A0A087XA54_POEFO Loading...

ER membrane protein complex subunit 4

AlphaFold DB , UniProt , Accession A0A087XA54, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 189 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
1M45.8Very low36.4Very low250 Ų250117.5 Ų117.5100%1.23287%0.873SS**  01440-79.3169.6165.900108.2
2A37.7Very low36.2Very low101 Ų101122 Ų12284%0.83588%0.875SS**  trans-50.3131.5-159.600000118.5
3S38.9Very low36.4Very low111 Ų111119.9 Ų119.978%0.77686%0.858SS**  5.4169.9120.5-124.90000119.9
4P49.2Very low36.3Very low119 Ų119121.7 Ų121.777%0.77386%0.861SS**  -139176.7-60.638.4-19.3000113.8
5G32.6Very low36.5Very low82 Ų82130.3 Ų130.385%0.84587%0.866SS**  trans86.7145.1130.800000123.1
6G32.7Very low36.1Very low76 Ų76127 Ų12778%0.78486%0.862SS**  trans93100.9149.700000116.4
7Q33.2Very low36.2Very low202 Ų202124.4 Ų124.494%0.94486%0.862SS**  72.9109.669-158.6169.410800114.9
8G33.6Very low36.2Very low82 Ų82124 Ų12485%0.84586%0.859SS**  trans78.2149.7144.300000119
9G28Very low36.7Very low81 Ų81121.6 Ų121.684%0.83586%0.856SS**  trans127.4105154.800000114.7
10G34.7Very low37.6Very low83 Ų83120.3 Ų120.386%0.85685%0.853SS**  trans-65.3159.6163.800000112.1
11A34.2Very low38.7Very low106 Ų106125 Ų12588%0.87685%0.852SS**  trans-136.7103.8163.600000108.9
12L33.8Very low39.4Very low171 Ų171124.7 Ų124.790%0.89584%0.837SS**  trans-73.6138.8164.3-170.678.1000108.8
13S39.4Very low40.6Very low95 Ų95126.4 Ų126.466%0.66483%0.829SS**  trans57.7126.2151.7-165.30000119.1
14T34.1Very low41.7Very low145 Ų145129.3 Ų129.389%0.8983%0.828SS**  -150.5127108.244.90000111
15R39Very low42.7Very low251 Ų251134 Ų13495%0.94783%0.831SS**  trans-84.4139.5171.1179.7-176.3-178.2-164.61.7108.8
16G30.5Very low44.2Very low77 Ų77134.1 Ų134.179%0.79482%0.823SS**  trans138.298.3168.800000109.6
17G38.8Very low45.8Very low83 Ų83138 Ų13886%0.85683%0.825SS**  120.286.163.800000107.5
18S35.9Very low47.2Very low117 Ų117134.6 Ų134.682%0.81881%0.809SS**  trans-143.3115.3158.748.10000106.8A20S18-A20 PolarHBondContact O-N 2.95Å
19G45.5Very low48.4Very low78 Ų78138.9 Ų138.980%0.80481%0.812SS**  trans-58.1112.2-174.200000110.4R21G19-R21 PolarHBondContact O-N 3.03Å
20A55.2Low49.3Very low96 Ų96138.4 Ų138.479%0.79380%0.795SS**  trans-57.5108.9167.500000107.3S18 R22S18-A20 PolarHBondContact O-N 2.95Å; A20-R22 PolarHBondContact O-N 2.91Å
21R60.5Low50.2Low219 Ų219141.7 Ų141.783%0.82680%0.799SS**  trans-56.8108175.4-77.5-170.9-89-165.1-4.9107.2G19 M23G19-R21 PolarHBondContact O-N 3.03Å; R21-M23 VanDerWaalsContact C-N 3.28Å; R21-M23 HydrophobicContact CB-SD 4.47Å; R21-M23 PolarHBondContact O-N 3.01Å
22R59.8Low51.1Low243 Ų243139.2 Ų139.292%0.91778%0.783SS**  trans-6193.8170.9-104-177.2166.3-165.2-3.4107.3A20 K24A20-R22 PolarHBondContact O-N 2.91Å; R22-K24 PolarHBondContact O-N 2.83Å
23M63.7Low52Low137 Ų137139 Ų13968%0.67578%0.783SS**  trans-68.5101.1174.1-61.9-59.9-144.200107.2R21 W25 A26R21-M23 VanDerWaalsContact C-N 3.28Å; R21-M23 HydrophobicContact CB-SD 4.47Å; R21-M23 PolarHBondContact O-N 3.01Å; M23-W25 PolarHBondContact O-N 2.95Å; M23-A26 HydrophobicContact CB-CB 4.03Å; M23-A26 PolarHBondContact O-N 3.01Å
24K61.6Low52.5Low173 Ų173138.6 Ų138.675%0.75279%0.786SS**THydrogen-bonded Turntrans-60.8-13.9-177.1-74.3178.475.8-109.50113.5R22R22-K24 PolarHBondContact O-N 2.83Å
25W69.1Low53.1Low218 Ų218141.9 Ų141.983%0.82678%0.782SS**THydrogen-bonded Turntrans-133.227.6-173.3-56.9117.6000113.3M23 L27M23-W25 PolarHBondContact O-N 2.95Å; W25-L27 PolarHBondContact O-N 3.4Å
26A64.5Low53.3Low83 Ų83135.1 Ų135.169%0.68677%0.773SS**  trans-63.4106.2171.800000109.1M23M23-A26 HydrophobicContact CB-CB 4.03Å; M23-A26 PolarHBondContact O-N 3.01Å
27L66.6Low54Low159 Ų159143.4 Ų143.483%0.83278%0.78SS**  trans-81.4118.7175.5-78.1159.4000108.6W25W25-L27 PolarHBondContact O-N 3.4Å
28E62Low54.4Low130 Ų130142.4 Ų142.461%0.60777%0.769SS**  trans-100.9103172-150.7-102.3160.600107.4S30 R35E28-S30 PolarHBondContact O-N 3.23Å; E28-S30 WeakPolarHBondContact OE1-CB 3.19Å; E28-S30 WeakPolarHBondContact OE2-CB 3.37Å; E28-R35 IonicContact OE2-NH2 3.32Å; E28-R35 PolarHBondContact OE2-NH2 3.26Å
29L60.6Low54.8Low172 Ų172144.5 Ų144.590%0.90177%0.772SS**  trans-87.758.7176.7-80.2146.2000109.4V31L29-V31 PolarHBondContact O-N 3.38Å
30S45.3Very low54.9Low70 Ų70151.6 Ų151.649%0.4977%0.774SS.*  trans-89.799.3171.5-173.30000110.5E28 G32E28-S30 PolarHBondContact O-N 3.23Å; E28-S30 WeakPolarHBondContact OE1-CB 3.19Å; E28-S30 WeakPolarHBondContact OE2-CB 3.37Å; S30-G32 PolarHBondContact O-N 3.32Å
31V54.8Low54.4Low152 Ų152156.4 Ų156.492%0.92178%0.78SS**  trans-65.8101.1151.3166.90000106.4L29L29-V31 PolarHBondContact O-N 3.38Å
32G52.3Low53.5Low54 Ų54149.3 Ų149.356%0.55778%0.775SS**SBendtrans133.296.5165.100000116.1S30S30-G32 PolarHBondContact O-N 3.32Å
33N52.5Low52.7Low167 Ų167141.3 Ų141.389%0.89377%0.768SS**  trans82.6132.3140.8-143.939.3000120
34A49.8Very low51.6Low86 Ų86145.1 Ų145.171%0.71178%0.784SS**  trans66.364.1156.400000118.2
35R47.2Very low50.9Low215 Ų215139.4 Ų139.481%0.81178%0.775SS**  trans-86.5112.1150.5-69.8-170.6-174.1171.95.8109.4E28E28-R35 IonicContact OE2-NH2 3.32Å; E28-R35 PolarHBondContact OE2-NH2 3.26Å
36S42.6Very low50.2Low108 Ų108136.6 Ų136.676%0.75578%0.776SS**  trans-35.9131.7177.6-1610000113.7G38S36-G38 PolarHBondContact O-N 3.12Å
37R46.2Very low50Low252 Ų252137.7 Ų137.795%0.95177%0.774SS**THydrogen-bonded Turntrans-67.833.2174.4-164.2-175.4179.8175.70.6112.5
38G46.8Very low49.8Very low61 Ų61136.1 Ų136.163%0.62977%0.77SS**THydrogen-bonded Turntrans-112-13.4-171.900000115.1S36S36-G38 PolarHBondContact O-N 3.12Å
39D45Very low49.9Very low162 Ų162136.8 Ų136.887%0.86677%0.768SS**SBendtrans-105.921.2-173.5-150.936.6000113.5
40R47.9Very low50.4Low226 Ų226133.1 Ų133.185%0.85376%0.755SS**SBendtrans-101.718178.5-84.2-173.8174.2176-4.6113.7
41Q44.7Very low51.5Low198 Ų198138.5 Ų138.593%0.92578%0.776SS**  trans-129.554.2-179.2-15615651.900111.6
42G41.6Very low51.9Low69 Ų69135.1 Ų135.171%0.71177%0.772SS**SBendtrans-130.8110.116600000109.3
43G41.8Very low52.4Low75 Ų75139 Ų13977%0.77377%0.771SS**  trans56.893.6159.200000116.6G45G43-G45 PolarHBondContact O-N 2.79Å
44Q41.9Very low53.3Low217 Ų217134.2 Ų134.2100%1.01475%0.751SS**  trans-65.276.5160.7-167.5-177.620.500109.2
45G45.6Very low53.7Low54 Ų54137 Ų13756%0.55775%0.749SS**  trans-124.2106.5176.400000109.4G43 V47G43-G45 PolarHBondContact O-N 2.79Å; G45-V47 PolarHBondContact O-N 2.88Å
46D54.8Low54.7Low159 Ų159134.4 Ų134.485%0.8574%0.744SS**  trans20.963.7162-71-51.9000117.8V48D46-V48 VanDerWaalsContact C-N 3.3Å; D46-V48 PolarHBondContact O-N 3.43Å; D46-V48 VanDerWaalsContact O-N 3.12Å
47V61.1Low55.3Low106 Ų106135.3 Ų135.364%0.64275%0.747SS**  trans-77.694.8153.9178.80000106.1G45 Y49G45-V47 PolarHBondContact O-N 2.88Å; V47-Y49 VanDerWaalsContact C-N 3.29Å; V47-Y49 VanDerWaalsContact O-CD2 3.24Å; V47-Y49 WeakPolarHBondContact O-CD2 3.45Å; V47-Y49 WeakPolarHBondContact O-CE2 3.24Å; V47-Y49 PolarHBondContact O-N 2.97Å
48V62.8Low55.8Low125 Ų125127.8 Ų127.876%0.75873%0.729SS**  trans-61.396.8169178.10000106.9D46D46-V48 VanDerWaalsContact C-N 3.3Å; D46-V48 PolarHBondContact O-N 3.43Å; D46-V48 VanDerWaalsContact O-N 3.12Å
49Y63.4Low56.3Low145 Ų145129.5 Ų129.557%0.56973%0.729SS**PPolyproline II helixtrans-56.4135.7168.4-60-84.1000108.2V47 I51 Y53V47-Y49 VanDerWaalsContact C-N 3.29Å; V47-Y49 VanDerWaalsContact O-CD2 3.24Å; V47-Y49 WeakPolarHBondContact O-CD2 3.45Å; V47-Y49 WeakPolarHBondContact O-CE2 3.24Å; V47-Y49 PolarHBondContact O-N 2.97Å; Y49-I51 PolarHBondContact O-N 3.09Å; Y49-Y53 AromaticContact CD1-CD1 3.68Å; Y49-Y53 HydrophobicContact CD1-CD1 3.68Å; Y49-Y53 HydrophobicContact CD1-CE1 4.14Å; Y49-Y53 HydrophobicContact CE1-CD1 4.39Å; Y49-Y53 HydrophobicContact CE1-CE1 4.46Å; Y49-Y53 HydrophobicContact CG-CD1 4.48Å
50P71.4Confident56.6Low94 Ų94127.3 Ų127.361%0.6172%0.717SS**PPolyproline II helixtrans-58.8140.3174.524.6-31.1000109G52 Y53P50-G52 PolarHBondContact O-N 2.82Å; P50-G52 VanDerWaalsContact O-N 3.09Å; P50-Y53 WeakPolarHBondContact O-CB 3.49Å; P50-Y53 PolarHBondContact O-N 3Å
51I67Low57.1Low183 Ų183120.3 Ų120.394%0.93870%0.7SS**THydrogen-bonded Turntrans-53.1119.7-178.5-175.9156.5000110.1Y49Y49-I51 PolarHBondContact O-N 3.09Å
52G63.8Low57.6Low82 Ų82114.1 Ų114.185%0.84568%0.678SS**THydrogen-bonded Turntrans102.1-1.4-176.600000116.4P50P50-G52 PolarHBondContact O-N 2.82Å; P50-G52 VanDerWaalsContact O-N 3.09Å
53Y62.7Low58.3Low135 Ų135115.1 Ų115.153%0.52967%0.666SS.*  trans-81.7118.2173.7-170.4-100.3000111.9Y49 P50 E55Y49-Y53 AromaticContact CD1-CD1 3.68Å; Y49-Y53 HydrophobicContact CD1-CD1 3.68Å; Y49-Y53 HydrophobicContact CD1-CE1 4.14Å; Y49-Y53 HydrophobicContact CE1-CD1 4.39Å; Y49-Y53 HydrophobicContact CE1-CE1 4.46Å; Y49-Y53 HydrophobicContact CG-CD1 4.48Å; P50-Y53 WeakPolarHBondContact O-CB 3.49Å; P50-Y53 PolarHBondContact O-N 3Å; Y53-E55 HydrophobicContact CD1-CG 4.49Å; Y53-E55 HydrophobicContact CE1-CG 3.57Å
54S70.9Confident59Low67 Ų67116.7 Ų116.747%0.46965%0.654SS.*  trans-130.9120.1171.3166.50000108.7K56S54-K56 PolarHBondContact O-N 3.45Å; S54-K56 PolarHBondContact OG-N 3.36Å; S54-K56 PolarHBondContact OG-O 2.86Å
55E59.7Low59.8Low143 Ų143112.1 Ų112.167%0.66863%0.632SS**SBendtrans-70.1-9.6175.4-68.1-170.4152.800113.2Y53Y53-E55 HydrophobicContact CD1-CG 4.49Å; Y53-E55 HydrophobicContact CE1-CG 3.57Å
56K66.6Low60.6Low161 Ų161113 Ų11370%0.763%0.627SS**SBendtrans-79.1131.2174.3-61.8176.7-178.2172.30108.2S54 V58S54-K56 PolarHBondContact O-N 3.45Å; S54-K56 PolarHBondContact OG-N 3.36Å; S54-K56 PolarHBondContact OG-O 2.86Å; K56-V58 PolarHBondContact O-N 3.25Å
57P54.9Low61.3Low127 Ų127109.4 Ų109.483%0.82561%0.608SS**  trans-55.1108.5166.522.5-29.8000106.9P59P57-P59 WeakPolarHBondContact O-CD 3.38Å
58V57.1Low61.7Low95 Ų95110.6 Ų110.658%0.57660%0.604SS**  trans-66.9119.9178.4-149.50000104.5K56 D60K56-V58 PolarHBondContact O-N 3.25Å; V58-D60 PolarHBondContact O-N 3.37Å
59P58.2Low62.1Low97 Ų97109 Ų10963%0.6359%0.592SS**  trans-55.6128.3166.923.2-29.9000106.3P57 T61P57-P59 WeakPolarHBondContact O-CD 3.38Å; P59-T61 VanDerWaalsContact C-N 3.28Å; P59-T61 PolarHBondContact O-N 2.69Å
60D50.9Low62.5Low115 Ų115107.2 Ų107.262%0.61559%0.591SS**  trans-56.989.2-175.9-72.8-51.5000110.5V58 S62 I63 Q64V58-D60 PolarHBondContact O-N 3.37Å; D60-S62 PolarHBondContact O-N 3.19Å; D60-I63 HydrophobicContact CB-CB 4.06Å; D60-I63 HydrophobicContact CB-CG1 3.61Å; D60-I63 PolarHBondContact O-N 2.91Å; D60-Q64 PolarHBondContact O-N 3.46Å
61T58.7Low62.7Low80 Ų80105.2 Ų105.249%0.49158%0.577SS.*Hα-helixtrans-67.5-25.1176.743.60000110.7P59 Q64 E65P59-T61 VanDerWaalsContact C-N 3.28Å; P59-T61 PolarHBondContact O-N 2.69Å; T61-Q64 PolarHBondContact O-N 2.89Å; T61-E65 WeakPolarHBondContact O-CB 3.49Å; T61-E65 PolarHBondContact O-N 3.25Å
62S55.6Low63.2Low67 Ų6799.6 Ų99.647%0.46955%0.547SS..Hα-helixtrans-60.2-42.3171.556.30000112D60 E65 T66D60-S62 PolarHBondContact O-N 3.19Å; S62-E65 PolarHBondContact O-N 2.89Å; S62-T66 WeakPolarHBondContact O-CG2 3.48Å; S62-T66 PolarHBondContact O-N 3.38Å; S62-T66 PolarHBondContact O-OG1 2.77Å; S62-T66 VanDerWaalsContact O-OG1 3.08Å
63I55Low63.8Low90 Ų90102.5 Ų102.546%0.46254%0.536SS..Hα-helixtrans-64.1-46.3176.9-63.1-73.4000109.7D60 E65 T66 D67D60-I63 HydrophobicContact CB-CB 4.06Å; D60-I63 HydrophobicContact CB-CG1 3.61Å; D60-I63 PolarHBondContact O-N 2.91Å; I63-E65 PolarHBondContact O-N 3.32Å; I63-T66 WeakPolarHBondContact CA-OG1 3.35Å; I63-T66 PolarHBondContact O-N 2.87Å; I63-T66 PolarHBondContact O-OG1 3.32Å; I63-D67 WeakPolarHBondContact O-CB 3.36Å; I63-D67 VanDerWaalsContact O-CG 3.29Å; I63-D67 PolarHBondContact O-N 3.33Å
64Q57.6Low64.6Low109 Ų109104.6 Ų104.651%0.50954%0.543SS..Hα-helixtrans-64.1-36.7177.4-70.9-170.6-2.100113.3D60 T61 K68D60-Q64 PolarHBondContact O-N 3.46Å; T61-Q64 PolarHBondContact O-N 2.89Å; Q64-K68 WeakPolarHBondContact O-CG 3.37Å; Q64-K68 PolarHBondContact O-N 3.22Å
65E59Low64.8Low120 Ų120101.6 Ų101.656%0.56152%0.522SS*.Hα-helixtrans-70-40.5174.8-80.5-179.8173.400111.7T61 S62 I63 D67 K68 N69T61-E65 WeakPolarHBondContact O-CB 3.49Å; T61-E65 PolarHBondContact O-N 3.25Å; S62-E65 PolarHBondContact O-N 2.89Å; I63-E65 PolarHBondContact O-N 3.32Å; E65-D67 VanDerWaalsContact C-N 3.31Å; E65-D67 PolarHBondContact O-N 3.44Å; E65-K68 PolarHBondContact O-N 3Å; E65-N69 PolarHBondContact O-N 3.41Å; E65-N69 PolarHBondContact O-ND2 3.48Å
66T62.3Low65.8Low73 Ų7398.2 Ų98.245%0.44850%0.503SS..Hα-helixtrans-62-41173.5510000111.6S62 I63 N69 L70S62-T66 WeakPolarHBondContact O-CG2 3.48Å; S62-T66 PolarHBondContact O-N 3.38Å; S62-T66 PolarHBondContact O-OG1 2.77Å; S62-T66 VanDerWaalsContact O-OG1 3.08Å; I63-T66 WeakPolarHBondContact CA-OG1 3.35Å; I63-T66 PolarHBondContact O-N 2.87Å; I63-T66 PolarHBondContact O-OG1 3.32Å; T66-N69 PolarHBondContact O-N 2.75Å; T66-L70 WeakPolarHBondContact O-CB 3.42Å; T66-L70 VanDerWaalsContact O-CD1 3.29Å; T66-L70 WeakPolarHBondContact O-CD1 3.23Å; T66-L70 VanDerWaalsContact O-CG 3.23Å; T66-L70 WeakPolarHBondContact O-CG 3.29Å; T66-L70 PolarHBondContact O-N 3.08Å
67D67.7Low66.5Low84 Ų8495 Ų9545%0.44949%0.494SS..Hα-helixtrans-63.1-42.3176.3-73.3-30000111.9I63 E65 L70 V71I63-D67 WeakPolarHBondContact O-CB 3.36Å; I63-D67 VanDerWaalsContact O-CG 3.29Å; I63-D67 PolarHBondContact O-N 3.33Å; E65-D67 VanDerWaalsContact C-N 3.31Å; E65-D67 PolarHBondContact O-N 3.44Å; D67-L70 PolarHBondContact O-N 3.12Å; D67-V71 VanDerWaalsContact O-CG2 3.26Å; D67-V71 WeakPolarHBondContact O-CG2 3.47Å; D67-V71 PolarHBondContact O-N 2.89Å
68K69.9Low67.6Low131 Ų13191.5 Ų91.557%0.5747%0.47SS*.Hα-helixtrans-61.8-44.8175.1-72.5167.7-172.3175.40112.1Q64 E65 L70 V71 E72Q64-K68 WeakPolarHBondContact O-CG 3.37Å; Q64-K68 PolarHBondContact O-N 3.22Å; E65-K68 PolarHBondContact O-N 3Å; K68-L70 VanDerWaalsContact C-N 3.32Å; K68-L70 PolarHBondContact O-N 2.95Å; K68-V71 PolarHBondContact O-N 3.05Å; K68-E72 WeakPolarHBondContact O-CB 3.21Å; K68-E72 PolarHBondContact O-N 3.46Å
69N71.1Confident68.6Low92 Ų9287.1 Ų87.149%0.49244%0.443SS..Hα-helixtrans-64.5-36.2176.7-79.7-80.9000112.1E65 T66 K73E65-N69 PolarHBondContact O-N 3.41Å; E65-N69 PolarHBondContact O-ND2 3.48Å; T66-N69 PolarHBondContact O-N 2.75Å; N69-K73 WeakPolarHBondContact O-CG 3.26Å; N69-K73 PolarHBondContact O-N 3.27Å; N69-K73 VanDerWaalsContact O-N 3.12Å
70L73.4Confident69.6Low107 Ų10785 Ų8556%0.5643%0.426SS*.Hα-helixtrans-68.3-42.3175.5-75.3157.1000111.8T66 D67 K68 K73 R74T66-L70 WeakPolarHBondContact O-CB 3.42Å; T66-L70 VanDerWaalsContact O-CD1 3.29Å; T66-L70 WeakPolarHBondContact O-CD1 3.23Å; T66-L70 VanDerWaalsContact O-CG 3.23Å; T66-L70 WeakPolarHBondContact O-CG 3.29Å; T66-L70 PolarHBondContact O-N 3.08Å; D67-L70 PolarHBondContact O-N 3.12Å; K68-L70 VanDerWaalsContact C-N 3.32Å; K68-L70 PolarHBondContact O-N 2.95Å; L70-K73 PolarHBondContact O-N 3.03Å; L70-R74 WeakPolarHBondContact O-CB 3.47Å; L70-R74 PolarHBondContact O-N 3.35Å
71V74.6Confident71.1Confident52 Ų5281 Ų8132%0.31541%0.412SS..Hα-helixtrans-63.4-42175.51710000110.9D67 K68 R74 C75D67-V71 VanDerWaalsContact O-CG2 3.26Å; D67-V71 WeakPolarHBondContact O-CG2 3.47Å; D67-V71 PolarHBondContact O-N 2.89Å; K68-V71 PolarHBondContact O-N 3.05Å; V71-R74 PolarHBondContact O-N 3.14Å; V71-C75 PolarHBondContact O-N 2.94Å; V71-C75 PolarHBondContact O-SG 2.93Å
72E77.3Confident72.1Confident64 Ų6478.1 Ų78.130%0.29940%0.395SS..Hα-helixtrans-63.8-45.3178.1-178.2169.7-175.200112.3K68 R74 C75 W76K68-E72 WeakPolarHBondContact O-CB 3.21Å; K68-E72 PolarHBondContact O-N 3.46Å; E72-R74 VanDerWaalsContact C-N 3.3Å; E72-R74 PolarHBondContact O-N 3.42Å; E72-C75 PolarHBondContact O-N 3.02Å; E72-W76 PolarHBondContact O-N 3.4Å
73K76.9Confident73.2Confident144 Ų14478.6 Ų78.663%0.62639%0.392SS*.Hα-helixtrans-58.5-43.6174.1-74.2175.3-179.4178.10111.7N69 L70 W76 D77N69-K73 WeakPolarHBondContact O-CG 3.26Å; N69-K73 PolarHBondContact O-N 3.27Å; N69-K73 VanDerWaalsContact O-N 3.12Å; L70-K73 PolarHBondContact O-N 3.03Å; K73-W76 PolarHBondContact O-N 3.33Å; K73-D77 PolarHBondContact O-N 3.3Å
74R78.2Confident74.4Confident179 Ų17980.1 Ų80.168%0.67540%0.395SS*.Hα-helixtrans-63.1-42.2176.9-173176.5-175.6174.71.4111.9L70 V71 E72 D77 V78L70-R74 WeakPolarHBondContact O-CB 3.47Å; L70-R74 PolarHBondContact O-N 3.35Å; V71-R74 PolarHBondContact O-N 3.14Å; E72-R74 VanDerWaalsContact C-N 3.3Å; E72-R74 PolarHBondContact O-N 3.42Å; R74-D77 PolarHBondContact O-N 3.21Å; R74-V78 VanDerWaalsContact O-CG2 3.32Å; R74-V78 WeakPolarHBondContact O-CG2 3.27Å; R74-V78 PolarHBondContact O-N 2.9Å
75C76.7Confident75.4Confident3 Ų379.5 Ų79.52%0.0239%0.392CS..Hα-helixtrans-65.7-39.1177.3-670000111.7V71 E72 V78 A79 L129 Q138V71-C75 PolarHBondContact O-N 2.94Å; V71-C75 PolarHBondContact O-SG 2.93Å; E72-C75 PolarHBondContact O-N 3.02Å; C75-V78 PolarHBondContact O-N 3.29Å; C75-A79 WeakPolarHBondContact O-CB 3.48Å; C75-A79 PolarHBondContact O-N 2.95Å; C75-L129 HydrophobicContact CB-CG 4.33Å; C75-Q138 VanDerWaalsContact CB-OE1 3.23Å
76W80.2Confident76.4Confident73 Ų7374.9 Ų74.928%0.27737%0.371SS..Hα-helixtrans-62.1-40.7172.4-90.1108.4000112.6E72 K73 A79 L80 L137 Q138E72-W76 PolarHBondContact O-N 3.4Å; K73-W76 PolarHBondContact O-N 3.33Å; W76-A79 PolarHBondContact O-N 2.9Å; W76-L80 HydrophobicContact CE3-CD1 4.14Å; W76-L80 HydrophobicContact CE3-CG 4.24Å; W76-L80 VanDerWaalsContact O-CB 3.32Å; W76-L80 WeakPolarHBondContact O-CB 3.32Å; W76-L80 VanDerWaalsContact O-CG 3.27Å; W76-L80 WeakPolarHBondContact O-CG 3.33Å; W76-L80 PolarHBondContact O-N 2.85Å; W76-L137 HydrophobicContact CH2-CD2 4.24Å; W76-L137 HydrophobicContact CZ2-CD2 4.5Å; W76-Q138 VanDerWaalsContact CD1-NE2 3.27Å; W76-Q138 HydrophobicContact CD2-CG 4.29Å; W76-Q138 HydrophobicContact CZ2-CG 4.47Å
77D81.9Confident77.3Confident93 Ų9375.2 Ų75.250%0.49738%0.375SS..Hα-helixtrans-65.6-38.5175.1-87.8-36.1000112.9K73 R74 G81 K84K73-D77 PolarHBondContact O-N 3.3Å; R74-D77 PolarHBondContact O-N 3.21Å; D77-G81 PolarHBondContact O-N 2.87Å; D77-K84 IonicContact OD1-NZ 2.94Å; D77-K84 PolarHBondContact OD1-NZ 3.1Å
78V77.6Confident77.9Confident54 Ų5476.1 Ų76.133%0.32738%0.378SS..Hα-helixtrans-66-44.8174.7172.50000110.9R74 C75 L80 G81 T125R74-V78 VanDerWaalsContact O-CG2 3.32Å; R74-V78 WeakPolarHBondContact O-CG2 3.27Å; R74-V78 PolarHBondContact O-N 2.9Å; C75-V78 PolarHBondContact O-N 3.29Å; V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 2.99Å; V78-G81 PolarHBondContact O-N 3.4Å; V78-T125 HydrophobicContact CG1-CG2 4.03Å
79A77Confident78.1Confident2 Ų270.6 Ų70.62%0.01735%0.354CS..Hα-helixtrans-64.1-38.117900000112.5C75 W76 G81 Q138C75-A79 WeakPolarHBondContact O-CB 3.48Å; C75-A79 PolarHBondContact O-N 2.95Å; W76-A79 PolarHBondContact O-N 2.9Å; A79-G81 VanDerWaalsContact C-N 3.34Å; A79-Q138 HydrophobicContact CB-CB 4.04Å; A79-Q138 HydrophobicContact CB-CG 4.48Å; A79-Q138 WeakPolarHBondContact CB-O 3.32Å
80L80.5Confident78.3Confident52 Ų5270.1 Ų70.127%0.27235%0.351SS..Hα-helixtrans-82.5-9.2177.6-67.9170.8000113.7W76 V78 L83 K84 V141W76-L80 HydrophobicContact CE3-CD1 4.14Å; W76-L80 HydrophobicContact CE3-CG 4.24Å; W76-L80 VanDerWaalsContact O-CB 3.32Å; W76-L80 WeakPolarHBondContact O-CB 3.32Å; W76-L80 VanDerWaalsContact O-CG 3.27Å; W76-L80 WeakPolarHBondContact O-CG 3.33Å; W76-L80 PolarHBondContact O-N 2.85Å; V78-L80 VanDerWaalsContact C-N 3.34Å; V78-L80 PolarHBondContact O-N 2.99Å; L80-L83 HydrophobicContact CD2-CD2 4.16Å; L80-L83 WeakPolarHBondContact O-CB 3.29Å; L80-L83 PolarHBondContact O-N 3.3Å; L80-L83 VanDerWaalsContact O-N 3.16Å; L80-K84 WeakPolarHBondContact O-CG 3.44Å; L80-K84 PolarHBondContact O-N 3.47Å; L80-V141 HydrophobicContact CD2-CG1 4.03Å
81G82.1Confident78.5Confident31 Ų3171 Ų7132%0.3235%0.351SS..Hα-helixtrans-52-54-179.500000113.7D77 V78 A79 L83 K84D77-G81 PolarHBondContact O-N 2.87Å; V78-G81 PolarHBondContact O-N 3.4Å; A79-G81 VanDerWaalsContact C-N 3.34Å; G81-L83 VanDerWaalsContact C-N 3.28Å; G81-L83 PolarHBondContact O-N 3.17Å; G81-K84 PolarHBondContact O-N 2.95Å
82P78.9Confident78.3Confident21 Ų2171.5 Ų71.514%0.13635%0.351CS..Hα-helixtrans-59.8-36.6177.7-23.132.5000113.2Q85 Y142 N146P82-Q85 PolarHBondContact O-N 3.31Å; P82-Y142 HydrophobicContact CG-CD2 3.57Å; P82-Y142 HydrophobicContact CG-CE2 3.61Å; P82-N146 WeakPolarHBondContact CG-ND2 3.39Å
83L80.1Confident78Confident76 Ų7669.6 Ų69.640%0.39834%0.342SS..Hα-helixtrans-66.9-40.2-179.5-160.783.6000111.7L80 G81 Q85 I86 P87L80-L83 HydrophobicContact CD2-CD2 4.16Å; L80-L83 WeakPolarHBondContact O-CB 3.29Å; L80-L83 PolarHBondContact O-N 3.3Å; L80-L83 VanDerWaalsContact O-N 3.16Å; G81-L83 VanDerWaalsContact C-N 3.28Å; G81-L83 PolarHBondContact O-N 3.17Å; L83-Q85 PolarHBondContact O-N 3.09Å; L83-I86 HydrophobicContact CD1-CD1 4.08Å; L83-I86 WeakPolarHBondContact O-CB 3.34Å; L83-I86 PolarHBondContact O-N 2.98Å; L83-P87 WeakPolarHBondContact O-CD 3.43Å
84K80.3Confident77.9Confident122 Ų12271.9 Ų71.953%0.5335%0.348SS..Hα-helixtrans-63.9-22.1177.9-72.1170.5179.7160.40112.8D77 L80 G81 P87D77-K84 IonicContact OD1-NZ 2.94Å; D77-K84 PolarHBondContact OD1-NZ 3.1Å; L80-K84 WeakPolarHBondContact O-CG 3.44Å; L80-K84 PolarHBondContact O-N 3.47Å; G81-K84 PolarHBondContact O-N 2.95Å; K84-P87 WeakPolarHBondContact O-CD 3.41Å
85Q77.4Confident77.5Confident96 Ų9669.5 Ų69.545%0.44935%0.346SS..Hα-helixtrans-84-20-179.8-170.1148.67.700113.4P82 L83 M88 N89P82-Q85 PolarHBondContact O-N 3.31Å; L83-Q85 PolarHBondContact O-N 3.09Å; Q85-M88 HydrophobicContact CG-CE 4.06Å; Q85-M88 PolarHBondContact O-N 2.98Å; Q85-N89 PolarHBondContact O-N 3.04Å; Q85-N89 PolarHBondContact O-ND2 3.01Å
86I79.7Confident76.7Confident23 Ų2371.1 Ų71.112%0.11836%0.358CS..Hα-helixtrans-60.1-48.6-179.5-67.5169.4000112.8L83 M88 N89 L90 L148 L152L83-I86 HydrophobicContact CD1-CD1 4.08Å; L83-I86 WeakPolarHBondContact O-CB 3.34Å; L83-I86 PolarHBondContact O-N 2.98Å; I86-M88 VanDerWaalsContact C-N 3.31Å; I86-M88 PolarHBondContact O-N 2.94Å; I86-N89 PolarHBondContact O-N 3.12Å; I86-L90 HydrophobicContact CG2-CD1 3.7Å; I86-L90 HydrophobicContact CG2-CG 4.4Å; I86-L90 WeakPolarHBondContact O-CB 3.46Å; I86-L90 PolarHBondContact O-N 2.91Å; I86-L148 HydrophobicContact CD1-CB 3.86Å; I86-L152 HydrophobicContact CB-CD1 4.49Å; I86-L152 HydrophobicContact CG1-CD1 4.4Å; I86-L152 HydrophobicContact CG2-CD1 3.51Å
87P82.9Confident75.8Confident81 Ų8169.2 Ų69.253%0.52636%0.361SS..Hα-helixtrans-61.1-38.4179.6-24.234.2000113.3L83 K84 L90 F91L83-P87 WeakPolarHBondContact O-CD 3.43Å; K84-P87 WeakPolarHBondContact O-CD 3.41Å; P87-L90 PolarHBondContact O-N 3.32Å; P87-F91 WeakPolarHBondContact O-CB 3.43Å; P87-F91 PolarHBondContact O-N 3.24Å
88M78.8Confident74.7Confident103 Ų10369.5 Ų69.551%0.50736%0.362SS..Hα-helixtrans-62.9-45.8178-175.8177.169.400110.8Q85 I86 F91 I92Q85-M88 HydrophobicContact CG-CE 4.06Å; Q85-M88 PolarHBondContact O-N 2.98Å; I86-M88 VanDerWaalsContact C-N 3.31Å; I86-M88 PolarHBondContact O-N 2.94Å; M88-F91 PolarHBondContact O-N 3.23Å; M88-I92 HydrophobicContact CG-CD1 4.31Å; M88-I92 WeakPolarHBondContact O-CG1 3.48Å; M88-I92 PolarHBondContact O-N 3.29Å; M88-I92 VanDerWaalsContact O-N 3.15Å
89N74.8Confident73.8Confident15 Ų1571.1 Ų71.18%0.0837%0.373CS..Hα-helixtrans-67.1-39.6178.9-67.6-19.8000112.2Q85 I86 I92 M93 M111Q85-N89 PolarHBondContact O-N 3.04Å; Q85-N89 PolarHBondContact O-ND2 3.01Å; I86-N89 PolarHBondContact O-N 3.12Å; N89-I92 PolarHBondContact O-N 3.28Å; N89-M93 WeakPolarHBondContact O-CB 3.26Å; N89-M93 WeakPolarHBondContact O-CG 3.49Å; N89-M93 PolarHBondContact O-N 3.06Å; N89-M111 HydrophobicContact CB-CE 3.4Å; N89-M111 VanDerWaalsContact CB-CE 3.4Å; N89-M111 HydrophobicContact CB-SD 3.57Å; N89-M111 VanDerWaalsContact CB-SD 3.57Å; N89-M111 VanDerWaalsContact ND2-CE 3.27Å; N89-M111 WeakPolarHBondContact ND2-CE 3.49Å; N89-M111 PolarHBondContact ND2-SD 3.37Å
90L75.2Confident72.9Confident82 Ų8276.9 Ų76.943%0.42940%0.402SS..Hα-helixtrans-62.2-41.7174.1-84.7165.8000112.4I86 P87 M93 Y94 L152I86-L90 HydrophobicContact CG2-CD1 3.7Å; I86-L90 HydrophobicContact CG2-CG 4.4Å; I86-L90 WeakPolarHBondContact O-CB 3.46Å; I86-L90 PolarHBondContact O-N 2.91Å; P87-L90 PolarHBondContact O-N 3.32Å; L90-M93 WeakPolarHBondContact O-CB 3.39Å; L90-M93 PolarHBondContact O-N 3.41Å; L90-Y94 WeakPolarHBondContact O-CB 3.33Å; L90-Y94 PolarHBondContact O-N 3.22Å; L90-L152 HydrophobicContact CD2-CD2 4.31Å
91F76.9Confident72Confident126 Ų12677 Ų7755%0.55341%0.407SS*.Hα-helixtrans-63-43.6178-179.4-104.2000111.7P87 M88 M93 Y94 M95P87-F91 WeakPolarHBondContact O-CB 3.43Å; P87-F91 PolarHBondContact O-N 3.24Å; M88-F91 PolarHBondContact O-N 3.23Å; F91-M93 VanDerWaalsContact C-N 3.34Å; F91-M93 PolarHBondContact O-N 3.32Å; F91-Y94 WeakPolarHBondContact O-CB 3.31Å; F91-Y94 PolarHBondContact O-N 3.46Å; F91-M95 HydrophobicContact CD1-CG 4.31Å; F91-M95 HydrophobicContact CD2-CG 4.33Å; F91-M95 HydrophobicContact CE1-CG 3.89Å; F91-M95 HydrophobicContact CE2-CG 3.91Å; F91-M95 HydrophobicContact CE2-SD 4.23Å; F91-M95 HydrophobicContact CZ-CE 4.19Å; F91-M95 HydrophobicContact CZ-CG 3.68Å; F91-M95 HydrophobicContact CZ-SD 4.09Å; F91-M95 WeakPolarHBondContact O-CG 3.44Å; F91-M95 PolarHBondContact O-N 3.4Å
92I71.8Confident71.1Confident61 Ų6182 Ų8231%0.31343%0.425SS..Hα-helixtrans-65.9-40.3176.5-61.3163.8000110.4M88 N89 Y94 M95 S96 M107M88-I92 HydrophobicContact CG-CD1 4.31Å; M88-I92 WeakPolarHBondContact O-CG1 3.48Å; M88-I92 PolarHBondContact O-N 3.29Å; M88-I92 VanDerWaalsContact O-N 3.15Å; N89-I92 PolarHBondContact O-N 3.28Å; I92-Y94 VanDerWaalsContact C-N 3.27Å; I92-Y94 PolarHBondContact O-N 2.99Å; I92-M95 PolarHBondContact O-N 2.91Å; I92-S96 WeakPolarHBondContact O-CB 3.36Å; I92-S96 PolarHBondContact O-N 3.32Å; I92-M107 HydrophobicContact CB-CE 3.85Å; I92-M107 HydrophobicContact CD1-CE 3.51Å; I92-M107 HydrophobicContact CD1-SD 4.45Å; I92-M107 HydrophobicContact CG1-CE 4.27Å; I92-M107 HydrophobicContact CG2-CE 3.54Å; I92-M107 HydrophobicContact CG2-SD 3.71Å
93M69.8Low70.4Confident24 Ų2489.2 Ų89.212%0.11845%0.454CS..Hα-helixtrans-61.5-34.4174.2-77-174.9-178.300113.4N89 L90 F91 M111 K156N89-M93 WeakPolarHBondContact O-CB 3.26Å; N89-M93 WeakPolarHBondContact O-CG 3.49Å; N89-M93 PolarHBondContact O-N 3.06Å; L90-M93 WeakPolarHBondContact O-CB 3.39Å; L90-M93 PolarHBondContact O-N 3.41Å; F91-M93 VanDerWaalsContact C-N 3.34Å; F91-M93 PolarHBondContact O-N 3.32Å; M93-M111 HydrophobicContact CE-CE 3.91Å; M93-M111 HydrophobicContact CE-SD 4.08Å; M93-K156 HydrophobicContact CB-CD 4.16Å; M93-K156 HydrophobicContact CE-CB 3.16Å; M93-K156 HydrophobicContact CE-CD 4.35Å; M93-K156 HydrophobicContact CE-CG 3.57Å; M93-K156 HydrophobicContact CG-CB 4.4Å; M93-K156 HydrophobicContact CG-CD 3.79Å; M93-K156 HydrophobicContact CG-CG 3.85Å; M93-K156 PolarHBondContact O-NZ 3.16Å; M93-K156 VanDerWaalsContact O-NZ 3.15Å; M93-K156 HydrophobicContact SD-CB 3.57Å; M93-K156 VanDerWaalsContact SD-CB 3.57Å; M93-K156 HydrophobicContact SD-CD 3.76Å; M93-K156 HydrophobicContact SD-CG 3.68Å
94Y74.8Confident69.7Low192 Ų19286.2 Ų86.275%0.75344%0.439SS*.Hα-helixtrans-71.7-44.8177.1176.8-101.6000111.4L90 F91 I92L90-Y94 WeakPolarHBondContact O-CB 3.33Å; L90-Y94 PolarHBondContact O-N 3.22Å; F91-Y94 WeakPolarHBondContact O-CB 3.31Å; F91-Y94 PolarHBondContact O-N 3.46Å; I92-Y94 VanDerWaalsContact C-N 3.27Å; I92-Y94 PolarHBondContact O-N 2.99Å
95M69.3Low69.2Low129 Ų12981.9 Ų81.964%0.63542%0.422SS*.Hα-helixtrans-77-31.2-177.8-65.4-71-81.300113.4F91 I92 G97F91-M95 HydrophobicContact CD1-CG 4.31Å; F91-M95 HydrophobicContact CD2-CG 4.33Å; F91-M95 HydrophobicContact CE1-CG 3.89Å; F91-M95 HydrophobicContact CE2-CG 3.91Å; F91-M95 HydrophobicContact CE2-SD 4.23Å; F91-M95 HydrophobicContact CZ-CE 4.19Å; F91-M95 HydrophobicContact CZ-CG 3.68Å; F91-M95 HydrophobicContact CZ-SD 4.09Å; F91-M95 WeakPolarHBondContact O-CG 3.44Å; F91-M95 PolarHBondContact O-N 3.4Å; I92-M95 PolarHBondContact O-N 2.91Å; M95-G97 VanDerWaalsContact C-N 3.28Å; M95-G97 PolarHBondContact O-N 3.45Å
96S59.8Low68.9Low37 Ų3783.3 Ų83.326%0.25943%0.43SS..THydrogen-bonded Turntrans-76.7-7.9-176.4178.20000114.2I92 P104I92-S96 WeakPolarHBondContact O-CB 3.36Å; I92-S96 PolarHBondContact O-N 3.32Å; S96-P104 WeakPolarHBondContact OG-CG 3.4Å
97G61.7Low68.6Low33 Ų3385 Ų8534%0.3444%0.438SS..THydrogen-bonded Turntrans61.6-163-178.600000114.5M95 K156M95-G97 VanDerWaalsContact C-N 3.28Å; M95-G97 PolarHBondContact O-N 3.45Å; G97-K156 PolarHBondContact O-NZ 3.15Å
98N60Low68Low99 Ų9981.3 Ų81.353%0.52941%0.414SS..THydrogen-bonded Turntrans-105.815.5-179.7-119.643.2000112.8I100 S159N98-I100 PolarHBondContact O-N 3.03Å; N98-S159 PolarHBondContact ND2-O 3.25Å; N98-S159 PolarHBondContact OD1-OG 3.25Å
99T58Low67.7Low89 Ų8979.5 Ų79.555%0.54641%0.411SS..  trans-76121.8-179.552.60000110.2S101T99-S101 VanDerWaalsContact C-N 3.35Å; T99-S101 PolarHBondContact O-N 3.29Å
100I57.3Low67.5Low123 Ų12384.5 Ų84.563%0.63144%0.435SS*.  trans-63.295.3172.4-66.2165.6000107.8N98 I105N98-I100 PolarHBondContact O-N 3.03Å; I100-I105 HydrophobicContact CG2-CD1 4.27Å
101S61.9Low67.4Low53 Ų5381.5 Ų81.537%0.37142%0.419SS..  trans-121137.2173-72.40000107.8T99 F103 P104 I105T99-S101 VanDerWaalsContact C-N 3.35Å; T99-S101 PolarHBondContact O-N 3.29Å; S101-F103 PolarHBondContact O-N 3.04Å; S101-F103 VanDerWaalsContact O-N 3.09Å; S101-P104 WeakPolarHBondContact O-CD 3.35Å; S101-I105 WeakPolarHBondContact O-CD1 3.31Å; S101-I105 VanDerWaalsContact O-CG1 3.28Å; S101-I105 WeakPolarHBondContact O-CG1 3.5Å; S101-I105 PolarHBondContact O-N 3.3Å
102I63.9Low67.1Low137 Ų13776.4 Ų76.470%0.70340%0.401SS*.Hα-helixtrans-52.8-33.1179.4-99.372.5000112.5I105 M106I102-I105 PolarHBondContact O-N 2.86Å; I102-M106 PolarHBondContact O-N 3.34Å
103F64.4Low67.5Low172 Ų17281 Ų8175%0.75441%0.414SS*.Hα-helixtrans-68.8-51.3-174.5-178.9-98.9000113.6S101 I105 M106 M107S101-F103 PolarHBondContact O-N 3.04Å; S101-F103 VanDerWaalsContact O-N 3.09Å; F103-I105 VanDerWaalsContact C-N 3.27Å; F103-I105 PolarHBondContact O-N 2.89Å; F103-M106 PolarHBondContact O-N 3.45Å; F103-M107 PolarHBondContact O-N 3.46Å
104P66.1Low68Low13 Ų1387.5 Ų87.58%0.08444%0.437CS..Hα-helixtrans-56.9-35.4169.4-27.430.5000114.6S96 S101 M107 V108 M160S96-P104 WeakPolarHBondContact OG-CG 3.4Å; S101-P104 WeakPolarHBondContact O-CD 3.35Å; P104-M107 PolarHBondContact O-N 2.88Å; P104-V108 WeakPolarHBondContact O-CB 3.48Å; P104-V108 VanDerWaalsContact O-CG2 3.24Å; P104-V108 WeakPolarHBondContact O-CG2 3.39Å; P104-V108 PolarHBondContact O-N 3.12Å; P104-M160 HydrophobicContact CB-CE 3.71Å; P104-M160 HydrophobicContact CB-SD 4.1Å; P104-M160 HydrophobicContact CG-CE 4.48Å
105I69.1Low68.2Low31 Ų3179 Ų7916%0.15941%0.406CS..Hα-helixtrans-62.5-49.7-177.9-63.1165.4000110.6I100 S101 I102 F103 M107 V108 C109 L162I100-I105 HydrophobicContact CG2-CD1 4.27Å; S101-I105 WeakPolarHBondContact O-CD1 3.31Å; S101-I105 VanDerWaalsContact O-CG1 3.28Å; S101-I105 WeakPolarHBondContact O-CG1 3.5Å; S101-I105 PolarHBondContact O-N 3.3Å; I102-I105 PolarHBondContact O-N 2.86Å; F103-I105 VanDerWaalsContact C-N 3.27Å; F103-I105 PolarHBondContact O-N 2.89Å; I105-M107 VanDerWaalsContact C-N 3.33Å; I105-M107 PolarHBondContact O-N 2.88Å; I105-V108 PolarHBondContact O-N 3.15Å; I105-C109 PolarHBondContact O-N 2.87Å; I105-C109 PolarHBondContact O-SG 2.81Å; I105-C109 VanDerWaalsContact O-SG 3.35Å; I105-L162 HydrophobicContact CB-CD1 4.24Å; I105-L162 HydrophobicContact CB-CD2 4.42Å; I105-L162 HydrophobicContact CD1-CD1 4.47Å; I105-L162 HydrophobicContact CD1-CD2 3.38Å; I105-L162 HydrophobicContact CD1-CG 4.47Å; I105-L162 HydrophobicContact CG1-CD1 3.65Å; I105-L162 HydrophobicContact CG1-CD2 3.54Å; I105-L162 HydrophobicContact CG1-CG 4.18Å; I105-L162 HydrophobicContact CG2-CD1 4.04Å; I105-L162 HydrophobicContact CG2-CD2 4.03Å
106M71.5Confident68.8Low126 Ų12676.4 Ų76.462%0.62139%0.394SS*.Hα-helixtrans-64.5-37.9178.7-72.1-63.6-67.600112.5I102 F103 M110I102-M106 PolarHBondContact O-N 3.34Å; F103-M106 PolarHBondContact O-N 3.45Å; M106-M110 PolarHBondContact O-N 3.37Å; M106-M110 VanDerWaalsContact O-N 3.15Å
107M71.7Confident69.8Low58 Ų5879.7 Ų79.729%0.28641%0.405SS..Hα-helixtrans-63.1-46.1174.8170.8-174.8164.300111.7I92 F103 P104 I105 M110 M111I92-M107 HydrophobicContact CB-CE 3.85Å; I92-M107 HydrophobicContact CD1-CE 3.51Å; I92-M107 HydrophobicContact CD1-SD 4.45Å; I92-M107 HydrophobicContact CG1-CE 4.27Å; I92-M107 HydrophobicContact CG2-CE 3.54Å; I92-M107 HydrophobicContact CG2-SD 3.71Å; F103-M107 PolarHBondContact O-N 3.46Å; P104-M107 PolarHBondContact O-N 2.88Å; I105-M107 VanDerWaalsContact C-N 3.33Å; I105-M107 PolarHBondContact O-N 2.88Å; M107-M110 PolarHBondContact O-N 3.4Å; M107-M111 WeakPolarHBondContact O-CB 3.48Å; M107-M111 PolarHBondContact O-N 3.36Å
108V70.3Confident70.7Confident5 Ų579 Ų793%0.0340%0.396CS..Hα-helixtrans-69.9-37.9-178.4175.20000111.2P104 I105 M111 A112 K156 C157P104-V108 WeakPolarHBondContact O-CB 3.48Å; P104-V108 VanDerWaalsContact O-CG2 3.24Å; P104-V108 WeakPolarHBondContact O-CG2 3.39Å; P104-V108 PolarHBondContact O-N 3.12Å; I105-V108 PolarHBondContact O-N 3.15Å; V108-M111 CarbonylContact O-C 3.53Å; V108-M111 WeakPolarHBondContact O-CB 3.49Å; V108-M111 PolarHBondContact O-N 3.27Å; V108-A112 PolarHBondContact O-N 3.25Å; V108-K156 HydrophobicContact CG2-CG 4.4Å; V108-C157 VanDerWaalsContact CG1-SG 3.54Å
109C73.1Confident71.6Confident65 Ų6576.9 Ų76.944%0.43938%0.384SS..Hα-helixtrans-60.5-48.3174-74.20000112.1I105 M111 A112 W113I105-C109 PolarHBondContact O-N 2.87Å; I105-C109 PolarHBondContact O-SG 2.81Å; I105-C109 VanDerWaalsContact O-SG 3.35Å; C109-M111 VanDerWaalsContact C-N 3.31Å; C109-M111 PolarHBondContact O-N 2.93Å; C109-A112 PolarHBondContact O-N 3.36Å; C109-W113 WeakPolarHBondContact O-CB 3.49Å; C109-W113 PolarHBondContact O-N 3.41Å
110M71.8Confident72.7Confident120 Ų12078.7 Ų78.759%0.59139%0.388SS*.Hα-helixtrans-63.7-36.9173.5-84.8-99.3179.900111.9M106 M107 A112 W113 R114M106-M110 PolarHBondContact O-N 3.37Å; M106-M110 VanDerWaalsContact O-N 3.15Å; M107-M110 PolarHBondContact O-N 3.4Å; M110-A112 VanDerWaalsContact C-N 3.34Å; M110-A112 PolarHBondContact O-N 3.02Å; M110-W113 PolarHBondContact O-N 3.06Å; M110-R114 WeakPolarHBondContact O-CB 3.29Å; M110-R114 WeakPolarHBondContact O-CG 3.38Å; M110-R114 PolarHBondContact O-N 3.23Å
111M71.6Confident73.7Confident18 Ų1875.4 Ų75.49%0.08938%0.376CS..Hα-helixtrans-67.2-30.8176.4-177.6-169.8150.300112.8N89 M93 M107 V108 C109 P115 A153N89-M111 HydrophobicContact CB-CE 3.4Å; N89-M111 VanDerWaalsContact CB-CE 3.4Å; N89-M111 HydrophobicContact CB-SD 3.57Å; N89-M111 VanDerWaalsContact CB-SD 3.57Å; N89-M111 VanDerWaalsContact ND2-CE 3.27Å; N89-M111 WeakPolarHBondContact ND2-CE 3.49Å; N89-M111 PolarHBondContact ND2-SD 3.37Å; M93-M111 HydrophobicContact CE-CE 3.91Å; M93-M111 HydrophobicContact CE-SD 4.08Å; M107-M111 WeakPolarHBondContact O-CB 3.48Å; M107-M111 PolarHBondContact O-N 3.36Å; V108-M111 CarbonylContact O-C 3.53Å; V108-M111 WeakPolarHBondContact O-CB 3.49Å; V108-M111 PolarHBondContact O-N 3.27Å; C109-M111 VanDerWaalsContact C-N 3.31Å; C109-M111 PolarHBondContact O-N 2.93Å; M111-P115 WeakPolarHBondContact O-CD 3.46Å; M111-P115 VanDerWaalsContact O-CG 3.31Å; M111-P115 WeakPolarHBondContact O-CG 3.4Å; M111-A153 HydrophobicContact CE-CB 4.17Å
112A72.4Confident74.2Confident20 Ų2074 Ų7417%0.16536%0.364CS..Hα-helixtrans-76.6-37.9171.800000111.4V108 C109 M110 P115 I116 A153V108-A112 PolarHBondContact O-N 3.25Å; C109-A112 PolarHBondContact O-N 3.36Å; M110-A112 VanDerWaalsContact C-N 3.34Å; M110-A112 PolarHBondContact O-N 3.02Å; A112-P115 WeakPolarHBondContact O-CD 3.48Å; A112-I116 WeakPolarHBondContact O-CD1 3.08Å; A112-I116 VanDerWaalsContact O-CG1 3.29Å; A112-I116 WeakPolarHBondContact O-CG1 3.39Å; A112-A153 HydrophobicContact CB-CB 3.72Å
113W78.8Confident74.7Confident157 Ų15771.4 Ų71.460%0.59536%0.358SS*.Hα-helixtrans-68.6-34.8179.9-161.9-92.6000113C109 M110 I116 Q117C109-W113 WeakPolarHBondContact O-CB 3.49Å; C109-W113 PolarHBondContact O-N 3.41Å; M110-W113 PolarHBondContact O-N 3.06Å; W113-I116 PolarHBondContact O-N 3.25Å; W113-Q117 WeakPolarHBondContact O-CB 3.36Å; W113-Q117 PolarHBondContact O-N 3.42Å
114R80Confident75.2Confident160 Ų16066.3 Ų66.360%0.60435%0.348SS*.Hα-helixtrans-59-52.4-179.7-75.5-99.1173.5163.6-4113.1M110 I116 Q117 A118M110-R114 WeakPolarHBondContact O-CB 3.29Å; M110-R114 WeakPolarHBondContact O-CG 3.38Å; M110-R114 PolarHBondContact O-N 3.23Å; R114-I116 VanDerWaalsContact C-N 3.33Å; R114-I116 PolarHBondContact O-N 3.44Å; R114-Q117 PolarHBondContact O-N 3.35Å; R114-A118 VanDerWaalsContact O-CB 3.24Å; R114-A118 WeakPolarHBondContact O-CB 3.35Å; R114-A118 PolarHBondContact O-N 2.82Å
115P80Confident75.3Confident14 Ų1466.9 Ų66.99%0.09135%0.351CS..Hα-helixtrans-59.5-40.2171.9-22.228.3000113M111 A112 A118 L119 N146 A150M111-P115 WeakPolarHBondContact O-CD 3.46Å; M111-P115 VanDerWaalsContact O-CG 3.31Å; M111-P115 WeakPolarHBondContact O-CG 3.4Å; A112-P115 WeakPolarHBondContact O-CD 3.48Å; P115-A118 WeakPolarHBondContact O-CB 3.37Å; P115-A118 PolarHBondContact O-N 3.14Å; P115-L119 WeakPolarHBondContact O-CB 3.42Å; P115-L119 VanDerWaalsContact O-CG 3.23Å; P115-L119 WeakPolarHBondContact O-CG 3.32Å; P115-L119 PolarHBondContact O-N 3.36Å; P115-N146 HydrophobicContact CB-CB 4.33Å; P115-N146 WeakPolarHBondContact CB-O 3.01Å; P115-A150 HydrophobicContact CB-CB 4.13Å
116I81.6Confident75.4Confident75 Ų7569.5 Ų69.539%0.38536%0.361SS..Hα-helixtrans-64.1-45179.1-64.9168.1000110.4A112 W113 R114 A118 L119 M120A112-I116 WeakPolarHBondContact O-CD1 3.08Å; A112-I116 VanDerWaalsContact O-CG1 3.29Å; A112-I116 WeakPolarHBondContact O-CG1 3.39Å; W113-I116 PolarHBondContact O-N 3.25Å; R114-I116 VanDerWaalsContact C-N 3.33Å; R114-I116 PolarHBondContact O-N 3.44Å; I116-A118 VanDerWaalsContact C-N 3.32Å; I116-A118 PolarHBondContact O-N 3.32Å; I116-L119 PolarHBondContact O-N 2.94Å; I116-M120 HydrophobicContact CG2-CE 4.22Å; I116-M120 WeakPolarHBondContact O-CG 3.44Å; I116-M120 PolarHBondContact O-N 2.95Å
117Q81.3Confident75.3Confident105 Ų10571 Ų7149%0.49137%0.365SS..Hα-helixtrans-62.3-40.8174.9-171.9177.113.900111.5W113 R114 L119 M120 S121W113-Q117 WeakPolarHBondContact O-CB 3.36Å; W113-Q117 PolarHBondContact O-N 3.42Å; R114-Q117 PolarHBondContact O-N 3.35Å; Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 3.5Å; Q117-M120 PolarHBondContact O-N 3.41Å; Q117-S121 PolarHBondContact O-N 3.15Å; Q117-S121 PolarHBondContact O-OG 3.44Å
118A80.1Confident75Confident18 Ų1873.2 Ų73.215%0.14938%0.377CS..Hα-helixtrans-65.4-32.5176.800000113R114 P115 I116 S121 M122 Y142 N146R114-A118 VanDerWaalsContact O-CB 3.24Å; R114-A118 WeakPolarHBondContact O-CB 3.35Å; R114-A118 PolarHBondContact O-N 2.82Å; P115-A118 WeakPolarHBondContact O-CB 3.37Å; P115-A118 PolarHBondContact O-N 3.14Å; I116-A118 VanDerWaalsContact C-N 3.32Å; I116-A118 PolarHBondContact O-N 3.32Å; A118-S121 PolarHBondContact O-OG 2.87Å; A118-M122 PolarHBondContact O-N 3.37Å; A118-Y142 WeakPolarHBondContact CB-OH 3.42Å; A118-Y142 PolarHBondContact O-OH 3.44Å; A118-N146 WeakPolarHBondContact CB-OD1 3.44Å
119L79.1Confident74.7Confident55 Ų5573.1 Ų73.129%0.28838%0.376SS..Hα-helixtrans-72.7-39.1171.5-70.8170.3000111.8P115 I116 Q117 S121 M122 L143 N146P115-L119 WeakPolarHBondContact O-CB 3.42Å; P115-L119 VanDerWaalsContact O-CG 3.23Å; P115-L119 WeakPolarHBondContact O-CG 3.32Å; P115-L119 PolarHBondContact O-N 3.36Å; I116-L119 PolarHBondContact O-N 2.94Å; Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 3.5Å; L119-S121 VanDerWaalsContact C-N 3.31Å; L119-S121 PolarHBondContact O-N 3.19Å; L119-M122 HydrophobicContact CD2-SD 4.39Å; L119-M122 WeakPolarHBondContact O-CB 3.23Å; L119-M122 PolarHBondContact O-N 2.93Å; L119-M122 VanDerWaalsContact O-N 3.16Å; L119-L143 HydrophobicContact CD2-CD1 3.68Å; L119-N146 HydrophobicContact CD2-CB 3.94Å; L119-N146 HydrophobicContact CG-CB 4.03Å
120M80.8Confident74.1Confident128 Ų12876.5 Ų76.563%0.63139%0.386SS*.Hα-helixtrans-66.4-32.6175-72.5-164.8-75.300112.6I116 Q117 M122I116-M120 HydrophobicContact CG2-CE 4.22Å; I116-M120 WeakPolarHBondContact O-CG 3.44Å; I116-M120 PolarHBondContact O-N 2.95Å; Q117-M120 PolarHBondContact O-N 3.41Å; M120-M122 VanDerWaalsContact C-N 3.3Å
121S79.2Confident73.4Confident54 Ų5475.1 Ų75.138%0.37839%0.387SS..THydrogen-bonded Turntrans-86.65.7173.764.60000114.1Q117 A118 L119 S123 A124 T125Q117-S121 PolarHBondContact O-N 3.15Å; Q117-S121 PolarHBondContact O-OG 3.44Å; A118-S121 PolarHBondContact O-OG 2.87Å; L119-S121 VanDerWaalsContact C-N 3.31Å; L119-S121 PolarHBondContact O-N 3.19Å; S121-S123 PolarHBondContact O-N 3.37Å; S121-A124 WeakPolarHBondContact O-CB 3.46Å; S121-A124 PolarHBondContact O-N 3.45Å; S121-T125 PolarHBondContact O-N 3.39Å; S121-T125 PolarHBondContact O-OG1 2.86Å
122M72.1Confident72.9Confident22 Ų2274.7 Ų74.711%0.10839%0.386CS..Hα-helixtrans-61.6-31.8-172.2-169.1-177.5-169.100112.8A118 L119 M120 A124 T125 F126 G139 Y142 L143A118-M122 PolarHBondContact O-N 3.37Å; L119-M122 HydrophobicContact CD2-SD 4.39Å; L119-M122 WeakPolarHBondContact O-CB 3.23Å; L119-M122 PolarHBondContact O-N 2.93Å; L119-M122 VanDerWaalsContact O-N 3.16Å; M120-M122 VanDerWaalsContact C-N 3.3Å; M122-A124 VanDerWaalsContact C-N 3.29Å; M122-A124 PolarHBondContact O-N 2.89Å; M122-T125 WeakPolarHBondContact O-CB 3.06Å; M122-T125 PolarHBondContact O-N 3.34Å; M122-T125 VanDerWaalsContact O-N 3.14Å; M122-F126 HydrophobicContact CE-CD2 4.41Å; M122-F126 HydrophobicContact CE-CE1 4.31Å; M122-F126 HydrophobicContact CE-CE2 3.33Å; M122-F126 HydrophobicContact CE-CZ 3.26Å; M122-F126 HydrophobicContact CG-CD2 3.69Å; M122-F126 HydrophobicContact CG-CE2 3.4Å; M122-F126 VanDerWaalsContact CG-CE2 3.4Å; M122-F126 HydrophobicContact CG-CZ 4.25Å; M122-F126 WeakPolarHBondContact O-CD2 3.19Å; M122-F126 PolarHBondContact O-N 3.45Å; M122-F126 HydrophobicContact SD-CD2 4.39Å; M122-F126 HydrophobicContact SD-CE2 3.52Å; M122-F126 VanDerWaalsContact SD-CE2 3.52Å; M122-F126 HydrophobicContact SD-CZ 4.11Å; M122-G139 WeakPolarHBondContact CE-O 3.31Å; M122-Y142 HydrophobicContact CB-CE1 4.42Å; M122-Y142 HydrophobicContact CE-CD1 3.99Å; M122-Y142 HydrophobicContact CG-CD1 4.14Å; M122-Y142 HydrophobicContact CG-CE1 3.98Å; M122-L143 HydrophobicContact CE-CB 3.7Å; M122-L143 HydrophobicContact CE-CD1 3.86Å; M122-L143 HydrophobicContact CE-CG 4.32Å; M122-L143 HydrophobicContact SD-CD1 3.92Å
123S73.9Confident72.3Confident84 Ų8479.5 Ų79.559%0.58742%0.419SS*.Hα-helixtrans-64.6-29.2175.236.90000113.3S121 K127S121-S123 PolarHBondContact O-N 3.37Å; S123-K127 WeakPolarHBondContact O-CG 3.33Å; S123-K127 PolarHBondContact O-N 3.07Å
124A74.4Confident71.6Confident64 Ų6475.9 Ų75.953%0.52941%0.409SS..Hα-helixtrans-74.8-36.9171.200000111.7S121 M122 K127 L128S121-A124 WeakPolarHBondContact O-CB 3.46Å; S121-A124 PolarHBondContact O-N 3.45Å; M122-A124 VanDerWaalsContact C-N 3.29Å; M122-A124 PolarHBondContact O-N 2.89Å; A124-K127 PolarHBondContact O-N 3.11Å; A124-L128 PolarHBondContact O-N 2.85Å
125T69.1Low71.2Confident26 Ų2672.7 Ų72.716%0.1640%0.401CS..Hα-helixtrans-66.8-40.4175.4-45.90000111.4V78 S121 M122 K127 L128 L129V78-T125 HydrophobicContact CG1-CG2 4.03Å; S121-T125 PolarHBondContact O-N 3.39Å; S121-T125 PolarHBondContact O-OG1 2.86Å; M122-T125 WeakPolarHBondContact O-CB 3.06Å; M122-T125 PolarHBondContact O-N 3.34Å; M122-T125 VanDerWaalsContact O-N 3.14Å; T125-K127 VanDerWaalsContact C-N 3.35Å; T125-K127 PolarHBondContact O-N 3.04Å; T125-L128 WeakPolarHBondContact O-CA 3.27Å; T125-L128 WeakPolarHBondContact O-CB 3.5Å; T125-L128 PolarHBondContact O-N 3.27Å; T125-L129 HydrophobicContact CG2-CD1 4.03Å; T125-L129 VanDerWaalsContact O-CD1 3.26Å; T125-L129 WeakPolarHBondContact O-CD1 3.33Å; T125-L129 PolarHBondContact O-N 3.47Å
126F70.4Confident71Confident85 Ų8581.7 Ų81.737%0.37343%0.433SS..Hα-helixtrans-61.2-39.8174.7-82.6-60.1000112.9M122 L128 L129 E130M122-F126 HydrophobicContact CE-CD2 4.41Å; M122-F126 HydrophobicContact CE-CE1 4.31Å; M122-F126 HydrophobicContact CE-CE2 3.33Å; M122-F126 HydrophobicContact CE-CZ 3.26Å; M122-F126 HydrophobicContact CG-CD2 3.69Å; M122-F126 HydrophobicContact CG-CE2 3.4Å; M122-F126 VanDerWaalsContact CG-CE2 3.4Å; M122-F126 HydrophobicContact CG-CZ 4.25Å; M122-F126 WeakPolarHBondContact O-CD2 3.19Å; M122-F126 PolarHBondContact O-N 3.45Å; M122-F126 HydrophobicContact SD-CD2 4.39Å; M122-F126 HydrophobicContact SD-CE2 3.52Å; M122-F126 VanDerWaalsContact SD-CE2 3.52Å; M122-F126 HydrophobicContact SD-CZ 4.11Å; F126-L128 PolarHBondContact O-N 3.37Å; F126-L129 CarbonylContact O-C 3.58Å; F126-L129 PolarHBondContact O-N 2.89Å; F126-L129 VanDerWaalsContact O-N 3.12Å; F126-E130 PolarHBondContact O-N 3.29Å
127K69.9Low70.9Confident159 Ų15982.5 Ų82.569%0.69144%0.438SS*.Hα-helixtrans-62.1-32.9172.7-74.7-180176.6-175.80112.8S123 A124 T125 L129S123-K127 WeakPolarHBondContact O-CG 3.33Å; S123-K127 PolarHBondContact O-N 3.07Å; A124-K127 PolarHBondContact O-N 3.11Å; T125-K127 VanDerWaalsContact C-N 3.35Å; T125-K127 PolarHBondContact O-N 3.04Å; K127-L129 VanDerWaalsContact C-N 3.35Å
128L66.3Low70.7Confident104 Ų10477.5 Ų77.555%0.54541%0.414SS..Hα-helixtrans-74.9-28.9176.6-152.9147000111.6A124 T125 F126A124-L128 PolarHBondContact O-N 2.85Å; T125-L128 WeakPolarHBondContact O-CA 3.27Å; T125-L128 WeakPolarHBondContact O-CB 3.5Å; T125-L128 PolarHBondContact O-N 3.27Å; F126-L128 PolarHBondContact O-N 3.37Å
129L62.8Low70.7Confident3 Ų376.8 Ų76.82%0.01641%0.409CS..Hα-helixtrans-82.4-15.4176.3-94.169000114.1C75 T125 F126 K127 S131 S132 Q138C75-L129 HydrophobicContact CB-CG 4.33Å; T125-L129 HydrophobicContact CG2-CD1 4.03Å; T125-L129 VanDerWaalsContact O-CD1 3.26Å; T125-L129 WeakPolarHBondContact O-CD1 3.33Å; T125-L129 PolarHBondContact O-N 3.47Å; F126-L129 CarbonylContact O-C 3.58Å; F126-L129 PolarHBondContact O-N 2.89Å; F126-L129 VanDerWaalsContact O-N 3.12Å; K127-L129 VanDerWaalsContact C-N 3.35Å; L129-S131 PolarHBondContact O-N 3.22Å; L129-S132 PolarHBondContact O-N 3.25Å; L129-Q138 HydrophobicContact CD2-CB 3.49Å; L129-Q138 VanDerWaalsContact CD2-CB 3.49Å; L129-Q138 HydrophobicContact CG-CB 4.42Å
130E60.4Low70.9Confident136 Ų13677.7 Ų77.764%0.63641%0.413SS*.THydrogen-bonded Turntrans-59.5-19.3-178.1-163.7167.3-17800113.1F126 S132F126-E130 PolarHBondContact O-N 3.29Å; E130-S132 VanDerWaalsContact C-N 3.28Å; E130-S132 PolarHBondContact O-N 3.47Å
131S56.6Low71.1Confident90 Ų9073.4 Ų73.463%0.62939%0.394SS*.THydrogen-bonded Turntrans-76-7173.2-170.30000114.4L129L129-S131 PolarHBondContact O-N 3.22Å
132S61.5Low71.3Confident9 Ų971.9 Ų71.96%0.06338%0.38CS..SBendtrans-110.5137.4-176.9-171.60000112.4L129 E130 Q134 Q135L129-S132 PolarHBondContact O-N 3.25Å; E130-S132 VanDerWaalsContact C-N 3.28Å; E130-S132 PolarHBondContact O-N 3.47Å; S132-Q134 PolarHBondContact O-N 2.9Å; S132-Q134 VanDerWaalsContact O-N 3.14Å; S132-Q135 PolarHBondContact O-N 3.16Å
133S59.9Low71.9Confident122 Ų12274.3 Ų74.385%0.85339%0.393SS*.THydrogen-bonded Turntrans-62.7-19.1177.8-177.30000113.6
134Q65.2Low72.5Confident81 Ų8174.4 Ų74.438%0.37939%0.386SS..THydrogen-bonded Turntrans-10929.2-178.2-64.4-167.6-28.400113.4S132 W136 L137 Q138S132-Q134 PolarHBondContact O-N 2.9Å; S132-Q134 VanDerWaalsContact O-N 3.14Å; Q134-W136 PolarHBondContact O-N 3.39Å; Q134-W136 VanDerWaalsContact O-N 3.12Å; Q134-L137 PolarHBondContact O-N 3.5Å; Q134-L137 VanDerWaalsContact O-N 3.09Å; Q134-Q138 PolarHBondContact O-N 3.46Å; Q134-Q138 VanDerWaalsContact O-N 3.1Å
135Q70.8Confident73Confident93 Ų9371.4 Ų71.444%0.43536%0.362SS..Hα-helixtrans-49-38.5-179.955.2178.6-27.900114.5S132 G139S132-Q135 PolarHBondContact O-N 3.16Å; Q135-G139 PolarHBondContact O-N 3Å
136W75.4Confident73.9Confident202 Ų20270.6 Ų70.677%0.76536%0.356SS*.Hα-helixtrans-66.3-45.5179.9178.3-97.4000112.3Q134 L140Q134-W136 PolarHBondContact O-N 3.39Å; Q134-W136 VanDerWaalsContact O-N 3.12Å; W136-L140 VanDerWaalsContact O-CB 3.29Å; W136-L140 WeakPolarHBondContact O-CB 3.38Å; W136-L140 PolarHBondContact O-N 3.21Å
137L79.5Confident74.6Confident93 Ų9371.8 Ų71.849%0.48737%0.366SS..Hα-helixtrans-69-44.7-178-131.8102.9000110.8W76 Q134 L140 V141W76-L137 HydrophobicContact CH2-CD2 4.24Å; W76-L137 HydrophobicContact CZ2-CD2 4.5Å; Q134-L137 PolarHBondContact O-N 3.5Å; Q134-L137 VanDerWaalsContact O-N 3.09Å; L137-L140 PolarHBondContact O-N 2.87Å; L137-V141 WeakPolarHBondContact O-CG2 3.45Å; L137-V141 PolarHBondContact O-N 3.28Å
138Q78.4Confident75.3Confident0 Ų068 Ų680%035%0.353CS..Hα-helixtrans-65-40.6178.6-70.1171.9-9.500111.6C75 W76 A79 L129 Q134 V141 Y142C75-Q138 VanDerWaalsContact CB-OE1 3.23Å; W76-Q138 VanDerWaalsContact CD1-NE2 3.27Å; W76-Q138 HydrophobicContact CD2-CG 4.29Å; W76-Q138 HydrophobicContact CZ2-CG 4.47Å; A79-Q138 HydrophobicContact CB-CB 4.04Å; A79-Q138 HydrophobicContact CB-CG 4.48Å; A79-Q138 WeakPolarHBondContact CB-O 3.32Å; L129-Q138 HydrophobicContact CD2-CB 3.49Å; L129-Q138 VanDerWaalsContact CD2-CB 3.49Å; L129-Q138 HydrophobicContact CG-CB 4.42Å; Q134-Q138 PolarHBondContact O-N 3.46Å; Q134-Q138 VanDerWaalsContact O-N 3.1Å; Q138-V141 PolarHBondContact O-N 2.86Å; Q138-Y142 WeakPolarHBondContact O-CB 2.79Å; Q138-Y142 PolarHBondContact O-N 3.19Å
139G79.8Confident76.1Confident3 Ų363.4 Ų63.43%0.03133%0.331CS..Hα-helixtrans-63.9-40.5173.800000113.5M122 Q135 Y142 L143M122-G139 WeakPolarHBondContact CE-O 3.31Å; Q135-G139 PolarHBondContact O-N 3Å; G139-Y142 PolarHBondContact O-N 3.16Å; G139-L143 WeakPolarHBondContact O-CB 3.39Å; G139-L143 PolarHBondContact O-N 2.95Å
140L83.6Confident77Confident74 Ų7464 Ų6439%0.38734%0.336SS..Hα-helixtrans-66.8-41.8177-173.9146.7000111.7W136 L137 L143 I144W136-L140 VanDerWaalsContact O-CB 3.29Å; W136-L140 WeakPolarHBondContact O-CB 3.38Å; W136-L140 PolarHBondContact O-N 3.21Å; L137-L140 PolarHBondContact O-N 2.87Å; L140-L143 PolarHBondContact O-N 3.22Å; L140-I144 HydrophobicContact CD2-CD1 3.42Å; L140-I144 VanDerWaalsContact CD2-CD1 3.42Å; L140-I144 HydrophobicContact CD2-CG1 4.3Å; L140-I144 HydrophobicContact CG-CD1 4.2Å; L140-I144 WeakPolarHBondContact O-CB 3.21Å; L140-I144 VanDerWaalsContact O-CG1 3.31Å; L140-I144 WeakPolarHBondContact O-CG1 3.47Å; L140-I144 PolarHBondContact O-N 3.37Å
141V84.7Confident78.1Confident37 Ų3760.1 Ų60.122%0.22433%0.327CS..Hα-helixtrans-62.5-43.4174.2170.80000111.1L80 L137 Q138 I144 G145L80-V141 HydrophobicContact CD2-CG1 4.03Å; L137-V141 WeakPolarHBondContact O-CG2 3.45Å; L137-V141 PolarHBondContact O-N 3.28Å; Q138-V141 PolarHBondContact O-N 2.86Å; V141-I144 PolarHBondContact O-N 2.94Å; V141-G145 PolarHBondContact O-N 2.84Å
142Y83.4Confident79.2Confident22 Ų2257.9 Ų57.99%0.08631%0.308CS..Hα-helixtrans-62.4-43.2175.4-179.9-97.8000111.9P82 A118 M122 Q138 G139 G145 N146P82-Y142 HydrophobicContact CG-CD2 3.57Å; P82-Y142 HydrophobicContact CG-CE2 3.61Å; A118-Y142 WeakPolarHBondContact CB-OH 3.42Å; A118-Y142 PolarHBondContact O-OH 3.44Å; M122-Y142 HydrophobicContact CB-CE1 4.42Å; M122-Y142 HydrophobicContact CE-CD1 3.99Å; M122-Y142 HydrophobicContact CG-CD1 4.14Å; M122-Y142 HydrophobicContact CG-CE1 3.98Å; Q138-Y142 WeakPolarHBondContact O-CB 2.79Å; Q138-Y142 PolarHBondContact O-N 3.19Å; G139-Y142 PolarHBondContact O-N 3.16Å; Y142-G145 PolarHBondContact O-N 3.37Å; Y142-N146 WeakPolarHBondContact CD1-ND2 3.24Å; Y142-N146 VanDerWaalsContact CE1-ND2 3.29Å; Y142-N146 WeakPolarHBondContact CE1-ND2 3.38Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.48Å; Y142-N146 PolarHBondContact O-N 3.31Å; Y142-N146 PolarHBondContact O-ND2 3.4Å
143L84.7Confident79.9Confident74 Ų7457.4 Ų57.439%0.38731%0.305SS..Hα-helixtrans-59.8-52176.5-175.270.3000110.9L119 M122 G139 L140 G145 N146 L147L119-L143 HydrophobicContact CD2-CD1 3.68Å; M122-L143 HydrophobicContact CE-CB 3.7Å; M122-L143 HydrophobicContact CE-CD1 3.86Å; M122-L143 HydrophobicContact CE-CG 4.32Å; M122-L143 HydrophobicContact SD-CD1 3.92Å; G139-L143 WeakPolarHBondContact O-CB 3.39Å; G139-L143 PolarHBondContact O-N 2.95Å; L140-L143 PolarHBondContact O-N 3.22Å; L143-G145 VanDerWaalsContact C-N 3.34Å; L143-G145 PolarHBondContact O-N 2.94Å; L143-N146 PolarHBondContact O-N 3.24Å; L143-L147 WeakPolarHBondContact O-CB 3.32Å; L143-L147 PolarHBondContact O-N 3.2Å
144I86.5Confident80.7Confident85 Ų8556.4 Ų56.444%0.43629%0.289SS..Hα-helixtrans-61.6-43-179.7-71.1177.1000110.8L140 V141 L147 L148L140-I144 HydrophobicContact CD2-CD1 3.42Å; L140-I144 VanDerWaalsContact CD2-CD1 3.42Å; L140-I144 HydrophobicContact CD2-CG1 4.3Å; L140-I144 HydrophobicContact CG-CD1 4.2Å; L140-I144 WeakPolarHBondContact O-CB 3.21Å; L140-I144 VanDerWaalsContact O-CG1 3.31Å; L140-I144 WeakPolarHBondContact O-CG1 3.47Å; L140-I144 PolarHBondContact O-N 3.37Å; V141-I144 PolarHBondContact O-N 2.94Å; I144-L147 PolarHBondContact O-N 3.2Å; I144-L148 HydrophobicContact CG2-CD1 3.66Å; I144-L148 HydrophobicContact CG2-CG 4.49Å; I144-L148 WeakPolarHBondContact O-CB 3.47Å; I144-L148 PolarHBondContact O-N 3.02Å
145G85.2Confident81.3Confident1 Ų159.8 Ų59.81%0.0130%0.299CS..Hα-helixtrans-61.3-44.1178.200000113V141 Y142 L143 G149V141-G145 PolarHBondContact O-N 2.84Å; Y142-G145 PolarHBondContact O-N 3.37Å; L143-G145 VanDerWaalsContact C-N 3.34Å; L143-G145 PolarHBondContact O-N 2.94Å; G145-G149 PolarHBondContact O-N 3.47Å
146N86.3Confident81.4Confident10 Ų1056.2 Ų56.25%0.05328%0.282CS..Hα-helixtrans-68.5-39.6175.3-76.5-73.6000112.1P82 P115 A118 L119 Y142 L143 G149 A150P82-N146 WeakPolarHBondContact CG-ND2 3.39Å; P115-N146 HydrophobicContact CB-CB 4.33Å; P115-N146 WeakPolarHBondContact CB-O 3.01Å; A118-N146 WeakPolarHBondContact CB-OD1 3.44Å; L119-N146 HydrophobicContact CD2-CB 3.94Å; L119-N146 HydrophobicContact CG-CB 4.03Å; Y142-N146 WeakPolarHBondContact CD1-ND2 3.24Å; Y142-N146 VanDerWaalsContact CE1-ND2 3.29Å; Y142-N146 WeakPolarHBondContact CE1-ND2 3.38Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.48Å; Y142-N146 PolarHBondContact O-N 3.31Å; Y142-N146 PolarHBondContact O-ND2 3.4Å; L143-N146 PolarHBondContact O-N 3.24Å; N146-G149 PolarHBondContact O-N 2.94Å; N146-A150 WeakPolarHBondContact O-CB 3.42Å; N146-A150 PolarHBondContact O-N 3.24Å
147L86Confident81.1Confident109 Ų10947.5 Ų47.557%0.57125%0.252SS*.Hα-helixtrans-64.1-42.7178.1-154.6102.2000111.6L143 I144 A150 A151L143-L147 WeakPolarHBondContact O-CB 3.32Å; L143-L147 PolarHBondContact O-N 3.2Å; I144-L147 PolarHBondContact O-N 3.2Å; L147-A150 PolarHBondContact O-N 2.81Å; L147-A151 WeakPolarHBondContact O-CB 3.41Å; L147-A151 PolarHBondContact O-N 3.45Å
148L85.3Confident80.6Confident80 Ų8048.9 Ų48.942%0.41926%0.256SS..Hα-helixtrans-61.7-45.2173.2-86.4158.3000111.6I86 I144 A150 A151 L152I86-L148 HydrophobicContact CD1-CB 3.86Å; I144-L148 HydrophobicContact CG2-CD1 3.66Å; I144-L148 HydrophobicContact CG2-CG 4.49Å; I144-L148 WeakPolarHBondContact O-CB 3.47Å; I144-L148 PolarHBondContact O-N 3.02Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 3.39Å; L148-A151 PolarHBondContact O-N 2.88Å; L148-L152 WeakPolarHBondContact O-CB 3.35Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.29Å; L148-L152 PolarHBondContact O-N 2.9Å
149G82.1Confident80Confident8 Ų851 Ų518%0.08227%0.271CS..Hα-helixtrans-59.5-42.9175.900000112.6G145 N146 A153G145-G149 PolarHBondContact O-N 3.47Å; N146-G149 PolarHBondContact O-N 2.94Å; G149-A153 WeakPolarHBondContact O-CB 3.47Å; G149-A153 PolarHBondContact O-N 3.36Å; G149-A153 VanDerWaalsContact O-N 3.11Å
150A82.3Confident79.1Confident16 Ų1651.2 Ų51.213%0.13227%0.271CS..Hα-helixtrans-65.6-46.5175.700000112P115 N146 L147 L148 L152 A153 I154P115-A150 HydrophobicContact CB-CB 4.13Å; N146-A150 WeakPolarHBondContact O-CB 3.42Å; N146-A150 PolarHBondContact O-N 3.24Å; L147-A150 PolarHBondContact O-N 2.81Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 3.39Å; A150-L152 PolarHBondContact O-N 3.35Å; A150-A153 PolarHBondContact O-N 3.45Å; A150-I154 WeakPolarHBondContact O-CG1 3.47Å; A150-I154 PolarHBondContact O-N 2.98Å
151A83Confident78.1Confident54 Ų5449.8 Ų49.845%0.44627%0.274SS..Hα-helixtrans-60.9-42.717900000112.1L147 L148 I154 Y155L147-A151 WeakPolarHBondContact O-CB 3.41Å; L147-A151 PolarHBondContact O-N 3.45Å; L148-A151 PolarHBondContact O-N 2.88Å; A151-I154 PolarHBondContact O-N 2.96Å; A151-Y155 WeakPolarHBondContact O-CB 3.41Å; A151-Y155 PolarHBondContact O-N 3.31Å
152L79.4Confident77Confident42 Ų4251 Ų5122%0.2228%0.279CS..Hα-helixtrans-63.4-40.6175.3-74.1170000112.2I86 L90 L148 A150 Y155 K156I86-L152 HydrophobicContact CB-CD1 4.49Å; I86-L152 HydrophobicContact CG1-CD1 4.4Å; I86-L152 HydrophobicContact CG2-CD1 3.51Å; L90-L152 HydrophobicContact CD2-CD2 4.31Å; L148-L152 WeakPolarHBondContact O-CB 3.35Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.29Å; L148-L152 PolarHBondContact O-N 2.9Å; A150-L152 PolarHBondContact O-N 3.35Å; L152-Y155 PolarHBondContact O-N 3.29Å; L152-K156 PolarHBondContact O-N 3.44Å
153A76.4Confident75.8Confident0 Ų053 Ų530%029%0.291CS..Hα-helixtrans-64.2-44.4176.600000111.7M111 A112 G149 A150 K156 C157M111-A153 HydrophobicContact CE-CB 4.17Å; A112-A153 HydrophobicContact CB-CB 3.72Å; G149-A153 WeakPolarHBondContact O-CB 3.47Å; G149-A153 PolarHBondContact O-N 3.36Å; G149-A153 VanDerWaalsContact O-N 3.11Å; A150-A153 PolarHBondContact O-N 3.45Å; A153-K156 PolarHBondContact O-N 2.92Å; A153-C157 PolarHBondContact O-N 3.34Å
154I77.6Confident74.4Confident101 Ų10153.5 Ų53.552%0.51830%0.299SS..Hα-helixtrans-61.7-45.6176.1-67.5165.9000110.7A150 A151 K156 C157 Q158A150-I154 WeakPolarHBondContact O-CG1 3.47Å; A150-I154 PolarHBondContact O-N 2.98Å; A151-I154 PolarHBondContact O-N 2.96Å; I154-K156 VanDerWaalsContact C-N 3.3Å; I154-K156 PolarHBondContact O-N 3.3Å; I154-C157 WeakPolarHBondContact O-CB 3.24Å; I154-C157 PolarHBondContact O-N 2.95Å; I154-Q158 PolarHBondContact O-N 3.5Å
155Y76.7Confident73.2Confident152 Ų15254.2 Ų54.260%0.59631%0.307SS*.Hα-helixtrans-58.7-41.2177.7177.6-101.9000112A151 L152 Q158 S159A151-Y155 WeakPolarHBondContact O-CB 3.41Å; A151-Y155 PolarHBondContact O-N 3.31Å; L152-Y155 PolarHBondContact O-N 3.29Å; Y155-Q158 WeakPolarHBondContact O-CB 3.33Å; Y155-Q158 PolarHBondContact O-N 2.82Å; Y155-S159 WeakPolarHBondContact O-CB 3.21Å; Y155-S159 PolarHBondContact O-N 3.48Å
156K72.8Confident71.6Confident17 Ų1760.2 Ų60.27%0.07434%0.335CS..Hα-helixtrans-72.8-36.6176.3-168.172.1178178.40112.8M93 G97 V108 L152 A153 I154 Q158 S159 M160M93-K156 HydrophobicContact CB-CD 4.16Å; M93-K156 HydrophobicContact CE-CB 3.16Å; M93-K156 HydrophobicContact CE-CD 4.35Å; M93-K156 HydrophobicContact CE-CG 3.57Å; M93-K156 HydrophobicContact CG-CB 4.4Å; M93-K156 HydrophobicContact CG-CD 3.79Å; M93-K156 HydrophobicContact CG-CG 3.85Å; M93-K156 PolarHBondContact O-NZ 3.16Å; M93-K156 VanDerWaalsContact O-NZ 3.15Å; M93-K156 HydrophobicContact SD-CB 3.57Å; M93-K156 VanDerWaalsContact SD-CB 3.57Å; M93-K156 HydrophobicContact SD-CD 3.76Å; M93-K156 HydrophobicContact SD-CG 3.68Å; G97-K156 PolarHBondContact O-NZ 3.15Å; V108-K156 HydrophobicContact CG2-CG 4.4Å; L152-K156 PolarHBondContact O-N 3.44Å; A153-K156 PolarHBondContact O-N 2.92Å; I154-K156 VanDerWaalsContact C-N 3.3Å; I154-K156 PolarHBondContact O-N 3.3Å; K156-Q158 PolarHBondContact O-N 3.39Å; K156-S159 CarbonylContact O-C 3.58Å; K156-S159 PolarHBondContact O-N 3.09Å; K156-S159 VanDerWaalsContact O-N 3.16Å; K156-M160 HydrophobicContact CD-CE 4.46Å; K156-M160 HydrophobicContact CD-CG 4.46Å; K156-M160 HydrophobicContact CG-CE 4.41Å; K156-M160 HydrophobicContact CG-CG 4.29Å; K156-M160 WeakPolarHBondContact O-CB 3.36Å; K156-M160 WeakPolarHBondContact O-CG 3.28Å; K156-M160 PolarHBondContact O-N 3.02Å
157C69.8Low70.1Confident19 Ų1964.4 Ų64.413%0.12837%0.365CS..Hα-helixtrans-56.6-40.8171.1-90.70000111.7V108 A153 I154 G161 L162 L163V108-C157 VanDerWaalsContact CG1-SG 3.54Å; A153-C157 PolarHBondContact O-N 3.34Å; I154-C157 WeakPolarHBondContact O-CB 3.24Å; I154-C157 PolarHBondContact O-N 2.95Å; C157-G161 PolarHBondContact O-N 3.42Å; C157-L162 PolarHBondContact O-N 3.18Å; C157-L163 HydrophobicContact CB-CD1 4.42Å; C157-L163 HydrophobicContact CB-CG 4.39Å
158Q69.8Low68.9Low122 Ų12262.5 Ų62.557%0.5736%0.361SS*.Hα-helixtrans-66.6-47.7172.9-173.9-179-9.300111.7I154 Y155 K156 M160 G161 L163I154-Q158 PolarHBondContact O-N 3.5Å; Y155-Q158 WeakPolarHBondContact O-CB 3.33Å; Y155-Q158 PolarHBondContact O-N 2.82Å; K156-Q158 PolarHBondContact O-N 3.39Å; Q158-M160 PolarHBondContact O-N 3.48Å; Q158-G161 PolarHBondContact O-N 3.28Å; Q158-L163 HydrophobicContact CB-CD1 3.93Å
159S64Low68.2Low45 Ų4561.9 Ų61.932%0.31536%0.358SS..Hα-helixtrans-64.4-23.3179.7-174.10000113.8N98 Y155 K156N98-S159 PolarHBondContact ND2-O 3.25Å; N98-S159 PolarHBondContact OD1-OG 3.25Å; Y155-S159 WeakPolarHBondContact O-CB 3.21Å; Y155-S159 PolarHBondContact O-N 3.48Å; K156-S159 CarbonylContact O-C 3.58Å; K156-S159 PolarHBondContact O-N 3.09Å; K156-S159 VanDerWaalsContact O-N 3.16Å
160M62.6Low67.7Low8 Ų868.3 Ų68.34%0.03938%0.38CS..THydrogen-bonded Turntrans-91-2.3174.5-71.5-161.8165.900113.5P104 K156 Q158 L162P104-M160 HydrophobicContact CB-CE 3.71Å; P104-M160 HydrophobicContact CB-SD 4.1Å; P104-M160 HydrophobicContact CG-CE 4.48Å; K156-M160 HydrophobicContact CD-CE 4.46Å; K156-M160 HydrophobicContact CD-CG 4.46Å; K156-M160 HydrophobicContact CG-CE 4.41Å; K156-M160 HydrophobicContact CG-CG 4.29Å; K156-M160 WeakPolarHBondContact O-CB 3.36Å; K156-M160 WeakPolarHBondContact O-CG 3.28Å; K156-M160 PolarHBondContact O-N 3.02Å; Q158-M160 PolarHBondContact O-N 3.48Å; M160-L162 VanDerWaalsContact C-N 3.31Å; M160-L162 HydrophobicContact CB-CD1 3.77Å; M160-L162 HydrophobicContact CB-CG 4.02Å; M160-L162 PolarHBondContact O-N 3.38Å; M160-L162 HydrophobicContact SD-CD1 4.44Å
161G60.9Low66.7Low44 Ų4473.2 Ų73.245%0.45440%0.403SS..THydrogen-bonded Turntrans69.624.6177.100000114.5C157 Q158C157-G161 PolarHBondContact O-N 3.42Å; Q158-G161 PolarHBondContact O-N 3.28Å
162L61.9Low65.9Low62 Ų6274.9 Ų74.933%0.32542%0.417SS..  trans-87.2-16.5-177.1-63.3160.2000113.2I105 C157 M160I105-L162 HydrophobicContact CB-CD1 4.24Å; I105-L162 HydrophobicContact CB-CD2 4.42Å; I105-L162 HydrophobicContact CD1-CD1 4.47Å; I105-L162 HydrophobicContact CD1-CD2 3.38Å; I105-L162 HydrophobicContact CD1-CG 4.47Å; I105-L162 HydrophobicContact CG1-CD1 3.65Å; I105-L162 HydrophobicContact CG1-CD2 3.54Å; I105-L162 HydrophobicContact CG1-CG 4.18Å; I105-L162 HydrophobicContact CG2-CD1 4.04Å; I105-L162 HydrophobicContact CG2-CD2 4.03Å; C157-L162 PolarHBondContact O-N 3.18Å; M160-L162 VanDerWaalsContact C-N 3.31Å; M160-L162 HydrophobicContact CB-CD1 3.77Å; M160-L162 HydrophobicContact CB-CG 4.02Å; M160-L162 PolarHBondContact O-N 3.38Å; M160-L162 HydrophobicContact SD-CD1 4.44Å
163L59.4Low65.6Low63 Ų6380.6 Ų80.633%0.3344%0.44SS..SBendtrans-81.1134.4175.1-70.7166.9000108.2C157 Q158 T165C157-L163 HydrophobicContact CB-CD1 4.42Å; C157-L163 HydrophobicContact CB-CG 4.39Å; Q158-L163 HydrophobicContact CB-CD1 3.93Å; L163-T165 HydrophobicContact CB-CG2 3.68Å; L163-T165 PolarHBondContact O-N 3.16Å; L163-T165 PolarHBondContact O-OG1 3.28Å
164P55.1Low65.6Low86 Ų8686.1 Ų86.156%0.55847%0.469SS*.THydrogen-bonded Turntrans-67.268.9175.329.3-34.7000110.3D169 W170P164-D169 WeakPolarHBondContact CA-OD2 3.45Å; P164-D169 HydrophobicContact CB-CB 4.45Å; P164-W170 PolarHBondContact O-NE1 2.82Å
165T60.1Low65.5Low100 Ų10089.2 Ų89.261%0.61348%0.481SS*.THydrogen-bonded Turntrans-126-14.1-170.1510000110.8L163 D169L163-T165 HydrophobicContact CB-CG2 3.68Å; L163-T165 PolarHBondContact O-N 3.16Å; L163-T165 PolarHBondContact O-OG1 3.28Å; T165-D169 PolarHBondContact N-OD2 2.9Å
166H53.2Low65.6Low126 Ų12687 Ų8758%0.58349%0.485SS*.SBendtrans-92.1139.5177.1-150.7-100.9000109.5S168 D169H166-S168 WeakPolarHBondContact CB-OG 3.5Å; H166-S168 PolarHBondContact ND1-OG 3Å; H166-S168 PolarHBondContact O-N 2.88Å; H166-D169 PolarHBondContact N-OD2 2.66Å; H166-D169 VanDerWaalsContact N-OD2 3.16Å; H166-D169 WeakPolarHBondContact O-CB 3.33Å; H166-D169 PolarHBondContact O-N 3.49Å
167S54.8Low65.9Low99 Ų9992.2 Ų92.269%0.69252%0.521SS*.G310 helixtrans-57.8-21.2179.8-50.30000113D169 W170 L171S167-D169 VanDerWaalsContact C-N 3.32Å; S167-W170 PolarHBondContact O-N 3.33Å; S167-L171 PolarHBondContact O-N 3.34Å
168S60.7Low66.5Low68 Ų6899.7 Ų99.748%0.47655%0.554SS.*G310 helixtrans-65.4-30.2172.349.50000113.8H166 W170 L171H166-S168 WeakPolarHBondContact CB-OG 3.5Å; H166-S168 PolarHBondContact ND1-OG 3Å; H166-S168 PolarHBondContact O-N 2.88Å; S168-W170 PolarHBondContact O-N 3.35Å; S168-L171 WeakPolarHBondContact O-CB 3.38Å; S168-L171 PolarHBondContact O-N 3.34Å
169D69.3Low66.9Low67 Ų67105 Ų10536%0.35857%0.569SS.*G310 helixtrans-70.5-21.6179-53.9-34.9000111.4P164 T165 H166 S167P164-D169 WeakPolarHBondContact CA-OD2 3.45Å; P164-D169 HydrophobicContact CB-CB 4.45Å; T165-D169 PolarHBondContact N-OD2 2.9Å; H166-D169 PolarHBondContact N-OD2 2.66Å; H166-D169 VanDerWaalsContact N-OD2 3.16Å; H166-D169 WeakPolarHBondContact O-CB 3.33Å; H166-D169 PolarHBondContact O-N 3.49Å; S167-D169 VanDerWaalsContact C-N 3.32Å
170W71.3Confident67.8Low143 Ų143111.6 Ų111.654%0.54260%0.597SS.*G310 helixtrans-99.7-8-179.5-58.690.3000113.2P164 S167 S168 A172 F173P164-W170 PolarHBondContact O-NE1 2.82Å; S167-W170 PolarHBondContact O-N 3.33Å; S168-W170 PolarHBondContact O-N 3.35Å; W170-A172 PolarHBondContact O-N 3.05Å; W170-F173 HydrophobicContact CE3-CD2 4.24Å; W170-F173 PolarHBondContact O-N 3.28Å
171L61.2Low68.9Low119 Ų119118.8 Ų118.862%0.62363%0.63SS**G310 helixtrans-63.9-28.3-179.9-163.3116.7000112.3S167 S168 F173 I174S167-L171 PolarHBondContact O-N 3.34Å; S168-L171 WeakPolarHBondContact O-CB 3.38Å; S168-L171 PolarHBondContact O-N 3.34Å; L171-F173 PolarHBondContact O-N 3.22Å; L171-I174 PolarHBondContact O-N 3.22Å
172A67.2Low69.8Low90 Ų90124.3 Ų124.374%0.74465%0.648SS**G310 helixtrans-64.7-18175.300000113.5W170W170-A172 PolarHBondContact O-N 3.05Å
173F73.3Confident70.6Confident162 Ų162130.1 Ų130.171%0.71168%0.675SS**G310 helixtrans-104.80.5178.9-57.1-64.9000113.4W170 L171W170-F173 HydrophobicContact CE3-CD2 4.24Å; W170-F173 PolarHBondContact O-N 3.28Å; L171-F173 PolarHBondContact O-N 3.22Å
174I76.3Confident71.6Confident115 Ų115131 Ų13159%0.5970%0.699SS**SBendtrans-86.7120.4175-60.2175.9000107.7L171L171-I174 PolarHBondContact O-N 3.22Å
175E76Confident72.9Confident166 Ų166130.9 Ų130.978%0.77671%0.714SS**PPolyproline II helixtrans-62.7136.2174.7-72.4175.7176.900110.2
176P78.3Confident74Confident106 Ų106129.5 Ų129.569%0.68872%0.72SS**PPolyproline II helixtrans-61.7139.9178.225.8-33000109.6Q178P176-Q178 PolarHBondContact O-N 3.1Å; P176-Q178 VanDerWaalsContact O-N 3.1Å
177P79.9Confident75Confident126 Ų126131.9 Ų131.982%0.81873%0.734SS**PPolyproline II helixtrans-58.4121.5178.423.1-32.2000109.7R179P177-R179 PolarHBondContact O-N 3.11Å
178Q82Confident75.8Confident176 Ų176134 Ų13482%0.82274%0.742SS**PPolyproline II helixtrans-70.4125.7177.6-67.6-170.8-17.300109.3P176 M180P176-Q178 PolarHBondContact O-N 3.1Å; P176-Q178 VanDerWaalsContact O-N 3.1Å; Q178-M180 PolarHBondContact O-N 3.4Å; Q178-M180 VanDerWaalsContact O-N 3.11Å
179R77.4Confident75.8Confident234 Ų234141.6 Ų141.688%0.88378%0.776SS**  trans-66.7110174.6-70.5-176.6174.9-173.1-2.1108.8P177P177-R179 PolarHBondContact O-N 3.11Å
180M82.3Confident76.1Confident184 Ų184145.4 Ų145.491%0.90680%0.797SS**  trans-84.7-16.6177.9-64.7-135.6-67.600113.4Q178Q178-M180 PolarHBondContact O-N 3.4Å; Q178-M180 VanDerWaalsContact O-N 3.11Å
181E86.2Confident76.4Confident159 Ų159145.5 Ų145.574%0.74381%0.81SS**  trans-129.2132.6-177.2-62.8-178.4-178.500110.4
182I79.8Confident77.2Confident160 Ų160146.9 Ų146.982%0.82182%0.821SS**  trans-119.5105.4176-60.2173.2000106.7
183M78.5Confident77.8Confident183 Ų183150.3 Ų150.390%0.90183%0.825SS**  trans-101.4112.5166.1-74-173.1173.100108.6
184G80.8Confident78.1Confident81 Ų81149.6 Ų149.684%0.83583%0.832SS**  trans-114.8108.3173.700000109.8
185G82.7Confident78.2Confident85 Ų85151.9 Ų151.988%0.87685%0.849SS**  trans-129.9117.5169.800000108.6
186G82.7Confident78.4Confident71 Ų71150.9 Ų150.973%0.73285%0.854SS**  trans-108.8166.4175.200000111.3V188G186-V188 PolarHBondContact O-N 3.31Å
187M74.2Confident78.4Confident176 Ų176154.3 Ų154.387%0.86787%0.867SS**  trans-65.9126.3176.7-158.1-179.6-60.500109.7L189M187-L189 PolarHBondContact O-N 3.37Å
188V72.5Confident78.3Confident142 Ų142156.7 Ų156.786%0.86187%0.871SS**  trans-74.2110.4171.5179.10000106.9G186G186-V188 PolarHBondContact O-N 3.31Å
189L60.2Low77.9Confident229 Ų229154.9 Ų154.9100%1.19988%0.875SS**  trans-91.80167.5-87163.9000109.6M187M187-L189 PolarHBondContact O-N 3.37Å

Retrieved 189 of 189 residues in 138 ms (Link to these results)