 PolarHBondContact O-OD1 2.67Å; T39-N42 PolarHBondContact OG1-OD1 2.79Å; T39-N42 VanDerWaalsContact OG1-OD1 3.07Å; S40-N42 PolarHBondContact O-N 3.26Å; N42-Y46 WeakPolarHBondContact O-CE2 3.33Å; N42-Y46 PolarHBondContact O-OH 3.41Å; N42-L65 WeakPolarHBondContact O-CD2 3.46Å
43S92.1Very high88Confident48 Ų4894 Ų9434%0.33651%0.509SS..  trans-65.4140.9174.7-56.50000110.6S40 C41 L65 V67S40-S43 VanDerWaalsContact O-CB 3.29Å; S40-S43 WeakPolarHBondContact O-CB 3.45Å; S40-S43 PolarHBondContact O-N 3.21Å; S40-S43 VanDerWaalsContact O-N 3.07Å; S40-S43 PolarHBondContact O-OG 3.07Å; S40-S43 VanDerWaalsContact O-OG 3.13Å; C41-S43 VanDerWaalsContact C-N 3.3Å; S43-L65 CarbonylContact C-O 3.53Å; S43-L65 VanDerWaalsContact CA-O 3.22Å; S43-L65 WeakPolarHBondContact CA-O 3.18Å; S43-L65 WeakPolarHBondContact CB-O 3.32Å; S43-V67 WeakPolarHBondContact OG-CB 3.37Å; S43-V67 PolarHBondContact OG-N 3.17Å
44G92.5Very high87.6Confident31 Ų3193.9 Ų93.932%0.3251%0.509SS..EExtended strand (participates in β ladder)trans158-174179.800000113Y46 L65G44-Y46 WeakPolarHBondContact O-CD2 3.38Å; G44-L65 PolarHBondContact N-O 2.96Å; G44-L65 PolarHBondContact O-N 2.8Å
45T95.7Very high86.8Confident98 Ų9887.5 Ų87.560%0.60149%0.49SS*.EExtended strand (participates in β ladder)trans-95.4115.3178.4-56.70000109.8K62T45-K62 HydrophobicContact CG2-CB 4.27Å; T45-K62 HydrophobicContact CG2-CD 4.33Å; T45-K62 HydrophobicContact CG2-CG 4.47Å
46Y93.2Very high85.7Confident78 Ų7892.6 Ų92.631%0.30651%0.513SS..EExtended strand (participates in β ladder)trans-95.6145175.7-70-102000109.6L33 I35 N42 G44 K62 V63 L65L33-Y46 HydrophobicContact CD2-CD1 4.37Å; I35-Y46 HydrophobicContact CD1-CE1 3.82Å; N42-Y46 WeakPolarHBondContact O-CE2 3.33Å; N42-Y46 PolarHBondContact O-OH 3.41Å; G44-Y46 WeakPolarHBondContact O-CD2 3.38Å; Y46-K62 CarbonylContact O-C 3.54Å; Y46-K62 VanDerWaalsContact O-CA 3.28Å; Y46-K62 WeakPolarHBondContact O-CA 3.42Å; Y46-V63 PolarHBondContact N-O 3.35Å; Y46-V63 PolarHBondContact O-N 2.85Å; Y46-L65 HydrophobicContact CD2-CB 3.74Å; Y46-L65 HydrophobicContact CD2-CD2 4.38Å; Y46-L65 HydrophobicContact CE2-CB 3.58Å; Y46-L65 HydrophobicContact CE2-CD2 3.63Å; Y46-L65 HydrophobicContact CE2-CG 4.22Å
47R92.1Very high84.7Confident180 Ų18097.1 Ų97.168%0.67953%0.53SS*.EExtended strand (participates in β ladder)trans-117.9122.8175.6-175.3170.762.9-113.54.9108.9S60 G61R47-S60 WeakPolarHBondContact CD-OG 3.46Å; R47-S60 VanDerWaalsContact CG-OG 3.25Å; R47-S60 WeakPolarHBondContact CG-OG 3.29Å; R47-G61 CarbonylContact C-O 3.57Å; R47-G61 WeakPolarHBondContact CA-O 3.25Å
48C87.4Confident84.4Confident79 Ų7994 Ų9453%0.53451%0.513SS..EExtended strand (participates in β ladder)trans-95.5129.3168.1-177.40000107.6S60 G61C48-S60 CarbonylContact O-C 3.5Å; C48-S60 WeakPolarHBondContact O-CA 3.39Å; C48-S60 PolarHBondContact O-OG 2.78Å; C48-G61 PolarHBondContact N-O 2.86Å; C48-G61 PolarHBondContact O-N 2.86Å
49T86.7Confident84.2Confident74 Ų7496.6 Ų96.645%0.45452%0.524SS..EExtended strand (participates in β ladder)trans-130.4123.4177.4-56.10000108.4L59T49-L59 CarbonylContact C-O 3.49Å; T49-L59 VanDerWaalsContact CA-O 3.32Å; T49-L59 WeakPolarHBondContact CA-O 3.34Å
50L85.3Confident84.2Confident95 Ų9596.9 Ų96.950%0.49753%0.529SS..EExtended strand (participates in β ladder)trans-99.7125.7168.5-64.1173000107.3N58 L59L50-N58 WeakPolarHBondContact O-CA 3.22Å; L50-L59 HydrophobicContact CB-CB 4.35Å; L50-L59 PolarHBondContact N-O 2.83Å; L50-L59 PolarHBondContact O-N 3.47Å
51Q84.4Confident84.3Confident143 Ų14396.1 Ų96.167%0.66853%0.529SS*.EExtended strand (participates in β ladder)trans-120.3124.7179.6176.8162.361.200108.3N58Q51-N58 WeakPolarHBondContact CG-OD1 3.49Å; Q51-N58 PolarHBondContact NE2-OD1 2.91Å
52D79.9Confident84.7Confident57 Ų5798.7 Ų98.731%0.30553%0.528SS..  trans-64.2142.7169.9-163.7-59000109.7D54 G55 R57D52-D54 PolarHBondContact O-N 3.14Å; D52-D54 VanDerWaalsContact O-N 3.14Å; D52-D54 PolarHBondContact OD1-N 3.25Å; D52-G55 WeakPolarHBondContact O-CA 3.28Å; D52-G55 PolarHBondContact O-N 3.01Å; D52-R57 HydrophobicContact CB-CB 4.2Å; D52-R57 PolarHBondContact N-O 3.13Å
53P76.9Confident84.8Confident131 Ų131101 Ų10185%0.85154%0.544SS*.THydrogen-bonded Turntrans-50.2-33.1176.111.4-26.2000114.6G55P53-G55 VanDerWaalsContact C-N 3.28Å; P53-G55 PolarHBondContact O-N 3.14Å
54D78.8Confident85Confident141 Ų141104.4 Ų104.475%0.75456%0.557SS**THydrogen-bonded Turntrans-85.33.1175.8-73.9-36.5000113.5D52 Q56D52-D54 PolarHBondContact O-N 3.14Å; D52-D54 VanDerWaalsContact O-N 3.14Å; D52-D54 PolarHBondContact OD1-N 3.25Å; D54-Q56 HydrophobicContact CB-CG 4.14Å; D54-Q56 PolarHBondContact O-N 2.64Å
55G70.6Confident85Confident32 Ų32105.6 Ų105.633%0.3356%0.556SS.*SBendtrans69.2-2.2177.900000115.4D52 P53 R57 N58D52-G55 WeakPolarHBondContact O-CA 3.28Å; D52-G55 PolarHBondContact O-N 3.01Å; P53-G55 VanDerWaalsContact C-N 3.28Å; P53-G55 PolarHBondContact O-N 3.14Å; G55-R57 PolarHBondContact O-N 3.02Å; G55-N58 PolarHBondContact O-ND2 3.07Å
56Q66.1Low84.8Confident163 Ų163110.7 Ų110.776%0.76256%0.564SS**  trans-70.3-29.8-172.2-71.7-84.418.600113.5D54D54-Q56 HydrophobicContact CB-CG 4.14Å; D54-Q56 PolarHBondContact O-N 2.64Å
57R67Low84.7Confident191 Ų191108.5 Ų108.572%0.72156%0.559SS**  trans-127.2109.8-175.6-64.2178.9-177.8168.41.7109.9D52 G55D52-R57 HydrophobicContact CB-CB 4.2Å; D52-R57 PolarHBondContact N-O 3.13Å; G55-R57 PolarHBondContact O-N 3.02Å
58N82.2Confident84.5Confident91 Ų91106 Ų10649%0.48756%0.564SS.*EExtended strand (participates in β ladder)trans-112.4116.2177-62-53.2000109.2L50 Q51 G55L50-N58 WeakPolarHBondContact O-CA 3.22Å; Q51-N58 WeakPolarHBondContact CG-OD1 3.49Å; Q51-N58 PolarHBondContact NE2-OD1 2.91Å; G55-N58 PolarHBondContact O-ND2 3.07Å
59L84.7Confident84.3Confident123 Ų123106.2 Ų106.264%0.64458%0.579SS**EExtended strand (participates in β ladder)trans-105.3127.6171.4-66.2170.9000108.4T49 L50T49-L59 CarbonylContact C-O 3.49Å; T49-L59 VanDerWaalsContact CA-O 3.32Å; T49-L59 WeakPolarHBondContact CA-O 3.34Å; L50-L59 HydrophobicContact CB-CB 4.35Å; L50-L59 PolarHBondContact N-O 2.83Å; L50-L59 PolarHBondContact O-N 3.47Å
60S89Confident83.8Confident74 Ų74105 Ų10552%0.51757%0.573SS.*EExtended strand (participates in β ladder)trans-130.6130.8179.6177.90000111.7R47 C48R47-S60 WeakPolarHBondContact CD-OG 3.46Å; R47-S60 VanDerWaalsContact CG-OG 3.25Å; R47-S60 WeakPolarHBondContact CG-OG 3.29Å; C48-S60 CarbonylContact O-C 3.5Å; C48-S60 WeakPolarHBondContact O-CA 3.39Å; C48-S60 PolarHBondContact O-OG 2.78Å
61G89.8Confident83.3Confident37 Ų37106.4 Ų106.438%0.38159%0.588SS.*EExtended strand (participates in β ladder)trans-116.7150.7172.400000111.3R47 C48R47-G61 CarbonylContact C-O 3.57Å; R47-G61 WeakPolarHBondContact CA-O 3.25Å; C48-G61 PolarHBondContact N-O 2.86Å; C48-G61 PolarHBondContact O-N 2.86Å
62K94.5Very high82.2Confident161 Ų161103.6 Ų103.670%0.759%0.589SS**EExtended strand (participates in β ladder)trans-113.6139.1172.1-68.3-179.6-177.7175.10109.9T45 Y46T45-K62 HydrophobicContact CG2-CB 4.27Å; T45-K62 HydrophobicContact CG2-CD 4.33Å; T45-K62 HydrophobicContact CG2-CG 4.47Å; Y46-K62 CarbonylContact O-C 3.54Å; Y46-K62 VanDerWaalsContact O-CA 3.28Å; Y46-K62 WeakPolarHBondContact O-CA 3.42Å
63V93.2Very high81.2Confident95 Ų95106.2 Ų106.258%0.57660%0.599SS**EExtended strand (participates in β ladder)trans-129.3134.3176.3-179.60000108.4Y46Y46-V63 PolarHBondContact N-O 3.35Å; Y46-V63 PolarHBondContact O-N 2.85Å
64I95.2Very high80.1Confident119 Ų119109.8 Ų109.861%0.6160%0.596SS**EExtended strand (participates in β ladder)trans-96.9112.7175.5-57.1174.7000107.9R66I64-R66 HydrophobicContact CG2-CG 4.29Å
65L92.9Very high78.9Confident56 Ų56108.7 Ų108.729%0.29358%0.584SS.*EExtended strand (participates in β ladder)trans-90.4120.8173.9-178.859.8000109.2I35 N42 S43 G44 Y46I35-L65 HydrophobicContact CD1-CD2 3.96Å; N42-L65 WeakPolarHBondContact O-CD2 3.46Å; S43-L65 CarbonylContact C-O 3.53Å; S43-L65 VanDerWaalsContact CA-O 3.22Å; S43-L65 WeakPolarHBondContact CA-O 3.18Å; S43-L65 WeakPolarHBondContact CB-O 3.32Å; G44-L65 PolarHBondContact N-O 2.96Å; G44-L65 PolarHBondContact O-N 2.8Å; Y46-L65 HydrophobicContact CD2-CB 3.74Å; Y46-L65 HydrophobicContact CD2-CD2 4.38Å; Y46-L65 HydrophobicContact CE2-CB 3.58Å; Y46-L65 HydrophobicContact CE2-CD2 3.63Å; Y46-L65 HydrophobicContact CE2-CG 4.22Å
66R92.1Very high78.1Confident204 Ų204114.2 Ų114.277%0.7760%0.601SS**  trans-115.1123.2172.1-72-179.6177.6-96.51.5109.4I64I64-R66 HydrophobicContact CG2-CG 4.29Å
67V90.6Very high77.5Confident33 Ų33113 Ų11320%0.260%0.595CS.*  trans-94.6119.2173.1-179.90000108.7T39 S43T39-V67 WeakPolarHBondContact O-CG2 3.46Å; S43-V67 WeakPolarHBondContact OG-CB 3.37Å; S43-V67 PolarHBondContact OG-N 3.17Å
68T87.9Confident77Confident128 Ų128106.1 Ų106.179%0.78558%0.575SS**  trans-99.9165.317955.80000110.9C70T68-C70 PolarHBondContact O-N 3.44Å
69G82.9Confident75.9Confident82 Ų82108.5 Ų108.585%0.84558%0.581SS**SBendtrans76.4-1.1177.400000115.5
70C76.6Confident74.7Confident50 Ų50110.5 Ų110.534%0.33859%0.585SS.*SBendtrans-72.6132.4162.7-68.60000108.3T68 A72T68-C70 PolarHBondContact O-N 3.44Å; C70-A72 PolarHBondContact O-N 3.3Å
71P74.3Confident73.6Confident124 Ų124114 Ų11481%0.80559%0.591SS**  trans-54.4120.8169.422.7-30.4000106.6Q73P71-Q73 PolarHBondContact O-N 3.01Å; P71-Q73 VanDerWaalsContact O-N 3.14Å
72A61Low72.8Confident83 Ų83118.4 Ų118.469%0.68660%0.597SS**  trans-45.9128.6-178.500000107.4C70 R74C70-A72 PolarHBondContact O-N 3.3Å; A72-R74 PolarHBondContact O-N 3.47Å
73Q58.3Low72.1Confident113 Ų113119.6 Ų119.653%0.52860%0.597SS.*  trans-61.386.8169.4-101.4-143.323.800107.1P71 K75 E76P71-Q73 PolarHBondContact O-N 3.01Å; P71-Q73 VanDerWaalsContact O-N 3.14Å; Q73-K75 HydrophobicContact CB-CB 4.2Å; Q73-K75 HydrophobicContact CG-CB 4.34Å; Q73-K75 HydrophobicContact CG-CD 4.45Å; Q73-K75 PolarHBondContact O-N 2.85Å; Q73-E76 PolarHBondContact O-N 3.01Å
74R54.4Low71.7Confident205 Ų205118.3 Ų118.377%0.77460%0.596SS**THydrogen-bonded Turntrans-48.3-16.4164.2-129179.7-173.9171.21.9111.6A72 T78A72-R74 PolarHBondContact O-N 3.47Å; R74-T78 WeakPolarHBondContact O-CG2 3.19Å; R74-T78 PolarHBondContact O-N 2.85Å; R74-T78 PolarHBondContact O-OG1 2.97Å
75K53.7Low71.4Confident118 Ų118117.3 Ų117.351%0.51359%0.589SS.*Hα-helixtrans-55.7-45.6175.9-80.2-175.7179.2-178.60113.6Q73 E77 T78 F79Q73-K75 HydrophobicContact CB-CB 4.2Å; Q73-K75 HydrophobicContact CG-CB 4.34Å; Q73-K75 HydrophobicContact CG-CD 4.45Å; Q73-K75 PolarHBondContact O-N 2.85Å; K75-E77 VanDerWaalsContact C-N 3.32Å; K75-E77 PolarHBondContact O-N 3.21Å; K75-T78 WeakPolarHBondContact CA-OG1 2.94Å; K75-T78 PolarHBondContact O-N 3.48Å; K75-T78 PolarHBondContact O-OG1 3.24Å; K75-F79 HydrophobicContact CB-CD2 4.08Å; K75-F79 HydrophobicContact CB-CE2 3.74Å; K75-F79 HydrophobicContact CD-CE2 4.36Å; K75-F79 HydrophobicContact CG-CE2 4.17Å; K75-F79 WeakPolarHBondContact O-CD2 3.44Å; K75-F79 WeakPolarHBondContact O-CG 3.45Å; K75-F79 PolarHBondContact O-N 3.21Å
76E53.6Low71.2Confident148 Ų148119.9 Ų119.969%0.69260%0.601SS**Hα-helixtrans-69.4-31.1-172.1-157.3161.7-169.800113.1Q73Q73-E76 PolarHBondContact O-N 3.01Å
77E54.4Low71.3Confident137 Ų137114.3 Ų114.364%0.6459%0.59SS**Hα-helixtrans-75.5-41.5174-25-172.7-149.300110.9K75 K80 K81K75-E77 VanDerWaalsContact C-N 3.32Å; K75-E77 PolarHBondContact O-N 3.21Å; E77-K80 PolarHBondContact O-N 2.85Å; E77-K81 WeakPolarHBondContact O-CB 3.37Å; E77-K81 PolarHBondContact O-N 3.21Å
78T56.1Low71.4Confident47 Ų47118.3 Ų118.329%0.28861%0.61SS.*Hα-helixtrans-68.1-36.4177.751.40000113.1R74 K75 K80 K81 Y82R74-T78 WeakPolarHBondContact O-CG2 3.19Å; R74-T78 PolarHBondContact O-N 2.85Å; R74-T78 PolarHBondContact O-OG1 2.97Å; K75-T78 WeakPolarHBondContact CA-OG1 2.94Å; K75-T78 PolarHBondContact O-N 3.48Å; K75-T78 PolarHBondContact O-OG1 3.24Å; T78-K80 PolarHBondContact O-N 3.04Å; T78-K81 WeakPolarHBondContact O-CB 3.43Å; T78-K81 PolarHBondContact O-N 3.34Å; T78-K81 VanDerWaalsContact O-N 3.17Å; T78-Y82 WeakPolarHBondContact O-CD2 3.41Å; T78-Y82 PolarHBondContact O-N 3.46Å
79F57.9Low71.7Confident142 Ų142117 Ų11762%0.62360%0.598SS**Hα-helixtrans-65.2-38.3177.8-76.5-61.6000112.1K75 R83K75-F79 HydrophobicContact CB-CD2 4.08Å; K75-F79 HydrophobicContact CB-CE2 3.74Å; K75-F79 HydrophobicContact CD-CE2 4.36Å; K75-F79 HydrophobicContact CG-CE2 4.17Å; K75-F79 WeakPolarHBondContact O-CD2 3.44Å; K75-F79 WeakPolarHBondContact O-CG 3.45Å; K75-F79 PolarHBondContact O-N 3.21Å; F79-R83 PolarHBondContact O-N 3.17Å
80K61Low72.3Confident165 Ų165118.1 Ų118.172%0.71758%0.583SS**Hα-helixtrans-67.1-38.6171.5-80.2-177.7176.1176.50112.2E77 T78 R83E77-K80 PolarHBondContact O-N 2.85Å; T78-K80 PolarHBondContact O-N 3.04Å; K80-R83 WeakPolarHBondContact O-CB 2.97Å; K80-R83 PolarHBondContact O-N 3.22Å
81K65.6Low73.2Confident147 Ų147118.2 Ų118.264%0.63959%0.588SS**Hα-helixtrans-61.5-48.9179-172.1176.9176.4-1790112.1E77 T78 R83 A84E77-K81 WeakPolarHBondContact O-CB 3.37Å; E77-K81 PolarHBondContact O-N 3.21Å; T78-K81 WeakPolarHBondContact O-CB 3.43Å; T78-K81 PolarHBondContact O-N 3.34Å; T78-K81 VanDerWaalsContact O-N 3.17Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 3.44Å; K81-A84 PolarHBondContact O-N 2.88Å
82Y71.9Confident74.3Confident130 Ų130117.3 Ų117.351%0.5158%0.576SS.*Hα-helixtrans-70.3-23.9178.5-64.6-62.7000113.1T78 A84 E85 I86T78-Y82 WeakPolarHBondContact O-CD2 3.41Å; T78-Y82 PolarHBondContact O-N 3.46Å; Y82-A84 PolarHBondContact O-N 2.87Å; Y82-E85 PolarHBondContact O-N 3.46Å; Y82-I86 WeakPolarHBondContact O-CB 3.32Å; Y82-I86 WeakPolarHBondContact O-CD1 3.36Å; Y82-I86 WeakPolarHBondContact O-CG1 3.16Å; Y82-I86 PolarHBondContact O-N 2.92Å
83R80.3Confident76.1Confident186 Ų186117.2 Ų117.270%0.70257%0.566SS**Hα-helixtrans-62.5-42.5176.7-167.6-179.4-172.7-95.31.8112.2F79 K80 K81 V87F79-R83 PolarHBondContact O-N 3.17Å; K80-R83 WeakPolarHBondContact O-CB 2.97Å; K80-R83 PolarHBondContact O-N 3.22Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 3.44Å; R83-V87 WeakPolarHBondContact O-CG2 3.47Å; R83-V87 PolarHBondContact O-N 3.37Å; R83-V87 VanDerWaalsContact O-N 3.15Å
84A85.3Confident78Confident67 Ų67116.3 Ų116.355%0.55456%0.564SS**Hα-helixtrans-68.8-41.2177.800000111.6K81 Y82 V87 L88K81-A84 PolarHBondContact O-N 2.88Å; Y82-A84 PolarHBondContact O-N 2.87Å; A84-V87 PolarHBondContact O-N 3.39Å; A84-L88 WeakPolarHBondContact O-CB 3.43Å; A84-L88 PolarHBondContact O-N 3.48Å
85E87.8Confident80Confident99 Ų99112.5 Ų112.546%0.46355%0.554SS.*Hα-helixtrans-64.3-44.9178.1-170.1173.3-176.700112Y82 V87 L88 L89Y82-E85 PolarHBondContact O-N 3.46Å; E85-V87 VanDerWaalsContact C-N 3.34Å; E85-V87 PolarHBondContact O-N 3.38Å; E85-L88 PolarHBondContact O-N 3.31Å; E85-L89 HydrophobicContact CG-CD1 4.42Å; E85-L89 VanDerWaalsContact O-CG 3.32Å; E85-L89 WeakPolarHBondContact O-CG 3.39Å; E85-L89 PolarHBondContact O-N 3.15Å
86I90.5Very high82.1Confident109 Ų109114.1 Ų114.156%0.55956%0.557SS**Hα-helixtrans-62.2-42.1176-68.6164.7000111Y82 L88 L89 L90Y82-I86 WeakPolarHBondContact O-CB 3.32Å; Y82-I86 WeakPolarHBondContact O-CD1 3.36Å; Y82-I86 WeakPolarHBondContact O-CG1 3.16Å; Y82-I86 PolarHBondContact O-N 2.92Å; I86-L88 VanDerWaalsContact C-N 3.34Å; I86-L89 PolarHBondContact O-N 3.44Å; I86-L90 WeakPolarHBondContact O-CB 3.33Å; I86-L90 PolarHBondContact O-N 2.93Å
87V92.6Very high84.1Confident87 Ų87111.5 Ų111.553%0.52755%0.548SS..Hα-helixtrans-63.8-41.2176.61700000111R83 A84 E85 L90 A91R83-V87 WeakPolarHBondContact O-CG2 3.47Å; R83-V87 PolarHBondContact O-N 3.37Å; R83-V87 VanDerWaalsContact O-N 3.15Å; A84-V87 PolarHBondContact O-N 3.39Å; E85-V87 VanDerWaalsContact C-N 3.34Å; E85-V87 PolarHBondContact O-N 3.38Å; V87-L90 PolarHBondContact O-N 3.36Å; V87-A91 WeakPolarHBondContact O-CB 3.2Å; V87-A91 PolarHBondContact O-N 3.28Å
88L92.5Very high86.1Confident118 Ų118108.4 Ų108.462%0.61854%0.538SS*.Hα-helixtrans-64.6-45.8177.2-17864000111.8A84 E85 I86 L90 A91 L92A84-L88 WeakPolarHBondContact O-CB 3.43Å; A84-L88 PolarHBondContact O-N 3.48Å; E85-L88 PolarHBondContact O-N 3.31Å; I86-L88 VanDerWaalsContact C-N 3.34Å; L88-L90 PolarHBondContact O-N 3.03Å; L88-A91 PolarHBondContact O-N 2.91Å; L88-L92 WeakPolarHBondContact O-CB 3.33Å; L88-L92 PolarHBondContact O-N 3.03Å
89L94.9Very high87.9Confident101 Ų101109.5 Ų109.553%0.52954%0.542SS..Hα-helixtrans-61.2-44.4176.5-70.8175.2000111.3E85 I86 L92 V93E85-L89 HydrophobicContact CG-CD1 4.42Å; E85-L89 VanDerWaalsContact O-CG 3.32Å; E85-L89 WeakPolarHBondContact O-CG 3.39Å; E85-L89 PolarHBondContact O-N 3.15Å; I86-L89 PolarHBondContact O-N 3.44Å; L89-L92 PolarHBondContact O-N 3.5Å; L89-V93 WeakPolarHBondContact O-CG2 3.33Å; L89-V93 PolarHBondContact O-N 3.47Å
90L96Very high89.6Confident104 Ų104106.1 Ų106.155%0.54553%0.53SS..Hα-helixtrans-62.5-43.9176.8-176.963.8000111.6I86 V87 L88 L92 V93 I94I86-L90 WeakPolarHBondContact O-CB 3.33Å; I86-L90 PolarHBondContact O-N 2.93Å; V87-L90 PolarHBondContact O-N 3.36Å; L88-L90 PolarHBondContact O-N 3.03Å; L90-L92 VanDerWaalsContact C-N 3.32Å; L90-L92 PolarHBondContact O-N 3.45Å; L90-V93 PolarHBondContact O-N 2.9Å; L90-I94 HydrophobicContact CD1-CD1 4.31Å; L90-I94 HydrophobicContact CG-CD1 4.05Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.46Å
91A96.2Very high91.1Very high52 Ų52103.3 Ų103.343%0.4352%0.521SS..Hα-helixtrans-61.9-40.1176.400000111.9V87 L88 I94 F95V87-A91 WeakPolarHBondContact O-CB 3.2Å; V87-A91 PolarHBondContact O-N 3.28Å; L88-A91 PolarHBondContact O-N 2.91Å; A91-I94 PolarHBondContact O-N 3.32Å; A91-F95 VanDerWaalsContact O-CB 3.22Å; A91-F95 WeakPolarHBondContact O-CB 3.42Å; A91-F95 PolarHBondContact O-N 2.9Å
92L96.9Very high92.3Very high106 Ų106102.9 Ų102.956%0.55552%0.52SS*.Hα-helixtrans-64.4-42.8177.7-171.6149.1000111.8L88 L89 L90 F95 Y96L88-L92 WeakPolarHBondContact O-CB 3.33Å; L88-L92 PolarHBondContact O-N 3.03Å; L89-L92 PolarHBondContact O-N 3.5Å; L90-L92 VanDerWaalsContact C-N 3.32Å; L90-L92 PolarHBondContact O-N 3.45Å; L92-F95 PolarHBondContact O-N 2.99Å; L92-Y96 WeakPolarHBondContact O-CB 3.47Å; L92-Y96 PolarHBondContact O-N 2.83Å
93V97.8Very high93.1Very high81 Ų81100.8 Ų100.849%0.49152%0.521SS..Hα-helixtrans-61.6-48.9175.5172.10000110.8L89 L90 F95 Y96 L97L89-V93 WeakPolarHBondContact O-CG2 3.33Å; L89-V93 PolarHBondContact O-N 3.47Å; L90-V93 PolarHBondContact O-N 2.9Å; V93-F95 VanDerWaalsContact C-N 3.35Å; V93-F95 PolarHBondContact O-N 3.43Å; V93-Y96 PolarHBondContact O-N 3.41Å; V93-L97 HydrophobicContact CG1-CD1 4.08Å; V93-L97 WeakPolarHBondContact O-CG 3.23Å; V93-L97 PolarHBondContact O-N 3.34Å
94I97.8Very high93.3Very high94 Ų9495.2 Ų95.248%0.48251%0.509SS..Hα-helixtrans-60.7-46.7178.3-66.4167.5000110.2L90 A91 Y96 L97 T98L90-I94 HydrophobicContact CD1-CD1 4.31Å; L90-I94 HydrophobicContact CG-CD1 4.05Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.46Å; A91-I94 PolarHBondContact O-N 3.32Å; I94-Y96 PolarHBondContact O-N 3.19Å; I94-L97 PolarHBondContact O-N 3.36Å; I94-T98 HydrophobicContact CG2-CG2 4.41Å; I94-T98 WeakPolarHBondContact O-CG2 3.45Å; I94-T98 PolarHBondContact O-N 2.86Å; I94-T98 PolarHBondContact O-OG1 2.89Å
95F97.7Very high93.1Very high125 Ų12597.1 Ų97.155%0.54851%0.505SS..Hα-helixtrans-57.8-47.8178.2-179.4-109.5000111.6A91 L92 V93 L97 T98 L99A91-F95 VanDerWaalsContact O-CB 3.22Å; A91-F95 WeakPolarHBondContact O-CB 3.42Å; A91-F95 PolarHBondContact O-N 2.9Å; L92-F95 PolarHBondContact O-N 2.99Å; V93-F95 VanDerWaalsContact C-N 3.35Å; V93-F95 PolarHBondContact O-N 3.43Å; F95-L97 PolarHBondContact O-N 2.67Å; F95-T98 WeakPolarHBondContact CA-OG1 3.32Å; F95-T98 PolarHBondContact O-N 3.16Å; F95-T98 VanDerWaalsContact O-N 3.16Å; F95-T98 PolarHBondContact O-OG1 3.44Å; F95-L99 HydrophobicContact CD1-CD1 3.92Å; F95-L99 HydrophobicContact CD1-CG 4.38Å; F95-L99 HydrophobicContact CE1-CD1 3.37Å; F95-L99 HydrophobicContact CE1-CG 4.05Å; F95-L99 HydrophobicContact CE2-CD1 4.43Å; F95-L99 HydrophobicContact CE2-CD2 4.34Å; F95-L99 HydrophobicContact CE2-CG 4.3Å; F95-L99 HydrophobicContact CZ-CD1 3.66Å; F95-L99 HydrophobicContact CZ-CD2 4.13Å; F95-L99 HydrophobicContact CZ-CG 4.01Å; F95-L99 WeakPolarHBondContact O-CG 3.45Å; F95-L99 PolarHBondContact O-N 3.41Å
96Y97.1Very high92.4Very high152 Ų15297.4 Ų97.460%0.59651%0.505SS*.Hα-helixtrans-62.9-41.8178.8-164-105.5000112.4L92 V93 I94 T98 L99 I100L92-Y96 WeakPolarHBondContact O-CB 3.47Å; L92-Y96 PolarHBondContact O-N 2.83Å; V93-Y96 PolarHBondContact O-N 3.41Å; I94-Y96 PolarHBondContact O-N 3.19Å; Y96-T98 VanDerWaalsContact C-N 3.34Å; Y96-T98 PolarHBondContact O-N 2.88Å; Y96-L99 PolarHBondContact O-N 3.4Å; Y96-I100 HydrophobicContact CD1-CD1 3.39Å; Y96-I100 HydrophobicContact CD1-CG1 4.12Å; Y96-I100 HydrophobicContact CE1-CD1 3.34Å; Y96-I100 HydrophobicContact CE1-CG1 3.97Å; Y96-I100 HydrophobicContact CG-CD1 4.38Å; Y96-I100 WeakPolarHBondContact O-CG1 3.16Å; Y96-I100 PolarHBondContact O-N 3.26Å
97L97.1Very high91.3Very high93 Ų9395 Ų9549%0.48750%0.501SS..Hα-helixtrans-61.1-42173.7-69.7172.3000111.8V93 I94 F95 I100 I101V93-L97 HydrophobicContact CG1-CD1 4.08Å; V93-L97 WeakPolarHBondContact O-CG 3.23Å; V93-L97 PolarHBondContact O-N 3.34Å; I94-L97 PolarHBondContact O-N 3.36Å; F95-L97 PolarHBondContact O-N 2.67Å; L97-I100 PolarHBondContact O-N 3.46Å; L97-I101 WeakPolarHBondContact O-CB 3.22Å; L97-I101 WeakPolarHBondContact O-CD1 3.5Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.32Å; L97-I101 PolarHBondContact O-N 2.9Å
98T95.2Very high90Very high71 Ų7199.2 Ų99.244%0.43651%0.507SS..Hα-helixtrans-64.7-40.3175.961.50000112I94 F95 Y96 I101 F102I94-T98 HydrophobicContact CG2-CG2 4.41Å; I94-T98 WeakPolarHBondContact O-CG2 3.45Å; I94-T98 PolarHBondContact O-N 2.86Å; I94-T98 PolarHBondContact O-OG1 2.89Å; F95-T98 WeakPolarHBondContact CA-OG1 3.32Å; F95-T98 PolarHBondContact O-N 3.16Å; F95-T98 VanDerWaalsContact O-N 3.16Å; F95-T98 PolarHBondContact O-OG1 3.44Å; Y96-T98 VanDerWaalsContact C-N 3.34Å; Y96-T98 PolarHBondContact O-N 2.88Å; T98-I101 PolarHBondContact O-N 3.28Å; T98-F102 WeakPolarHBondContact O-CB 3.23Å; T98-F102 PolarHBondContact O-N 3.46Å
99L94.3Very high88.5Confident71 Ų71100.5 Ų100.537%0.37251%0.514SS..Hα-helixtrans-64.1-42.8174.7-71.2-176000111.9F95 Y96 F102 T103F95-L99 HydrophobicContact CD1-CD1 3.92Å; F95-L99 HydrophobicContact CD1-CG 4.38Å; F95-L99 HydrophobicContact CE1-CD1 3.37Å; F95-L99 HydrophobicContact CE1-CG 4.05Å; F95-L99 HydrophobicContact CE2-CD1 4.43Å; F95-L99 HydrophobicContact CE2-CD2 4.34Å; F95-L99 HydrophobicContact CE2-CG 4.3Å; F95-L99 HydrophobicContact CZ-CD1 3.66Å; F95-L99 HydrophobicContact CZ-CD2 4.13Å; F95-L99 HydrophobicContact CZ-CG 4.01Å; F95-L99 WeakPolarHBondContact O-CG 3.45Å; F95-L99 PolarHBondContact O-N 3.41Å; Y96-L99 PolarHBondContact O-N 3.4Å; L99-F102 PolarHBondContact O-N 3.18Å; L99-T103 VanDerWaalsContact O-CB 3.23Å; L99-T103 WeakPolarHBondContact O-CB 3.18Å; L99-T103 PolarHBondContact O-N 2.9Å; L99-T103 PolarHBondContact O-OG1 3.47Å
100I94.3Very high86.8Confident71 Ų71101.9 Ų101.936%0.36452%0.518SS..Hα-helixtrans-60.2-52.3174.4-69.2162.6000109.7Y96 L97 F102 T103 C104Y96-I100 HydrophobicContact CD1-CD1 3.39Å; Y96-I100 HydrophobicContact CD1-CG1 4.12Å; Y96-I100 HydrophobicContact CE1-CD1 3.34Å; Y96-I100 HydrophobicContact CE1-CG1 3.97Å; Y96-I100 HydrophobicContact CG-CD1 4.38Å; Y96-I100 WeakPolarHBondContact O-CG1 3.16Å; Y96-I100 PolarHBondContact O-N 3.26Å; L97-I100 PolarHBondContact O-N 3.46Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.44Å; I100-T103 PolarHBondContact O-N 3.41Å; I100-C104 WeakPolarHBondContact O-CB 3.35Å; I100-C104 PolarHBondContact O-N 3.25Å; I100-C104 PolarHBondContact O-SG 3.46Å
101I91.3Very high84.7Confident105 Ų10599.6 Ų99.654%0.53851%0.511SS..Hα-helixtrans-60.8-43.5-178.8-68.1164.6000110.5L97 T98 C104 K105L97-I101 WeakPolarHBondContact O-CB 3.22Å; L97-I101 WeakPolarHBondContact O-CD1 3.5Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.32Å; L97-I101 PolarHBondContact O-N 2.9Å; T98-I101 PolarHBondContact O-N 3.28Å; I101-C104 PolarHBondContact O-N 2.81Å; I101-K105 HydrophobicContact CG2-CG 4.12Å; I101-K105 WeakPolarHBondContact O-CB 3.1Å; I101-K105 WeakPolarHBondContact O-CG 3.23Å; I101-K105 PolarHBondContact O-N 2.79Å
102F90.9Very high82.6Confident139 Ų139105.2 Ų105.261%0.6153%0.532SS*.Hα-helixtrans-65.4-43.6178.5-177.2-100.7000111.3T98 L99 I100 K105 F106T98-F102 WeakPolarHBondContact O-CB 3.23Å; T98-F102 PolarHBondContact O-N 3.46Å; L99-F102 PolarHBondContact O-N 3.18Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.44Å; F102-K105 PolarHBondContact O-N 3.16Å; F102-F106 WeakPolarHBondContact O-CA 3.19Å; F102-F106 WeakPolarHBondContact O-CB 3.18Å; F102-F106 PolarHBondContact O-N 2.69Å
103T88.6Confident80.4Confident86 Ų86107.9 Ų107.953%0.52854%0.539SS..Hα-helixtrans-64.2-42.5175.9-55.10000110.8L99 I100 F106 A107L99-T103 VanDerWaalsContact O-CB 3.23Å; L99-T103 WeakPolarHBondContact O-CB 3.18Å; L99-T103 PolarHBondContact O-N 2.9Å; L99-T103 PolarHBondContact O-OG1 3.47Å; I100-T103 PolarHBondContact O-N 3.41Å; T103-F106 PolarHBondContact O-N 2.78Å; T103-A107 WeakPolarHBondContact O-CB 3.32Å; T103-A107 PolarHBondContact O-N 2.77Å
104C84.7Confident78.2Confident68 Ų68108.1 Ų108.146%0.45954%0.542SS..Hα-helixtrans-65.6-41.3174.3-68.60000111.8I100 I101 R108I100-C104 WeakPolarHBondContact O-CB 3.35Å; I100-C104 PolarHBondContact O-N 3.25Å; I100-C104 PolarHBondContact O-SG 3.46Å; I101-C104 PolarHBondContact O-N 2.81Å; C104-R108 VanDerWaalsContact O-CB 3.23Å; C104-R108 WeakPolarHBondContact O-CB 3.12Å; C104-R108 WeakPolarHBondContact O-CG 3.5Å; C104-R108 PolarHBondContact O-N 3.38Å
105K81.2Confident75.8Confident108 Ų108109.4 Ų109.447%0.4755%0.55SS.*Hα-helixtrans-66.9-42.4176.4-80.5-78.9-173.7166.50110.9I101 F102 R108 L109I101-K105 HydrophobicContact CG2-CG 4.12Å; I101-K105 WeakPolarHBondContact O-CB 3.1Å; I101-K105 WeakPolarHBondContact O-CG 3.23Å; I101-K105 PolarHBondContact O-N 2.79Å; F102-K105 PolarHBondContact O-N 3.16Å; K105-R108 CarbonylContact O-C 3.55Å; K105-R108 PolarHBondContact O-N 2.73Å; K105-L109 WeakPolarHBondContact O-CB 3.34Å; K105-L109 WeakPolarHBondContact O-CD1 3.14Å; K105-L109 WeakPolarHBondContact O-CG 3.48Å; K105-L109 PolarHBondContact O-N 3.14Å
106F73.6Confident73.6Confident104 Ų104112.7 Ų112.746%0.45656%0.564SS.*Hα-helixtrans-66.9-44.6176.7-178.2-103.1000111F102 T103 R108 L109 Q110F102-F106 WeakPolarHBondContact O-CA 3.19Å; F102-F106 WeakPolarHBondContact O-CB 3.18Å; F102-F106 PolarHBondContact O-N 2.69Å; T103-F106 PolarHBondContact O-N 2.78Å; F106-R108 VanDerWaalsContact C-N 3.28Å; F106-R108 PolarHBondContact O-N 2.9Å; F106-L109 CarbonylContact O-C 3.53Å; F106-L109 PolarHBondContact O-N 3.35Å; F106-Q110 VanDerWaalsContact O-CB 3.27Å; F106-Q110 WeakPolarHBondContact O-CB 3.33Å; F106-Q110 PolarHBondContact O-N 3.42Å
107A67.4Low71.4Confident58 Ų58110.6 Ų110.648%0.47957%0.572SS.*Hα-helixtrans-61-37.2172.500000112T103 S111T103-A107 WeakPolarHBondContact O-CB 3.32Å; T103-A107 PolarHBondContact O-N 2.77Å; A107-S111 WeakPolarHBondContact O-CB 3.27Å; A107-S111 PolarHBondContact O-N 3.14Å
108R64.1Low68.8Low176 Ų176115.5 Ų115.566%0.66459%0.59SS**Hα-helixtrans-72.7-22.1172.6-74.8177.767-162.40.3114.3C104 K105 F106 S111C104-R108 VanDerWaalsContact O-CB 3.23Å; C104-R108 WeakPolarHBondContact O-CB 3.12Å; C104-R108 WeakPolarHBondContact O-CG 3.5Å; C104-R108 PolarHBondContact O-N 3.38Å; K105-R108 CarbonylContact O-C 3.55Å; K105-R108 PolarHBondContact O-N 2.73Å; F106-R108 VanDerWaalsContact C-N 3.28Å; F106-R108 PolarHBondContact O-N 2.9Å; R108-S111 PolarHBondContact O-OG 3.16Å
109L62.7Low66.5Low145 Ų145117.3 Ų117.376%0.75961%0.612SS**Hα-helixtrans-90.9-31.8176.9-74.5167.1000111.4K105 F106K105-L109 WeakPolarHBondContact O-CB 3.34Å; K105-L109 WeakPolarHBondContact O-CD1 3.14Å; K105-L109 WeakPolarHBondContact O-CG 3.48Å; K105-L109 PolarHBondContact O-N 3.14Å; F106-L109 CarbonylContact O-C 3.53Å; F106-L109 PolarHBondContact O-N 3.35Å
110Q57.8Low64.1Low131 Ų131117.2 Ų117.261%0.61263%0.628SS**Hα-helixtrans-86.4-10.3175.7-157.3176.918.400112F106 I112F106-Q110 VanDerWaalsContact O-CB 3.27Å; F106-Q110 WeakPolarHBondContact O-CB 3.33Å; F106-Q110 PolarHBondContact O-N 3.42Å; Q110-I112 VanDerWaalsContact C-N 3.33Å; Q110-I112 PolarHBondContact O-N 2.71Å
111S51.7Low62Low55 Ų55122.3 Ų122.339%0.38565%0.652SS.*  trans-68.393.4165.965.50000110A107 R108 F113A107-S111 WeakPolarHBondContact O-CB 3.27Å; A107-S111 PolarHBondContact O-N 3.14Å; R108-S111 PolarHBondContact O-OG 3.16Å; S111-F113 PolarHBondContact O-N 3.29Å
112I53.2Low59.5Low171 Ų171126.5 Ų126.588%0.87767%0.67SS**  -39.989.6127.3-63.7162.7000107.1Q110Q110-I112 VanDerWaalsContact C-N 3.33Å; Q110-I112 PolarHBondContact O-N 2.71Å
113F50.1Low57.3Low162 Ų162129.3 Ų129.371%0.71168%0.676SS**  trans-10.1150.8-176.6-79.1-82.8000121.8S111S111-F113 PolarHBondContact O-N 3.29Å
114P50.7Low55.1Low85 Ų85130.1 Ų130.155%0.55269%0.691SS**  -144.7158.156.937.4-16.4000118.6F116P114-F116 HydrophobicContact CG-CE2 4.49Å; P114-F116 HydrophobicContact CG-CZ 4.35Å; P114-F116 PolarHBondContact O-N 2.96Å
115D49.1Very low53.2Low122 Ų122134.6 Ų134.665%0.65270%0.703SS**  trans-63.5115.2162-73.9-59.7000110.6S117D115-S117 PolarHBondContact O-N 3.37Å; D115-S117 VanDerWaalsContact O-N 3.16Å
116F50.9Low51.4Low193 Ų193136.8 Ų136.885%0.84672%0.719SS**  trans-78.519174.2-72.3-79.9000113.9P114 K118P114-F116 HydrophobicContact CG-CE2 4.49Å; P114-F116 HydrophobicContact CG-CZ 4.35Å; P114-F116 PolarHBondContact O-N 2.96Å; F116-K118 VanDerWaalsContact C-N 3.32Å; F116-K118 PolarHBondContact O-N 2.95Å
117S51.7Low49.8Very low109 Ų109137.6 Ų137.676%0.76274%0.735SS**  trans-90.618.5-179.461.50000114.4D115D115-S117 PolarHBondContact O-N 3.37Å; D115-S117 VanDerWaalsContact O-N 3.16Å
118K40.7Very low48.3Very low195 Ų195141 Ų14185%0.84875%0.749SS**SBendtrans-121.9110.8169.4-141.4172.1-174.1-179.10110.8F116 G120F116-K118 VanDerWaalsContact C-N 3.32Å; F116-K118 PolarHBondContact O-N 2.95Å; K118-G120 PolarHBondContact O-N 3.31Å
119A47.6Very low47.2Very low110 Ų110139 Ų13991%0.90976%0.757SS**  trans-48.8117.7169.800000110.2
120G44Very low46.1Very low68 Ų68137 Ų13770%0.70176%0.756SS**  trans174.883.2-177.700000110.3K118 E122K118-G120 PolarHBondContact O-N 3.31Å; G120-E122 PolarHBondContact O-N 3.04Å; G120-E122 VanDerWaalsContact O-N 3.14Å
121M49.3Very low45.5Very low178 Ų178136.6 Ų136.688%0.87776%0.764SS**  trans-63.5105.8178.1-52.8144.665.200109.2
122E40.5Very low44.5Very low194 Ų194141.5 Ų141.591%0.90779%0.786SS**  trans-133.2111153-74.1-145.8162.600110.4G120 A124G120-E122 PolarHBondContact O-N 3.04Å; G120-E122 VanDerWaalsContact O-N 3.14Å; E122-A124 PolarHBondContact O-N 2.84Å
123R43.3Very low43.7Very low198 Ų198142.4 Ų142.475%0.74778%0.783SS**  trans-70.8118176-64.8178.5174.8131.2-7.2107.7F125R123-F125 HydrophobicContact CB-CD2 3.65Å; R123-F125 HydrophobicContact CB-CE2 3.56Å; R123-F125 HydrophobicContact CB-CZ 4.33Å; R123-F125 HydrophobicContact CG-CE2 4.04Å; R123-F125 PolarHBondContact O-N 2.73Å
124A42.5Very low42.9Very low102 Ų102143.6 Ų143.684%0.84379%0.791SS**  trans-69.684.8163.300000108.9E122E122-A124 PolarHBondContact O-N 2.84Å
125F45.4Very low42.1Very low163 Ų163147.3 Ų147.372%0.71581%0.805SS**  trans-85113.1160.9-71.7-70.7000108R123R123-F125 HydrophobicContact CB-CD2 3.65Å; R123-F125 HydrophobicContact CB-CE2 3.56Å; R123-F125 HydrophobicContact CB-CZ 4.33Å; R123-F125 HydrophobicContact CG-CE2 4.04Å; R123-F125 PolarHBondContact O-N 2.73Å
126L42.8Very low41.2Very low153 Ų153144.8 Ų144.880%0.80181%0.808SS**  trans-58.2129.9169.3-61.6169.9000109.3V128L126-V128 PolarHBondContact O-N 3.24Å; L126-V128 VanDerWaalsContact O-N 3.16Å
127P40.8Very low40.1Very low121 Ų121143.6 Ų143.679%0.78681%0.81SS**  trans-80.798.316630.7-26.3000107.9T129P127-T129 PolarHBondContact O-N 2.9Å
128V36Very low39.1Very low129 Ų129143.8 Ų143.878%0.78281%0.806SS**  trans-73104.2158.9175.60000106.3L126 S130L126-V128 PolarHBondContact O-N 3.24Å; L126-V128 VanDerWaalsContact O-N 3.16Å; V128-S130 PolarHBondContact O-N 2.92Å; V128-S130 VanDerWaalsContact O-N 3.14Å
129T41.4Very low38.7Very low136 Ų136139.8 Ų139.883%0.83480%0.798SS**  trans-68106.117133.80000109.3P127P127-T129 PolarHBondContact O-N 2.9Å
130S39.6Very low38.3Very low103 Ų103140.3 Ų140.372%0.7279%0.792SS**  trans-102.9128.1167.6173.20000108.8V128V128-S130 PolarHBondContact O-N 2.92Å; V128-S130 VanDerWaalsContact O-N 3.14Å
131P44.6Very low37.8Very low121 Ų121145.7 Ų145.779%0.78680%0.799SS**  trans-90.7120179.533.4-26.8000109.7
132N30.8Very low37.3Very low158 Ų158145.9 Ų145.985%0.84580%0.795SS**  trans-148.6132.5153.8-149.7-32.5000112.4
133K35.7Very low37Very low190 Ų190143.4 Ų143.483%0.82679%0.793SS**  trans-79.7136.4-176-59.1179.5176.2-176.50109.3
134H32.5Very low36.7Very low187 Ų187141.7 Ų141.787%0.86679%0.793SS**  trans-151.2110.9142-146.1-87.7000112.6
135L35.1Very low36.3Very low164 Ų164143.9 Ų143.986%0.85979%0.79SS**  trans-9.9139.4153-133.572000119.6
136G30.6Very low35.8Very low69 Ų69146 Ų14671%0.71182%0.816SS**  trans149.578.7157.400000112.4
137L28Very low35.5Very low168 Ų168145.6 Ų145.688%0.8882%0.816SS**  49.1112.7104.1-153.478.5000112
138V29.4Very low35.2Very low113 Ų113146.9 Ų146.969%0.68582%0.818SS**  -175.9125.487.21580000110.1
139T33Very low35.2Very low111 Ų111147.9 Ų147.968%0.68182%0.82SS**  trans35.4136.2154.857.30000124
140P38.5Very low34.8Very low121 Ų121148.6 Ų148.679%0.78682%0.819SS**  trans-95132157.335.1-24.7000111.1
141H33.9Very low34.5Very low181 Ų181151.4 Ų151.484%0.83883%0.825SS**  trans-128.6110.4159-92.4-78.5000111
142K39Very low33.8Very low182 Ų182153.5 Ų153.579%0.79183%0.828SS**  trans-23.3138.7150.8174.8175.5178.7169.80114.3
143T35Very low34.1Very low141 Ų141153.1 Ų153.187%0.86583%0.827SS**  trans-163.5121.2134.9-65.50000109.6
144E35.2Very low33.9Very low162 Ų162150.3 Ų150.376%0.75783%0.827SS**  trans-82.6161.4161.7-99-175114.500110.3
145L35.3Very low34Very low149 Ų149147.3 Ų147.378%0.7882%0.823SS**  trans88.2110.8150.3-113.2150.3000118.9
146V35.6Very low34Very low206 Ų206145.7 Ų145.7100%1.24882%0.82SS**  -139.90120.9164.40000107.7

Retrieved 146 of 146 residues in 82.4 ms (Link to these results)