A0A087X6D1_POEFO Loading...

F-box only protein 25

Substrate-recognition component of the SCF (SKP1-CUL1-F-box protein)-type E3 ubiquitin ligase complex. May play a role in accumulation of expanded polyglutamine (polyQ) protein huntingtin (HTT).

AlphaFold DB , UniProt , Accession A0A087X6D1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 365 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
1M24.6Very low36.2Very low229 Ų229126 Ų126100%1.12864%0.64SS**  01180-72.8175.2161.800108.1
2P33.6Very low36.7Very low119 Ų119120.3 Ų120.377%0.77364%0.636SS**  trans-74.2128.6174.716.3-4.6000108.9L4P2-L4 PolarHBondContact O-N 2.94Å; P2-L4 VanDerWaalsContact O-N 3.08Å
3F32.1Very low37.9Very low217 Ų217119.8 Ų119.895%0.95262%0.62SS**  trans-60.2109.3174.4-89.9-99.5000109.5G5F3-G5 PolarHBondContact O-N 3.03Å
4L33.6Very low38.4Very low167 Ų167114.6 Ų114.687%0.87460%0.599SS**  trans-68.1110.2162.3-79.4155.9000107.4P2P2-L4 PolarHBondContact O-N 2.94Å; P2-L4 VanDerWaalsContact O-N 3.08Å
5G36.1Very low39.5Very low59 Ų59115.1 Ų115.161%0.60859%0.59SS**  trans-54.6144.316600000109.8F3 D7F3-G5 PolarHBondContact O-N 3.03Å; G5-D7 PolarHBondContact O-N 3.08Å
6K35.1Very low40.3Very low226 Ų226112.4 Ų112.498%0.98358%0.581SS**SBendtrans-60.4-6.1-179.1-76-178.4174.5179.10114.5
7D41.3Very low40.6Very low64 Ų64114.8 Ų114.834%0.34259%0.586SS.*  trans-127.6112.7-176.8-167.4-0.6000111G5 R9G5-D7 PolarHBondContact O-N 3.08Å; D7-R9 PolarHBondContact O-N 2.85Å; D7-R9 VanDerWaalsContact OD1-CB 3.31Å; D7-R9 WeakPolarHBondContact OD1-CB 3.37Å; D7-R9 PolarHBondContact OD1-N 2.73Å
8W43Very low42.1Very low126 Ų126111.6 Ų111.648%0.47757%0.573SS.*THydrogen-bonded Turntrans-76.1-5.5177.560.3-86000112.9K240 F273W8-K240 HydrophobicContact CD2-CD 4.3Å; W8-K240 HydrophobicContact CE3-CB 4.33Å; W8-K240 HydrophobicContact CE3-CD 4.39Å; W8-K240 HydrophobicContact CZ3-CB 4.45Å; W8-K240 VanDerWaalsContact CZ3-O 3.24Å; W8-K240 WeakPolarHBondContact CZ3-O 3.44Å; W8-F273 HydrophobicContact CH2-CE2 4.33Å
9R43.3Very low42.9Very low102 Ų102114.9 Ų114.939%0.38559%0.592SS.*THydrogen-bonded Turntrans-91.9-7.8178.9-61.7179.3162.8108.8-7.7114.5D7 P11D7-R9 PolarHBondContact O-N 2.85Å; D7-R9 VanDerWaalsContact OD1-CB 3.31Å; D7-R9 WeakPolarHBondContact OD1-CB 3.37Å; D7-R9 PolarHBondContact OD1-N 2.73Å; R9-P11 WeakPolarHBondContact O-CD 3.36Å
10S36.7Very low43.1Very low29 Ų29121.7 Ų121.720%0.20361%0.609CS.*SBendtrans-71.8121.2160.1-82.20000106.4G12 R118S10-G12 PolarHBondContact O-N 2.79Å; S10-R118 PolarHBondContact OG-NH2 3.1Å
11P39.1Very low44.2Very low48 Ų48117.3 Ų117.331%0.31260%0.596SS.*PPolyproline II helixtrans-53120.3153.226.5-30000103.8R9 W13 L117R9-P11 WeakPolarHBondContact O-CD 3.36Å; P11-W13 PolarHBondContact O-N 2.88Å; P11-L117 HydrophobicContact CG-CB 4.11Å
12G41.9Very low45.5Very low58 Ų58113.9 Ų113.960%0.59857%0.57SS**PPolyproline II helixtrans-46.8143.4-174.300000109.3S10 S14S10-G12 PolarHBondContact O-N 2.79Å; G12-S14 PolarHBondContact O-N 3.45Å
13W52Low46Very low114 Ų114114.9 Ų114.943%0.43256%0.562SS.*PPolyproline II helixtrans-47.2136.4172.9-54.9-28.3000108.7P11 W15 R24P11-W13 PolarHBondContact O-N 2.88Å; W13-W15 HydrophobicContact CD2-CZ2 4.49Å; W13-W15 HydrophobicContact CE3-CH2 4.19Å; W13-W15 AromaticContact CE3-CZ2 3.42Å; W13-W15 HydrophobicContact CE3-CZ2 3.42Å; W13-W15 VanDerWaalsContact CE3-CZ2 3.42Å; W13-W15 AromaticContact CZ3-CZ2 3.99Å; W13-W15 HydrophobicContact CZ3-CZ2 3.99Å; W13-W15 PolarHBondContact O-N 3.25Å; W13-W15 VanDerWaalsContact O-N 3.14Å; W13-W15 PolarHBondContact O-NE1 3.1Å; W13-R24 HydrophobicContact CB-CG 4.15Å; W13-R24 VanDerWaalsContact CD1-NH2 3.27Å; W13-R24 VanDerWaalsContact CD2-NE 3.29Å; W13-R24 VanDerWaalsContact CE2-NH2 3.27Å; W13-R24 VanDerWaalsContact CG-NE 3.32Å; W13-R24 VanDerWaalsContact NE1-NH2 3.16Å
14S45.4Very low47Very low46 Ų46108.1 Ų108.132%0.32253%0.53SS..PPolyproline II helixtrans-65.5120.5176.6-55.40000107.3G12 I25G12-S14 PolarHBondContact O-N 3.45Å; S14-I25 WeakPolarHBondContact O-CB 3.43Å; S14-I25 PolarHBondContact O-N 2.72Å
15W54.5Low47.6Very low122 Ų122103.3 Ų103.346%0.46251%0.505SS..EExtended strand (participates in β ladder)trans-115.7131.7-179.3-65.296.4000108.9W13 W22 K23 R24W13-W15 HydrophobicContact CD2-CZ2 4.49Å; W13-W15 HydrophobicContact CE3-CH2 4.19Å; W13-W15 AromaticContact CE3-CZ2 3.42Å; W13-W15 HydrophobicContact CE3-CZ2 3.42Å; W13-W15 VanDerWaalsContact CE3-CZ2 3.42Å; W13-W15 AromaticContact CZ3-CZ2 3.99Å; W13-W15 HydrophobicContact CZ3-CZ2 3.99Å; W13-W15 PolarHBondContact O-N 3.25Å; W13-W15 VanDerWaalsContact O-N 3.14Å; W13-W15 PolarHBondContact O-NE1 3.1Å; W15-W22 HydrophobicContact CB-CE3 3.85Å; W15-W22 HydrophobicContact CB-CZ3 4.44Å; W15-W22 HydrophobicContact CE3-CB 3.89Å; W15-W22 HydrophobicContact CZ3-CB 4.4Å; W15-K23 CarbonylContact C-O 3.58Å; W15-K23 WeakPolarHBondContact CA-O 3.42Å; W15-R24 HydrophobicContact CE3-CB 3.99Å; W15-R24 HydrophobicContact CH2-CB 4.36Å; W15-R24 HydrophobicContact CZ3-CB 3.89Å
16T52.5Low47.8Very low72 Ų72104.2 Ų104.244%0.44250%0.498SS..EExtended strand (participates in β ladder)trans-102.7131.5170.3-19.30000108.6T18 K23 I25T16-T18 PolarHBondContact O-N 2.85Å; T16-K23 PolarHBondContact N-O 3.35Å; T16-K23 PolarHBondContact O-N 2.79Å; T16-I25 WeakPolarHBondContact OG1-CD1 3.44Å; T16-I25 WeakPolarHBondContact OG1-CG1 3.44Å
17K45Very low47.8Very low154 Ų154100.7 Ų100.767%0.6748%0.483SS*.EExtended strand (participates in β ladder)trans-74124.5171.6-165.8-179.9179.3-173.50108.2W22K17-W22 HydrophobicContact CB-CE3 4.08Å; K17-W22 HydrophobicContact CB-CH2 4.19Å; K17-W22 HydrophobicContact CB-CZ3 3.91Å; K17-W22 HydrophobicContact CD-CH2 4.44Å; K17-W22 HydrophobicContact CD-CZ2 4.36Å; K17-W22 HydrophobicContact CG-CH2 4.48Å; K17-W22 HydrophobicContact CG-CZ2 4.44Å
18T68Low47.3Very low57 Ų57106 Ų10635%0.3550%0.503SS..EExtended strand (participates in β ladder)trans-118.6164.3174.866.20000109.4T16 R20 G21 K23T16-T18 PolarHBondContact O-N 2.85Å; T18-R20 PolarHBondContact O-N 3.1Å; T18-G21 CarbonylContact C-O 3.59Å; T18-G21 WeakPolarHBondContact CA-O 3.23Å; T18-G21 PolarHBondContact N-O 3.3Å; T18-G21 PolarHBondContact O-N 3.32Å; T18-G21 VanDerWaalsContact O-O 3.05Å; T18-G21 PolarHBondContact OG1-O 3.46Å; T18-K23 HydrophobicContact CG2-CB 3.76Å; T18-K23 HydrophobicContact CG2-CD 4.43Å
19D56.8Low46.9Very low175 Ų175103.2 Ų103.294%0.93651%0.514SS*.THydrogen-bonded Turntrans-60.4-18.7179.7-53-30000113.1
20R47.5Very low46Very low249 Ų249106.9 Ų106.994%0.9454%0.535SS*.THydrogen-bonded Turntrans-103.411.2177.1-59.2-172.2-178.2-1641.1113.9T18T18-R20 PolarHBondContact O-N 3.1Å
21G65.5Low45.5Very low31 Ų31113.9 Ų113.932%0.3257%0.565SS.*EExtended strand (participates in β ladder)trans117.7-160.1179.500000113.7T18T18-G21 CarbonylContact C-O 3.59Å; T18-G21 WeakPolarHBondContact CA-O 3.23Å; T18-G21 PolarHBondContact N-O 3.3Å; T18-G21 PolarHBondContact O-N 3.32Å; T18-G21 VanDerWaalsContact O-O 3.05Å; T18-G21 PolarHBondContact OG1-O 3.46Å
22W53Low45Very low157 Ų157119.3 Ų119.360%0.59559%0.591SS**EExtended strand (participates in β ladder)trans-85.8118.7-178.4-65.893.2000110.6W15 K17W15-W22 HydrophobicContact CB-CE3 3.85Å; W15-W22 HydrophobicContact CB-CZ3 4.44Å; W15-W22 HydrophobicContact CE3-CB 3.89Å; W15-W22 HydrophobicContact CZ3-CB 4.4Å; K17-W22 HydrophobicContact CB-CE3 4.08Å; K17-W22 HydrophobicContact CB-CH2 4.19Å; K17-W22 HydrophobicContact CB-CZ3 3.91Å; K17-W22 HydrophobicContact CD-CH2 4.44Å; K17-W22 HydrophobicContact CD-CZ2 4.36Å; K17-W22 HydrophobicContact CG-CH2 4.48Å; K17-W22 HydrophobicContact CG-CZ2 4.44Å
23K43.9Very low44.3Very low139 Ų139124.5 Ų124.560%0.60460%0.599SS**EExtended strand (participates in β ladder)trans-102.2133.2174.7-170.1175.7178.4-1770109.5W15 T16 T18W15-K23 CarbonylContact C-O 3.58Å; W15-K23 WeakPolarHBondContact CA-O 3.42Å; T16-K23 PolarHBondContact N-O 3.35Å; T16-K23 PolarHBondContact O-N 2.79Å; T18-K23 HydrophobicContact CG2-CB 3.76Å; T18-K23 HydrophobicContact CG2-CD 4.43Å
24R52.3Low43.4Very low76 Ų76126 Ų12629%0.28762%0.616SS.*EExtended strand (participates in β ladder)trans-73.9132176.2-167177.6-173.3-151.5-3.3109.5W13 W15 V26W13-R24 HydrophobicContact CB-CG 4.15Å; W13-R24 VanDerWaalsContact CD1-NH2 3.27Å; W13-R24 VanDerWaalsContact CD2-NE 3.29Å; W13-R24 VanDerWaalsContact CE2-NH2 3.27Å; W13-R24 VanDerWaalsContact CG-NE 3.32Å; W13-R24 VanDerWaalsContact NE1-NH2 3.16Å; W15-R24 HydrophobicContact CE3-CB 3.99Å; W15-R24 HydrophobicContact CH2-CB 4.36Å; W15-R24 HydrophobicContact CZ3-CB 3.89Å; R24-V26 HydrophobicContact CB-CG2 4.35Å; R24-V26 HydrophobicContact CG-CG2 4.18Å; R24-V26 PolarHBondContact O-N 2.81Å
25I47.8Very low42.5Very low66 Ų66130.7 Ų130.734%0.33864%0.637SS.*  trans-77.9109.7164.9-60.2163.8000105.6S14 T16 F27S14-I25 WeakPolarHBondContact O-CB 3.43Å; S14-I25 PolarHBondContact O-N 2.72Å; T16-I25 WeakPolarHBondContact OG1-CD1 3.44Å; T16-I25 WeakPolarHBondContact OG1-CG1 3.44Å; I25-F27 HydrophobicContact CG2-CD2 4Å; I25-F27 HydrophobicContact CG2-CE1 4.43Å; I25-F27 HydrophobicContact CG2-CE2 3.65Å; I25-F27 HydrophobicContact CG2-CZ 3.89Å
26V39.5Very low41.7Very low78 Ų78132 Ų13247%0.47365%0.653SS.*  trans-102.2107.4172.7-165.10000106.4R24 F28R24-V26 HydrophobicContact CB-CG2 4.35Å; R24-V26 HydrophobicContact CG-CG2 4.18Å; R24-V26 PolarHBondContact O-N 2.81Å; V26-F28 HydrophobicContact CB-CD2 4.01Å; V26-F28 HydrophobicContact CB-CE2 4.27Å; V26-F28 HydrophobicContact CG1-CD2 3.25Å; V26-F28 HydrophobicContact CG1-CE2 3.29Å; V26-F28 HydrophobicContact CG1-CG 4.15Å; V26-F28 HydrophobicContact CG1-CZ 4.18Å; V26-F28 PolarHBondContact O-N 2.7Å
27F35.7Very low40.6Very low152 Ų152137.4 Ų137.467%0.66767%0.67SS**  trans-74.379167-68.4-81000107.4I25I25-F27 HydrophobicContact CG2-CD2 4Å; I25-F27 HydrophobicContact CG2-CE1 4.43Å; I25-F27 HydrophobicContact CG2-CE2 3.65Å; I25-F27 HydrophobicContact CG2-CZ 3.89Å
28F30.3Very low39.9Very low174 Ų174138 Ų13876%0.76368%0.681SS**  trans-75.5133.5158-85.9-72.3000107.3V26 H30V26-F28 HydrophobicContact CB-CD2 4.01Å; V26-F28 HydrophobicContact CB-CE2 4.27Å; V26-F28 HydrophobicContact CG1-CD2 3.25Å; V26-F28 HydrophobicContact CG1-CE2 3.29Å; V26-F28 HydrophobicContact CG1-CG 4.15Å; V26-F28 HydrophobicContact CG1-CZ 4.18Å; V26-F28 PolarHBondContact O-N 2.7Å; F28-H30 PolarHBondContact O-N 3.39Å
29G33.3Very low37.9Very low68 Ų68142.3 Ų142.370%0.70170%0.7SS**  trans-52.5125.116400000107.5E31G29-E31 VanDerWaalsContact C-N 3.35Å; G29-E31 PolarHBondContact O-N 3.07Å
30H25.4Very low36.5Very low180 Ų180140.4 Ų140.483%0.83369%0.69SS**  trans-53.2107.6164.7-108.6-83.3000106.8F28 L32F28-H30 PolarHBondContact O-N 3.39Å; H30-L32 PolarHBondContact O-N 3Å; H30-L32 VanDerWaalsContact O-N 3.13Å
31E25.9Very low35.5Very low176 Ų176136.3 Ų136.382%0.82269%0.686SS**  trans-52.5114.5143.6-72-179.5163.700104.7G29 E33G29-E31 VanDerWaalsContact C-N 3.35Å; G29-E31 PolarHBondContact O-N 3.07Å; E31-E33 PolarHBondContact O-N 3.31Å
32L29.3Very low33.7Very low162 Ų162139.9 Ų139.985%0.84870%0.702SS**  trans-63.191.3171.1-74160.6000106.3H30 D34H30-L32 PolarHBondContact O-N 3Å; H30-L32 VanDerWaalsContact O-N 3.13Å; L32-D34 PolarHBondContact O-N 3.28Å
33E25.7Very low32.5Very low167 Ų167141 Ų14178%0.7871%0.713SS**  trans-68113.6151.7-78.7-174162.900106.7E31 N35E31-E33 PolarHBondContact O-N 3.31Å; E33-N35 PolarHBondContact O-N 2.9Å; E33-N35 VanDerWaalsContact O-N 3.12Å
34D35.2Very low31.6Very low146 Ų146142.2 Ų142.278%0.78173%0.726SS**  trans-40.2114.3165.1-92.5-35.9000110.3L32L32-D34 PolarHBondContact O-N 3.28Å
35N26.5Very low30.4Very low144 Ų144145.1 Ų145.177%0.7776%0.757SS**  trans-135.784.6157.9-90.5-47.2000108.3E33 K37E33-N35 PolarHBondContact O-N 2.9Å; E33-N35 VanDerWaalsContact O-N 3.12Å; N35-K37 PolarHBondContact O-N 3.44Å; N35-K37 VanDerWaalsContact O-N 3.1Å
36N36.3Very low29.3Very low149 Ų149146.7 Ų146.780%0.79777%0.773SS**  trans-53.3108156.8-80.3-33.9000109
37K28.7Very low28.7Very low185 Ų185149.8 Ų149.880%0.80479%0.787SS**  trans-134.5105150-80.1-172176.2176.60107.9N35 I39N35-K37 PolarHBondContact O-N 3.44Å; N35-K37 VanDerWaalsContact O-N 3.1Å; K37-I39 PolarHBondContact O-N 3.29Å
38D30.9Very low28.2Very low166 Ų166149.5 Ų149.589%0.88879%0.793SS**  trans-47.4121.7160.8-70.3-51.3000109
39I27.3Very low28.1Very low148 Ų148147.5 Ų147.576%0.75979%0.79SS**  trans-110105.8164-63.9178.5000106K37K37-I39 PolarHBondContact O-N 3.29Å
40D25.7Very low27.8Very low135 Ų135151.2 Ų151.272%0.72279%0.789SS**  trans-58.1124.8173.7-151-0.1000110.1
41L26.8Very low27.9Very low164 Ų164149.2 Ų149.286%0.85978%0.784SS**  trans-115.163177.2-103.5157.2000108.3
42T29.1Very low27.9Very low106 Ų106147.3 Ų147.365%0.6578%0.779SS**  trans-109.581.4164.251.20000109.1
43E27.4Very low27.7Very low179 Ų179148.6 Ų148.684%0.83678%0.778SS**  trans-171.4104.5154.1-114169.8-170.600109.3
44L25.4Very low27.6Very low166 Ų166147.1 Ų147.187%0.86978%0.78SS**  trans16465141.8-84.2157.2000108.8
45C26.2Very low27.1Very low137 Ų137143.4 Ų143.493%0.92678%0.777SS**  trans-113.1108.3152.1-75.40000107
46S25.3Very low27.5Very low98 Ų98145.9 Ų145.969%0.68578%0.784SS**  trans-143.6100.1162.558.10000108.6
47D25.3Very low27.2Very low144 Ų144145.3 Ų145.377%0.7779%0.785SS**  trans36.8121.7142.2-66.3-19.1000121.3
48N27Very low27.3Very low146 Ų146140.6 Ų140.678%0.78177%0.774SS**  177.7121.894.2-92.9-43.1000112.9
49N28Very low27.2Very low131 Ų131141.6 Ų141.670%0.70177%0.774SS**  trans10.2143132.9-77.514.3000118.5
50E26.9Very low27.4Very low147 Ų147142.1 Ų142.169%0.68778%0.777SS**  cis-175.3145.331.9-113.5157.3-132.100108.8
51N27.9Very low27.7Very low138 Ų138137.8 Ų137.874%0.73876%0.761SS**  trans152.2108.4130.3-75.9-47000116.3
52L25.6Very low28Very low136 Ų136133.9 Ų133.971%0.71274%0.741SS**  trans54.8113.7135.8-77.2108.2000124.1
53F23.6Very low28.2Very low188 Ų188133.6 Ų133.683%0.82574%0.739SS**  58.7139.6125.4-83.8-79.6000120
54V25.5Very low28.6Very low136 Ų136132.9 Ų132.982%0.82473%0.733SS**  cis-152.5150.612.8159.50000106.7
55G24.4Very low29.1Very low69 Ų69133.2 Ų133.271%0.71172%0.722SS**  trans158.268.8155.900000116.5V57G55-V57 PolarHBondContact O-N 3.47Å
56E33.3Very low29.4Very low196 Ų196134.5 Ų134.592%0.91671%0.712SS**  trans-58.397.7167.2-74.6176.6128.900112
57V31.3Very low29.7Very low136 Ų136138.2 Ų138.282%0.82472%0.716SS**  trans-160.574.6146.7-170.90000109.5G55G55-V57 PolarHBondContact O-N 3.47Å
58C30.6Very low30.2Very low86 Ų86138 Ų13858%0.58171%0.711SS**  trans-169.223.2160.8-118.90000117.8L60C58-L60 VanDerWaalsContact C-N 3.35Å; C58-L60 PolarHBondContact O-N 3.39Å
59E28.6Very low30.7Very low188 Ų188139.1 Ų139.188%0.87971%0.709SS**THydrogen-bonded Turntrans-79.7-9.7-174.3-69.9-162.1147.100115.5
60L31.6Very low30.9Very low158 Ų158142 Ų14283%0.82771%0.711SS**THydrogen-bonded Turntrans-93.6-9.6178.7-142.373.9000115C58C58-L60 VanDerWaalsContact C-N 3.35Å; C58-L60 PolarHBondContact O-N 3.39Å
61A31.8Very low31.2Very low45 Ų45140 Ų14037%0.37271%0.705SS.*THydrogen-bonded Turntrans-92.4-23.9-178.300000113.6R65A61-R65 PolarHBondContact O-N 2.91Å
62N33.7Very low31.5Very low82 Ų82140.1 Ų140.144%0.43971%0.706SS.*Hα-helixtrans-80.7-22.5-173.7-70.5-22.8000113.5K66N62-K66 PolarHBondContact O-N 2.95Å; N62-K66 VanDerWaalsContact O-N 3.17Å
63T33.7Very low31.8Very low99 Ų99139.7 Ų139.761%0.60770%0.704SS**Hα-helixtrans-76.9-28.8174.949.10000112.6
64K34.1Very low32.2Very low164 Ų164134.6 Ų134.671%0.71369%0.689SS**Hα-helixtrans-72.5-37.5168.8-84.6-178.6176.5175.20112.6K67K64-K67 PolarHBondContact O-N 3.36Å
65R36.5Very low32.6Very low173 Ų173137.1 Ų137.165%0.65369%0.689SS**Hα-helixtrans-67.1-35176.6-80.7-179.7174.4164.4-2113.8A61A61-R65 PolarHBondContact O-N 2.91Å
66K33.3Very low33.3Very low165 Ų165137.5 Ų137.572%0.71768%0.68SS**Hα-helixtrans-74.3-27.3177.8-78.6-177.2176-179.80113.6N62 E68N62-K66 PolarHBondContact O-N 2.95Å; N62-K66 VanDerWaalsContact O-N 3.17Å; K66-E68 VanDerWaalsContact C-N 3.35Å
67K31.9Very low33.4Very low176 Ų176136.9 Ų136.977%0.76568%0.677SS**Hα-helixtrans-76.3-21.6177.1-148.9173.3-174.3176.30113K64K64-K67 PolarHBondContact O-N 3.36Å
68E36Very low33.9Very low140 Ų140134.3 Ų134.365%0.65466%0.655SS**Hα-helixtrans-86.9-26.2178.7-71.1-176.3171.900113.8K66 Y70 N71K66-E68 VanDerWaalsContact C-N 3.35Å; E68-Y70 VanDerWaalsContact C-N 3.29Å; E68-Y70 PolarHBondContact O-N 3.22Å; E68-N71 PolarHBondContact O-N 3.5Å
69F35.7Very low34.3Very low168 Ų168135.3 Ų135.374%0.73766%0.658SS**Hα-helixtrans-65.6-31.4172.4-102.8-88.1000112.8N71F69-N71 VanDerWaalsContact C-N 3.31Å; F69-N71 PolarHBondContact O-N 3.1Å
70Y32.5Very low34.9Very low192 Ų192135.2 Ų135.275%0.75366%0.655SS**G310 helixtrans-77.6-12.2174.9-86.8-85.6000114E68 N73E68-Y70 VanDerWaalsContact C-N 3.29Å; E68-Y70 PolarHBondContact O-N 3.22Å; Y70-N73 PolarHBondContact O-N 3.45Å
71N33.1Very low36.2Very low106 Ų106133.1 Ų133.157%0.56764%0.637SS**G310 helixtrans-87.9-9.4179-15017.7000113.5E68 F69 N73 T74E68-N71 PolarHBondContact O-N 3.5Å; F69-N71 VanDerWaalsContact C-N 3.31Å; F69-N71 PolarHBondContact O-N 3.1Å; N71-N73 PolarHBondContact O-N 2.98Å; N71-T74 PolarHBondContact O-OG1 2.93Å
72N35.5Very low37.8Very low139 Ų139133.2 Ų133.274%0.74363%0.631SS**G310 helixtrans-72.5-13.6165.9-71.2-20.3000112.4
73N31.3Very low39.8Very low127 Ų127137.8 Ų137.868%0.67965%0.647SS**G310 helixtrans-9924.6177.5-138.36.3000112.7Y70 N71 K75Y70-N73 PolarHBondContact O-N 3.45Å; N71-N73 PolarHBondContact O-N 2.98Å; N73-K75 PolarHBondContact O-N 3.37Å
74T31.3Very low42.1Very low82 Ų82137.4 Ų137.450%0.50363%0.634SS.*SBendtrans-64.593.8156.4260000106.9N71 S76N71-T74 PolarHBondContact O-OG1 2.93Å; T74-S76 PolarHBondContact O-N 3.43Å
75K35.5Very low44.5Very low189 Ų189129.8 Ų129.882%0.82260%0.601SS**  trans-27.8113.6162.1-78.7178.4173.7179.20108.1N73 Q77N73-K75 PolarHBondContact O-N 3.37Å; K75-Q77 PolarHBondContact O-N 3.14Å
76S37.4Very low46.8Very low76 Ų76126.9 Ų126.953%0.53159%0.591SS.*  trans-20.8102.4177.8490000112.9T74 F78 V79T74-S76 PolarHBondContact O-N 3.43Å; S76-F78 PolarHBondContact O-N 3.41Å; S76-V79 VanDerWaalsContact O-CG2 3.24Å; S76-V79 WeakPolarHBondContact O-CG2 3.34Å; S76-V79 VanDerWaalsContact OG-CG2 3.28Å; S76-V79 WeakPolarHBondContact OG-CG2 3.44Å
77Q36.1Very low49.1Very low183 Ų183119.2 Ų119.286%0.85556%0.558SS**SBendtrans-69.78.6170-115174.7-4.700112.6K75K75-Q77 PolarHBondContact O-N 3.14Å
78F41.5Very low50.9Low82 Ų82113.1 Ų113.136%0.3653%0.532SS..  trans-112.842.7177.3-59.6-78.6000111.7S76 F80 N106S76-F78 PolarHBondContact O-N 3.41Å; F78-F80 VanDerWaalsContact C-N 3.34Å; F78-N106 HydrophobicContact CE1-CB 4.36Å
79V40.1Very low52Low107 Ų107113.6 Ų113.665%0.64853%0.532SS*.  trans-82.7-13.8174.6173.40000111.7S76 R81S76-V79 VanDerWaalsContact O-CG2 3.24Å; S76-V79 WeakPolarHBondContact O-CG2 3.34Å; S76-V79 VanDerWaalsContact OG-CG2 3.28Å; S76-V79 WeakPolarHBondContact OG-CG2 3.44Å; V79-R81 PolarHBondContact O-N 3.28Å; V79-R81 VanDerWaalsContact O-N 3.16Å
80F40.2Very low52.9Low186 Ų186107.4 Ų107.482%0.81652%0.516SS*.  trans-78.4101.2167.5-99.3-89.7000110.1F78F78-F80 VanDerWaalsContact C-N 3.34Å
81R59.8Low53.5Low115 Ų115102.2 Ų102.243%0.43451%0.508SS..  trans-108.8110.8174.6-69.5177.6178.9-170.713.3107.9V79 D109 S112V79-R81 PolarHBondContact O-N 3.28Å; V79-R81 VanDerWaalsContact O-N 3.16Å; R81-D109 HydrophobicContact CB-CB 4.41Å; R81-D109 WeakPolarHBondContact CD-OD2 3.34Å; R81-D109 HydrophobicContact CG-CB 4.47Å; R81-D109 IonicContact CZ-OD1 3.04Å; R81-D109 IonicContact CZ-OD2 3.27Å; R81-D109 IonicContact NE-OD1 2.66Å; R81-D109 IonicContact NE-OD2 2.79Å; R81-D109 IonicContact NH1-OD1 2.95Å; R81-D109 PolarHBondContact NH1-OD1 2.98Å; R81-D109 IonicContact NH1-OD2 2.65Å; R81-D109 PolarHBondContact NH1-OD2 3.32Å; R81-S112 PolarHBondContact NH1-OG 3.33Å
82D65.6Low54.2Low47 Ų47100.8 Ų100.825%0.25150%0.503SS..BIsolated β-bridgetrans-77.7133.3178-65.7-35.7000109.3W84 I85 R107D82-W84 VanDerWaalsContact CB-O 3.22Å; D82-W84 WeakPolarHBondContact CB-O 3.09Å; D82-W84 PolarHBondContact O-N 3.49Å; D82-I85 HydrophobicContact CB-CG2 4.35Å; D82-R107 PolarHBondContact N-O 3.37Å; D82-R107 IonicContact OD2-CZ 3.78Å; D82-R107 IonicContact OD2-NE 2.8Å; D82-R107 PolarHBondContact OD2-NE 3.35Å; D82-R107 IonicContact OD2-NH2 3.9Å; D82-R107 PolarHBondContact OD2-NH2 2.96Å
83K74Confident54.9Low178 Ų178103.8 Ų103.877%0.77451%0.509SS*.SBendtrans-60-25.5171.6-69.3-177.4177.7-179.40111.4F325K83-F325 WeakPolarHBondContact O-CB 3.33Å
84W83Confident55.8Low91 Ų91106.5 Ų106.535%0.34552%0.518SS..EExtended strand (participates in β ladder)trans-154.1151.2-178.651.8-91.8000109.9D82 T323 L324 F325 H340 P341D82-W84 VanDerWaalsContact CB-O 3.22Å; D82-W84 WeakPolarHBondContact CB-O 3.09Å; D82-W84 PolarHBondContact O-N 3.49Å; W84-T323 HydrophobicContact CE3-CG2 3.77Å; W84-T323 HydrophobicContact CZ3-CG2 4.22Å; W84-L324 CarbonylContact C-O 3.6Å; W84-L324 VanDerWaalsContact CA-O 3.32Å; W84-L324 WeakPolarHBondContact CA-O 3.33Å; W84-F325 HydrophobicContact CB-CB 3.7Å; W84-H340 HydrophobicContact CB-CB 4.03Å; W84-H340 HydrophobicContact CG-CB 4.01Å; W84-P341 HydrophobicContact CD2-CG 4.39Å; W84-P341 HydrophobicContact CH2-CG 3.99Å; W84-P341 HydrophobicContact CZ2-CG 3.51Å; W84-P341 VanDerWaalsContact NE1-CD 3.33Å
85I85.1Confident56.7Low3 Ų3110.4 Ų110.42%0.01552%0.524CS..EExtended strand (participates in β ladder)trans-117.9150.517267.7170.6000110D82 V87 A104 R107 L108 T323 L324 F363D82-I85 HydrophobicContact CB-CG2 4.35Å; I85-V87 HydrophobicContact CG1-CG2 4.37Å; I85-A104 HydrophobicContact CD1-CB 3.45Å; I85-A104 VanDerWaalsContact CD1-CB 3.45Å; I85-R107 HydrophobicContact CG2-CB 3.62Å; I85-L108 HydrophobicContact CD1-CD1 3.82Å; I85-L108 HydrophobicContact CD1-CD2 4.46Å; I85-L108 HydrophobicContact CD1-CG 3.95Å; I85-L108 HydrophobicContact CG1-CD1 4.3Å; I85-L108 HydrophobicContact CG1-CD2 4.14Å; I85-L108 HydrophobicContact CG1-CG 4.18Å; I85-L108 HydrophobicContact CG2-CD2 3.94Å; I85-L108 HydrophobicContact CG2-CG 3.98Å; I85-T323 CarbonylContact O-C 3.57Å; I85-T323 WeakPolarHBondContact O-CA 3.42Å; I85-L324 HydrophobicContact CD1-CB 4.49Å; I85-L324 HydrophobicContact CD1-CD2 4.12Å; I85-L324 HydrophobicContact CG1-CB 3.82Å; I85-L324 HydrophobicContact CG1-CD2 4.33Å; I85-L324 HydrophobicContact CG1-CG 4.44Å; I85-L324 PolarHBondContact N-O 3.1Å; I85-L324 PolarHBondContact O-N 3.37Å; I85-F363 HydrophobicContact CD1-CZ 4.31Å
86Y83.3Confident57.1Low113 Ų113108.1 Ų108.144%0.44352%0.516SS..EExtended strand (participates in β ladder)trans-85130.7172-174-97.2000110Q88 C99 C321 T323Y86-Q88 HydrophobicContact CD1-CB 4.35Å; Y86-Q88 HydrophobicContact CE1-CB 3.95Å; Y86-Q88 HydrophobicContact CE1-CG 4.29Å; Y86-C99 PolarHBondContact O-SG 3.37Å; Y86-C321 WeakPolarHBondContact CD2-O 3.44Å; Y86-C321 WeakPolarHBondContact CE2-O 3.36Å; Y86-T323 HydrophobicContact CD2-CG2 4.4Å
87V81.8Confident57.6Low4 Ų4107.2 Ų107.22%0.02452%0.518CS..  trans-110.9111.7176.6-177.90000108.4I85 F317 S322 L324 L362 F363I85-V87 HydrophobicContact CG1-CG2 4.37Å; V87-F317 HydrophobicContact CB-CD2 4.39Å; V87-F317 HydrophobicContact CB-CE2 3.9Å; V87-F317 HydrophobicContact CG1-CE2 4.4Å; V87-S322 PolarHBondContact N-O 2.79Å; V87-S322 WeakPolarHBondContact O-CB 3.18Å; V87-L324 HydrophobicContact CG2-CB 3.6Å; V87-L324 HydrophobicContact CG2-CD2 4.1Å; V87-L362 HydrophobicContact CG1-CB 4.26Å; V87-F363 HydrophobicContact CG1-CE1 4.26Å; V87-F363 HydrophobicContact CG2-CE1 4.24Å; V87-F363 HydrophobicContact CG2-CZ 4.13Å
88Q70.8Confident58.5Low48 Ų48106.7 Ų106.722%0.22451%0.509CS..  trans-80137.1-172.3-172.8168.1-16.400111.9Y86 G90Y86-Q88 HydrophobicContact CD1-CB 4.35Å; Y86-Q88 HydrophobicContact CE1-CB 3.95Å; Y86-Q88 HydrophobicContact CE1-CG 4.29Å; Q88-G90 WeakPolarHBondContact CG-O 3.37Å; Q88-G90 PolarHBondContact NE2-O 2.93Å
89K59.8Low59.9Low149 Ų149104.2 Ų104.265%0.64850%0.502SS*.SBendtrans-9311-176-119.1178.2-177.5178.10115.4
90G53.3Low62.1Low39 Ų39102.7 Ų102.740%0.40249%0.493SS..SBendtrans-177.9141.5-179.300000113.5Q88 T92Q88-G90 WeakPolarHBondContact CG-O 3.37Å; Q88-G90 PolarHBondContact NE2-O 2.93Å; G90-T92 PolarHBondContact O-N 2.79Å
91S45Very low64.4Low82 Ų8294.4 Ų94.457%0.57346%0.457SS*.  trans-78.7109.6177.2148.20000110.7H96S91-H96 PolarHBondContact OG-CE1 3.24Å; S91-H96 PolarHBondContact OG-ND1 3.46Å
92T48.3Very low65.8Low77 Ų7789.1 Ų89.147%0.47244%0.438SS..  trans-97.2132.5157.9510000108.5G90 E94 R95G90-T92 PolarHBondContact O-N 2.79Å; T92-E94 PolarHBondContact O-N 3.2Å; T92-R95 PolarHBondContact O-N 2.85Å
93K49.5Very low66.9Low202 Ų20290.4 Ų90.488%0.87844%0.442SS*.THydrogen-bonded Turntrans-52.3-22.8-174.2-73.5-177176179.80114.6
94E51.1Low67.6Low184 Ų18482 Ų8286%0.8641%0.406SS*.THydrogen-bonded Turntrans-85.7-9.9-179-64.5-179.2168.100115.1T92T92-E94 PolarHBondContact O-N 3.2Å
95R49.5Very low67.9Low164 Ų16477.7 Ų77.762%0.61939%0.39SS*.  trans-134.220.2-173.8-64.6-170.4-175.3-173.51.7114.7T92 G97T92-R95 PolarHBondContact O-N 2.85Å; R95-G97 PolarHBondContact O-N 3.29Å
96H43.4Very low68.2Low141 Ų14178.6 Ų78.665%0.65340%0.395SS*.THydrogen-bonded Turntrans-60.60.8-175-133.791000115.4S91S91-H96 PolarHBondContact OG-CE1 3.24Å; S91-H96 PolarHBondContact OG-ND1 3.46Å
97G48.9Very low68.4Low56 Ų5676.8 Ų76.858%0.57739%0.387SS*.THydrogen-bonded Turntrans-106.3-5.8-172.700000117.4R95R95-G97 PolarHBondContact O-N 3.29Å
98Y54.9Low68.7Low173 Ų17376.9 Ų76.968%0.67839%0.388SS*.SBendtrans-109.96.1-160.7-66.2-73.2000117.6
99C70.4Confident69.5Low29 Ų2976.2 Ų76.220%0.19639%0.385CS..  trans-149.461.6-179.5-153.80000112.7Y86 F363Y86-C99 PolarHBondContact O-SG 3.37Å; C99-F363 WeakPolarHBondContact O-CD1 3.28Å; C99-F363 VanDerWaalsContact SG-CE1 3.58Å
100T86Confident71Confident75 Ų7569.1 Ų69.146%0.4636%0.355SS..  trans-89.6161.8172.265.50000110.8G102 E103 A104T100-G102 PolarHBondContact O-N 3.3Å; T100-E103 PolarHBondContact O-N 3.24Å; T100-E103 PolarHBondContact OG1-N 3.4Å; T100-A104 PolarHBondContact O-N 3.14Å
101L89.4Confident72.7Confident13 Ų1368.1 Ų68.17%0.06834%0.342CS..Hα-helixtrans-52.9-41172178.564000111.9E103 A104 L105 Q134 L138 F359 I360 F363L101-E103 VanDerWaalsContact C-N 3.34Å; L101-E103 PolarHBondContact O-N 2.86Å; L101-A104 PolarHBondContact O-N 3.3Å; L101-L105 HydrophobicContact CG-CD1 4.4Å; L101-L105 WeakPolarHBondContact O-CG 3.37Å; L101-L105 PolarHBondContact O-N 3.04Å; L101-Q134 HydrophobicContact CD2-CB 3.71Å; L101-Q134 HydrophobicContact CD2-CG 3.86Å; L101-L138 HydrophobicContact CB-CD2 4.33Å; L101-L138 HydrophobicContact CD2-CD2 3.94Å; L101-L138 HydrophobicContact CG-CD2 3.94Å; L101-F359 HydrophobicContact CD1-CD1 4.05Å; L101-F359 HydrophobicContact CD1-CE1 3.47Å; L101-F359 VanDerWaalsContact CD1-CE1 3.47Å; L101-F359 HydrophobicContact CD1-CZ 4.33Å; L101-I360 HydrophobicContact CD2-CG2 4.42Å; L101-F363 HydrophobicContact CB-CB 3.94Å; L101-F363 HydrophobicContact CB-CD2 4.37Å; L101-F363 HydrophobicContact CB-CG 4.29Å; L101-F363 HydrophobicContact CD1-CD2 3.87Å; L101-F363 HydrophobicContact CD1-CE2 4.45Å
102G88.6Confident74.6Confident3 Ų366.9 Ų66.93%0.03133%0.333CS..Hα-helixtrans-64.6-36.9178.500000113.2T100 L105 N106 A142T100-G102 PolarHBondContact O-N 3.3Å; G102-L105 PolarHBondContact O-N 3.39Å; G102-N106 VanDerWaalsContact O-CG 3.24Å; G102-N106 PolarHBondContact O-N 2.95Å; G102-N106 VanDerWaalsContact O-N 3.12Å; G102-N106 PolarHBondContact O-ND2 3.35Å; G102-A142 VanDerWaalsContact CA-CB 3.44Å
103E87.9Confident76.5Confident74 Ų7463.2 Ų63.235%0.34631%0.31SS..Hα-helixtrans-69.5-41.6176.3-170.259.9-166.600111.6T100 L101 L105 N106 R107T100-E103 PolarHBondContact O-N 3.24Å; T100-E103 PolarHBondContact OG1-N 3.4Å; L101-E103 VanDerWaalsContact C-N 3.34Å; L101-E103 PolarHBondContact O-N 2.86Å; E103-L105 VanDerWaalsContact C-N 3.31Å; E103-L105 PolarHBondContact O-N 3.11Å; E103-N106 PolarHBondContact O-N 2.71Å; E103-N106 VanDerWaalsContact O-N 3.17Å; E103-R107 HydrophobicContact CG-CG 4.4Å; E103-R107 WeakPolarHBondContact O-CB 3.46Å; E103-R107 WeakPolarHBondContact O-CG 3.33Å; E103-R107 PolarHBondContact O-N 3.07Å; E103-R107 WeakPolarHBondContact OE1-CD 3.38Å
104A89.4Confident78.4Confident2 Ų253.6 Ų53.62%0.01727%0.268CS..Hα-helixtrans-60.6-40.6174.100000112.2I85 T100 L101 N106 L108 F359 F363I85-A104 HydrophobicContact CD1-CB 3.45Å; I85-A104 VanDerWaalsContact CD1-CB 3.45Å; T100-A104 PolarHBondContact O-N 3.14Å; L101-A104 PolarHBondContact O-N 3.3Å; A104-N106 VanDerWaalsContact C-N 3.32Å; A104-N106 PolarHBondContact O-N 3.49Å; A104-L108 WeakPolarHBondContact O-CB 3.4Å; A104-L108 WeakPolarHBondContact O-CG 3.49Å; A104-L108 PolarHBondContact O-N 3.24Å; A104-L108 VanDerWaalsContact O-N 3.11Å; A104-F359 HydrophobicContact CB-CE2 4.5Å; A104-F359 HydrophobicContact CB-CZ 4.01Å; A104-F363 HydrophobicContact CB-CE1 3.86Å; A104-F363 HydrophobicContact CB-CE2 3.8Å; A104-F363 HydrophobicContact CB-CZ 3.38Å
105L90.4Very high80.2Confident1 Ų149.5 Ų49.51%0.00525%0.249CC..Hα-helixtrans-63.1-35.5174.7-76.2172.3000113.2L101 G102 E103 F110 F127 I130 L138 N145L101-L105 HydrophobicContact CG-CD1 4.4Å; L101-L105 WeakPolarHBondContact O-CG 3.37Å; L101-L105 PolarHBondContact O-N 3.04Å; G102-L105 PolarHBondContact O-N 3.39Å; E103-L105 VanDerWaalsContact C-N 3.31Å; E103-L105 PolarHBondContact O-N 3.11Å; L105-F110 HydrophobicContact CD2-CD2 4.3Å; L105-F110 HydrophobicContact CD2-CE2 3.86Å; L105-F110 HydrophobicContact CD2-CZ 4.29Å; L105-F127 HydrophobicContact CD2-CE2 4.35Å; L105-F127 HydrophobicContact CD2-CZ 4.5Å; L105-I130 HydrophobicContact CD1-CD1 3.95Å; L105-I130 HydrophobicContact CD2-CD1 3.79Å; L105-I130 HydrophobicContact CG-CD1 4.39Å; L105-L138 HydrophobicContact CD1-CD1 3.81Å; L105-L138 HydrophobicContact CD1-CD2 3.84Å; L105-N145 PolarHBondContact O-ND2 3.28Å
106N90Very high81.9Confident22 Ų2244.1 Ų44.112%0.11823%0.233CC..Hα-helixtrans-77.8-35.9-179.6-69.3-23.5000113.2F78 G102 E103 A104 N145F78-N106 HydrophobicContact CE1-CB 4.36Å; G102-N106 VanDerWaalsContact O-CG 3.24Å; G102-N106 PolarHBondContact O-N 2.95Å; G102-N106 VanDerWaalsContact O-N 3.12Å; G102-N106 PolarHBondContact O-ND2 3.35Å; E103-N106 PolarHBondContact O-N 2.71Å; E103-N106 VanDerWaalsContact O-N 3.17Å; A104-N106 VanDerWaalsContact C-N 3.32Å; A104-N106 PolarHBondContact O-N 3.49Å; N106-N145 WeakPolarHBondContact CA-ND2 3.4Å; N106-N145 VanDerWaalsContact OD1-CB 3.24Å; N106-N145 WeakPolarHBondContact OD1-CB 3.43Å; N106-N145 PolarHBondContact OD1-ND2 3.09Å; N106-N145 VanDerWaalsContact OD1-ND2 3.15Å
107R87.6Confident83.9Confident74 Ų7439.3 Ų39.328%0.27921%0.212SC..Hα-helixtrans-88.2-34-173.2-69.6178.265.7174.86.4114.1D82 I85 E103D82-R107 PolarHBondContact N-O 3.37Å; D82-R107 IonicContact OD2-CZ 3.78Å; D82-R107 IonicContact OD2-NE 2.8Å; D82-R107 PolarHBondContact OD2-NE 3.35Å; D82-R107 IonicContact OD2-NH2 3.9Å; D82-R107 PolarHBondContact OD2-NH2 2.96Å; I85-R107 HydrophobicContact CG2-CB 3.62Å; E103-R107 HydrophobicContact CG-CG 4.4Å; E103-R107 WeakPolarHBondContact O-CB 3.46Å; E103-R107 WeakPolarHBondContact O-CG 3.33Å; E103-R107 PolarHBondContact O-N 3.07Å; E103-R107 WeakPolarHBondContact OE1-CD 3.38Å
108L88.9Confident85.6Confident7 Ų738 Ų384%0.03719%0.189CC..BIsolated β-bridgetrans-77.8139.9179.4-72.1169.7000111.5I85 A104 F110 L315 L324 F359I85-L108 HydrophobicContact CD1-CD1 3.82Å; I85-L108 HydrophobicContact CD1-CD2 4.46Å; I85-L108 HydrophobicContact CD1-CG 3.95Å; I85-L108 HydrophobicContact CG1-CD1 4.3Å; I85-L108 HydrophobicContact CG1-CD2 4.14Å; I85-L108 HydrophobicContact CG1-CG 4.18Å; I85-L108 HydrophobicContact CG2-CD2 3.94Å; I85-L108 HydrophobicContact CG2-CG 3.98Å; A104-L108 WeakPolarHBondContact O-CB 3.4Å; A104-L108 WeakPolarHBondContact O-CG 3.49Å; A104-L108 PolarHBondContact O-N 3.24Å; A104-L108 VanDerWaalsContact O-N 3.11Å; L108-F110 VanDerWaalsContact C-N 3.3Å; L108-F110 HydrophobicContact CB-CD2 3.99Å; L108-F110 HydrophobicContact CB-CE2 3.56Å; L108-F110 HydrophobicContact CB-CZ 4.15Å; L108-F110 HydrophobicContact CD1-CE2 4.12Å; L108-F110 HydrophobicContact CD1-CZ 4.05Å; L108-F110 HydrophobicContact CG-CE2 4.48Å; L108-F110 WeakPolarHBondContact O-CD2 3.46Å; L108-F110 PolarHBondContact O-N 3.44Å; L108-L315 HydrophobicContact CD1-CD1 4.13Å; L108-L315 HydrophobicContact CD1-CD2 4.37Å; L108-L324 HydrophobicContact CD1-CD2 3.99Å; L108-L324 HydrophobicContact CD1-CG 4.34Å; L108-F359 HydrophobicContact CD1-CE2 3.78Å; L108-F359 HydrophobicContact CD1-CZ 4.29Å
109D87.4Confident87.3Confident33 Ų3331.1 Ų31.118%0.17616%0.162CC..  trans-79.673.5-179.5-168.42.3000113.3R81 S111 S112 A113 W326R81-D109 HydrophobicContact CB-CB 4.41Å; R81-D109 WeakPolarHBondContact CD-OD2 3.34Å; R81-D109 HydrophobicContact CG-CB 4.47Å; R81-D109 IonicContact CZ-OD1 3.04Å; R81-D109 IonicContact CZ-OD2 3.27Å; R81-D109 IonicContact NE-OD1 2.66Å; R81-D109 IonicContact NE-OD2 2.79Å; R81-D109 IonicContact NH1-OD1 2.95Å; R81-D109 PolarHBondContact NH1-OD1 2.98Å; R81-D109 IonicContact NH1-OD2 2.65Å; R81-D109 PolarHBondContact NH1-OD2 3.32Å; D109-S111 VanDerWaalsContact C-N 3.28Å; D109-S111 PolarHBondContact OD1-N 3.21Å; D109-S112 VanDerWaalsContact CG-OG 3.23Å; D109-S112 PolarHBondContact OD1-N 2.95Å; D109-S112 PolarHBondContact OD1-OG 2.95Å; D109-S112 WeakPolarHBondContact OD2-CB 3.29Å; D109-S112 PolarHBondContact OD2-OG 3.29Å; D109-A113 WeakPolarHBondContact O-CB 3.24Å; D109-A113 PolarHBondContact O-N 2.89Å; D109-W326 PolarHBondContact O-NE1 2.94Å
110F91.2Very high88.3Confident1 Ų129.8 Ų29.80%0.00415%0.153CC..Hα-helixtrans-69.2-26.4170.8-68.9-75.6000112.5L105 L108 A113 I114 V123 L126 F127 I149 L315 W326 F359L105-F110 HydrophobicContact CD2-CD2 4.3Å; L105-F110 HydrophobicContact CD2-CE2 3.86Å; L105-F110 HydrophobicContact CD2-CZ 4.29Å; L108-F110 VanDerWaalsContact C-N 3.3Å; L108-F110 HydrophobicContact CB-CD2 3.99Å; L108-F110 HydrophobicContact CB-CE2 3.56Å; L108-F110 HydrophobicContact CB-CZ 4.15Å; L108-F110 HydrophobicContact CD1-CE2 4.12Å; L108-F110 HydrophobicContact CD1-CZ 4.05Å; L108-F110 HydrophobicContact CG-CE2 4.48Å; L108-F110 WeakPolarHBondContact O-CD2 3.46Å; L108-F110 PolarHBondContact O-N 3.44Å; F110-A113 PolarHBondContact O-N 3.13Å; F110-I114 WeakPolarHBondContact O-CD1 3.38Å; F110-I114 VanDerWaalsContact O-CG1 3.26Å; F110-I114 WeakPolarHBondContact O-CG1 3.47Å; F110-I114 PolarHBondContact O-N 3.19Å; F110-V123 HydrophobicContact CB-CG1 4.46Å; F110-V123 HydrophobicContact CD1-CG1 4.01Å; F110-V123 HydrophobicContact CD1-CG2 4.05Å; F110-L126 HydrophobicContact CE1-CD2 3.58Å; F110-L126 HydrophobicContact CZ-CD2 3.83Å; F110-F127 HydrophobicContact CD1-CE2 4.4Å; F110-F127 HydrophobicContact CG-CE2 4.4Å; F110-I149 HydrophobicContact CB-CD1 4.01Å; F110-I149 HydrophobicContact CB-CG2 4.18Å; F110-L315 HydrophobicContact CE1-CD1 4.29Å; F110-L315 HydrophobicContact CZ-CD1 4.23Å; F110-W326 HydrophobicContact CD1-CH2 4.39Å; F110-W326 AromaticContact CD1-CZ2 3.63Å; F110-W326 HydrophobicContact CD1-CZ2 3.63Å; F110-W326 HydrophobicContact CE1-CH2 4.23Å; F110-W326 AromaticContact CE1-CZ2 3.62Å; F110-W326 HydrophobicContact CE1-CZ2 3.62Å; F110-F359 HydrophobicContact CZ-CE2 4.22Å; F110-F359 AromaticContact CZ-CZ 3.93Å; F110-F359 HydrophobicContact CZ-CZ 3.93Å
111S88.4Confident88.5Confident18 Ų1828 Ų2813%0.12614%0.141CC..Hα-helixtrans-64.7-46.9-178.8-77.80000112.1D109 K152D109-S111 VanDerWaalsContact C-N 3.28Å; D109-S111 PolarHBondContact OD1-N 3.21Å; S111-K152 PolarHBondContact OG-NZ 3.13Å
112S86Confident88.7Confident55 Ų5527.4 Ų27.439%0.38514%0.138SC..Hα-helixtrans-73.7-33.2174.8-530000111.6R81 D109 I114 Q115R81-S112 PolarHBondContact NH1-OG 3.33Å; D109-S112 VanDerWaalsContact CG-OG 3.23Å; D109-S112 PolarHBondContact OD1-N 2.95Å; D109-S112 PolarHBondContact OD1-OG 2.95Å; D109-S112 WeakPolarHBondContact OD2-CB 3.29Å; D109-S112 PolarHBondContact OD2-OG 3.29Å; S112-I114 PolarHBondContact O-N 3.29Å; S112-Q115 WeakPolarHBondContact O-CB 3.31Å; S112-Q115 PolarHBondContact O-N 3.28Å
113A87.7Confident89Confident0 Ų027.3 Ų27.30%014%0.136CC..Hα-helixtrans-61.6-32.1176.400000112.6D109 F110 Q115 D116 R119 V123 W326D109-A113 WeakPolarHBondContact O-CB 3.24Å; D109-A113 PolarHBondContact O-N 2.89Å; F110-A113 PolarHBondContact O-N 3.13Å; A113-Q115 PolarHBondContact O-N 2.87Å; A113-D116 PolarHBondContact O-N 3.2Å; A113-R119 HydrophobicContact CB-CB 4.23Å; A113-R119 WeakPolarHBondContact O-CB 3.45Å; A113-V123 HydrophobicContact CB-CG2 3.98Å; A113-W326 HydrophobicContact CB-CD2 4.3Å; A113-W326 HydrophobicContact CB-CH2 4.07Å; A113-W326 HydrophobicContact CB-CZ2 3.58Å
114I90.3Very high89.4Confident0 Ų023.8 Ų23.80%012%0.12CC..Hα-helixtrans-62.8-33.6174.2-73.6158.5000111.5F110 S112 D116 F120 V123 I149 K152 I153 K156F110-I114 WeakPolarHBondContact O-CD1 3.38Å; F110-I114 VanDerWaalsContact O-CG1 3.26Å; F110-I114 WeakPolarHBondContact O-CG1 3.47Å; F110-I114 PolarHBondContact O-N 3.19Å; S112-I114 PolarHBondContact O-N 3.29Å; I114-D116 VanDerWaalsContact C-N 3.25Å; I114-D116 PolarHBondContact O-N 3.32Å; I114-F120 HydrophobicContact CG2-CD2 4.11Å; I114-F120 HydrophobicContact CG2-CE2 4.3Å; I114-V123 HydrophobicContact CD1-CG1 4.21Å; I114-V123 HydrophobicContact CG1-CB 4.34Å; I114-V123 HydrophobicContact CG1-CG1 3.83Å; I114-I149 HydrophobicContact CD1-CG2 3.32Å; I114-K152 HydrophobicContact CD1-CB 4.4Å; I114-I153 HydrophobicContact CD1-CD1 4.14Å; I114-I153 HydrophobicContact CD1-CG1 3.41Å; I114-I153 VanDerWaalsContact CD1-CG1 3.41Å; I114-I153 HydrophobicContact CG1-CG1 3.82Å; I114-I153 HydrophobicContact CG2-CG1 4.43Å; I114-K156 HydrophobicContact CG2-CB 4.17Å; I114-K156 HydrophobicContact CG2-CD 3.6Å; I114-K156 WeakPolarHBondContact O-CD 2.95Å; I114-K156 WeakPolarHBondContact O-CE 3.27Å
115Q87.5Confident89.6Confident99 Ų9925.6 Ų25.646%0.46313%0.127SC..Hα-helixtrans-68.5-27-179.2-62.4-58.7-15.900113S112 A113 K156S112-Q115 WeakPolarHBondContact O-CB 3.31Å; S112-Q115 PolarHBondContact O-N 3.28Å; A113-Q115 PolarHBondContact O-N 2.87Å; Q115-K156 PolarHBondContact O-NZ 3.43Å; Q115-K156 VanDerWaalsContact O-NZ 3.14Å
116D85.8Confident89.8Confident51 Ų5125.6 Ų25.627%0.27313%0.127SC..SBendtrans-82.3116.1174.3-175-8.5000111.3A113 I114 R118 R119 F120A113-D116 PolarHBondContact O-N 3.2Å; I114-D116 VanDerWaalsContact C-N 3.25Å; I114-D116 PolarHBondContact O-N 3.32Å; D116-R118 PolarHBondContact O-N 3.12Å; D116-R118 VanDerWaalsContact O-N 3.09Å; D116-R118 VanDerWaalsContact OD1-CB 3.31Å; D116-R118 WeakPolarHBondContact OD1-CB 3.42Å; D116-R118 PolarHBondContact OD1-N 3.33Å; D116-R119 HydrophobicContact CB-CB 4.32Å; D116-R119 HydrophobicContact CB-CG 4.33Å; D116-R119 PolarHBondContact O-N 3.19Å; D116-R119 IonicContact OD2-NE 2.86Å; D116-F120 PolarHBondContact O-N 3.01Å
117L85.9Confident90.1Very high40 Ų4024.5 Ų24.521%0.20912%0.122CC..Hα-helixtrans-55.1-28.6177.5-62.2176.8000113.2P11 Y162P11-L117 HydrophobicContact CG-CB 4.11Å; L117-Y162 HydrophobicContact CD2-CD1 3.83Å; L117-Y162 HydrophobicContact CD2-CD2 3.95Å; L117-Y162 HydrophobicContact CD2-CE1 4.12Å; L117-Y162 HydrophobicContact CD2-CE2 4.24Å; L117-Y162 HydrophobicContact CD2-CG 3.74Å
118R84.6Confident90.4Very high27 Ų2721.1 Ų21.110%0.10211%0.109CC..Hα-helixtrans-71.7-32.3179.6-63.6171.4168.9174.7-10.8112.6S10 D116 G312 D313S10-R118 PolarHBondContact OG-NH2 3.1Å; D116-R118 PolarHBondContact O-N 3.12Å; D116-R118 VanDerWaalsContact O-N 3.09Å; D116-R118 VanDerWaalsContact OD1-CB 3.31Å; D116-R118 WeakPolarHBondContact OD1-CB 3.42Å; D116-R118 PolarHBondContact OD1-N 3.33Å; R118-G312 WeakPolarHBondContact O-CA 3.3Å; R118-G312 PolarHBondContact O-N 3.49Å; R118-D313 HydrophobicContact CB-CB 4.11Å; R118-D313 WeakPolarHBondContact CD-OD2 3.4Å; R118-D313 PolarHBondContact O-N 3.18Å
119R89.4Confident90.6Very high29 Ų2921.7 Ų21.711%0.10911%0.112CC..Hα-helixtrans-95.8-23-178.3-63.3176.4-177.2178.3-0.4111.8A113 D116 N121 Y122 V123 D313 W326 K327A113-R119 HydrophobicContact CB-CB 4.23Å; A113-R119 WeakPolarHBondContact O-CB 3.45Å; D116-R119 HydrophobicContact CB-CB 4.32Å; D116-R119 HydrophobicContact CB-CG 4.33Å; D116-R119 PolarHBondContact O-N 3.19Å; D116-R119 IonicContact OD2-NE 2.86Å; R119-N121 PolarHBondContact O-N 3.14Å; R119-Y122 WeakPolarHBondContact O-CA 3.49Å; R119-Y122 WeakPolarHBondContact O-CB 3.08Å; R119-Y122 PolarHBondContact O-N 2.75Å; R119-V123 WeakPolarHBondContact O-CG2 3.4Å; R119-V123 PolarHBondContact O-N 3.48Å; R119-D313 HydrophobicContact CG-CB 3.75Å; R119-W326 HydrophobicContact CB-CZ3 4.33Å; R119-W326 HydrophobicContact CG-CE3 4.26Å; R119-W326 HydrophobicContact CG-CZ3 4.17Å; R119-K327 PolarHBondContact NH2-O 3.12Å
120F91.6Very high90.9Very high1 Ų120.1 Ų20.10%0.00410%0.104CC..Hα-helixtrans-49-55-177.5-179.9-93.2000113.4I114 D116 Y122 V123 A124 I153 K156 V157 Y162 V167I114-F120 HydrophobicContact CG2-CD2 4.11Å; I114-F120 HydrophobicContact CG2-CE2 4.3Å; D116-F120 PolarHBondContact O-N 3.01Å; F120-Y122 PolarHBondContact O-N 3.33Å; F120-V123 PolarHBondContact O-N 3.21Å; F120-V123 VanDerWaalsContact O-N 3.17Å; F120-A124 HydrophobicContact CE1-CB 4.42Å; F120-A124 HydrophobicContact CZ-CB 4.48Å; F120-A124 WeakPolarHBondContact O-CB 3.47Å; F120-A124 PolarHBondContact O-N 2.6Å; F120-I153 HydrophobicContact CE2-CG2 3.98Å; F120-I153 HydrophobicContact CZ-CG2 3.97Å; F120-K156 HydrophobicContact CD2-CD 3.87Å; F120-K156 HydrophobicContact CE2-CD 4.12Å; F120-V157 HydrophobicContact CE1-CG2 4.21Å; F120-V157 HydrophobicContact CE2-CG2 4.13Å; F120-V157 HydrophobicContact CZ-CG2 3.41Å; F120-V157 VanDerWaalsContact CZ-CG2 3.41Å; F120-Y162 HydrophobicContact CB-CE1 4.29Å; F120-Y162 AromaticContact CD1-CD1 3.61Å; F120-Y162 HydrophobicContact CD1-CD1 3.61Å; F120-Y162 AromaticContact CD1-CE1 3.68Å; F120-Y162 HydrophobicContact CD1-CE1 3.68Å; F120-Y162 HydrophobicContact CE1-CD1 4.03Å; F120-Y162 HydrophobicContact CE1-CE1 4.44Å; F120-Y162 HydrophobicContact CG-CD1 4.12Å; F120-Y162 HydrophobicContact CG-CE1 4.23Å; F120-V167 HydrophobicContact CE1-CG2 4.48Å; F120-V167 HydrophobicContact CZ-CG2 3.94Å
121N91.6Very high91Very high39 Ų3920.1 Ų20.121%0.20910%0.103CC..Hα-helixtrans-61.5-33.9-178.5-69.6-28.2000112.2R119 K125 Y162 N163 Y311R119-N121 PolarHBondContact O-N 3.14Å; N121-K125 VanDerWaalsContact O-CB 3.29Å; N121-K125 WeakPolarHBondContact O-CB 3.47Å; N121-K125 PolarHBondContact O-N 3.2Å; N121-K125 VanDerWaalsContact O-N 3.08Å; N121-Y162 PolarHBondContact ND2-OH 2.79Å; N121-N163 PolarHBondContact OD1-ND2 3.42Å; N121-Y311 HydrophobicContact CB-CD1 4.19Å
122Y93.7Very high91.1Very high0 Ų025 Ų250%012%0.119CC..Hα-helixtrans-66.4-50.3175.3176.4-84.3000111R119 F120 K125 L126 Y311 T314 L315 W326 I354 P356R119-Y122 WeakPolarHBondContact O-CA 3.49Å; R119-Y122 WeakPolarHBondContact O-CB 3.08Å; R119-Y122 PolarHBondContact O-N 2.75Å; F120-Y122 PolarHBondContact O-N 3.33Å; Y122-K125 PolarHBondContact O-N 3.41Å; Y122-L126 HydrophobicContact CE1-CD2 4.33Å; Y122-L126 WeakPolarHBondContact O-CB 3.2Å; Y122-L126 PolarHBondContact O-N 3.42Å; Y122-Y311 VanDerWaalsContact CA-CD1 3.43Å; Y122-Y311 HydrophobicContact CD2-CD1 4.4Å; Y122-Y311 AromaticContact CD2-CD2 3.74Å; Y122-Y311 HydrophobicContact CD2-CD2 3.74Å; Y122-Y311 HydrophobicContact CD2-CE2 4.12Å; Y122-Y311 AromaticContact CD2-CG 3.9Å; Y122-Y311 HydrophobicContact CD2-CG 3.9Å; Y122-Y311 HydrophobicContact CG-CG 4.38Å; Y122-T314 HydrophobicContact CD2-CG2 3.77Å; Y122-T314 HydrophobicContact CE2-CG2 4.07Å; Y122-L315 HydrophobicContact CE1-CB 4.48Å; Y122-L315 HydrophobicContact CE1-CD1 4.04Å; Y122-L315 HydrophobicContact CE1-CG 4.11Å; Y122-W326 AromaticContact CD1-CH2 3.61Å; Y122-W326 HydrophobicContact CD1-CH2 3.61Å; Y122-W326 AromaticContact CD1-CZ3 3.93Å; Y122-W326 HydrophobicContact CD1-CZ3 3.93Å; Y122-W326 AromaticContact CE1-CH2 3.78Å; Y122-W326 HydrophobicContact CE1-CH2 3.78Å; Y122-W326 HydrophobicContact CE1-CZ3 4.15Å; Y122-I354 WeakPolarHBondContact CE2-O 3.42Å; Y122-P356 HydrophobicContact CD2-CG 3.69Å; Y122-P356 HydrophobicContact CE2-CB 4.49Å; Y122-P356 VanDerWaalsContact CE2-CD 3.46Å; Y122-P356 HydrophobicContact CE2-CG 3.61Å; Y122-P356 HydrophobicContact CG-CG 4.33Å
123V94.8Very high91.1Very high0 Ų025.2 Ų25.20%012%0.121CC..Hα-helixtrans-62.9-47.6-178.4178.70000110.4F110 A113 I114 R119 F120 K125 L126 F127 I153 W326F110-V123 HydrophobicContact CB-CG1 4.46Å; F110-V123 HydrophobicContact CD1-CG1 4.01Å; F110-V123 HydrophobicContact CD1-CG2 4.05Å; A113-V123 HydrophobicContact CB-CG2 3.98Å; I114-V123 HydrophobicContact CD1-CG1 4.21Å; I114-V123 HydrophobicContact CG1-CB 4.34Å; I114-V123 HydrophobicContact CG1-CG1 3.83Å; R119-V123 WeakPolarHBondContact O-CG2 3.4Å; R119-V123 PolarHBondContact O-N 3.48Å; F120-V123 PolarHBondContact O-N 3.21Å; F120-V123 VanDerWaalsContact O-N 3.17Å; V123-K125 VanDerWaalsContact C-N 3.33Å; V123-K125 PolarHBondContact O-N 3.42Å; V123-L126 WeakPolarHBondContact O-CB 3.49Å; V123-L126 PolarHBondContact O-N 3.26Å; V123-F127 HydrophobicContact CG1-CD2 3.87Å; V123-F127 HydrophobicContact CG1-CE2 3.88Å; V123-F127 VanDerWaalsContact O-CD2 3.23Å; V123-F127 WeakPolarHBondContact O-CD2 3.47Å; V123-F127 PolarHBondContact O-N 3.05Å; V123-I153 HydrophobicContact CG1-CD1 4.23Å; V123-W326 HydrophobicContact CG2-CH2 3.74Å; V123-W326 HydrophobicContact CG2-CZ2 4.08Å
124A94.4Very high91Very high0 Ų027 Ų270%013%0.129CC..Hα-helixtrans-65.7-36.1-178.800000112F120 F127 Q128 I153 L166 L170F120-A124 HydrophobicContact CE1-CB 4.42Å; F120-A124 HydrophobicContact CZ-CB 4.48Å; F120-A124 WeakPolarHBondContact O-CB 3.47Å; F120-A124 PolarHBondContact O-N 2.6Å; A124-F127 PolarHBondContact O-N 3.16Å; A124-Q128 PolarHBondContact O-N 3.41Å; A124-I153 HydrophobicContact CB-CG2 4.28Å; A124-L166 HydrophobicContact CB-CD2 3.13Å; A124-L170 WeakPolarHBondContact O-CD1 3.42Å
125K93.8Very high90.9Very high41 Ų4127.1 Ų27.118%0.17813%0.13CC..Hα-helixtrans-65.8-41.5171.6-173.258.2169.2-169.80112.8N121 Y122 V123 F127 Q128 L129 Y311 P356N121-K125 VanDerWaalsContact O-CB 3.29Å; N121-K125 WeakPolarHBondContact O-CB 3.47Å; N121-K125 PolarHBondContact O-N 3.2Å; N121-K125 VanDerWaalsContact O-N 3.08Å; Y122-K125 PolarHBondContact O-N 3.41Å; V123-K125 VanDerWaalsContact C-N 3.33Å; V123-K125 PolarHBondContact O-N 3.42Å; K125-F127 VanDerWaalsContact C-N 3.3Å; K125-F127 PolarHBondContact O-N 2.93Å; K125-Q128 WeakPolarHBondContact O-CB 3.44Å; K125-Q128 PolarHBondContact O-N 2.87Å; K125-L129 WeakPolarHBondContact O-CG 3.42Å; K125-L129 PolarHBondContact O-N 3.2Å; K125-Y311 HydrophobicContact CB-CE1 4.1Å; K125-Y311 VanDerWaalsContact CG-OH 3.3Å; K125-Y311 WeakPolarHBondContact CG-OH 3Å; K125-P356 HydrophobicContact CB-CG 4.26Å; K125-P356 HydrophobicContact CG-CB 4.4Å; K125-P356 HydrophobicContact CG-CG 4.2Å
126L95.1Very high90.8Very high0 Ų025.7 Ų25.70%013%0.128CC..Hα-helixtrans-58.7-44.4174.7173.559.7000111.3F110 Y122 V123 L129 I130 P356 F359 I360F110-L126 HydrophobicContact CE1-CD2 3.58Å; F110-L126 HydrophobicContact CZ-CD2 3.83Å; Y122-L126 HydrophobicContact CE1-CD2 4.33Å; Y122-L126 WeakPolarHBondContact O-CB 3.2Å; Y122-L126 PolarHBondContact O-N 3.42Å; V123-L126 WeakPolarHBondContact O-CB 3.49Å; V123-L126 PolarHBondContact O-N 3.26Å; L126-L129 PolarHBondContact O-N 2.94Å; L126-I130 HydrophobicContact CD1-CD1 3.94Å; L126-I130 HydrophobicContact CD1-CG1 4.27Å; L126-I130 HydrophobicContact CG-CD1 3.88Å; L126-I130 WeakPolarHBondContact O-CG1 3.43Å; L126-I130 PolarHBondContact O-N 2.86Å; L126-P356 HydrophobicContact CB-CB 4Å; L126-P356 HydrophobicContact CD1-CB 4.39Å; L126-F359 HydrophobicContact CD1-CB 4.39Å; L126-F359 HydrophobicContact CD1-CD1 3.42Å; L126-F359 VanDerWaalsContact CD1-CD1 3.42Å; L126-F359 HydrophobicContact CD1-CE1 4.01Å; L126-F359 HydrophobicContact CD1-CG 4.19Å; L126-F359 HydrophobicContact CD2-CD1 3.8Å; L126-F359 HydrophobicContact CD2-CE1 3.85Å; L126-F359 HydrophobicContact CD2-CG 4.26Å; L126-F359 HydrophobicContact CD2-CZ 4.38Å; L126-F359 HydrophobicContact CG-CD1 4.25Å; L126-F359 HydrophobicContact CG-CE1 4.49Å; L126-I360 HydrophobicContact CD1-CD1 4.08Å; L126-I360 HydrophobicContact CD1-CG1 3.86Å
127F95.9Very high90.9Very high0 Ų026.8 Ų26.80%014%0.139CC..Hα-helixtrans-64.9-40.2177.9-86.3-118.9000112L105 F110 V123 A124 K125 L129 I130 A131 Y146 I149 L150 I153 L170L105-F127 HydrophobicContact CD2-CE2 4.35Å; L105-F127 HydrophobicContact CD2-CZ 4.5Å; F110-F127 HydrophobicContact CD1-CE2 4.4Å; F110-F127 HydrophobicContact CG-CE2 4.4Å; V123-F127 HydrophobicContact CG1-CD2 3.87Å; V123-F127 HydrophobicContact CG1-CE2 3.88Å; V123-F127 VanDerWaalsContact O-CD2 3.23Å; V123-F127 WeakPolarHBondContact O-CD2 3.47Å; V123-F127 PolarHBondContact O-N 3.05Å; A124-F127 PolarHBondContact O-N 3.16Å; K125-F127 VanDerWaalsContact C-N 3.3Å; K125-F127 PolarHBondContact O-N 2.93Å; F127-L129 VanDerWaalsContact C-N 3.33Å; F127-L129 PolarHBondContact O-N 2.89Å; F127-I130 PolarHBondContact O-N 3.41Å; F127-A131 WeakPolarHBondContact O-CB 3.36Å; F127-A131 PolarHBondContact O-N 3.1Å; F127-Y146 HydrophobicContact CB-CE2 3.92Å; F127-Y146 AromaticContact CD1-CD2 3.5Å; F127-Y146 HydrophobicContact CD1-CD2 3.5Å; F127-Y146 AromaticContact CD1-CE2 3.23Å; F127-Y146 HydrophobicContact CD1-CE2 3.23Å; F127-Y146 HydrophobicContact CD1-CG 4.28Å; F127-Y146 AromaticContact CD1-CZ 3.8Å; F127-Y146 AromaticContact CE1-CD2 3.52Å; F127-Y146 HydrophobicContact CE1-CD2 3.52Å; F127-Y146 AromaticContact CE1-CE2 3.79Å; F127-Y146 HydrophobicContact CE1-CE2 3.79Å; F127-Y146 HydrophobicContact CE1-CG 4.09Å; F127-Y146 WeakPolarHBondContact CE1-O 3.48Å; F127-Y146 HydrophobicContact CG-CD2 4.25Å; F127-Y146 AromaticContact CG-CE2 3.75Å; F127-Y146 HydrophobicContact CG-CE2 3.75Å; F127-Y146 HydrophobicContact CZ-CD2 4.3Å; F127-Y146 PolarHBondContact O-OH 3.49Å; F127-Y146 VanDerWaalsContact O-OH 3.06Å; F127-I149 HydrophobicContact CD1-CG2 4.49Å; F127-I149 HydrophobicContact CE1-CB 3.62Å; F127-I149 HydrophobicContact CE1-CG2 3.54Å; F127-I149 HydrophobicContact CE2-CG2 3.99Å; F127-I149 HydrophobicContact CZ-CB 3.59Å; F127-I149 HydrophobicContact CZ-CD1 3.9Å; F127-I149 HydrophobicContact CZ-CG1 4.36Å; F127-I149 HydrophobicContact CZ-CG2 3.24Å; F127-L150 HydrophobicContact CD1-CB 4.44Å; F127-I153 HydrophobicContact CB-CD1 4.28Å; F127-I153 HydrophobicContact CD1-CD1 4.01Å; F127-I153 HydrophobicContact CD2-CD1 4.41Å; F127-I153 HydrophobicContact CG-CD1 3.96Å; F127-L170 HydrophobicContact CB-CD1 3.92Å
128Q94.9Very high91Very high2 Ų225.2 Ų25.21%0.00913%0.131CC..Hα-helixtrans-57.8-43.3172-174.1-177.841.200112.3A124 K125 A131 R132 L170 D173A124-Q128 PolarHBondContact O-N 3.41Å; K125-Q128 WeakPolarHBondContact O-CB 3.44Å; K125-Q128 PolarHBondContact O-N 2.87Å; Q128-A131 PolarHBondContact O-N 3.09Å; Q128-R132 WeakPolarHBondContact O-CG 3.41Å; Q128-R132 PolarHBondContact O-N 2.9Å; Q128-R132 VanDerWaalsContact O-N 3.16Å; Q128-L170 HydrophobicContact CB-CB 4.21Å; Q128-L170 HydrophobicContact CB-CG 3.98Å; Q128-L170 HydrophobicContact CG-CB 4.44Å; Q128-D173 VanDerWaalsContact CD-OD2 3.29Å; Q128-D173 HydrophobicContact CG-CB 4.46Å; Q128-D173 WeakPolarHBondContact CG-OD2 3.03Å; Q128-D173 PolarHBondContact NE2-OD2 3.38Å
129L93.4Very high91.2Very high20 Ų2026.9 Ų26.911%0.10515%0.147CC..Hα-helixtrans-67-39.5177.5-68.9178.8000112.7K125 L126 F127 R132 S133 P356 Q357 I360K125-L129 WeakPolarHBondContact O-CG 3.42Å; K125-L129 PolarHBondContact O-N 3.2Å; L126-L129 PolarHBondContact O-N 2.94Å; F127-L129 VanDerWaalsContact C-N 3.33Å; F127-L129 PolarHBondContact O-N 2.89Å; L129-R132 PolarHBondContact O-N 3.46Å; L129-S133 PolarHBondContact O-N 3.01Å; L129-S133 PolarHBondContact O-OG 3.24Å; L129-P356 HydrophobicContact CD1-CB 3.72Å; L129-Q357 HydrophobicContact CD1-CB 4.14Å; L129-I360 HydrophobicContact CB-CD1 3.5Å; L129-I360 VanDerWaalsContact CB-CD1 3.5Å; L129-I360 HydrophobicContact CD1-CD1 4.19Å
130I93.2Very high91.1Very high0 Ų026.7 Ų26.70%015%0.154CC..Hα-helixtrans-63-45.8175.1-68.8161.9000110.2L105 L126 F127 R132 S133 Q134 L135 L138 Y146 I360L105-I130 HydrophobicContact CD1-CD1 3.95Å; L105-I130 HydrophobicContact CD2-CD1 3.79Å; L105-I130 HydrophobicContact CG-CD1 4.39Å; L126-I130 HydrophobicContact CD1-CD1 3.94Å; L126-I130 HydrophobicContact CD1-CG1 4.27Å; L126-I130 HydrophobicContact CG-CD1 3.88Å; L126-I130 WeakPolarHBondContact O-CG1 3.43Å; L126-I130 PolarHBondContact O-N 2.86Å; F127-I130 PolarHBondContact O-N 3.41Å; I130-R132 VanDerWaalsContact C-N 3.29Å; I130-R132 PolarHBondContact O-N 3.29Å; I130-S133 PolarHBondContact O-N 3.09Å; I130-Q134 HydrophobicContact CG2-CB 4.4Å; I130-Q134 CarbonylContact O-C 3.47Å; I130-Q134 PolarHBondContact O-N 3.06Å; I130-L135 PolarHBondContact O-N 3.43Å; I130-L138 HydrophobicContact CG2-CD1 3.85Å; I130-Y146 HydrophobicContact CB-CD2 4.46Å; I130-Y146 HydrophobicContact CB-CE2 4Å; I130-Y146 HydrophobicContact CG2-CD2 3.84Å; I130-Y146 HydrophobicContact CG2-CE2 3.75Å; I130-I360 HydrophobicContact CG1-CD1 4.26Å; I130-I360 HydrophobicContact CG1-CG1 4.45Å
131A92Very high90.9Very high0 Ų028.9 Ų28.90%017%0.173CC..Hα-helixtrans-54.5-45.5176.600000111.9F127 Q128 Y146 L174 T177F127-A131 WeakPolarHBondContact O-CB 3.36Å; F127-A131 PolarHBondContact O-N 3.1Å; Q128-A131 PolarHBondContact O-N 3.09Å; A131-Y146 WeakPolarHBondContact CB-OH 3.32Å; A131-L174 HydrophobicContact CB-CB 4.11Å; A131-L174 HydrophobicContact CB-CD1 3.92Å; A131-T177 WeakPolarHBondContact O-CG2 3.37Å
132R90.8Very high90.9Very high120 Ų12027 Ų2745%0.45316%0.163SC..Hα-helixtrans-69-31.7-177-75179.3173.8167.53.3114.5Q128 L129 I130 D173Q128-R132 WeakPolarHBondContact O-CG 3.41Å; Q128-R132 PolarHBondContact O-N 2.9Å; Q128-R132 VanDerWaalsContact O-N 3.16Å; L129-R132 PolarHBondContact O-N 3.46Å; I130-R132 VanDerWaalsContact C-N 3.29Å; I130-R132 PolarHBondContact O-N 3.29Å; R132-D173 HydrophobicContact CG-CB 4.03Å; R132-D173 VanDerWaalsContact CZ-CG 3.48Å; R132-D173 IonicContact CZ-OD1 2.92Å; R132-D173 VanDerWaalsContact CZ-OD1 3.27Å; R132-D173 IonicContact CZ-OD2 3.43Å; R132-D173 IonicContact NE-OD1 2.69Å; R132-D173 PolarHBondContact NE-OD1 3.09Å; R132-D173 IonicContact NE-OD2 3.85Å; R132-D173 PolarHBondContact NE-OD2 3.41Å; R132-D173 IonicContact NH2-OD1 2.79Å; R132-D173 PolarHBondContact NH2-OD1 3.22Å; R132-D173 IonicContact NH2-OD2 3.71Å; R132-D173 PolarHBondContact NH2-OD2 3.45Å
133S85.8Confident90.8Very high61 Ų6127.1 Ų27.143%0.42716%0.163SC..Hα-helixtrans-138.4-18.5-161.666.10000116.7L129 I130L129-S133 PolarHBondContact O-N 3.01Å; L129-S133 PolarHBondContact O-OG 3.24Å; I130-S133 PolarHBondContact O-N 3.09Å
134Q87.3Confident90.5Very high38 Ų3832.1 Ų32.118%0.17819%0.185CC..THydrogen-bonded Turntrans-129.6-4.2-171.2-61.9-58.5-36.500113.9L101 I130 T136 S137 L138 I360L101-Q134 HydrophobicContact CD2-CB 3.71Å; L101-Q134 HydrophobicContact CD2-CG 3.86Å; I130-Q134 HydrophobicContact CG2-CB 4.4Å; I130-Q134 CarbonylContact O-C 3.47Å; I130-Q134 PolarHBondContact O-N 3.06Å; Q134-T136 PolarHBondContact O-N 3Å; Q134-T136 VanDerWaalsContact O-N 3.1Å; Q134-S137 PolarHBondContact O-N 3.3Å; Q134-S137 PolarHBondContact O-OG 3.49Å; Q134-S137 PolarHBondContact OE1-OG 3.02Å; Q134-L138 WeakPolarHBondContact O-CG 3.3Å; Q134-L138 PolarHBondContact O-N 3.12Å; Q134-I360 HydrophobicContact CG-CG2 3.79Å
135L87.1Confident90.4Very high2 Ų232.9 Ų32.91%0.0119%0.189CC..THydrogen-bonded Turntrans-57.6-34.8-173.7-167.262.5000113.2I130 L138 Q143 Y146 L174 L178 L190I130-L135 PolarHBondContact O-N 3.43Å; L135-L138 HydrophobicContact CD1-CD1 4.44Å; L135-Q143 PolarHBondContact O-NE2 3.03Å; L135-Q143 VanDerWaalsContact O-NE2 3.12Å; L135-Y146 HydrophobicContact CD1-CD1 3.78Å; L135-Y146 HydrophobicContact CD1-CE1 3.99Å; L135-Y146 HydrophobicContact CD1-CG 4.13Å; L135-L174 HydrophobicContact CD2-CD1 3.51Å; L135-L178 HydrophobicContact CD2-CD2 4.02Å; L135-L190 HydrophobicContact CD2-CD1 3.7Å; L135-L190 HydrophobicContact CD2-CD2 4.33Å; L135-L190 HydrophobicContact CG-CD1 3.95Å; L135-L190 HydrophobicContact CG-CD2 4.22Å
136T85.6Confident90.5Very high69 Ų6931 Ų3142%0.42318%0.181SC..THydrogen-bonded Turntrans-78.7-23.5178.962.40000113.5Q134 L138 L181 V189 L190Q134-T136 PolarHBondContact O-N 3Å; Q134-T136 VanDerWaalsContact O-N 3.1Å; T136-L138 VanDerWaalsContact C-N 3.35Å; T136-L181 HydrophobicContact CG2-CD1 3.45Å; T136-L181 VanDerWaalsContact CG2-CD1 3.45Å; T136-L181 HydrophobicContact CG2-CD2 4.11Å; T136-L181 HydrophobicContact CG2-CG 4.43Å; T136-V189 HydrophobicContact CG2-CG1 3.41Å; T136-V189 VanDerWaalsContact CG2-CG1 3.41Å; T136-L190 HydrophobicContact CG2-CD2 3.96Å
137S87.1Confident90.3Very high73 Ų7331.5 Ų31.551%0.5118%0.183SC..THydrogen-bonded Turntrans-82.6-14.6177.968.70000112.7Q134Q134-S137 PolarHBondContact O-N 3.3Å; Q134-S137 PolarHBondContact O-OG 3.49Å; Q134-S137 PolarHBondContact OE1-OG 3.02Å
138L88.6Confident90.2Very high7 Ų734.7 Ų34.74%0.03720%0.2CC..SBendtrans-72143.7176.9-64.8-175.5000112.3L101 L105 I130 Q134 L135 T136 A142 Q143L101-L138 HydrophobicContact CB-CD2 4.33Å; L101-L138 HydrophobicContact CD2-CD2 3.94Å; L101-L138 HydrophobicContact CG-CD2 3.94Å; L105-L138 HydrophobicContact CD1-CD1 3.81Å; L105-L138 HydrophobicContact CD1-CD2 3.84Å; I130-L138 HydrophobicContact CG2-CD1 3.85Å; Q134-L138 WeakPolarHBondContact O-CG 3.3Å; Q134-L138 PolarHBondContact O-N 3.12Å; L135-L138 HydrophobicContact CD1-CD1 4.44Å; T136-L138 VanDerWaalsContact C-N 3.35Å; L138-A142 HydrophobicContact CB-CB 4.07Å; L138-A142 HydrophobicContact CD2-CB 4.34Å; L138-Q143 HydrophobicContact CB-CG 3.69Å; L138-Q143 PolarHBondContact O-NE2 2.89Å
139S88.6Confident90.2Very high62 Ų6234.8 Ų34.843%0.43420%0.201SC..  trans-63.6158.4169.172.20000111.5A141 A142 Q143S139-A141 PolarHBondContact O-N 2.73Å; S139-A142 PolarHBondContact O-N 2.79Å; S139-A142 WeakPolarHBondContact OG-CB 3.35Å; S139-A142 PolarHBondContact OG-N 3.2Å; S139-Q143 WeakPolarHBondContact O-CG 3.31Å; S139-Q143 PolarHBondContact O-N 3.35Å
140G87.4Confident90.3Very high25 Ų2533.9 Ų33.926%0.25820%0.196SC..Hα-helixtrans-59.2-33.9179.800000114.1K144G140-K144 WeakPolarHBondContact O-CB 3.21Å; G140-K144 PolarHBondContact O-N 2.9Å
141A88Confident90.3Very high48 Ų4836.7 Ų36.740%0.39721%0.209SC..Hα-helixtrans-64.9-45.7172.900000111.6S139 K144 N145S139-A141 PolarHBondContact O-N 2.73Å; A141-K144 PolarHBondContact O-N 3.12Å; A141-N145 PolarHBondContact O-N 3.37Å
142A91.1Very high90.4Very high0 Ų040.6 Ų40.60%023%0.226CC..Hα-helixtrans-66.6-37.7177.400000112.5G102 L138 S139 N145 Y146G102-A142 VanDerWaalsContact CA-CB 3.44Å; L138-A142 HydrophobicContact CB-CB 4.07Å; L138-A142 HydrophobicContact CD2-CB 4.34Å; S139-A142 PolarHBondContact O-N 2.79Å; S139-A142 WeakPolarHBondContact OG-CB 3.35Å; S139-A142 PolarHBondContact OG-N 3.2Å; A142-N145 PolarHBondContact O-N 3.37Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 3.31Å
143Q91.1Very high90.6Very high2 Ų234.9 Ų34.91%0.00920%0.204CC..Hα-helixtrans-63.7-43.6172.6-67.91767.600111.4L135 L138 S139 N145 Y146 F147L135-Q143 PolarHBondContact O-NE2 3.03Å; L135-Q143 VanDerWaalsContact O-NE2 3.12Å; L138-Q143 HydrophobicContact CB-CG 3.69Å; L138-Q143 PolarHBondContact O-NE2 2.89Å; S139-Q143 WeakPolarHBondContact O-CG 3.31Å; S139-Q143 PolarHBondContact O-N 3.35Å; Q143-N145 VanDerWaalsContact C-N 3.34Å; Q143-N145 PolarHBondContact O-N 2.96Å; Q143-Y146 WeakPolarHBondContact O-CB 3.34Å; Q143-Y146 PolarHBondContact O-N 3.43Å; Q143-F147 WeakPolarHBondContact O-CD2 3.44Å; Q143-F147 PolarHBondContact O-N 3.14Å
144K90.1Very high91.1Very high104 Ų10432 Ų3245%0.45218%0.184SC..Hα-helixtrans-58.5-47.2174.3-178.7179.2178179.70110.9G140 A141 Y146 F147 N148G140-K144 WeakPolarHBondContact O-CB 3.21Å; G140-K144 PolarHBondContact O-N 2.9Å; A141-K144 PolarHBondContact O-N 3.12Å; K144-Y146 VanDerWaalsContact C-N 3.35Å; K144-Y146 PolarHBondContact O-N 3.39Å; K144-F147 PolarHBondContact O-N 2.67Å; K144-N148 VanDerWaalsContact O-CG 3.24Å; K144-N148 PolarHBondContact O-N 3.09Å; K144-N148 PolarHBondContact O-OD1 3.3Å
145N92.3Very high91.3Very high16 Ų1636.2 Ų36.29%0.08620%0.198CC..Hα-helixtrans-64.7-38.3177.9-170.237.4000112.4L105 N106 A141 A142 Q143 F147 N148 I149L105-N145 PolarHBondContact O-ND2 3.28Å; N106-N145 WeakPolarHBondContact CA-ND2 3.4Å; N106-N145 VanDerWaalsContact OD1-CB 3.24Å; N106-N145 WeakPolarHBondContact OD1-CB 3.43Å; N106-N145 PolarHBondContact OD1-ND2 3.09Å; N106-N145 VanDerWaalsContact OD1-ND2 3.15Å; A141-N145 PolarHBondContact O-N 3.37Å; A142-N145 PolarHBondContact O-N 3.37Å; Q143-N145 VanDerWaalsContact C-N 3.34Å; Q143-N145 PolarHBondContact O-N 2.96Å; N145-F147 PolarHBondContact O-N 2.99Å; N145-N148 PolarHBondContact O-N 3.11Å; N145-I149 WeakPolarHBondContact O-CB 3.12Å; N145-I149 VanDerWaalsContact O-CG1 3.28Å; N145-I149 WeakPolarHBondContact O-CG1 3.35Å; N145-I149 PolarHBondContact O-N 2.82Å; N145-I149 WeakPolarHBondContact OD1-CD1 3.47Å
146Y94.2Very high91.5Very high1 Ų136.5 Ų36.50%0.00420%0.2CC..Hα-helixtrans-55.4-50.8172.9175.8-86.9000111.5F127 I130 A131 L135 A142 Q143 K144 N148 I149 L150F127-Y146 HydrophobicContact CB-CE2 3.92Å; F127-Y146 AromaticContact CD1-CD2 3.5Å; F127-Y146 HydrophobicContact CD1-CD2 3.5Å; F127-Y146 AromaticContact CD1-CE2 3.23Å; F127-Y146 HydrophobicContact CD1-CE2 3.23Å; F127-Y146 HydrophobicContact CD1-CG 4.28Å; F127-Y146 AromaticContact CD1-CZ 3.8Å; F127-Y146 AromaticContact CE1-CD2 3.52Å; F127-Y146 HydrophobicContact CE1-CD2 3.52Å; F127-Y146 AromaticContact CE1-CE2 3.79Å; F127-Y146 HydrophobicContact CE1-CE2 3.79Å; F127-Y146 HydrophobicContact CE1-CG 4.09Å; F127-Y146 WeakPolarHBondContact CE1-O 3.48Å; F127-Y146 HydrophobicContact CG-CD2 4.25Å; F127-Y146 AromaticContact CG-CE2 3.75Å; F127-Y146 HydrophobicContact CG-CE2 3.75Å; F127-Y146 HydrophobicContact CZ-CD2 4.3Å; F127-Y146 PolarHBondContact O-OH 3.49Å; F127-Y146 VanDerWaalsContact O-OH 3.06Å; I130-Y146 HydrophobicContact CB-CD2 4.46Å; I130-Y146 HydrophobicContact CB-CE2 4Å; I130-Y146 HydrophobicContact CG2-CD2 3.84Å; I130-Y146 HydrophobicContact CG2-CE2 3.75Å; A131-Y146 WeakPolarHBondContact CB-OH 3.32Å; L135-Y146 HydrophobicContact CD1-CD1 3.78Å; L135-Y146 HydrophobicContact CD1-CE1 3.99Å; L135-Y146 HydrophobicContact CD1-CG 4.13Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 3.31Å; Q143-Y146 WeakPolarHBondContact O-CB 3.34Å; Q143-Y146 PolarHBondContact O-N 3.43Å; K144-Y146 VanDerWaalsContact C-N 3.35Å; K144-Y146 PolarHBondContact O-N 3.39Å; Y146-N148 PolarHBondContact O-N 2.94Å; Y146-I149 PolarHBondContact O-N 3.36Å; Y146-L150 HydrophobicContact CE1-CD2 3.96Å; Y146-L150 VanDerWaalsContact O-CB 3.28Å; Y146-L150 WeakPolarHBondContact O-CB 3.48Å; Y146-L150 PolarHBondContact O-N 3.41Å
147F92.8Very high91.9Very high11 Ų1133.2 Ų33.25%0.04818%0.179CC..Hα-helixtrans-65.5-38.3178.5-76.8-72.2000112.8Q143 K144 N145 I149 L150 E151 L174 L190 W197 I204Q143-F147 WeakPolarHBondContact O-CD2 3.44Å; Q143-F147 PolarHBondContact O-N 3.14Å; K144-F147 PolarHBondContact O-N 2.67Å; N145-F147 PolarHBondContact O-N 2.99Å; F147-I149 VanDerWaalsContact C-N 3.35Å; F147-I149 PolarHBondContact O-N 2.95Å; F147-L150 HydrophobicContact CD1-CD2 4.45Å; F147-L150 PolarHBondContact O-N 3.38Å; F147-E151 WeakPolarHBondContact O-CB 3.31Å; F147-E151 PolarHBondContact O-N 3.38Å; F147-L174 HydrophobicContact CE1-CD2 4.2Å; F147-L190 HydrophobicContact CE2-CD1 4.17Å; F147-L190 HydrophobicContact CZ-CD1 4.22Å; F147-W197 HydrophobicContact CE2-CH2 4.37Å; F147-W197 HydrophobicContact CE2-CZ3 4.43Å; F147-I204 HydrophobicContact CE1-CD1 4.12Å
148N92.9Very high92Very high68 Ų6832.2 Ų32.236%0.36417%0.168SC..Hα-helixtrans-63.1-40.8175.9-69.9-7.1000112.3K144 N145 Y146 K152K144-N148 VanDerWaalsContact O-CG 3.24Å; K144-N148 PolarHBondContact O-N 3.09Å; K144-N148 PolarHBondContact O-OD1 3.3Å; N145-N148 PolarHBondContact O-N 3.11Å; Y146-N148 PolarHBondContact O-N 2.94Å; N148-K152 WeakPolarHBondContact O-CG 3.46Å; N148-K152 PolarHBondContact O-N 3.15Å
149I94.2Very high92.1Very high4 Ų438.3 Ų38.32%0.02120%0.196CC..Hα-helixtrans-72.7-40177.8-66.1164.2000109.9F110 I114 F127 N145 Y146 F147 E151 K152 I153F110-I149 HydrophobicContact CB-CD1 4.01Å; F110-I149 HydrophobicContact CB-CG2 4.18Å; I114-I149 HydrophobicContact CD1-CG2 3.32Å; F127-I149 HydrophobicContact CD1-CG2 4.49Å; F127-I149 HydrophobicContact CE1-CB 3.62Å; F127-I149 HydrophobicContact CE1-CG2 3.54Å; F127-I149 HydrophobicContact CE2-CG2 3.99Å; F127-I149 HydrophobicContact CZ-CB 3.59Å; F127-I149 HydrophobicContact CZ-CD1 3.9Å; F127-I149 HydrophobicContact CZ-CG1 4.36Å; F127-I149 HydrophobicContact CZ-CG2 3.24Å; N145-I149 WeakPolarHBondContact O-CB 3.12Å; N145-I149 VanDerWaalsContact O-CG1 3.28Å; N145-I149 WeakPolarHBondContact O-CG1 3.35Å; N145-I149 PolarHBondContact O-N 2.82Å; N145-I149 WeakPolarHBondContact OD1-CD1 3.47Å; Y146-I149 PolarHBondContact O-N 3.36Å; F147-I149 VanDerWaalsContact C-N 3.35Å; F147-I149 PolarHBondContact O-N 2.95Å; I149-E151 VanDerWaalsContact C-N 3.3Å; I149-E151 PolarHBondContact O-N 3.29Å; I149-K152 WeakPolarHBondContact O-CA 3.47Å; I149-K152 WeakPolarHBondContact O-CB 3.44Å; I149-K152 PolarHBondContact O-N 3.15Å; I149-I153 HydrophobicContact CG2-CD1 4.49Å; I149-I153 WeakPolarHBondContact O-CG1 3.27Å; I149-I153 PolarHBondContact O-N 2.9Å
150L95.8Very high92Very high0 Ų038.9 Ų38.90%019%0.194CC..Hα-helixtrans-58.8-41.8174.6178.958.4000111.8F127 Y146 F147 K152 I153 V154 L170 L171 L174 W207F127-L150 HydrophobicContact CD1-CB 4.44Å; Y146-L150 HydrophobicContact CE1-CD2 3.96Å; Y146-L150 VanDerWaalsContact O-CB 3.28Å; Y146-L150 WeakPolarHBondContact O-CB 3.48Å; Y146-L150 PolarHBondContact O-N 3.41Å; F147-L150 HydrophobicContact CD1-CD2 4.45Å; F147-L150 PolarHBondContact O-N 3.38Å; L150-K152 VanDerWaalsContact C-N 3.29Å; L150-K152 PolarHBondContact O-N 3.29Å; L150-I153 WeakPolarHBondContact O-CB 3.47Å; L150-I153 PolarHBondContact O-N 3.23Å; L150-I153 VanDerWaalsContact O-N 3.12Å; L150-V154 HydrophobicContact CD1-CG2 4.48Å; L150-V154 WeakPolarHBondContact O-CG2 3.16Å; L150-V154 PolarHBondContact O-N 2.95Å; L150-L170 HydrophobicContact CD1-CD1 3.98Å; L150-L170 HydrophobicContact CD1-CD2 3.55Å; L150-L170 HydrophobicContact CD1-CG 4.46Å; L150-L170 HydrophobicContact CD2-CD2 4.3Å; L150-L171 HydrophobicContact CD1-CD2 4.26Å; L150-L171 HydrophobicContact CD2-CD2 4.17Å; L150-L171 HydrophobicContact CG-CD2 4.45Å; L150-L174 HydrophobicContact CD2-CD2 3.53Å; L150-W207 HydrophobicContact CD2-CZ3 3.83Å; L150-W207 HydrophobicContact CG-CE3 4.49Å; L150-W207 HydrophobicContact CG-CH2 4.43Å; L150-W207 HydrophobicContact CG-CZ3 3.82Å
151E94.4Very high91.9Very high60 Ų6039.9 Ų39.928%0.2819%0.194SC..Hα-helixtrans-56.9-43.9173-178176.4170.500111.6F147 I149 I153 V154 R155 W207F147-E151 WeakPolarHBondContact O-CB 3.31Å; F147-E151 PolarHBondContact O-N 3.38Å; I149-E151 VanDerWaalsContact C-N 3.3Å; I149-E151 PolarHBondContact O-N 3.29Å; E151-I153 VanDerWaalsContact C-N 3.34Å; E151-I153 PolarHBondContact O-N 3.08Å; E151-V154 PolarHBondContact O-N 3.39Å; E151-R155 HydrophobicContact CG-CG 4.48Å; E151-R155 WeakPolarHBondContact O-CG 3.44Å; E151-R155 PolarHBondContact O-N 2.91Å; E151-R155 IonicContact OE1-CZ 3.78Å; E151-R155 VanDerWaalsContact OE1-CZ 3.25Å; E151-R155 IonicContact OE1-NE 2.84Å; E151-R155 PolarHBondContact OE1-NE 3.47Å; E151-R155 IonicContact OE1-NH2 3.77Å; E151-R155 PolarHBondContact OE1-NH2 3.33Å; E151-W207 HydrophobicContact CB-CH2 3.78Å; E151-W207 HydrophobicContact CB-CZ2 3.44Å; E151-W207 VanDerWaalsContact CB-CZ2 3.44Å; E151-W207 HydrophobicContact CG-CH2 4.45Å; E151-W207 HydrophobicContact CG-CZ2 3.62Å
152K93.8Very high91.7Very high81 Ų8140.3 Ų40.335%0.35219%0.186SC..Hα-helixtrans-64.7-36.6175.8-66.3179-175.9-175.40112.5S111 I114 N148 I149 L150 K156S111-K152 PolarHBondContact OG-NZ 3.13Å; I114-K152 HydrophobicContact CD1-CB 4.4Å; N148-K152 WeakPolarHBondContact O-CG 3.46Å; N148-K152 PolarHBondContact O-N 3.15Å; I149-K152 WeakPolarHBondContact O-CA 3.47Å; I149-K152 WeakPolarHBondContact O-CB 3.44Å; I149-K152 PolarHBondContact O-N 3.15Å; L150-K152 VanDerWaalsContact C-N 3.29Å; L150-K152 PolarHBondContact O-N 3.29Å; K152-K156 WeakPolarHBondContact O-CB 3.38Å; K152-K156 PolarHBondContact O-N 2.99Å
153I95.1Very high91.3Very high0 Ų042.6 Ų42.60%020%0.198CC..Hα-helixtrans-60.3-49.4173.5-65.9172.4000109.6I114 F120 V123 A124 F127 I149 L150 E151 K156 V157 V167I114-I153 HydrophobicContact CD1-CD1 4.14Å; I114-I153 HydrophobicContact CD1-CG1 3.41Å; I114-I153 VanDerWaalsContact CD1-CG1 3.41Å; I114-I153 HydrophobicContact CG1-CG1 3.82Å; I114-I153 HydrophobicContact CG2-CG1 4.43Å; F120-I153 HydrophobicContact CE2-CG2 3.98Å; F120-I153 HydrophobicContact CZ-CG2 3.97Å; V123-I153 HydrophobicContact CG1-CD1 4.23Å; A124-I153 HydrophobicContact CB-CG2 4.28Å; F127-I153 HydrophobicContact CB-CD1 4.28Å; F127-I153 HydrophobicContact CD1-CD1 4.01Å; F127-I153 HydrophobicContact CD2-CD1 4.41Å; F127-I153 HydrophobicContact CG-CD1 3.96Å; I149-I153 HydrophobicContact CG2-CD1 4.49Å; I149-I153 WeakPolarHBondContact O-CG1 3.27Å; I149-I153 PolarHBondContact O-N 2.9Å; L150-I153 WeakPolarHBondContact O-CB 3.47Å; L150-I153 PolarHBondContact O-N 3.23Å; L150-I153 VanDerWaalsContact O-N 3.12Å; E151-I153 VanDerWaalsContact C-N 3.34Å; E151-I153 PolarHBondContact O-N 3.08Å; I153-K156 PolarHBondContact O-N 2.7Å; I153-V157 WeakPolarHBondContact O-CG2 3.22Å; I153-V157 PolarHBondContact O-N 3.09Å; I153-V157 VanDerWaalsContact O-N 3.17Å; I153-V167 HydrophobicContact CG2-CG1 4.3Å; I153-V167 HydrophobicContact CG2-CG2 3.63Å
154V95Very high91.3Very high0 Ų044 Ų440%021%0.207CC..Hα-helixtrans-62.9-50-179.5175.10000110.9L150 E151 K156 V157 L158 V167 L171 W207 L211L150-V154 HydrophobicContact CD1-CG2 4.48Å; L150-V154 WeakPolarHBondContact O-CG2 3.16Å; L150-V154 PolarHBondContact O-N 2.95Å; E151-V154 PolarHBondContact O-N 3.39Å; V154-K156 VanDerWaalsContact C-N 3.33Å; V154-K156 PolarHBondContact O-N 3.39Å; V154-V157 PolarHBondContact O-N 3.04Å; V154-V157 VanDerWaalsContact O-N 3.1Å; V154-L158 HydrophobicContact CG1-CD1 3.84Å; V154-L158 HydrophobicContact CG1-CG 4.29Å; V154-L158 WeakPolarHBondContact O-CG 3.43Å; V154-L158 PolarHBondContact O-N 2.9Å; V154-V167 HydrophobicContact CG2-CG1 3.94Å; V154-L171 HydrophobicContact CG2-CD1 4.26Å; V154-L171 HydrophobicContact CG2-CD2 4.36Å; V154-W207 HydrophobicContact CB-CD2 4.34Å; V154-W207 HydrophobicContact CB-CG 4.26Å; V154-W207 HydrophobicContact CG1-CB 3.91Å; V154-W207 HydrophobicContact CG1-CD2 4.31Å; V154-W207 HydrophobicContact CG1-CG 3.72Å; V154-W207 HydrophobicContact CG2-CB 4.29Å; V154-W207 HydrophobicContact CG2-CD2 3.95Å; V154-W207 HydrophobicContact CG2-CE3 4.05Å; V154-W207 HydrophobicContact CG2-CG 4.09Å; V154-L211 HydrophobicContact CG1-CD1 4.39Å
155R92.9Very high91.2Very high127 Ų12742.3 Ų42.348%0.47920%0.198SC..Hα-helixtrans-56.1-46.2178.1-72.4-179.3-172.8-76.5-0.9111.8E151 V157 L158 E159E151-R155 HydrophobicContact CG-CG 4.48Å; E151-R155 WeakPolarHBondContact O-CG 3.44Å; E151-R155 PolarHBondContact O-N 2.91Å; E151-R155 IonicContact OE1-CZ 3.78Å; E151-R155 VanDerWaalsContact OE1-CZ 3.25Å; E151-R155 IonicContact OE1-NE 2.84Å; E151-R155 PolarHBondContact OE1-NE 3.47Å; E151-R155 IonicContact OE1-NH2 3.77Å; E151-R155 PolarHBondContact OE1-NH2 3.33Å; R155-V157 VanDerWaalsContact C-N 3.31Å; R155-V157 PolarHBondContact O-N 3.29Å; R155-L158 PolarHBondContact O-N 3.01Å; R155-L158 VanDerWaalsContact O-N 3.17Å; R155-E159 WeakPolarHBondContact O-CB 3.22Å; R155-E159 WeakPolarHBondContact O-CG 3.31Å; R155-E159 PolarHBondContact O-N 2.89Å
156K91.4Very high91.1Very high9 Ų942.9 Ų42.94%0.03920%0.201CC..Hα-helixtrans-58.3-41.4177.2-175.5174.4-177.8690112.4I114 Q115 F120 K152 I153 V154 E159 D160I114-K156 HydrophobicContact CG2-CB 4.17Å; I114-K156 HydrophobicContact CG2-CD 3.6Å; I114-K156 WeakPolarHBondContact O-CD 2.95Å; I114-K156 WeakPolarHBondContact O-CE 3.27Å; Q115-K156 PolarHBondContact O-NZ 3.43Å; Q115-K156 VanDerWaalsContact O-NZ 3.14Å; F120-K156 HydrophobicContact CD2-CD 3.87Å; F120-K156 HydrophobicContact CE2-CD 4.12Å; K152-K156 WeakPolarHBondContact O-CB 3.38Å; K152-K156 PolarHBondContact O-N 2.99Å; I153-K156 PolarHBondContact O-N 2.7Å; V154-K156 VanDerWaalsContact C-N 3.33Å; V154-K156 PolarHBondContact O-N 3.39Å; K156-E159 PolarHBondContact O-N 3.44Å; K156-D160 VanDerWaalsContact CE-OD2 3.27Å; K156-D160 WeakPolarHBondContact CE-OD2 3.28Å; K156-D160 WeakPolarHBondContact CG-OD2 3.31Å; K156-D160 IonicContact NZ-OD2 3.71Å; K156-D160 PolarHBondContact NZ-OD2 3.2Å; K156-D160 VanDerWaalsContact O-CB 3.28Å; K156-D160 WeakPolarHBondContact O-CB 3.05Å; K156-D160 PolarHBondContact O-N 2.9Å
157V92.3Very high91.1Very high0 Ų042.8 Ų42.80%020%0.201CC..Hα-helixtrans-68-40177.91720000112F120 I153 V154 R155 E159 N161 Y162 P164 V167 L211 M214F120-V157 HydrophobicContact CE1-CG2 4.21Å; F120-V157 HydrophobicContact CE2-CG2 4.13Å; F120-V157 HydrophobicContact CZ-CG2 3.41Å; F120-V157 VanDerWaalsContact CZ-CG2 3.41Å; I153-V157 WeakPolarHBondContact O-CG2 3.22Å; I153-V157 PolarHBondContact O-N 3.09Å; I153-V157 VanDerWaalsContact O-N 3.17Å; V154-V157 PolarHBondContact O-N 3.04Å; V154-V157 VanDerWaalsContact O-N 3.1Å; R155-V157 VanDerWaalsContact C-N 3.31Å; R155-V157 PolarHBondContact O-N 3.29Å; V157-E159 VanDerWaalsContact C-N 3.3Å; V157-E159 PolarHBondContact O-N 3.09Å; V157-N161 WeakPolarHBondContact O-CA 3.14Å; V157-N161 PolarHBondContact O-N 2.88Å; V157-Y162 WeakPolarHBondContact CG2-O 3.25Å; V157-P164 HydrophobicContact CG1-CB 3.79Å; V157-V167 HydrophobicContact CG2-CB 4.32Å; V157-V167 HydrophobicContact CG2-CG2 3.53Å; V157-L211 HydrophobicContact CB-CD2 4.27Å; V157-L211 HydrophobicContact CG1-CD2 3.59Å; V157-M214 HydrophobicContact CG1-CE 4.35Å; V157-M214 HydrophobicContact CG1-SD 4.4Å; V157-M214 VanDerWaalsContact O-CE 3.24Å; V157-M214 WeakPolarHBondContact O-CE 3.45Å
158L90.9Very high91.1Very high52 Ų5245.8 Ų45.827%0.27221%0.214SC..Hα-helixtrans-64.5-36.6177-67.1172.3000111.7V154 R155 E210 L211 M214V154-L158 HydrophobicContact CG1-CD1 3.84Å; V154-L158 HydrophobicContact CG1-CG 4.29Å; V154-L158 WeakPolarHBondContact O-CG 3.43Å; V154-L158 PolarHBondContact O-N 2.9Å; R155-L158 PolarHBondContact O-N 3.01Å; R155-L158 VanDerWaalsContact O-N 3.17Å; L158-E210 HydrophobicContact CD1-CB 4.09Å; L158-E210 WeakPolarHBondContact CD1-OE2 3.35Å; L158-E210 HydrophobicContact CD2-CB 4Å; L158-L211 HydrophobicContact CD2-CD2 3.76Å; L158-L211 HydrophobicContact CD2-CG 4.15Å; L158-L211 HydrophobicContact CG-CD2 4.23Å; L158-M214 HydrophobicContact CD2-SD 4.44Å
159E89.8Confident91.1Very high134 Ų13446.6 Ų46.663%0.62622%0.215SC*.Hα-helixtrans-78.1-54.3178.6-69.8167.3-168.500112.4R155 K156 V157 N161R155-E159 WeakPolarHBondContact O-CB 3.22Å; R155-E159 WeakPolarHBondContact O-CG 3.31Å; R155-E159 PolarHBondContact O-N 2.89Å; K156-E159 PolarHBondContact O-N 3.44Å; V157-E159 VanDerWaalsContact C-N 3.3Å; V157-E159 PolarHBondContact O-N 3.09Å; E159-N161 PolarHBondContact O-ND2 3.08Å
160D86.8Confident91.1Very high74 Ų7446.4 Ų46.440%0.39621%0.214SC..Hα-helixtrans-87.3-11-170.9-68.8-18.9000113.7K156 Y162K156-D160 VanDerWaalsContact CE-OD2 3.27Å; K156-D160 WeakPolarHBondContact CE-OD2 3.28Å; K156-D160 WeakPolarHBondContact CG-OD2 3.31Å; K156-D160 IonicContact NZ-OD2 3.71Å; K156-D160 PolarHBondContact NZ-OD2 3.2Å; K156-D160 VanDerWaalsContact O-CB 3.28Å; K156-D160 WeakPolarHBondContact O-CB 3.05Å; K156-D160 PolarHBondContact O-N 2.9Å; D160-Y162 PolarHBondContact O-N 3.3Å; D160-Y162 VanDerWaalsContact O-N 3.15Å
161N85.9Confident91Very high46 Ų4646.4 Ų46.425%0.24621%0.214CC..  trans56.522.9-171.8-57.4-93.8000114.8V157 E159 M214V157-N161 WeakPolarHBondContact O-CA 3.14Å; V157-N161 PolarHBondContact O-N 2.88Å; E159-N161 PolarHBondContact O-ND2 3.08Å; N161-M214 HydrophobicContact CB-CE 3.63Å; N161-M214 VanDerWaalsContact CG-CE 3.5Å; N161-M214 WeakPolarHBondContact OD1-CE 3.39Å
162Y83.9Confident91Very high58 Ų5848.4 Ų48.423%0.22722%0.223CC..  trans-88118.3-174-172.3-104.4000112.2L117 F120 N121 V157 D160L117-Y162 HydrophobicContact CD2-CD1 3.83Å; L117-Y162 HydrophobicContact CD2-CD2 3.95Å; L117-Y162 HydrophobicContact CD2-CE1 4.12Å; L117-Y162 HydrophobicContact CD2-CE2 4.24Å; L117-Y162 HydrophobicContact CD2-CG 3.74Å; F120-Y162 HydrophobicContact CB-CE1 4.29Å; F120-Y162 AromaticContact CD1-CD1 3.61Å; F120-Y162 HydrophobicContact CD1-CD1 3.61Å; F120-Y162 AromaticContact CD1-CE1 3.68Å; F120-Y162 HydrophobicContact CD1-CE1 3.68Å; F120-Y162 HydrophobicContact CE1-CD1 4.03Å; F120-Y162 HydrophobicContact CE1-CE1 4.44Å; F120-Y162 HydrophobicContact CG-CD1 4.12Å; F120-Y162 HydrophobicContact CG-CE1 4.23Å; N121-Y162 PolarHBondContact ND2-OH 2.79Å; V157-Y162 WeakPolarHBondContact CG2-O 3.25Å; D160-Y162 PolarHBondContact O-N 3.3Å; D160-Y162 VanDerWaalsContact O-N 3.15Å
163N82.8Confident90.9Very high47 Ų4746 Ų4625%0.25121%0.214SC..  trans4660.7174.9-163.52.4000115.4N121 R165 L166N121-N163 PolarHBondContact OD1-ND2 3.42Å; N163-R165 PolarHBondContact O-N 3.2Å; N163-L166 PolarHBondContact O-N 3.36Å
164P89.4Confident90.8Very high32 Ų3246 Ų4621%0.20821%0.214CC..Hα-helixtrans-65.5-25.5-178.426.3-34.9000113.9V157 L166 V167 K168 M214V157-P164 HydrophobicContact CG1-CB 3.79Å; P164-L166 PolarHBondContact O-N 3Å; P164-V167 PolarHBondContact O-N 2.88Å; P164-K168 WeakPolarHBondContact O-CG 2.97Å; P164-K168 PolarHBondContact O-N 2.87Å; P164-M214 HydrophobicContact CB-CE 4.39Å; P164-M214 HydrophobicContact CB-SD 4.02Å
165R89.1Confident90.6Very high68 Ų6847.9 Ų47.926%0.25723%0.228SC..Hα-helixtrans-62-44.1-178.9-165.6-178.473.7-134.3-8.5111.7N163 V167 K168 E169 D243 D246N163-R165 PolarHBondContact O-N 3.2Å; R165-V167 VanDerWaalsContact C-N 3.33Å; R165-V167 PolarHBondContact O-N 2.9Å; R165-K168 WeakPolarHBondContact O-CB 3.39Å; R165-K168 PolarHBondContact O-N 2.92Å; R165-E169 IonicContact NE-OE1 2.66Å; R165-E169 WeakPolarHBondContact O-CG 3.46Å; R165-E169 PolarHBondContact O-N 3.41Å; R165-D243 IonicContact CZ-OD2 3.25Å; R165-D243 IonicContact NH1-OD2 3Å; R165-D243 IonicContact NH2-OD1 2.71Å; R165-D243 IonicContact NH2-OD2 2.66Å; R165-D243 PolarHBondContact NH2-OD2 3.39Å; R165-D246 IonicContact CZ-OD1 3.97Å; R165-D246 IonicContact NH1-OD1 2.58Å; R165-D246 PolarHBondContact NH1-OD1 2.97Å
166L89.3Confident90.4Very high28 Ų2844.7 Ų44.715%0.14723%0.225CC..Hα-helixtrans-64.2-37.2-178-174.7139000112.3A124 N163 P164 L170A124-L166 HydrophobicContact CB-CD2 3.13Å; N163-L166 PolarHBondContact O-N 3.36Å; P164-L166 PolarHBondContact O-N 3Å; L166-L170 WeakPolarHBondContact O-CB 3.4Å; L166-L170 PolarHBondContact O-N 2.85Å
167V93.9Very high90.3Very high0 Ų045.6 Ų45.60%023%0.231CC..Hα-helixtrans-75.5-35.7176.5-1780000111.8F120 I153 V154 V157 P164 R165 E169 L170 L171 L211F120-V167 HydrophobicContact CE1-CG2 4.48Å; F120-V167 HydrophobicContact CZ-CG2 3.94Å; I153-V167 HydrophobicContact CG2-CG1 4.3Å; I153-V167 HydrophobicContact CG2-CG2 3.63Å; V154-V167 HydrophobicContact CG2-CG1 3.94Å; V157-V167 HydrophobicContact CG2-CB 4.32Å; V157-V167 HydrophobicContact CG2-CG2 3.53Å; P164-V167 PolarHBondContact O-N 2.88Å; R165-V167 VanDerWaalsContact C-N 3.33Å; R165-V167 PolarHBondContact O-N 2.9Å; V167-E169 VanDerWaalsContact C-N 3.35Å; V167-E169 PolarHBondContact O-N 3.2Å; V167-L170 WeakPolarHBondContact O-CB 3.42Å; V167-L170 PolarHBondContact O-N 3.33Å; V167-L171 HydrophobicContact CG1-CD1 4.4Å; V167-L171 HydrophobicContact CG1-CG 4.37Å; V167-L171 WeakPolarHBondContact O-CG 3.41Å; V167-L171 PolarHBondContact O-N 3.04Å; V167-L211 HydrophobicContact CB-CD1 4.37Å; V167-L211 HydrophobicContact CG1-CD1 3.74Å
168K93.4Very high90Very high74 Ų7446.2 Ų46.232%0.32223%0.234SC..Hα-helixtrans-58.3-46.8171.1-74.7179.1-179.9-1700111.6P164 R165 L171 Q172 L211 N212P164-K168 WeakPolarHBondContact O-CG 2.97Å; P164-K168 PolarHBondContact O-N 2.87Å; R165-K168 WeakPolarHBondContact O-CB 3.39Å; R165-K168 PolarHBondContact O-N 2.92Å; K168-L171 PolarHBondContact O-N 3.26Å; K168-Q172 WeakPolarHBondContact O-CB 3.34Å; K168-Q172 PolarHBondContact O-N 3.18Å; K168-L211 VanDerWaalsContact CE-C 3.43Å; K168-L211 WeakPolarHBondContact CE-O 3.42Å; K168-L211 HydrophobicContact CG-CB 4.12Å; K168-L211 HydrophobicContact CG-CD1 4.47Å; K168-L211 PolarHBondContact NZ-O 2.89Å; K168-N212 PolarHBondContact NZ-OD1 2.78Å
169E92.1Very high89.6Confident84 Ų8449.6 Ų49.639%0.39325%0.249SC..Hα-helixtrans-61.4-43.5175.6-71.8174.2-15900111.9R165 V167 Q172 D173R165-E169 IonicContact NE-OE1 2.66Å; R165-E169 WeakPolarHBondContact O-CG 3.46Å; R165-E169 PolarHBondContact O-N 3.41Å; V167-E169 VanDerWaalsContact C-N 3.35Å; V167-E169 PolarHBondContact O-N 3.2Å; E169-Q172 PolarHBondContact O-N 3.35Å; E169-D173 WeakPolarHBondContact O-CB 3.39Å; E169-D173 VanDerWaalsContact O-CG 3.28Å; E169-D173 PolarHBondContact O-N 2.97Å; E169-D173 VanDerWaalsContact O-OD2 3.14Å
170L94.8Very high89.4Confident0 Ų045.7 Ų45.70%024%0.236CC..Hα-helixtrans-57.3-52.1175.5-173.7174.4000111.6A124 F127 Q128 L150 L166 V167 Q172 D173 L174A124-L170 WeakPolarHBondContact O-CD1 3.42Å; F127-L170 HydrophobicContact CB-CD1 3.92Å; Q128-L170 HydrophobicContact CB-CB 4.21Å; Q128-L170 HydrophobicContact CB-CG 3.98Å; Q128-L170 HydrophobicContact CG-CB 4.44Å; L150-L170 HydrophobicContact CD1-CD1 3.98Å; L150-L170 HydrophobicContact CD1-CD2 3.55Å; L150-L170 HydrophobicContact CD1-CG 4.46Å; L150-L170 HydrophobicContact CD2-CD2 4.3Å; L166-L170 WeakPolarHBondContact O-CB 3.4Å; L166-L170 PolarHBondContact O-N 2.85Å; V167-L170 WeakPolarHBondContact O-CB 3.42Å; V167-L170 PolarHBondContact O-N 3.33Å; L170-Q172 VanDerWaalsContact C-N 3.29Å; L170-Q172 PolarHBondContact O-N 2.58Å; L170-D173 PolarHBondContact O-N 2.87Å; L170-L174 WeakPolarHBondContact O-CB 3.48Å; L170-L174 PolarHBondContact O-N 3.32Å
171L94.9Very high88.9Confident0 Ų043.3 Ų43.30%022%0.223CC..Hα-helixtrans-64.4-36.5-179.5-67.5179.6000111.8L150 V154 V167 K168 L174 S175 W207 Q208 L211L150-L171 HydrophobicContact CD1-CD2 4.26Å; L150-L171 HydrophobicContact CD2-CD2 4.17Å; L150-L171 HydrophobicContact CG-CD2 4.45Å; V154-L171 HydrophobicContact CG2-CD1 4.26Å; V154-L171 HydrophobicContact CG2-CD2 4.36Å; V167-L171 HydrophobicContact CG1-CD1 4.4Å; V167-L171 HydrophobicContact CG1-CG 4.37Å; V167-L171 WeakPolarHBondContact O-CG 3.41Å; V167-L171 PolarHBondContact O-N 3.04Å; K168-L171 PolarHBondContact O-N 3.26Å; L171-L174 PolarHBondContact O-N 2.97Å; L171-S175 WeakPolarHBondContact O-CB 3.29Å; L171-S175 PolarHBondContact O-N 3.47Å; L171-W207 HydrophobicContact CD1-CB 3.77Å; L171-W207 HydrophobicContact CD2-CE3 3.94Å; L171-Q208 HydrophobicContact CB-CG 3.9Å; L171-Q208 HydrophobicContact CD1-CG 4.03Å; L171-L211 HydrophobicContact CD1-CD1 3.53Å
172Q93.3Very high88.4Confident102 Ų10245.2 Ų45.248%0.47724%0.237SC..Hα-helixtrans-63.1-48.1174.3-175.460.130.900111.4K168 E169 L170 L174 S175 S176K168-Q172 WeakPolarHBondContact O-CB 3.34Å; K168-Q172 PolarHBondContact O-N 3.18Å; E169-Q172 PolarHBondContact O-N 3.35Å; L170-Q172 VanDerWaalsContact C-N 3.29Å; L170-Q172 PolarHBondContact O-N 2.58Å; Q172-L174 VanDerWaalsContact C-N 3.32Å; Q172-L174 PolarHBondContact O-N 3.39Å; Q172-S175 PolarHBondContact O-N 3.24Å; Q172-S176 WeakPolarHBondContact O-CB 3.36Å; Q172-S176 PolarHBondContact O-N 3.34Å; Q172-S176 PolarHBondContact O-OG 3.19Å
173D92.6Very high88Confident30 Ų3047.6 Ų47.616%0.1625%0.252CS..Hα-helixtrans-60.7-42176.5-72.7-51.3000112.1Q128 R132 E169 L170 S176 T177Q128-D173 VanDerWaalsContact CD-OD2 3.29Å; Q128-D173 HydrophobicContact CG-CB 4.46Å; Q128-D173 WeakPolarHBondContact CG-OD2 3.03Å; Q128-D173 PolarHBondContact NE2-OD2 3.38Å; R132-D173 HydrophobicContact CG-CB 4.03Å; R132-D173 VanDerWaalsContact CZ-CG 3.48Å; R132-D173 IonicContact CZ-OD1 2.92Å; R132-D173 VanDerWaalsContact CZ-OD1 3.27Å; R132-D173 IonicContact CZ-OD2 3.43Å; R132-D173 IonicContact NE-OD1 2.69Å; R132-D173 PolarHBondContact NE-OD1 3.09Å; R132-D173 IonicContact NE-OD2 3.85Å; R132-D173 PolarHBondContact NE-OD2 3.41Å; R132-D173 IonicContact NH2-OD1 2.79Å; R132-D173 PolarHBondContact NH2-OD1 3.22Å; R132-D173 IonicContact NH2-OD2 3.71Å; R132-D173 PolarHBondContact NH2-OD2 3.45Å; E169-D173 WeakPolarHBondContact O-CB 3.39Å; E169-D173 VanDerWaalsContact O-CG 3.28Å; E169-D173 PolarHBondContact O-N 2.97Å; E169-D173 VanDerWaalsContact O-OD2 3.14Å; L170-D173 PolarHBondContact O-N 2.87Å; D173-S176 PolarHBondContact O-N 3.48Å; D173-T177 WeakPolarHBondContact O-CB 3.47Å; D173-T177 PolarHBondContact O-N 3.16Å; D173-T177 PolarHBondContact O-OG1 3.26Å
174L92.4Very high87.4Confident0 Ų052.1 Ų52.10%027%0.272CS..Hα-helixtrans-61.1-48.517617862.9000110.6A131 L135 F147 L150 L170 L171 Q172 T177 L178 I204A131-L174 HydrophobicContact CB-CB 4.11Å; A131-L174 HydrophobicContact CB-CD1 3.92Å; L135-L174 HydrophobicContact CD2-CD1 3.51Å; F147-L174 HydrophobicContact CE1-CD2 4.2Å; L150-L174 HydrophobicContact CD2-CD2 3.53Å; L170-L174 WeakPolarHBondContact O-CB 3.48Å; L170-L174 PolarHBondContact O-N 3.32Å; L171-L174 PolarHBondContact O-N 2.97Å; Q172-L174 VanDerWaalsContact C-N 3.32Å; Q172-L174 PolarHBondContact O-N 3.39Å; L174-T177 PolarHBondContact O-N 2.58Å; L174-L178 HydrophobicContact CD1-CD1 4Å; L174-L178 HydrophobicContact CD1-CG 4.15Å; L174-L178 HydrophobicContact CG-CD1 4.01Å; L174-L178 HydrophobicContact CG-CG 4.49Å; L174-L178 WeakPolarHBondContact O-CB 3.32Å; L174-L178 VanDerWaalsContact O-CG 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.5Å; L174-L178 PolarHBondContact O-N 2.89Å; L174-I204 HydrophobicContact CD2-CD1 3.74Å; L174-I204 HydrophobicContact CD2-CG1 4.1Å; L174-I204 HydrophobicContact CG-CD1 4.15Å
175S90.7Very high86.1Confident40 Ų4057.2 Ų57.228%0.2829%0.291SS..Hα-helixtrans-60.4-47.1178.1-175.50000111.6L171 Q172 T177 L178 H179L171-S175 WeakPolarHBondContact O-CB 3.29Å; L171-S175 PolarHBondContact O-N 3.47Å; Q172-S175 PolarHBondContact O-N 3.24Å; S175-T177 PolarHBondContact O-N 2.84Å; S175-L178 PolarHBondContact O-N 3.35Å; S175-H179 VanDerWaalsContact O-CB 3.29Å; S175-H179 WeakPolarHBondContact O-CB 3.32Å; S175-H179 PolarHBondContact O-N 3.46Å
176S89.9Confident84.5Confident61 Ų6157.1 Ų57.143%0.42731%0.311SS..Hα-helixtrans-62-41176.5-63.50000112.7Q172 D173 H179 S180Q172-S176 WeakPolarHBondContact O-CB 3.36Å; Q172-S176 PolarHBondContact O-N 3.34Å; Q172-S176 PolarHBondContact O-OG 3.19Å; D173-S176 PolarHBondContact O-N 3.48Å; S176-H179 PolarHBondContact O-N 2.8Å; S176-S180 WeakPolarHBondContact O-CB 3.41Å; S176-S180 PolarHBondContact O-N 2.66Å
177T87.8Confident82.9Confident28 Ų2866 Ų6617%0.17234%0.343CS..Hα-helixtrans-64.3-48.4176.7-54.20000110.4A131 D173 L174 S175 H179 S180 L181A131-T177 WeakPolarHBondContact O-CG2 3.37Å; D173-T177 WeakPolarHBondContact O-CB 3.47Å; D173-T177 PolarHBondContact O-N 3.16Å; D173-T177 PolarHBondContact O-OG1 3.26Å; L174-T177 PolarHBondContact O-N 2.58Å; S175-T177 PolarHBondContact O-N 2.84Å; T177-H179 VanDerWaalsContact C-N 3.33Å; T177-H179 PolarHBondContact O-N 3.24Å; T177-S180 PolarHBondContact O-N 2.92Å; T177-L181 HydrophobicContact CG2-CD1 4Å; T177-L181 HydrophobicContact CG2-CG 4.42Å; T177-L181 WeakPolarHBondContact O-CB 3.45Å; T177-L181 VanDerWaalsContact O-CG 3.22Å; T177-L181 WeakPolarHBondContact O-CG 3.29Å; T177-L181 PolarHBondContact O-N 2.79Å
178L85.6Confident81.2Confident12 Ų1268.9 Ų68.96%0.06336%0.362CS..Hα-helixtrans-62.8-39.6178.6-68.3175.6000112.3L135 L174 S175 L181 T182 L190 L201 I204L135-L178 HydrophobicContact CD2-CD2 4.02Å; L174-L178 HydrophobicContact CD1-CD1 4Å; L174-L178 HydrophobicContact CD1-CG 4.15Å; L174-L178 HydrophobicContact CG-CD1 4.01Å; L174-L178 HydrophobicContact CG-CG 4.49Å; L174-L178 WeakPolarHBondContact O-CB 3.32Å; L174-L178 VanDerWaalsContact O-CG 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.5Å; L174-L178 PolarHBondContact O-N 2.89Å; S175-L178 PolarHBondContact O-N 3.35Å; L178-L181 PolarHBondContact O-N 3.21Å; L178-T182 WeakPolarHBondContact O-CB 3.48Å; L178-T182 PolarHBondContact O-N 3.2Å; L178-T182 PolarHBondContact O-OG1 3.27Å; L178-L190 HydrophobicContact CD2-CD1 3.6Å; L178-L190 HydrophobicContact CD2-CD2 4.22Å; L178-L190 HydrophobicContact CD2-CG 4.25Å; L178-L201 HydrophobicContact CB-CD2 4.44Å; L178-L201 HydrophobicContact CD1-CD2 3.84Å; L178-I204 HydrophobicContact CD1-CD1 3.66Å
179H83.9Confident79.7Confident124 Ų12467.7 Ų67.757%0.57436%0.361SS*.Hα-helixtrans-63.3-48.2175.9-177.5-96.6000111.6S175 S176 T177 L181 T182 I183S175-H179 VanDerWaalsContact O-CB 3.29Å; S175-H179 WeakPolarHBondContact O-CB 3.32Å; S175-H179 PolarHBondContact O-N 3.46Å; S176-H179 PolarHBondContact O-N 2.8Å; T177-H179 VanDerWaalsContact C-N 3.33Å; T177-H179 PolarHBondContact O-N 3.24Å; H179-L181 VanDerWaalsContact C-N 3.34Å; H179-L181 PolarHBondContact O-N 2.91Å; H179-T182 PolarHBondContact O-N 3.24Å; H179-I183 WeakPolarHBondContact CE1-CD1 3.33Å; H179-I183 PolarHBondContact O-N 3.33Å
180S84.2Confident78.7Confident52 Ų5264 Ų6436%0.36434%0.344SS..Hα-helixtrans-58-45.9175.6178.50000111.6S176 T177 T182 I183 H184S176-S180 WeakPolarHBondContact O-CB 3.41Å; S176-S180 PolarHBondContact O-N 2.66Å; T177-S180 PolarHBondContact O-N 2.92Å; S180-T182 VanDerWaalsContact C-N 3.32Å; S180-T182 PolarHBondContact O-N 2.99Å; S180-I183 PolarHBondContact O-N 3.38Å; S180-H184 PolarHBondContact O-CD2 2.9Å; S180-H184 PolarHBondContact O-N 3.17Å; S180-H184 PolarHBondContact OG-CD2 2.98Å
181L77.9Confident77.5Confident23 Ų2368 Ų6812%0.1237%0.368CS..Hα-helixtrans-62.2-38.7177.5-72.3176000112.6T136 T177 L178 H179 F185 V189 L190T136-L181 HydrophobicContact CG2-CD1 3.45Å; T136-L181 VanDerWaalsContact CG2-CD1 3.45Å; T136-L181 HydrophobicContact CG2-CD2 4.11Å; T136-L181 HydrophobicContact CG2-CG 4.43Å; T177-L181 HydrophobicContact CG2-CD1 4Å; T177-L181 HydrophobicContact CG2-CG 4.42Å; T177-L181 WeakPolarHBondContact O-CB 3.45Å; T177-L181 VanDerWaalsContact O-CG 3.22Å; T177-L181 WeakPolarHBondContact O-CG 3.29Å; T177-L181 PolarHBondContact O-N 2.79Å; L178-L181 PolarHBondContact O-N 3.21Å; H179-L181 VanDerWaalsContact C-N 3.34Å; H179-L181 PolarHBondContact O-N 2.91Å; L181-F185 HydrophobicContact CD2-CD2 3.83Å; L181-F185 HydrophobicContact CD2-CE2 3.65Å; L181-F185 WeakPolarHBondContact O-CB 3.41Å; L181-F185 WeakPolarHBondContact O-CD2 3.16Å; L181-F185 PolarHBondContact O-N 3Å; L181-V189 HydrophobicContact CB-CB 4.22Å; L181-V189 HydrophobicContact CB-CG1 4.45Å; L181-V189 HydrophobicContact CB-CG2 3.84Å; L181-V189 HydrophobicContact CD1-CB 4.44Å; L181-V189 HydrophobicContact CD1-CG1 4.15Å; L181-V189 HydrophobicContact CD2-CG1 4.16Å; L181-V189 HydrophobicContact CG-CG1 4.48Å; L181-L190 HydrophobicContact CD1-CD2 4.35Å
182T74.9Confident76.3Confident87 Ų8769.9 Ų69.953%0.53439%0.388SS..Hα-helixtrans-66.2-43.5178.9-56.80000111.5L178 H179 S180 G186L178-T182 WeakPolarHBondContact O-CB 3.48Å; L178-T182 PolarHBondContact O-N 3.2Å; L178-T182 PolarHBondContact O-OG1 3.27Å; H179-T182 PolarHBondContact O-N 3.24Å; S180-T182 VanDerWaalsContact C-N 3.32Å; S180-T182 PolarHBondContact O-N 2.99Å; T182-G186 PolarHBondContact O-N 2.91Å
183I76.3Confident75.5Confident108 Ų10869.9 Ų69.955%0.55439%0.391SS*.Hα-helixtrans-66.8-45.6179.2-69.6177.1000111.5H179 S180H179-I183 WeakPolarHBondContact CE1-CD1 3.33Å; H179-I183 PolarHBondContact O-N 3.33Å; S180-I183 PolarHBondContact O-N 3.38Å
184H69Low74.8Confident142 Ų14272.1 Ų72.166%0.65741%0.405SS*.Hα-helixtrans-82.1-32.8-171.5-68.6-59.8000114.3S180S180-H184 PolarHBondContact O-CD2 2.9Å; S180-H184 PolarHBondContact O-N 3.17Å; S180-H184 PolarHBondContact OG-CD2 2.98Å
185F61.9Low74.1Confident138 Ų13877 Ų7761%0.60543%0.432SS*.Hα-helixtrans-105.1-9.3-172.9-64.9-85.4000113.9L181 R187 V189L181-F185 HydrophobicContact CD2-CD2 3.83Å; L181-F185 HydrophobicContact CD2-CE2 3.65Å; L181-F185 WeakPolarHBondContact O-CB 3.41Å; L181-F185 WeakPolarHBondContact O-CD2 3.16Å; L181-F185 PolarHBondContact O-N 3Å; F185-R187 PolarHBondContact O-N 3.33Å; F185-V189 HydrophobicContact CB-CG2 3.71Å; F185-V189 HydrophobicContact CD2-CG2 4.3Å; F185-V189 HydrophobicContact CG-CG2 4.23Å
186G55.3Low73.6Confident67 Ų6779.1 Ų79.169%0.69144%0.439SS*.  trans58.68.6172.100000115.9T182T182-G186 PolarHBondContact O-N 2.91Å
187R55.5Low73Confident214 Ų21477 Ų7781%0.80842%0.422SS*.SBendtrans-140.8156.5-179.3-70.2-173.4177.1-176.7-0.2109.5F185 V189F185-R187 PolarHBondContact O-N 3.33Å; R187-V189 WeakPolarHBondContact O-CG2 3.42Å; R187-V189 PolarHBondContact O-N 3.1Å
188C58.5Low72.6Confident61 Ų6180.5 Ų80.541%0.41244%0.439SS..  trans-56.1101172.3-70.10000109.4L190 W197C188-L190 PolarHBondContact O-N 3.45Å; C188-W197 VanDerWaalsContact CB-CD1 3.45Å; C188-W197 HydrophobicContact CB-CG 4.07Å
189V62.5Low72.6Confident48 Ų4883.8 Ų83.829%0.29146%0.462SS..  trans-72.7-21.2-169.8-177.10000112.1T136 L181 F185 R187T136-V189 HydrophobicContact CG2-CG1 3.41Å; T136-V189 VanDerWaalsContact CG2-CG1 3.41Å; L181-V189 HydrophobicContact CB-CB 4.22Å; L181-V189 HydrophobicContact CB-CG1 4.45Å; L181-V189 HydrophobicContact CB-CG2 3.84Å; L181-V189 HydrophobicContact CD1-CB 4.44Å; L181-V189 HydrophobicContact CD1-CG1 4.15Å; L181-V189 HydrophobicContact CD2-CG1 4.16Å; L181-V189 HydrophobicContact CG-CG1 4.48Å; F185-V189 HydrophobicContact CB-CG2 3.71Å; F185-V189 HydrophobicContact CD2-CG2 4.3Å; F185-V189 HydrophobicContact CG-CG2 4.23Å; R187-V189 WeakPolarHBondContact O-CG2 3.42Å; R187-V189 PolarHBondContact O-N 3.1Å
190L69.9Low72.6Confident8 Ų879.8 Ų79.84%0.04244%0.442CS..SBendtrans-105.8165.8176.91.7164.3000111.8L135 T136 F147 L178 L181 C188 G192 W197L135-L190 HydrophobicContact CD2-CD1 3.7Å; L135-L190 HydrophobicContact CD2-CD2 4.33Å; L135-L190 HydrophobicContact CG-CD1 3.95Å; L135-L190 HydrophobicContact CG-CD2 4.22Å; T136-L190 HydrophobicContact CG2-CD2 3.96Å; F147-L190 HydrophobicContact CE2-CD1 4.17Å; F147-L190 HydrophobicContact CZ-CD1 4.22Å; L178-L190 HydrophobicContact CD2-CD1 3.6Å; L178-L190 HydrophobicContact CD2-CD2 4.22Å; L178-L190 HydrophobicContact CD2-CG 4.25Å; L181-L190 HydrophobicContact CD1-CD2 4.35Å; C188-L190 PolarHBondContact O-N 3.45Å; L190-G192 PolarHBondContact O-N 3.37Å; L190-W197 VanDerWaalsContact C-CE2 3.48Å; L190-W197 VanDerWaalsContact CA-CZ2 3.42Å; L190-W197 HydrophobicContact CB-CH2 3.09Å; L190-W197 HydrophobicContact CB-CZ2 3.19Å; L190-W197 HydrophobicContact CB-CZ3 3.93Å; L190-W197 HydrophobicContact CD1-CE3 4.19Å; L190-W197 HydrophobicContact CD1-CH2 3.08Å; L190-W197 HydrophobicContact CD1-CZ2 4.11Å; L190-W197 HydrophobicContact CD1-CZ3 3.1Å; L190-W197 HydrophobicContact CG-CE3 4.27Å; L190-W197 HydrophobicContact CG-CH2 3.21Å; L190-W197 HydrophobicContact CG-CZ2 3.75Å; L190-W197 HydrophobicContact CG-CZ3 3.49Å; L190-W197 VanDerWaalsContact CG-CZ3 3.49Å; L190-W197 WeakPolarHBondContact O-CZ2 2.94Å; L190-W197 PolarHBondContact O-NE1 2.99Å
191V70.1Confident72.7Confident82 Ų8280.6 Ų80.650%0.49744%0.441SS..SBendtrans-75.8121.9-167.9-176.20000111.6W197V191-W197 WeakPolarHBondContact O-CZ2 3.49Å
192G69.9Low73.2Confident40 Ų4083.2 Ų83.241%0.41246%0.456SS..SBendtrans146.5170.2175.100000113L190 W197L190-G192 PolarHBondContact O-N 3.37Å; G192-W197 PolarHBondContact O-NE1 3.2Å
193N77.6Confident74Confident102 Ų10281.3 Ų81.355%0.54544%0.444SS..  trans-70152170.3-173.4-2.9000110.4N195 I196 W197N193-N195 PolarHBondContact O-N 2.92Å; N193-N195 VanDerWaalsContact O-N 3.11Å; N193-I196 WeakPolarHBondContact O-CB 3.38Å; N193-I196 PolarHBondContact O-N 3.49Å; N193-W197 VanDerWaalsContact O-CD1 3.29Å; N193-W197 PolarHBondContact O-N 3.02Å
194V76.6Confident74.7Confident77 Ų7776.3 Ų76.347%0.46742%0.418SS..Hα-helixtrans-46.7-39176.2-177.40000112.4I196 W197 L198V194-I196 PolarHBondContact O-N 3.2Å; V194-W197 WeakPolarHBondContact O-CA 3.26Å; V194-W197 VanDerWaalsContact O-CB 3.28Å; V194-W197 WeakPolarHBondContact O-CB 3.44Å; V194-W197 PolarHBondContact O-N 2.96Å; V194-W197 VanDerWaalsContact O-N 3.13Å; V194-L198 HydrophobicContact CG1-CD1 4.18Å; V194-L198 HydrophobicContact CG1-CG 4.38Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 3.24Å
195N79.1Confident75.8Confident104 Ų10472.7 Ų72.756%0.55641%0.406SS*.Hα-helixtrans-63.2-40.2178.2-65.6-23.8000112.7N193 W197 L198 C199N193-N195 PolarHBondContact O-N 2.92Å; N193-N195 VanDerWaalsContact O-N 3.11Å; N195-W197 PolarHBondContact O-N 3.47Å; N195-L198 PolarHBondContact O-N 3.33Å; N195-C199 PolarHBondContact O-N 3.08Å; N195-C199 PolarHBondContact O-SG 3.32Å
196I79.3Confident77.3Confident84 Ų8470.9 Ų70.943%0.43140%0.398SS..Hα-helixtrans-64.7-36.3176.4-59.9174000109.7N193 V194 R200N193-I196 WeakPolarHBondContact O-CB 3.38Å; N193-I196 PolarHBondContact O-N 3.49Å; V194-I196 PolarHBondContact O-N 3.2Å; I196-R200 WeakPolarHBondContact O-CG 3.34Å; I196-R200 PolarHBondContact O-N 3.41Å
197W77.4Confident79.3Confident17 Ų1768.5 Ų68.56%0.06437%0.368CS..Hα-helixtrans-62.8-50.5174.6-74107.4000112.8F147 C188 L190 V191 G192 N193 V194 N195 C199 R200 L201F147-W197 HydrophobicContact CE2-CH2 4.37Å; F147-W197 HydrophobicContact CE2-CZ3 4.43Å; C188-W197 VanDerWaalsContact CB-CD1 3.45Å; C188-W197 HydrophobicContact CB-CG 4.07Å; L190-W197 VanDerWaalsContact C-CE2 3.48Å; L190-W197 VanDerWaalsContact CA-CZ2 3.42Å; L190-W197 HydrophobicContact CB-CH2 3.09Å; L190-W197 HydrophobicContact CB-CZ2 3.19Å; L190-W197 HydrophobicContact CB-CZ3 3.93Å; L190-W197 HydrophobicContact CD1-CE3 4.19Å; L190-W197 HydrophobicContact CD1-CH2 3.08Å; L190-W197 HydrophobicContact CD1-CZ2 4.11Å; L190-W197 HydrophobicContact CD1-CZ3 3.1Å; L190-W197 HydrophobicContact CG-CE3 4.27Å; L190-W197 HydrophobicContact CG-CH2 3.21Å; L190-W197 HydrophobicContact CG-CZ2 3.75Å; L190-W197 HydrophobicContact CG-CZ3 3.49Å; L190-W197 VanDerWaalsContact CG-CZ3 3.49Å; L190-W197 WeakPolarHBondContact O-CZ2 2.94Å; L190-W197 PolarHBondContact O-NE1 2.99Å; V191-W197 WeakPolarHBondContact O-CZ2 3.49Å; G192-W197 PolarHBondContact O-NE1 3.2Å; N193-W197 VanDerWaalsContact O-CD1 3.29Å; N193-W197 PolarHBondContact O-N 3.02Å; V194-W197 WeakPolarHBondContact O-CA 3.26Å; V194-W197 VanDerWaalsContact O-CB 3.28Å; V194-W197 WeakPolarHBondContact O-CB 3.44Å; V194-W197 PolarHBondContact O-N 2.96Å; V194-W197 VanDerWaalsContact O-N 3.13Å; N195-W197 PolarHBondContact O-N 3.47Å; W197-C199 VanDerWaalsContact C-N 3.33Å; W197-C199 PolarHBondContact O-N 3.29Å; W197-R200 PolarHBondContact O-N 2.97Å; W197-R200 VanDerWaalsContact O-N 3.17Å; W197-L201 WeakPolarHBondContact O-CG 3.31Å; W197-L201 PolarHBondContact O-N 3.37Å
198L80Confident81.1Confident100 Ų10060.1 Ų60.152%0.52434%0.338SS..Hα-helixtrans-60.4-43.6178.5-68.3172.4000111.3V194 N195 R200 L201 D202V194-L198 HydrophobicContact CG1-CD1 4.18Å; V194-L198 HydrophobicContact CG1-CG 4.38Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 3.24Å; N195-L198 PolarHBondContact O-N 3.33Å; L198-R200 VanDerWaalsContact C-N 3.34Å; L198-R200 PolarHBondContact O-N 3.25Å; L198-L201 PolarHBondContact O-N 2.9Å; L198-D202 WeakPolarHBondContact O-CB 3.37Å; L198-D202 PolarHBondContact O-N 3.29Å
199C84.5Confident82.8Confident81 Ų8162.3 Ų62.355%0.54734%0.342SS..Hα-helixtrans-60.4-40.8175.3-690000112.6N195 W197 T203N195-C199 PolarHBondContact O-N 3.08Å; N195-C199 PolarHBondContact O-SG 3.32Å; W197-C199 VanDerWaalsContact C-N 3.33Å; W197-C199 PolarHBondContact O-N 3.29Å; C199-T203 WeakPolarHBondContact O-CB 3.24Å; C199-T203 PolarHBondContact O-N 2.75Å; C199-T203 PolarHBondContact O-OG1 3.22Å
200R84.8Confident84.3Confident40 Ų4064.7 Ų64.715%0.15135%0.35CS..Hα-helixtrans-66.7-41.9177.4-76.6175.7174.6173.8-2.2112.2I196 W197 L198 T203 I204I196-R200 WeakPolarHBondContact O-CG 3.34Å; I196-R200 PolarHBondContact O-N 3.41Å; W197-R200 PolarHBondContact O-N 2.97Å; W197-R200 VanDerWaalsContact O-N 3.17Å; L198-R200 VanDerWaalsContact C-N 3.34Å; L198-R200 PolarHBondContact O-N 3.25Å; R200-T203 WeakPolarHBondContact O-CB 3.5Å; R200-T203 PolarHBondContact O-N 3.18Å; R200-I204 VanDerWaalsContact O-CG1 3.3Å; R200-I204 WeakPolarHBondContact O-CG1 3.35Å; R200-I204 PolarHBondContact O-N 3.24Å
201L85.4Confident85.3Confident69 Ų6964.3 Ų64.336%0.36135%0.348SS..Hα-helixtrans-64-46.2176.5-72174.9000111.5L178 W197 L198 T203 I204 V205L178-L201 HydrophobicContact CB-CD2 4.44Å; L178-L201 HydrophobicContact CD1-CD2 3.84Å; W197-L201 WeakPolarHBondContact O-CG 3.31Å; W197-L201 PolarHBondContact O-N 3.37Å; L198-L201 PolarHBondContact O-N 2.9Å; L201-T203 VanDerWaalsContact C-N 3.26Å; L201-T203 PolarHBondContact O-N 3.25Å; L201-I204 HydrophobicContact CD2-CD1 4.5Å; L201-I204 PolarHBondContact O-N 3.48Å; L201-V205 WeakPolarHBondContact O-CG2 3.47Å; L201-V205 PolarHBondContact O-N 3.45Å
202D88.4Confident86.2Confident79 Ų7965.3 Ų65.342%0.42235%0.351SS..Hα-helixtrans-57-42.2174.3178.667.3000111.4L198 V205 K206L198-D202 WeakPolarHBondContact O-CB 3.37Å; L198-D202 PolarHBondContact O-N 3.29Å; D202-V205 PolarHBondContact O-N 3.05Å; D202-K206 WeakPolarHBondContact O-CG 2.93Å; D202-K206 PolarHBondContact O-N 3.44Å; D202-K206 IonicContact OD1-NZ 2.71Å; D202-K206 WeakPolarHBondContact OD2-CE 3.21Å; D202-K206 IonicContact OD2-NZ 3.12Å; D202-K206 PolarHBondContact OD2-NZ 2.77Å
203T91.2Very high87.2Confident46 Ų4669.3 Ų69.328%0.28236%0.363SS..Hα-helixtrans-63.8-43176.4-56.70000112.3C199 R200 L201 V205 K206 W207C199-T203 WeakPolarHBondContact O-CB 3.24Å; C199-T203 PolarHBondContact O-N 2.75Å; C199-T203 PolarHBondContact O-OG1 3.22Å; R200-T203 WeakPolarHBondContact O-CB 3.5Å; R200-T203 PolarHBondContact O-N 3.18Å; L201-T203 VanDerWaalsContact C-N 3.26Å; L201-T203 PolarHBondContact O-N 3.25Å; T203-V205 VanDerWaalsContact C-N 3.34Å; T203-V205 PolarHBondContact O-N 3.41Å; T203-K206 WeakPolarHBondContact O-CB 3.3Å; T203-K206 PolarHBondContact O-N 2.88Å; T203-W207 HydrophobicContact CG2-CD2 3.91Å; T203-W207 HydrophobicContact CG2-CE3 4.33Å; T203-W207 HydrophobicContact CG2-CH2 3.78Å; T203-W207 HydrophobicContact CG2-CZ2 3.27Å; T203-W207 HydrophobicContact CG2-CZ3 4.28Å; T203-W207 VanDerWaalsContact O-CG 3.28Å; T203-W207 PolarHBondContact O-N 2.88Å
204I91.9Very high87.7Confident4 Ų466.4 Ų66.42%0.02135%0.346CS..Hα-helixtrans-61.4-44.4176.4-68161.6000110.6F147 L174 L178 R200 L201 K206 W207 Q208F147-I204 HydrophobicContact CE1-CD1 4.12Å; L174-I204 HydrophobicContact CD2-CD1 3.74Å; L174-I204 HydrophobicContact CD2-CG1 4.1Å; L174-I204 HydrophobicContact CG-CD1 4.15Å; L178-I204 HydrophobicContact CD1-CD1 3.66Å; R200-I204 VanDerWaalsContact O-CG1 3.3Å; R200-I204 WeakPolarHBondContact O-CG1 3.35Å; R200-I204 PolarHBondContact O-N 3.24Å; L201-I204 HydrophobicContact CD2-CD1 4.5Å; L201-I204 PolarHBondContact O-N 3.48Å; I204-K206 VanDerWaalsContact C-N 3.34Å; I204-W207 HydrophobicContact CG1-CE3 4.35Å; I204-W207 HydrophobicContact CG1-CZ3 4.37Å; I204-W207 PolarHBondContact O-N 2.91Å; I204-Q208 WeakPolarHBondContact O-CG 3.39Å; I204-Q208 PolarHBondContact O-N 3.27Å
205V91.9Very high87.9Confident66 Ų6670.9 Ų70.940%0.436%0.362SS..Hα-helixtrans-62.3-43.9178172.80000110.6L201 D202 T203 W207 Q208 Q209L201-V205 WeakPolarHBondContact O-CG2 3.47Å; L201-V205 PolarHBondContact O-N 3.45Å; D202-V205 PolarHBondContact O-N 3.05Å; T203-V205 VanDerWaalsContact C-N 3.34Å; T203-V205 PolarHBondContact O-N 3.41Å; V205-W207 PolarHBondContact O-N 3.18Å; V205-Q208 PolarHBondContact O-N 2.69Å; V205-Q209 WeakPolarHBondContact O-CG 3.13Å; V205-Q209 PolarHBondContact O-N 3.11Å
206K94.7Very high87.9Confident100 Ų10071.7 Ų71.744%0.43537%0.365SS..Hα-helixtrans-57.7-48.4174-75.7169.5174.8168.20111.8D202 T203 I204 Q208 Q209 E210D202-K206 WeakPolarHBondContact O-CG 2.93Å; D202-K206 PolarHBondContact O-N 3.44Å; D202-K206 IonicContact OD1-NZ 2.71Å; D202-K206 WeakPolarHBondContact OD2-CE 3.21Å; D202-K206 IonicContact OD2-NZ 3.12Å; D202-K206 PolarHBondContact OD2-NZ 2.77Å; T203-K206 WeakPolarHBondContact O-CB 3.3Å; T203-K206 PolarHBondContact O-N 2.88Å; I204-K206 VanDerWaalsContact C-N 3.34Å; K206-Q208 VanDerWaalsContact C-N 3.32Å; K206-Q208 PolarHBondContact O-N 2.71Å; K206-Q209 WeakPolarHBondContact O-CB 3.36Å; K206-Q209 PolarHBondContact O-N 3.17Å; K206-Q209 VanDerWaalsContact O-N 3.13Å; K206-E210 WeakPolarHBondContact O-CG 3.21Å; K206-E210 PolarHBondContact O-N 3.36Å
207W95.4Very high87.7Confident17 Ų1771.8 Ų71.86%0.06437%0.371CS..Hα-helixtrans-60.1-40.2176.7-67.7-23.2000112.9L150 E151 V154 L171 T203 I204 V205 Q209 L211L150-W207 HydrophobicContact CD2-CZ3 3.83Å; L150-W207 HydrophobicContact CG-CE3 4.49Å; L150-W207 HydrophobicContact CG-CH2 4.43Å; L150-W207 HydrophobicContact CG-CZ3 3.82Å; E151-W207 HydrophobicContact CB-CH2 3.78Å; E151-W207 HydrophobicContact CB-CZ2 3.44Å; E151-W207 VanDerWaalsContact CB-CZ2 3.44Å; E151-W207 HydrophobicContact CG-CH2 4.45Å; E151-W207 HydrophobicContact CG-CZ2 3.62Å; V154-W207 HydrophobicContact CB-CD2 4.34Å; V154-W207 HydrophobicContact CB-CG 4.26Å; V154-W207 HydrophobicContact CG1-CB 3.91Å; V154-W207 HydrophobicContact CG1-CD2 4.31Å; V154-W207 HydrophobicContact CG1-CG 3.72Å; V154-W207 HydrophobicContact CG2-CB 4.29Å; V154-W207 HydrophobicContact CG2-CD2 3.95Å; V154-W207 HydrophobicContact CG2-CE3 4.05Å; V154-W207 HydrophobicContact CG2-CG 4.09Å; L171-W207 HydrophobicContact CD1-CB 3.77Å; L171-W207 HydrophobicContact CD2-CE3 3.94Å; T203-W207 HydrophobicContact CG2-CD2 3.91Å; T203-W207 HydrophobicContact CG2-CE3 4.33Å; T203-W207 HydrophobicContact CG2-CH2 3.78Å; T203-W207 HydrophobicContact CG2-CZ2 3.27Å; T203-W207 HydrophobicContact CG2-CZ3 4.28Å; T203-W207 VanDerWaalsContact O-CG 3.28Å; T203-W207 PolarHBondContact O-N 2.88Å; I204-W207 HydrophobicContact CG1-CE3 4.35Å; I204-W207 HydrophobicContact CG1-CZ3 4.37Å; I204-W207 PolarHBondContact O-N 2.91Å; V205-W207 PolarHBondContact O-N 3.18Å; W207-Q209 VanDerWaalsContact C-N 3.35Å; W207-L211 WeakPolarHBondContact O-CB 3.37Å; W207-L211 WeakPolarHBondContact O-CG 3.49Å; W207-L211 PolarHBondContact O-N 3.44Å
208Q94.3Very high87.4Confident37 Ų3780.4 Ų80.417%0.17341%0.409CS..Hα-helixtrans-62.8-42.3175-72.3179.5-50.300111.5L171 I204 V205 K206 N212L171-Q208 HydrophobicContact CB-CG 3.9Å; L171-Q208 HydrophobicContact CD1-CG 4.03Å; I204-Q208 WeakPolarHBondContact O-CG 3.39Å; I204-Q208 PolarHBondContact O-N 3.27Å; V205-Q208 PolarHBondContact O-N 2.69Å; K206-Q208 VanDerWaalsContact C-N 3.32Å; K206-Q208 PolarHBondContact O-N 2.71Å; Q208-N212 VanDerWaalsContact O-CB 3.28Å; Q208-N212 WeakPolarHBondContact O-CB 3.26Å; Q208-N212 PolarHBondContact O-N 2.92Å; Q208-N212 PolarHBondContact O-ND2 3.46Å; Q208-N212 VanDerWaalsContact O-ND2 3.13Å
209Q93.6Very high86.7Confident107 Ų10783.4 Ų83.450%0.542%0.421SS..Hα-helixtrans-64.3-47.9176.8-71172.5-800111.8V205 K206 W207 L211 N212 N213V205-Q209 WeakPolarHBondContact O-CG 3.13Å; V205-Q209 PolarHBondContact O-N 3.11Å; K206-Q209 WeakPolarHBondContact O-CB 3.36Å; K206-Q209 PolarHBondContact O-N 3.17Å; K206-Q209 VanDerWaalsContact O-N 3.13Å; W207-Q209 VanDerWaalsContact C-N 3.35Å; Q209-L211 PolarHBondContact O-N 3.4Å; Q209-N212 PolarHBondContact O-N 3.06Å; Q209-N213 WeakPolarHBondContact O-CB 3.34Å; Q209-N213 VanDerWaalsContact O-CG 3.26Å; Q209-N213 PolarHBondContact O-N 2.9Å; Q209-N213 PolarHBondContact O-ND2 2.92Å
210E93.6Very high85.5Confident99 Ų9987.8 Ų87.846%0.46344%0.438SS..Hα-helixtrans-57.8-47.4177.4-72.3176.8163.400111.4L158 K206 N212 N213 M214L158-E210 HydrophobicContact CD1-CB 4.09Å; L158-E210 WeakPolarHBondContact CD1-OE2 3.35Å; L158-E210 HydrophobicContact CD2-CB 4Å; K206-E210 WeakPolarHBondContact O-CG 3.21Å; K206-E210 PolarHBondContact O-N 3.36Å; E210-N212 VanDerWaalsContact C-N 3.32Å; E210-N212 PolarHBondContact O-N 3.45Å; E210-N213 PolarHBondContact O-N 3.18Å; E210-M214 PolarHBondContact O-N 3.08Å
211L90.9Very high84.3Confident0 Ų094.2 Ų94.20%046%0.463CS..Hα-helixtrans-67.4-31.3178-73.4168.9000112.9V154 V157 L158 V167 K168 L171 W207 Q209 M214V154-L211 HydrophobicContact CG1-CD1 4.39Å; V157-L211 HydrophobicContact CB-CD2 4.27Å; V157-L211 HydrophobicContact CG1-CD2 3.59Å; L158-L211 HydrophobicContact CD2-CD2 3.76Å; L158-L211 HydrophobicContact CD2-CG 4.15Å; L158-L211 HydrophobicContact CG-CD2 4.23Å; V167-L211 HydrophobicContact CB-CD1 4.37Å; V167-L211 HydrophobicContact CG1-CD1 3.74Å; K168-L211 VanDerWaalsContact CE-C 3.43Å; K168-L211 WeakPolarHBondContact CE-O 3.42Å; K168-L211 HydrophobicContact CG-CB 4.12Å; K168-L211 HydrophobicContact CG-CD1 4.47Å; K168-L211 PolarHBondContact NZ-O 2.89Å; L171-L211 HydrophobicContact CD1-CD1 3.53Å; W207-L211 WeakPolarHBondContact O-CB 3.37Å; W207-L211 WeakPolarHBondContact O-CG 3.49Å; W207-L211 PolarHBondContact O-N 3.44Å; Q209-L211 PolarHBondContact O-N 3.4Å; L211-M214 HydrophobicContact CD2-SD 4.18Å; L211-M214 WeakPolarHBondContact O-CB 3.41Å
212N90.3Very high83.3Confident103 Ų10398.3 Ų98.355%0.55149%0.491SS*.Hα-helixtrans-74.2-34.9177-75.5-22.8000112.6K168 Q208 Q209 E210 M214K168-N212 PolarHBondContact NZ-OD1 2.78Å; Q208-N212 VanDerWaalsContact O-CB 3.28Å; Q208-N212 WeakPolarHBondContact O-CB 3.26Å; Q208-N212 PolarHBondContact O-N 2.92Å; Q208-N212 PolarHBondContact O-ND2 3.46Å; Q208-N212 VanDerWaalsContact O-ND2 3.13Å; Q209-N212 PolarHBondContact O-N 3.06Å; E210-N212 VanDerWaalsContact C-N 3.32Å; E210-N212 PolarHBondContact O-N 3.45Å; N212-M214 VanDerWaalsContact C-N 3.32Å
213N90.3Very high82.7Confident124 Ų12496.6 Ų96.666%0.66349%0.493SS*.Hα-helixtrans-84.1-9.5178.6-65-22.8000113.3Q209 E210 Q215Q209-N213 WeakPolarHBondContact O-CB 3.34Å; Q209-N213 VanDerWaalsContact O-CG 3.26Å; Q209-N213 PolarHBondContact O-N 2.9Å; Q209-N213 PolarHBondContact O-ND2 2.92Å; E210-N213 PolarHBondContact O-N 3.18Å; N213-Q215 PolarHBondContact O-N 3.12Å
214M87.3Confident82.2Confident40 Ų40100.6 Ų100.620%0.19751%0.51CS..  trans-56.6125.3178.5-175.4-175.5174.400111.7V157 L158 N161 P164 E210 L211 N212V157-M214 HydrophobicContact CG1-CE 4.35Å; V157-M214 HydrophobicContact CG1-SD 4.4Å; V157-M214 VanDerWaalsContact O-CE 3.24Å; V157-M214 WeakPolarHBondContact O-CE 3.45Å; L158-M214 HydrophobicContact CD2-SD 4.44Å; N161-M214 HydrophobicContact CB-CE 3.63Å; N161-M214 VanDerWaalsContact CG-CE 3.5Å; N161-M214 WeakPolarHBondContact OD1-CE 3.39Å; P164-M214 HydrophobicContact CB-CE 4.39Å; P164-M214 HydrophobicContact CB-SD 4.02Å; E210-M214 PolarHBondContact O-N 3.08Å; L211-M214 HydrophobicContact CD2-SD 4.18Å; L211-M214 WeakPolarHBondContact O-CB 3.41Å; N212-M214 VanDerWaalsContact C-N 3.32Å
215Q81.3Confident81.8Confident171 Ų171103 Ų10380%0.79953%0.526SS*.  trans-114.4126.6172.3-62.7-1741400108.7N213 P217N213-Q215 PolarHBondContact O-N 3.12Å; Q215-P217 VanDerWaalsContact O-CD 3.25Å; Q215-P217 WeakPolarHBondContact O-CD 3.17Å
216I79Confident81.6Confident121 Ų121103 Ų10362%0.62152%0.521SS*.  trans-68.9117.9174.2-60.1175.5000107K218I216-K218 PolarHBondContact O-N 2.94Å
217P76.4Confident81.3Confident86 Ų86102.4 Ų102.456%0.55852%0.523SS*.  trans-57.9132.9-178.7-23.333.3000110.5Q215 Q219Q215-P217 VanDerWaalsContact O-CD 3.25Å; Q215-P217 WeakPolarHBondContact O-CD 3.17Å; P217-Q219 PolarHBondContact O-N 3.47Å
218K70.5Confident81Confident199 Ų199106.1 Ų106.187%0.86554%0.544SS*.  trans-65.5107.4170.5-71.9-178.3-179.1177.10108I216 L220I216-K218 PolarHBondContact O-N 2.94Å; K218-L220 PolarHBondContact O-N 3.39Å
219Q65.6Low80.8Confident162 Ų162106.9 Ų106.976%0.75755%0.549SS*.  trans-66.3118171.5-70.2-170.4-13.300108.6P217 Y221P217-Q219 PolarHBondContact O-N 3.47Å; Q219-Y221 PolarHBondContact O-N 2.95Å
220L58.5Low80.8Confident174 Ų174105.7 Ų105.791%0.91155%0.551SS**  trans-72.973.4171.4-66.1171.7000108.6K218K218-L220 PolarHBondContact O-N 3.39Å
221Y60Low80.7Confident174 Ų174106 Ų10668%0.68256%0.555SS**  trans-95.6116.4175.2-122.3-90.2000109.1Q219 G223Q219-Y221 PolarHBondContact O-N 2.95Å; Y221-G223 PolarHBondContact O-N 3.41Å
222T64.6Low80.6Confident155 Ų155111.6 Ų111.695%0.95158%0.581SS**  trans-83.318.1174.136.90000113
223G75.3Confident80.7Confident44 Ų44110.2 Ų110.245%0.45457%0.572SS.*SBendtrans-96.7-174.8-178.700000113.6Y221 S225Y221-G223 PolarHBondContact O-N 3.41Å; G223-S225 PolarHBondContact O-N 3.06Å
224M80.8Confident80.8Confident130 Ų130104.6 Ų104.664%0.6454%0.542SS*.  trans-58.1128.4172.3-171.2-179.2-171.300110.6D228 L229M224-D228 VanDerWaalsContact CE-C 3.49Å; M224-D228 HydrophobicContact CE-CB 3.76Å; M224-D228 VanDerWaalsContact CE-O 3.23Å; M224-D228 WeakPolarHBondContact CE-O 3.1Å; M224-D228 HydrophobicContact CG-CB 3.66Å; M224-L229 HydrophobicContact CE-CD2 3.69Å; M224-L229 HydrophobicContact CE-CG 4.24Å; M224-L229 HydrophobicContact SD-CD2 4.31Å
225S84.8Confident81Confident53 Ų53104.1 Ų104.137%0.37154%0.54SS..  trans-90164.3176.7770000111.4G223 N227 D228G223-S225 PolarHBondContact O-N 3.06Å; S225-N227 PolarHBondContact O-N 3.39Å; S225-N227 PolarHBondContact OG-N 3.39Å; S225-D228 WeakPolarHBondContact CA-OD2 3.24Å; S225-D228 WeakPolarHBondContact CB-OD2 3.48Å; S225-D228 PolarHBondContact N-OD2 2.96Å; S225-D228 WeakPolarHBondContact O-CB 3.3Å; S225-D228 PolarHBondContact O-N 3Å; S225-D228 PolarHBondContact OG-OD2 3.25Å
226F87.4Confident81.4Confident66 Ų66100.5 Ų100.529%0.28952%0.523SS..G310 helixtrans-58.5-32.3175.4-177.4-116.7000112.7D228 L229 Q234 I237 L238 L250 L257F226-D228 PolarHBondContact O-N 3.17Å; F226-L229 HydrophobicContact CD2-CD1 3.71Å; F226-L229 HydrophobicContact CE2-CD1 4.11Å; F226-L229 WeakPolarHBondContact O-CB 3.22Å; F226-L229 PolarHBondContact O-N 2.99Å; F226-Q234 HydrophobicContact CE2-CG 4.46Å; F226-Q234 HydrophobicContact CZ-CB 4.21Å; F226-Q234 HydrophobicContact CZ-CG 4.26Å; F226-Q234 PolarHBondContact O-NE2 3.44Å; F226-I237 HydrophobicContact CD2-CD1 4.5Å; F226-I237 HydrophobicContact CE2-CB 4.35Å; F226-I237 HydrophobicContact CE2-CD1 3.75Å; F226-I237 HydrophobicContact CE2-CG2 4.1Å; F226-I237 HydrophobicContact CZ-CG2 4.41Å; F226-L238 HydrophobicContact CE1-CD1 4.48Å; F226-L238 HydrophobicContact CZ-CD1 3.97Å; F226-L250 HydrophobicContact CE1-CD1 4.38Å; F226-L257 HydrophobicContact CD1-CD1 4.12Å; F226-L257 HydrophobicContact CD1-CD2 4.26Å; F226-L257 HydrophobicContact CE1-CD1 3.91Å; F226-L257 HydrophobicContact CE1-CD2 3.45Å; F226-L257 VanDerWaalsContact CE1-CD2 3.45Å; F226-L257 HydrophobicContact CE1-CG 4.31Å; F226-L257 HydrophobicContact CZ-CD2 4.26Å
227N87.1Confident82Confident88 Ų8898.3 Ų98.347%0.47151%0.512SS..G310 helixtrans-69.9-21.5178.9-67.5-32.8000112.9S225 L229 Q234S225-N227 PolarHBondContact O-N 3.39Å; S225-N227 PolarHBondContact OG-N 3.39Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 3.34Å; N227-Q234 PolarHBondContact O-NE2 2.66Å
228D88.9Confident82.8Confident96 Ų9694.2 Ų94.251%0.51349%0.485SS..G310 helixtrans-79.6-10.5179.3-56.5-44.2000112.3M224 S225 F226M224-D228 VanDerWaalsContact CE-C 3.49Å; M224-D228 HydrophobicContact CE-CB 3.76Å; M224-D228 VanDerWaalsContact CE-O 3.23Å; M224-D228 WeakPolarHBondContact CE-O 3.1Å; M224-D228 HydrophobicContact CG-CB 3.66Å; S225-D228 WeakPolarHBondContact CA-OD2 3.24Å; S225-D228 WeakPolarHBondContact CB-OD2 3.48Å; S225-D228 PolarHBondContact N-OD2 2.96Å; S225-D228 WeakPolarHBondContact O-CB 3.3Å; S225-D228 PolarHBondContact O-N 3Å; S225-D228 PolarHBondContact OG-OD2 3.25Å; F226-D228 PolarHBondContact O-N 3.17Å
229L91.1Very high83.7Confident52 Ų5286.1 Ų86.127%0.27245%0.453SS..SBendtrans-72.6143.7176.4-65.7171.5000110.7M224 F226 N227 M233 Q234 I237M224-L229 HydrophobicContact CE-CD2 3.69Å; M224-L229 HydrophobicContact CE-CG 4.24Å; M224-L229 HydrophobicContact SD-CD2 4.31Å; F226-L229 HydrophobicContact CD2-CD1 3.71Å; F226-L229 HydrophobicContact CE2-CD1 4.11Å; F226-L229 WeakPolarHBondContact O-CB 3.22Å; F226-L229 PolarHBondContact O-N 2.99Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 3.34Å; L229-M233 HydrophobicContact CB-CB 4.45Å; L229-Q234 HydrophobicContact CB-CG 3.99Å; L229-Q234 PolarHBondContact O-NE2 2.88Å; L229-I237 HydrophobicContact CD1-CD1 3.92Å
230P92.9Very high84.8Confident83 Ų8384 Ų8454%0.53944%0.441SS..  trans-54.9143.6172.3-25.333.7000112.3H232 M233 Q234P230-H232 PolarHBondContact O-N 3.27Å; P230-H232 VanDerWaalsContact O-N 3.1Å; P230-M233 HydrophobicContact CB-CG 4.38Å; P230-M233 HydrophobicContact CG-CG 4.45Å; P230-M233 WeakPolarHBondContact O-CA 3.49Å; P230-M233 WeakPolarHBondContact O-CB 3.35Å; P230-M233 PolarHBondContact O-N 2.97Å; P230-Q234 PolarHBondContact O-N 3.18Å; P230-Q234 VanDerWaalsContact O-N 3.1Å
231L90.8Very high86.3Confident105 Ų10578.2 Ų78.255%0.5541%0.411SS..Hα-helixtrans-52.1-38.8-177.2-72.2174.2000113.6M233 Q234 N235 T256L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 2.87Å; L231-Q234 PolarHBondContact O-N 3.49Å; L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 PolarHBondContact O-N 3Å; L231-T256 HydrophobicContact CD2-CG2 3.34Å
232H89.8Confident87.6Confident117 Ų11772.7 Ų72.754%0.54240%0.398SS..Hα-helixtrans-62.1-38.9176.8-179.462000112.3P230 N235 Q236P230-H232 PolarHBondContact O-N 3.27Å; P230-H232 VanDerWaalsContact O-N 3.1Å; H232-N235 PolarHBondContact O-N 3.42Å; H232-Q236 PolarHBondContact NE2-NE2 3.29Å; H232-Q236 WeakPolarHBondContact O-CG 3.44Å; H232-Q236 PolarHBondContact O-N 3.36Å
233M91.8Very high88.8Confident74 Ų7467.1 Ų67.137%0.36536%0.363SS..Hα-helixtrans-69.6-43177-66.2-67.1104.100111.3L229 P230 L231 N235 Q236 I237L229-M233 HydrophobicContact CB-CB 4.45Å; P230-M233 HydrophobicContact CB-CG 4.38Å; P230-M233 HydrophobicContact CG-CG 4.45Å; P230-M233 WeakPolarHBondContact O-CA 3.49Å; P230-M233 WeakPolarHBondContact O-CB 3.35Å; P230-M233 PolarHBondContact O-N 2.97Å; L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 2.87Å; M233-N235 VanDerWaalsContact C-N 3.34Å; M233-N235 PolarHBondContact O-N 3.44Å; M233-Q236 PolarHBondContact O-N 2.93Å; M233-I237 WeakPolarHBondContact O-CG1 3.41Å; M233-I237 PolarHBondContact O-N 3.48Å
234Q92.9Very high89.5Confident6 Ų665.1 Ų65.13%0.02834%0.342CS..Hα-helixtrans-56.7-49.6173.6-62.3-178.523.200110.3F226 N227 L229 P230 L231 Q236 I237 L238 L260F226-Q234 HydrophobicContact CE2-CG 4.46Å; F226-Q234 HydrophobicContact CZ-CB 4.21Å; F226-Q234 HydrophobicContact CZ-CG 4.26Å; F226-Q234 PolarHBondContact O-NE2 3.44Å; N227-Q234 PolarHBondContact O-NE2 2.66Å; L229-Q234 HydrophobicContact CB-CG 3.99Å; L229-Q234 PolarHBondContact O-NE2 2.88Å; P230-Q234 PolarHBondContact O-N 3.18Å; P230-Q234 VanDerWaalsContact O-N 3.1Å; L231-Q234 PolarHBondContact O-N 3.49Å; Q234-Q236 VanDerWaalsContact C-N 3.33Å; Q234-Q236 PolarHBondContact O-N 2.92Å; Q234-I237 WeakPolarHBondContact O-CB 3.29Å; Q234-I237 PolarHBondContact O-N 3.05Å; Q234-I237 VanDerWaalsContact O-N 3.1Å; Q234-L238 WeakPolarHBondContact O-CD1 3.49Å; Q234-L238 PolarHBondContact O-N 3.29Å; Q234-L260 HydrophobicContact CB-CD1 3.76Å
235N91.4Very high90Very high31 Ų3161.6 Ų61.617%0.16633%0.329CS..Hα-helixtrans-61.2-38.8178-170.236.5000113L231 H232 M233 I237 L238 C239 L260L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 PolarHBondContact O-N 3Å; H232-N235 PolarHBondContact O-N 3.42Å; M233-N235 VanDerWaalsContact C-N 3.34Å; M233-N235 PolarHBondContact O-N 3.44Å; N235-I237 VanDerWaalsContact C-N 3.34Å; N235-L238 PolarHBondContact O-N 3.02Å; N235-C239 WeakPolarHBondContact O-CB 3.28Å; N235-C239 PolarHBondContact O-N 3.06Å; N235-C239 PolarHBondContact O-SG 3.46Å; N235-L260 HydrophobicContact CB-CD2 4.09Å
236Q90.7Very high90.2Very high94 Ų9462.3 Ų62.344%0.43933%0.329SS..Hα-helixtrans-62.3-41.4174.2-78.6-166.43.200111.9H232 M233 Q234 C239 K240H232-Q236 PolarHBondContact NE2-NE2 3.29Å; H232-Q236 WeakPolarHBondContact O-CG 3.44Å; H232-Q236 PolarHBondContact O-N 3.36Å; M233-Q236 PolarHBondContact O-N 2.93Å; Q234-Q236 VanDerWaalsContact C-N 3.33Å; Q234-Q236 PolarHBondContact O-N 2.92Å; Q236-C239 PolarHBondContact O-N 2.86Å; Q236-K240 WeakPolarHBondContact O-CG 3.44Å; Q236-K240 PolarHBondContact O-N 3.26Å
237I91.7Very high90.5Very high76 Ų7659.2 Ų59.239%0.3932%0.315SS..Hα-helixtrans-64.3-46.6177.5-68.2164.7000110.2F226 L229 M233 Q234 N235 C239 K240F226-I237 HydrophobicContact CD2-CD1 4.5Å; F226-I237 HydrophobicContact CE2-CB 4.35Å; F226-I237 HydrophobicContact CE2-CD1 3.75Å; F226-I237 HydrophobicContact CE2-CG2 4.1Å; F226-I237 HydrophobicContact CZ-CG2 4.41Å; L229-I237 HydrophobicContact CD1-CD1 3.92Å; M233-I237 WeakPolarHBondContact O-CG1 3.41Å; M233-I237 PolarHBondContact O-N 3.48Å; Q234-I237 WeakPolarHBondContact O-CB 3.29Å; Q234-I237 PolarHBondContact O-N 3.05Å; Q234-I237 VanDerWaalsContact O-N 3.1Å; N235-I237 VanDerWaalsContact C-N 3.34Å; I237-C239 VanDerWaalsContact C-N 3.29Å; I237-C239 PolarHBondContact O-N 3.22Å; I237-K240 WeakPolarHBondContact O-CB 3.46Å; I237-K240 PolarHBondContact O-N 3.46Å
238L92.1Very high90.8Very high0 Ų057.4 Ų57.40%031%0.305CS..Hα-helixtrans-58.3-41175.6-90.477.7000112F226 Q234 N235 K240 L241 L250 L257 L260 L266F226-L238 HydrophobicContact CE1-CD1 4.48Å; F226-L238 HydrophobicContact CZ-CD1 3.97Å; Q234-L238 WeakPolarHBondContact O-CD1 3.49Å; Q234-L238 PolarHBondContact O-N 3.29Å; N235-L238 PolarHBondContact O-N 3.02Å; L238-K240 PolarHBondContact O-N 3.05Å; L238-K240 VanDerWaalsContact O-N 3.11Å; L238-L241 WeakPolarHBondContact O-CB 3.23Å; L238-L241 PolarHBondContact O-N 3.21Å; L238-L241 VanDerWaalsContact O-N 3.09Å; L238-L250 HydrophobicContact CD1-CD2 3.42Å; L238-L250 VanDerWaalsContact CD1-CD2 3.42Å; L238-L250 HydrophobicContact CD2-CD2 4.08Å; L238-L250 HydrophobicContact CG-CD2 3.56Å; L238-L257 HydrophobicContact CD1-CD2 4.23Å; L238-L260 HydrophobicContact CD2-CB 3.78Å; L238-L266 HydrophobicContact CB-CD1 3.54Å; L238-L266 HydrophobicContact CD2-CD1 4.3Å; L238-L266 HydrophobicContact CG-CD1 4.46Å
239C89.4Confident91Very high28 Ų2857 Ų5719%0.18930%0.303CS..THydrogen-bonded Turntrans-65.1-10.1175.5-73.70000114.2N235 Q236 I237 K269N235-C239 WeakPolarHBondContact O-CB 3.28Å; N235-C239 PolarHBondContact O-N 3.06Å; N235-C239 PolarHBondContact O-SG 3.46Å; Q236-C239 PolarHBondContact O-N 2.86Å; I237-C239 VanDerWaalsContact C-N 3.29Å; I237-C239 PolarHBondContact O-N 3.22Å; C239-K269 HydrophobicContact CB-CD 4.31Å
240K89.1Confident91Very high117 Ų11756.8 Ų56.851%0.50930%0.302SS..THydrogen-bonded Turntrans-96.1-10.6175.1-63.8-63.2-179.9179.60113.1W8 Q236 I237 L238 S242W8-K240 HydrophobicContact CD2-CD 4.3Å; W8-K240 HydrophobicContact CE3-CB 4.33Å; W8-K240 HydrophobicContact CE3-CD 4.39Å; W8-K240 HydrophobicContact CZ3-CB 4.45Å; W8-K240 VanDerWaalsContact CZ3-O 3.24Å; W8-K240 WeakPolarHBondContact CZ3-O 3.44Å; Q236-K240 WeakPolarHBondContact O-CG 3.44Å; Q236-K240 PolarHBondContact O-N 3.26Å; I237-K240 WeakPolarHBondContact O-CB 3.46Å; I237-K240 PolarHBondContact O-N 3.46Å; L238-K240 PolarHBondContact O-N 3.05Å; L238-K240 VanDerWaalsContact O-N 3.11Å; K240-S242 PolarHBondContact O-N 2.98Å
241L90.1Very high90.9Very high53 Ų5353 Ų5328%0.27728%0.278SS..  trans-67.1132.4173.9-62.3176.6000109.5L238 D246 I247 L250L238-L241 WeakPolarHBondContact O-CB 3.23Å; L238-L241 PolarHBondContact O-N 3.21Å; L238-L241 VanDerWaalsContact O-N 3.09Å; L241-D246 HydrophobicContact CD1-CB 4.46Å; L241-I247 HydrophobicContact CB-CD1 4.23Å; L241-I247 HydrophobicContact CB-CG1 3.85Å; L241-I247 HydrophobicContact CD1-CG1 3.82Å; L241-I247 HydrophobicContact CG-CG1 4.48Å; L241-L250 HydrophobicContact CD1-CD2 4.18Å
242S87.9Confident91Very high58 Ų5855.3 Ų55.341%0.40629%0.286SS..  trans-986.3179.458.30000112.8K240 H274K240-S242 PolarHBondContact O-N 2.98Å; S242-H274 PolarHBondContact O-CE1 3.12Å; S242-H274 PolarHBondContact O-NE2 3.08Å
243D88.4Confident91.1Very high39 Ų3953 Ų5321%0.20929%0.287CS..  trans-132.7127.1-175.8-160.8-43.5000111R165 C245 D246 I247R165-D243 IonicContact CZ-OD2 3.25Å; R165-D243 IonicContact NH1-OD2 3Å; R165-D243 IonicContact NH2-OD1 2.71Å; R165-D243 IonicContact NH2-OD2 2.66Å; R165-D243 PolarHBondContact NH2-OD2 3.39Å; D243-C245 VanDerWaalsContact C-N 3.33Å; D243-C245 PolarHBondContact O-N 3.08Å; D243-C245 WeakPolarHBondContact OD1-CB 3.37Å; D243-C245 PolarHBondContact OD1-N 3.36Å; D243-D246 HydrophobicContact CB-CB 4.19Å; D243-D246 PolarHBondContact O-N 2.8Å; D243-I247 WeakPolarHBondContact O-CD1 3.34Å; D243-I247 WeakPolarHBondContact O-CG1 3.49Å; D243-I247 PolarHBondContact O-N 3.42Å
244A91.4Very high91Very high2 Ų251 Ų512%0.01728%0.279CS..Hα-helixtrans-64.4-35.9178.300000112.8D246 I247 I248 W267 L270 Y298 F299A244-D246 VanDerWaalsContact C-N 3.29Å; A244-D246 PolarHBondContact O-N 3.1Å; A244-I247 PolarHBondContact O-N 2.99Å; A244-I248 VanDerWaalsContact O-CG1 3.29Å; A244-I248 WeakPolarHBondContact O-CG1 3.5Å; A244-I248 PolarHBondContact O-N 3.44Å; A244-W267 HydrophobicContact CB-CH2 3.83Å; A244-W267 HydrophobicContact CB-CZ3 3.68Å; A244-L270 HydrophobicContact CB-CD2 4.05Å; A244-Y298 HydrophobicContact CB-CD1 4.03Å; A244-Y298 HydrophobicContact CB-CE1 3.3Å; A244-F299 HydrophobicContact CB-CZ 4.3Å
245C89.6Confident91Very high55 Ų5555.8 Ų55.837%0.37231%0.311SS..Hα-helixtrans-65.3-37.3178.2-73.30000110.9D243 I248 N249D243-C245 VanDerWaalsContact C-N 3.33Å; D243-C245 PolarHBondContact O-N 3.08Å; D243-C245 WeakPolarHBondContact OD1-CB 3.37Å; D243-C245 PolarHBondContact OD1-N 3.36Å; C245-I248 PolarHBondContact O-N 3.47Å; C245-N249 VanDerWaalsContact O-CB 3.31Å; C245-N249 WeakPolarHBondContact O-CB 3.45Å; C245-N249 PolarHBondContact O-N 3.35Å; C245-N249 PolarHBondContact O-ND2 3.03Å
246D90.6Very high91Very high68 Ų6857.3 Ų57.336%0.36432%0.321SS..Hα-helixtrans-67.3-40.5178-62.9-7.5000110.9R165 L241 D243 A244 L250R165-D246 IonicContact CZ-OD1 3.97Å; R165-D246 IonicContact NH1-OD1 2.58Å; R165-D246 PolarHBondContact NH1-OD1 2.97Å; L241-D246 HydrophobicContact CD1-CB 4.46Å; D243-D246 HydrophobicContact CB-CB 4.19Å; D243-D246 PolarHBondContact O-N 2.8Å; A244-D246 VanDerWaalsContact C-N 3.29Å; A244-D246 PolarHBondContact O-N 3.1Å; D246-L250 WeakPolarHBondContact O-CB 3.39Å; D246-L250 PolarHBondContact O-N 3.49Å
247I93.4Very high91.1Very high1 Ų153 Ų531%0.00530%0.302CS..Hα-helixtrans-61.7-46.3174.8-67.8156.4000111.1L241 D243 A244 L250 G251 L266 W267 L270L241-I247 HydrophobicContact CB-CD1 4.23Å; L241-I247 HydrophobicContact CB-CG1 3.85Å; L241-I247 HydrophobicContact CD1-CG1 3.82Å; L241-I247 HydrophobicContact CG-CG1 4.48Å; D243-I247 WeakPolarHBondContact O-CD1 3.34Å; D243-I247 WeakPolarHBondContact O-CG1 3.49Å; D243-I247 PolarHBondContact O-N 3.42Å; A244-I247 PolarHBondContact O-N 2.99Å; I247-L250 PolarHBondContact O-N 2.98Å; I247-G251 PolarHBondContact O-N 3.02Å; I247-L266 HydrophobicContact CD1-CD2 3.86Å; I247-L266 HydrophobicContact CG1-CD2 4.38Å; I247-L266 HydrophobicContact CG2-CD2 3.79Å; I247-W267 HydrophobicContact CG2-CZ2 3.96Å; I247-L270 HydrophobicContact CD1-CD1 4.4Å; I247-L270 HydrophobicContact CD1-CD2 3.78Å
248I93.3Very high91.2Very high51 Ų5154.1 Ų54.126%0.26231%0.305SS..Hα-helixtrans-65.6-47.6-179.1-70.5167000110.9A244 C245 L250 G251 Q252 W267 F299A244-I248 VanDerWaalsContact O-CG1 3.29Å; A244-I248 WeakPolarHBondContact O-CG1 3.5Å; A244-I248 PolarHBondContact O-N 3.44Å; C245-I248 PolarHBondContact O-N 3.47Å; I248-L250 VanDerWaalsContact C-N 3.28Å; I248-L250 PolarHBondContact O-N 3.17Å; I248-G251 PolarHBondContact O-N 3.42Å; I248-G251 VanDerWaalsContact O-N 3.11Å; I248-Q252 PolarHBondContact O-N 3.38Å; I248-W267 HydrophobicContact CD1-CH2 4.15Å; I248-W267 HydrophobicContact CG1-CH2 4.15Å; I248-W267 HydrophobicContact CG1-CZ2 4.26Å; I248-F299 HydrophobicContact CD1-CE2 4.24Å; I248-F299 HydrophobicContact CD1-CZ 3.67Å
249N91.8Very high91.2Very high88 Ų8860 Ų6047%0.47134%0.335SS..Hα-helixtrans-62.7-37.5179-69-19000111.3C245 G251 Q252C245-N249 VanDerWaalsContact O-CB 3.31Å; C245-N249 WeakPolarHBondContact O-CB 3.45Å; C245-N249 PolarHBondContact O-N 3.35Å; C245-N249 PolarHBondContact O-ND2 3.03Å; N249-G251 VanDerWaalsContact C-N 3.34Å; N249-Q252 WeakPolarHBondContact O-CB 3.28Å; N249-Q252 PolarHBondContact O-N 3.28Å
250L91.6Very high91.4Very high46 Ų4659.8 Ų59.824%0.24133%0.332CS..Hα-helixtrans-65.4-38.5174.5-171.770.8000111.9F226 L238 L241 D246 I247 I248 Q252 A253 L257F226-L250 HydrophobicContact CE1-CD1 4.38Å; L238-L250 HydrophobicContact CD1-CD2 3.42Å; L238-L250 VanDerWaalsContact CD1-CD2 3.42Å; L238-L250 HydrophobicContact CD2-CD2 4.08Å; L238-L250 HydrophobicContact CG-CD2 3.56Å; L241-L250 HydrophobicContact CD1-CD2 4.18Å; D246-L250 WeakPolarHBondContact O-CB 3.39Å; D246-L250 PolarHBondContact O-N 3.49Å; I247-L250 PolarHBondContact O-N 2.98Å; I248-L250 VanDerWaalsContact C-N 3.28Å; I248-L250 PolarHBondContact O-N 3.17Å; L250-Q252 PolarHBondContact O-N 2.97Å; L250-A253 VanDerWaalsContact O-CB 3.31Å; L250-A253 WeakPolarHBondContact O-CB 3.24Å; L250-A253 PolarHBondContact O-N 3.22Å; L250-A253 VanDerWaalsContact O-N 3.09Å; L250-L257 HydrophobicContact CD1-CD1 3.99Å; L250-L257 HydrophobicContact CG-CD1 4.09Å; L250-L257 WeakPolarHBondContact O-CB 3.41Å
251G92.2Very high91.5Very high4 Ų454.3 Ų54.34%0.04131%0.308CS..Hα-helixtrans-62.1-25.4174.700000113.7I247 I248 N249 A253 H258I247-G251 PolarHBondContact O-N 3.02Å; I248-G251 PolarHBondContact O-N 3.42Å; I248-G251 VanDerWaalsContact O-N 3.11Å; N249-G251 VanDerWaalsContact C-N 3.34Å; G251-A253 VanDerWaalsContact C-N 3.3Å; G251-H258 WeakPolarHBondContact O-CA 3.36Å; G251-H258 VanDerWaalsContact O-CB 3.31Å; G251-H258 WeakPolarHBondContact O-CB 3.49Å; G251-H258 PolarHBondContact O-N 3.38Å
252Q92.9Very high91.6Very high153 Ų15355.8 Ų55.872%0.71531%0.314SS*.THydrogen-bonded Turntrans-79.1-11.4176-65.9174.5-9.100113.4I248 N249 L250I248-Q252 PolarHBondContact O-N 3.38Å; N249-Q252 WeakPolarHBondContact O-CB 3.28Å; N249-Q252 PolarHBondContact O-N 3.28Å; L250-Q252 PolarHBondContact O-N 2.97Å
253A90.6Very high91.7Very high68 Ų6855.2 Ų55.256%0.56231%0.306SS*.THydrogen-bonded Turntrans-77.9-40.4-174.500000113.3L250 G251 L257L250-A253 VanDerWaalsContact O-CB 3.31Å; L250-A253 WeakPolarHBondContact O-CB 3.24Å; L250-A253 PolarHBondContact O-N 3.22Å; L250-A253 VanDerWaalsContact O-N 3.09Å; G251-A253 VanDerWaalsContact C-N 3.3Å; A253-L257 HydrophobicContact CB-CD1 4.28Å
254T90.3Very high91.8Very high33 Ų3356.9 Ų56.920%0.20231%0.314CS..  trans-148.3154.5177.969.20000111.7T256 L257 H258T254-T256 VanDerWaalsContact C-N 3.26Å; T254-T256 PolarHBondContact O-N 3.15Å; T254-L257 HydrophobicContact CG2-CD1 4.45Å; T254-L257 PolarHBondContact O-N 2.92Å; T254-L257 VanDerWaalsContact O-N 3.13Å; T254-L257 WeakPolarHBondContact OG1-CB 3.36Å; T254-L257 WeakPolarHBondContact OG1-CD1 2.89Å; T254-L257 WeakPolarHBondContact OG1-CG 3.4Å; T254-L257 PolarHBondContact OG1-N 3.12Å; T254-H258 PolarHBondContact O-N 2.97Å
255P92.4Very high91.6Very high107 Ų10759.7 Ų59.770%0.69533%0.33SS*.Hα-helixtrans-58.6-35.9177.4-25.534.8000113.7H258 I259P255-H258 WeakPolarHBondContact O-CB 3.36Å; P255-H258 PolarHBondContact O-N 3.44Å; P255-I259 WeakPolarHBondContact O-CG1 3.34Å; P255-I259 PolarHBondContact O-N 3.06Å
256T91.3Very high91.7Very high63 Ų6357.2 Ų57.239%0.38731%0.313SS..Hα-helixtrans-62.9-44.7176.2-53.60000111.4L231 T254 H258 I259 L260L231-T256 HydrophobicContact CD2-CG2 3.34Å; T254-T256 VanDerWaalsContact C-N 3.26Å; T254-T256 PolarHBondContact O-N 3.15Å; T256-H258 VanDerWaalsContact C-N 3.32Å; T256-I259 PolarHBondContact O-N 2.88Å; T256-L260 WeakPolarHBondContact O-CG 3.42Å; T256-L260 PolarHBondContact O-N 3.27Å
257L92.7Very high91.8Very high4 Ų454.1 Ų54.12%0.02130%0.297CS..Hα-helixtrans-70.5-31178.2-64.6173.8000112F226 L238 L250 A253 T254 L260 S261F226-L257 HydrophobicContact CD1-CD1 4.12Å; F226-L257 HydrophobicContact CD1-CD2 4.26Å; F226-L257 HydrophobicContact CE1-CD1 3.91Å; F226-L257 HydrophobicContact CE1-CD2 3.45Å; F226-L257 VanDerWaalsContact CE1-CD2 3.45Å; F226-L257 HydrophobicContact CE1-CG 4.31Å; F226-L257 HydrophobicContact CZ-CD2 4.26Å; L238-L257 HydrophobicContact CD1-CD2 4.23Å; L250-L257 HydrophobicContact CD1-CD1 3.99Å; L250-L257 HydrophobicContact CG-CD1 4.09Å; L250-L257 WeakPolarHBondContact O-CB 3.41Å; A253-L257 HydrophobicContact CB-CD1 4.28Å; T254-L257 HydrophobicContact CG2-CD1 4.45Å; T254-L257 PolarHBondContact O-N 2.92Å; T254-L257 VanDerWaalsContact O-N 3.13Å; T254-L257 WeakPolarHBondContact OG1-CB 3.36Å; T254-L257 WeakPolarHBondContact OG1-CD1 2.89Å; T254-L257 WeakPolarHBondContact OG1-CG 3.4Å; T254-L257 PolarHBondContact OG1-N 3.12Å; L257-L260 HydrophobicContact CD2-CD1 4.35Å; L257-L260 PolarHBondContact O-N 2.89Å; L257-S261 VanDerWaalsContact O-CB 3.27Å; L257-S261 WeakPolarHBondContact O-CB 3.46Å; L257-S261 PolarHBondContact O-N 2.66Å; L257-S261 PolarHBondContact O-OG 3.34Å
258H94Very high91.5Very high98 Ų9856.4 Ų56.445%0.45431%0.307SS..Hα-helixtrans-56.2-52.3171.3-174.356.3000111G251 T254 P255 T256 L260 S261 E262G251-H258 WeakPolarHBondContact O-CA 3.36Å; G251-H258 VanDerWaalsContact O-CB 3.31Å; G251-H258 WeakPolarHBondContact O-CB 3.49Å; G251-H258 PolarHBondContact O-N 3.38Å; T254-H258 PolarHBondContact O-N 2.97Å; P255-H258 WeakPolarHBondContact O-CB 3.36Å; P255-H258 PolarHBondContact O-N 3.44Å; T256-H258 VanDerWaalsContact C-N 3.32Å; H258-L260 VanDerWaalsContact C-N 3.3Å; H258-L260 PolarHBondContact O-N 3.32Å; H258-S261 PolarHBondContact O-N 3Å; H258-S261 VanDerWaalsContact O-N 3.12Å; H258-S261 PolarHBondContact O-OG 2.89Å; H258-E262 IonicContact CE1-OE1 3.1Å; H258-E262 PolarHBondContact O-N 3.48Å; H258-E262 VanDerWaalsContact O-N 3.12Å
259I92.5Very high91.3Very high125 Ų12558.9 Ų58.964%0.64132%0.316SS*.Hα-helixtrans-58.5-42.1178.4-63.3165.2000111.3P255 T256P255-I259 WeakPolarHBondContact O-CG1 3.34Å; P255-I259 PolarHBondContact O-N 3.06Å; T256-I259 PolarHBondContact O-N 2.88Å
260L92.7Very high91.3Very high22 Ų2255 Ų5512%0.11530%0.295CS..Hα-helixtrans-70.1-34.6178.3-64.5-179.6000112.8Q234 N235 L238 T256 L257 H258 E262 N263Q234-L260 HydrophobicContact CB-CD1 3.76Å; N235-L260 HydrophobicContact CB-CD2 4.09Å; L238-L260 HydrophobicContact CD2-CB 3.78Å; T256-L260 WeakPolarHBondContact O-CG 3.42Å; T256-L260 PolarHBondContact O-N 3.27Å; L257-L260 HydrophobicContact CD2-CD1 4.35Å; L257-L260 PolarHBondContact O-N 2.89Å; H258-L260 VanDerWaalsContact C-N 3.3Å; H258-L260 PolarHBondContact O-N 3.32Å; L260-E262 VanDerWaalsContact C-N 3.31Å; L260-E262 PolarHBondContact O-N 3.48Å; L260-N263 WeakPolarHBondContact O-CB 3.46Å; L260-N263 PolarHBondContact O-N 2.84Å
261S92.9Very high91.1Very high2 Ų253 Ų531%0.01428%0.284CS..Hα-helixtrans-69.5-28178.774.20000112.8L257 H258 N263 W267L257-S261 VanDerWaalsContact O-CB 3.27Å; L257-S261 WeakPolarHBondContact O-CB 3.46Å; L257-S261 PolarHBondContact O-N 2.66Å; L257-S261 PolarHBondContact O-OG 3.34Å; H258-S261 PolarHBondContact O-N 3Å; H258-S261 VanDerWaalsContact O-N 3.12Å; H258-S261 PolarHBondContact O-OG 2.89Å; S261-N263 VanDerWaalsContact C-N 3.26Å; S261-N263 PolarHBondContact O-N 3.49Å; S261-W267 PolarHBondContact O-NE1 2.94Å
262E92.1Very high90.9Very high85 Ų8556.2 Ų56.240%0.39730%0.298SS..THydrogen-bonded Turntrans-84.64.4175.4-61.3-56.4151.500113H258 L260 M264 K295H258-E262 IonicContact CE1-OE1 3.1Å; H258-E262 PolarHBondContact O-N 3.48Å; H258-E262 VanDerWaalsContact O-N 3.12Å; L260-E262 VanDerWaalsContact C-N 3.31Å; L260-E262 PolarHBondContact O-N 3.48Å; E262-M264 PolarHBondContact O-N 3.28Å; E262-K295 IonicContact OE1-NZ 3.59Å; E262-K295 PolarHBondContact OE1-NZ 3.29Å; E262-K295 WeakPolarHBondContact OE2-CD 3.19Å; E262-K295 IonicContact OE2-NZ 3.23Å; E262-K295 PolarHBondContact OE2-NZ 2.94Å
263N90Very high90.7Very high45 Ų4551 Ų5124%0.24127%0.273CS..  trans-64.7121.6-177.6-171-43.7000112L260 S261 T265 L266 W267L260-N263 WeakPolarHBondContact O-CB 3.46Å; L260-N263 PolarHBondContact O-N 2.84Å; S261-N263 VanDerWaalsContact C-N 3.26Å; S261-N263 PolarHBondContact O-N 3.49Å; N263-T265 VanDerWaalsContact C-N 3.28Å; N263-T265 PolarHBondContact O-N 3.36Å; N263-T265 WeakPolarHBondContact OD1-CB 3.41Å; N263-T265 PolarHBondContact OD1-N 3.41Å; N263-T265 PolarHBondContact OD1-OG1 2.92Å; N263-L266 HydrophobicContact CB-CB 4.21Å; N263-L266 WeakPolarHBondContact O-CB 3.25Å; N263-L266 PolarHBondContact O-N 3.49Å; N263-L266 VanDerWaalsContact O-N 3.09Å; N263-W267 PolarHBondContact O-N 2.9Å
264M88.9Confident90.5Very high75 Ų7548.3 Ų48.337%0.36925%0.249SC..Hα-helixtrans-51.8-43178.7-171.5-171.867.300113.5E262 L266 W267 K268 W294E262-M264 PolarHBondContact O-N 3.28Å; M264-L266 VanDerWaalsContact C-N 3.27Å; M264-L266 PolarHBondContact O-N 2.94Å; M264-W267 PolarHBondContact O-N 3.46Å; M264-K268 WeakPolarHBondContact O-CB 3.07Å; M264-K268 PolarHBondContact O-N 3.27Å; M264-W294 HydrophobicContact CG-CG 4.29Å
265T87.6Confident90.3Very high60 Ų6046.8 Ų46.837%0.36824%0.24SC..Hα-helixtrans-69.3-27.7-17666.60000112.6N263 K269N263-T265 VanDerWaalsContact C-N 3.28Å; N263-T265 PolarHBondContact O-N 3.36Å; N263-T265 WeakPolarHBondContact OD1-CB 3.41Å; N263-T265 PolarHBondContact OD1-N 3.41Å; N263-T265 PolarHBondContact OD1-OG1 2.92Å; T265-K269 VanDerWaalsContact O-CG 3.32Å; T265-K269 WeakPolarHBondContact O-CG 3.5Å; T265-K269 PolarHBondContact O-N 3.25Å; T265-K269 VanDerWaalsContact O-N 3.1Å
266L92Very high89.7Confident3 Ų344.1 Ų44.12%0.01622%0.223CC..Hα-helixtrans-67.8-51.3175.5172.2144.7000110.4L238 I247 N263 M264 K268 K269 L270L238-L266 HydrophobicContact CB-CD1 3.54Å; L238-L266 HydrophobicContact CD2-CD1 4.3Å; L238-L266 HydrophobicContact CG-CD1 4.46Å; I247-L266 HydrophobicContact CD1-CD2 3.86Å; I247-L266 HydrophobicContact CG1-CD2 4.38Å; I247-L266 HydrophobicContact CG2-CD2 3.79Å; N263-L266 HydrophobicContact CB-CB 4.21Å; N263-L266 WeakPolarHBondContact O-CB 3.25Å; N263-L266 PolarHBondContact O-N 3.49Å; N263-L266 VanDerWaalsContact O-N 3.09Å; M264-L266 VanDerWaalsContact C-N 3.27Å; M264-L266 PolarHBondContact O-N 2.94Å; L266-K268 VanDerWaalsContact C-N 3.31Å; L266-K268 PolarHBondContact O-N 2.98Å; L266-K269 WeakPolarHBondContact O-CB 3.47Å; L266-K269 PolarHBondContact O-N 3.37Å; L266-K269 VanDerWaalsContact O-N 3.16Å; L266-L270 PolarHBondContact O-N 2.85Å
267W92.2Very high88.8Confident3 Ų345.9 Ų45.91%0.01123%0.231CC..Hα-helixtrans-65.2-36178.6-69.998.6000112.2A244 I247 I248 S261 N263 M264 K269 L270 C271 W294 K295 Y298 F299A244-W267 HydrophobicContact CB-CH2 3.83Å; A244-W267 HydrophobicContact CB-CZ3 3.68Å; I247-W267 HydrophobicContact CG2-CZ2 3.96Å; I248-W267 HydrophobicContact CD1-CH2 4.15Å; I248-W267 HydrophobicContact CG1-CH2 4.15Å; I248-W267 HydrophobicContact CG1-CZ2 4.26Å; S261-W267 PolarHBondContact O-NE1 2.94Å; N263-W267 PolarHBondContact O-N 2.9Å; M264-W267 PolarHBondContact O-N 3.46Å; W267-K269 PolarHBondContact O-N 3Å; W267-L270 HydrophobicContact CE3-CD2 3.89Å; W267-L270 HydrophobicContact CZ3-CD2 3.84Å; W267-L270 PolarHBondContact O-N 2.95Å; W267-C271 WeakPolarHBondContact O-CB 3.44Å; W267-C271 PolarHBondContact O-N 2.91Å; W267-C271 PolarHBondContact O-SG 2.96Å; W267-C271 VanDerWaalsContact O-SG 3.41Å; W267-W294 HydrophobicContact CB-CB 3.63Å; W267-K295 HydrophobicContact CB-CB 4.48Å; W267-K295 HydrophobicContact CD2-CB 3.76Å; W267-K295 HydrophobicContact CD2-CD 4.49Å; W267-K295 HydrophobicContact CD2-CG 3.82Å; W267-K295 HydrophobicContact CE3-CB 4.26Å; W267-K295 HydrophobicContact CE3-CG 4.12Å; W267-K295 HydrophobicContact CG-CB 3.82Å; W267-K295 HydrophobicContact CG-CG 4.38Å; W267-K295 HydrophobicContact CH2-CG 4.1Å; W267-K295 HydrophobicContact CZ2-CD 3.89Å; W267-K295 HydrophobicContact CZ2-CG 3.8Å; W267-K295 HydrophobicContact CZ3-CG 4.25Å; W267-Y298 HydrophobicContact CE3-CD1 4.25Å; W267-Y298 AromaticContact CE3-CG 3.99Å; W267-Y298 HydrophobicContact CE3-CG 3.99Å; W267-Y298 AromaticContact CZ3-CD1 3.79Å; W267-Y298 HydrophobicContact CZ3-CD1 3.79Å; W267-Y298 HydrophobicContact CZ3-CE1 4.34Å; W267-Y298 HydrophobicContact CZ3-CG 4.01Å; W267-F299 HydrophobicContact CH2-CE2 4.15Å; W267-F299 HydrophobicContact CH2-CZ 4.31Å; W267-F299 HydrophobicContact CZ3-CE2 4.18Å; W267-F299 HydrophobicContact CZ3-CZ 4.42Å
268K88.6Confident88.1Confident50 Ų5048.9 Ų48.922%0.21724%0.243CC..Hα-helixtrans-59-46.5172.1-173.8175.6-177.21750111.9M264 L266 L270 C271 Q272 L286 W294M264-K268 WeakPolarHBondContact O-CB 3.07Å; M264-K268 PolarHBondContact O-N 3.27Å; L266-K268 VanDerWaalsContact C-N 3.31Å; L266-K268 PolarHBondContact O-N 2.98Å; K268-L270 VanDerWaalsContact C-N 3.34Å; K268-C271 PolarHBondContact O-N 3.49Å; K268-Q272 VanDerWaalsContact O-CG 3.3Å; K268-Q272 WeakPolarHBondContact O-CG 3.4Å; K268-Q272 PolarHBondContact O-N 3.28Å; K268-L286 WeakPolarHBondContact CE-O 3.44Å; K268-L286 HydrophobicContact CG-CD2 4.31Å; K268-L286 PolarHBondContact NZ-O 2.65Å; K268-W294 HydrophobicContact CB-CB 4.43Å; K268-W294 HydrophobicContact CB-CD2 3.69Å; K268-W294 HydrophobicContact CB-CE3 4.16Å; K268-W294 HydrophobicContact CB-CG 3.79Å; K268-W294 HydrophobicContact CD-CD2 4.37Å; K268-W294 HydrophobicContact CD-CZ2 4Å; K268-W294 HydrophobicContact CG-CD2 3.81Å; K268-W294 HydrophobicContact CG-CE3 4.09Å; K268-W294 HydrophobicContact CG-CG 4.4Å; K268-W294 HydrophobicContact CG-CH2 4.34Å; K268-W294 HydrophobicContact CG-CZ2 4.02Å; K268-W294 HydrophobicContact CG-CZ3 4.35Å
269K88.9Confident86.7Confident103 Ų10348.2 Ų48.245%0.44825%0.248SC..Hα-helixtrans-63.5-39.8175.9-76.2172.2-177.81710111.8C239 T265 L266 W267 Q272 F273C239-K269 HydrophobicContact CB-CD 4.31Å; T265-K269 VanDerWaalsContact O-CG 3.32Å; T265-K269 WeakPolarHBondContact O-CG 3.5Å; T265-K269 PolarHBondContact O-N 3.25Å; T265-K269 VanDerWaalsContact O-N 3.1Å; L266-K269 WeakPolarHBondContact O-CB 3.47Å; L266-K269 PolarHBondContact O-N 3.37Å; L266-K269 VanDerWaalsContact O-N 3.16Å; W267-K269 PolarHBondContact O-N 3Å; K269-Q272 PolarHBondContact O-N 3.42Å; K269-F273 WeakPolarHBondContact O-CB 3.32Å; K269-F273 PolarHBondContact O-N 3.13Å
270L90.4Very high85.4Confident7 Ų746.4 Ų46.44%0.03724%0.236CC..Hα-helixtrans-64.1-44.8177.5-168.267.5000111.4A244 I247 L266 W267 K268 Q272 F273 H274 Y298A244-L270 HydrophobicContact CB-CD2 4.05Å; I247-L270 HydrophobicContact CD1-CD1 4.4Å; I247-L270 HydrophobicContact CD1-CD2 3.78Å; L266-L270 PolarHBondContact O-N 2.85Å; W267-L270 HydrophobicContact CE3-CD2 3.89Å; W267-L270 HydrophobicContact CZ3-CD2 3.84Å; W267-L270 PolarHBondContact O-N 2.95Å; K268-L270 VanDerWaalsContact C-N 3.34Å; L270-Q272 PolarHBondContact O-N 3.41Å; L270-F273 WeakPolarHBondContact O-CB 3.44Å; L270-F273 PolarHBondContact O-N 2.84Å; L270-H274 PolarHBondContact O-CD2 3.26Å; L270-H274 VanDerWaalsContact O-CD2 3.3Å; L270-H274 PolarHBondContact O-N 2.83Å; L270-H274 VanDerWaalsContact O-N 3.08Å; L270-Y298 HydrophobicContact CB-CD2 4.47Å; L270-Y298 HydrophobicContact CB-CE2 4.5Å; L270-Y298 HydrophobicContact CD2-CD2 3.85Å; L270-Y298 HydrophobicContact CD2-CE1 4.37Å; L270-Y298 HydrophobicContact CD2-CE2 3.53Å; L270-Y298 HydrophobicContact CD2-CG 4.38Å; L270-Y298 HydrophobicContact CG-CD2 3.97Å; L270-Y298 HydrophobicContact CG-CE2 3.57Å
271C89Confident83.9Confident3 Ų346.1 Ų46.12%0.0224%0.236CC..Hα-helixtrans-58.1-47.3172.4-76.20000112.1W267 K268 F273 H274 F275 W294 Y298W267-C271 WeakPolarHBondContact O-CB 3.44Å; W267-C271 PolarHBondContact O-N 2.91Å; W267-C271 PolarHBondContact O-SG 2.96Å; W267-C271 VanDerWaalsContact O-SG 3.41Å; K268-C271 PolarHBondContact O-N 3.49Å; C271-F273 VanDerWaalsContact C-N 3.28Å; C271-F273 PolarHBondContact O-N 2.88Å; C271-H274 PolarHBondContact O-N 3.13Å; C271-F275 HydrophobicContact CB-CD2 4.46Å; C271-F275 WeakPolarHBondContact O-CB 3.15Å; C271-F275 WeakPolarHBondContact O-CD2 3.42Å; C271-F275 PolarHBondContact O-N 2.71Å; C271-W294 HydrophobicContact CB-CE3 4.24Å; C271-W294 HydrophobicContact CB-CZ3 4.5Å; C271-Y298 VanDerWaalsContact SG-CA 3.54Å; C271-Y298 VanDerWaalsContact SG-CB 3.56Å
272Q87Confident82.4Confident71 Ų7154.8 Ų54.833%0.33227%0.268SS..Hα-helixtrans-59.8-41176.3-73.5174.5-14.600111.6K268 K269 L270 S276 L286K268-Q272 VanDerWaalsContact O-CG 3.3Å; K268-Q272 WeakPolarHBondContact O-CG 3.4Å; K268-Q272 PolarHBondContact O-N 3.28Å; K269-Q272 PolarHBondContact O-N 3.42Å; L270-Q272 PolarHBondContact O-N 3.41Å; Q272-S276 WeakPolarHBondContact O-CB 3.44Å; Q272-S276 PolarHBondContact O-N 2.94Å; Q272-S276 VanDerWaalsContact O-N 3.09Å; Q272-S276 PolarHBondContact O-OG 3.48Å; Q272-L286 HydrophobicContact CG-CD1 3.83Å; Q272-L286 HydrophobicContact CG-CD2 3.73Å; Q272-L286 HydrophobicContact CG-CG 4.38Å
273F88.1Confident80.7Confident44 Ų4457.4 Ų57.419%0.19329%0.285CS..Hα-helixtrans-63.6-46.1-179.5175.1-93.6000112.7W8 K269 L270 C271 K308 Q310W8-F273 HydrophobicContact CH2-CE2 4.33Å; K269-F273 WeakPolarHBondContact O-CB 3.32Å; K269-F273 PolarHBondContact O-N 3.13Å; L270-F273 WeakPolarHBondContact O-CB 3.44Å; L270-F273 PolarHBondContact O-N 2.84Å; C271-F273 VanDerWaalsContact C-N 3.28Å; C271-F273 PolarHBondContact O-N 2.88Å; F273-K308 VanDerWaalsContact O-CD 3.29Å; F273-K308 WeakPolarHBondContact O-CD 3.43Å; F273-Q310 HydrophobicContact CZ-CG 4.46Å
274H87.3Confident78.9Confident12 Ų1258.8 Ų58.86%0.05629%0.291CS..Hα-helixtrans-84.8-30.3-177.6-68.8-75.1000114.3S242 L270 C271 Y298S242-H274 PolarHBondContact O-CE1 3.12Å; S242-H274 PolarHBondContact O-NE2 3.08Å; L270-H274 PolarHBondContact O-CD2 3.26Å; L270-H274 VanDerWaalsContact O-CD2 3.3Å; L270-H274 PolarHBondContact O-N 2.83Å; L270-H274 VanDerWaalsContact O-N 3.08Å; C271-H274 PolarHBondContact O-N 3.13Å; H274-Y298 AromaticContact CD2-CE2 3.81Å
275F86.6Confident77.1Confident0 Ų056.7 Ų56.70%029%0.289CS..Hα-helixtrans-122.12.7-166-49-64.7000114.7C271 D277 K278 C281 Y298 L301C271-F275 HydrophobicContact CB-CD2 4.46Å; C271-F275 WeakPolarHBondContact O-CB 3.15Å; C271-F275 WeakPolarHBondContact O-CD2 3.42Å; C271-F275 PolarHBondContact O-N 2.71Å; F275-D277 PolarHBondContact O-N 3.25Å; F275-D277 VanDerWaalsContact O-N 3.08Å; F275-K278 HydrophobicContact CB-CG 4.43Å; F275-K278 WeakPolarHBondContact O-CB 3.48Å; F275-K278 PolarHBondContact O-N 3.07Å; F275-C281 VanDerWaalsContact CB-SG 3.55Å; F275-C281 VanDerWaalsContact O-CB 3.3Å; F275-C281 WeakPolarHBondContact O-CB 3.24Å; F275-C281 PolarHBondContact O-SG 3.31Å; F275-Y298 AromaticContact CE2-CD2 3.93Å; F275-Y298 HydrophobicContact CE2-CD2 3.93Å; F275-Y298 AromaticContact CE2-CE2 3.99Å; F275-Y298 HydrophobicContact CE2-CE2 3.99Å; F275-Y298 HydrophobicContact CZ-CE2 4.5Å; F275-L301 HydrophobicContact CB-CD1 4.4Å; F275-L301 HydrophobicContact CD1-CB 4.4Å; F275-L301 HydrophobicContact CD2-CB 3.83Å; F275-L301 HydrophobicContact CD2-CD1 3.62Å; F275-L301 HydrophobicContact CD2-CG 4.37Å; F275-L301 HydrophobicContact CE1-CB 4.2Å; F275-L301 HydrophobicContact CE2-CB 3.61Å; F275-L301 HydrophobicContact CE2-CD1 4.14Å; F275-L301 HydrophobicContact CG-CB 4.24Å; F275-L301 HydrophobicContact CG-CD1 4.13Å; F275-L301 HydrophobicContact CZ-CB 3.81Å
276S79.6Confident75.4Confident51 Ų5155.6 Ų55.636%0.35728%0.281SS..THydrogen-bonded Turntrans-51.4-34.6179.437.30000114.6Q272 K278Q272-S276 WeakPolarHBondContact O-CB 3.44Å; Q272-S276 PolarHBondContact O-N 2.94Å; Q272-S276 VanDerWaalsContact O-N 3.09Å; Q272-S276 PolarHBondContact O-OG 3.48Å; S276-K278 VanDerWaalsContact C-N 3.26Å; S276-K278 PolarHBondContact O-N 2.96Å
277D72.6Confident73.4Confident100 Ų10061 Ų6154%0.53531%0.314SS..THydrogen-bonded Turntrans-80.3-3.6-177.1-59.8-45.9000113.2F275 K308F275-D277 PolarHBondContact O-N 3.25Å; F275-D277 VanDerWaalsContact O-N 3.08Å; D277-K308 IonicContact OD2-NZ 2.67Å; D277-K308 PolarHBondContact OD2-NZ 3.31Å
278K77.1Confident71.4Confident67 Ų6771.5 Ų71.529%0.29135%0.354SS..SBendtrans-90.7139.8-176.4-55.8-58.7-178-176.90111.9F275 S276 F280 C281 R282 Y305F275-K278 HydrophobicContact CB-CG 4.43Å; F275-K278 WeakPolarHBondContact O-CB 3.48Å; F275-K278 PolarHBondContact O-N 3.07Å; S276-K278 VanDerWaalsContact C-N 3.26Å; S276-K278 PolarHBondContact O-N 2.96Å; K278-F280 VanDerWaalsContact C-N 3.25Å; K278-F280 PolarHBondContact O-N 3.25Å; K278-C281 PolarHBondContact O-N 2.97Å; K278-R282 PolarHBondContact O-N 3.34Å; K278-Y305 HydrophobicContact CD-CD1 4.16Å; K278-Y305 HydrophobicContact CG-CD1 4.25Å; K278-Y305 HydrophobicContact CG-CG 4.43Å
279P65.6Low69.9Low85 Ų8571.5 Ų71.555%0.55236%0.36SS*.Hα-helixtrans-59.7-33.8-174.721.7-32000113.1C281 R282 N283P279-C281 VanDerWaalsContact C-N 3.33Å; P279-C281 PolarHBondContact O-N 2.84Å; P279-R282 PolarHBondContact O-N 2.89Å; P279-N283 PolarHBondContact O-N 3.39Å; P279-N283 VanDerWaalsContact O-N 3.08Å
280F63.9Low68.5Low86 Ų8672.8 Ų72.838%0.37737%0.372SS..Hα-helixtrans-58.4-41.9173.6-176.1-101000112.5K278 R282 N283 L284 M297 L301K278-F280 VanDerWaalsContact C-N 3.25Å; K278-F280 PolarHBondContact O-N 3.25Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 3.28Å; F280-N283 PolarHBondContact O-N 3.16Å; F280-L284 HydrophobicContact CD1-CD1 4.02Å; F280-L284 HydrophobicContact CD2-CD1 4.37Å; F280-L284 HydrophobicContact CE1-CD1 3.29Å; F280-L284 HydrophobicContact CE2-CD1 3.71Å; F280-L284 HydrophobicContact CZ-CD1 3.12Å; F280-L284 PolarHBondContact O-N 3.22Å; F280-M297 HydrophobicContact CE1-SD 4.44Å; F280-L301 HydrophobicContact CD1-CD2 3.71Å; F280-L301 HydrophobicContact CE1-CD2 3.79Å
281C61.3Low67.4Low17 Ų1780.2 Ų80.212%0.11541%0.411CS..Hα-helixtrans-73.5-23.7178.9-65.10000113.4F275 K278 P279 L286F275-C281 VanDerWaalsContact CB-SG 3.55Å; F275-C281 VanDerWaalsContact O-CB 3.3Å; F275-C281 WeakPolarHBondContact O-CB 3.24Å; F275-C281 PolarHBondContact O-SG 3.31Å; K278-C281 PolarHBondContact O-N 2.97Å; P279-C281 VanDerWaalsContact C-N 3.33Å; P279-C281 PolarHBondContact O-N 2.84Å; C281-L286 HydrophobicContact CB-CD1 4.49Å
282R61.6Low66.9Low184 Ų18481.5 Ų81.569%0.69442%0.419SS*.Hα-helixtrans-71.9-40.4170.6-65.7-176.1-179.6-173.3-0.4111.5K278 P279 F280K278-R282 PolarHBondContact O-N 3.34Å; P279-R282 PolarHBondContact O-N 2.89Å; F280-R282 VanDerWaalsContact C-N 3.33Å; F280-R282 PolarHBondContact O-N 3.28Å
283N55.7Low66.9Low140 Ų14082.7 Ų82.775%0.74943%0.428SS*.Hα-helixtrans-79.2-30.7-175.8-68.4-9.5000113.6P279 F280 G285P279-N283 PolarHBondContact O-N 3.39Å; P279-N283 VanDerWaalsContact O-N 3.08Å; F280-N283 PolarHBondContact O-N 3.16Å; N283-G285 PolarHBondContact O-N 3.44Å; N283-G285 VanDerWaalsContact O-N 3.15Å
284L52.7Low67Low73 Ų7381.3 Ų81.338%0.38242%0.421SS..THydrogen-bonded Turntrans-73.3-4.7-175.4-134.2131.6000114.2F280F280-L284 HydrophobicContact CD1-CD1 4.02Å; F280-L284 HydrophobicContact CD2-CD1 4.37Å; F280-L284 HydrophobicContact CE1-CD1 3.29Å; F280-L284 HydrophobicContact CE2-CD1 3.71Å; F280-L284 HydrophobicContact CZ-CD1 3.12Å; F280-L284 PolarHBondContact O-N 3.22Å
285G51.5Low67.2Low31 Ų3183.2 Ų83.232%0.3243%0.429SS..THydrogen-bonded Turntrans46.676.7-176.600000109.8N283 T287N283-G285 PolarHBondContact O-N 3.44Å; N283-G285 VanDerWaalsContact O-N 3.15Å; G285-T287 WeakPolarHBondContact CA-OG1 3.4Å; G285-T287 PolarHBondContact O-N 2.79Å; G285-T287 PolarHBondContact O-OG1 3.04Å
286L52.8Low67.4Low38 Ų3888.3 Ų88.320%0.19946%0.456CS..THydrogen-bonded Turntrans-47.42.1169.3-86.7150000114.5K268 Q272 C281 W294K268-L286 WeakPolarHBondContact CE-O 3.44Å; K268-L286 HydrophobicContact CG-CD2 4.31Å; K268-L286 PolarHBondContact NZ-O 2.65Å; Q272-L286 HydrophobicContact CG-CD1 3.83Å; Q272-L286 HydrophobicContact CG-CD2 3.73Å; Q272-L286 HydrophobicContact CG-CG 4.38Å; C281-L286 HydrophobicContact CB-CD1 4.49Å; L286-W294 HydrophobicContact CD2-CH2 3.3Å; L286-W294 HydrophobicContact CD2-CZ2 4.22Å; L286-W294 HydrophobicContact CD2-CZ3 3.46Å; L286-W294 VanDerWaalsContact CD2-CZ3 3.46Å; L286-W294 HydrophobicContact CG-CH2 4.26Å
287T49.2Very low67.8Low116 Ų11688 Ų8871%0.71245%0.449SS*.THydrogen-bonded Turntrans-79.9-31.1-171.836.30000115.7G285G285-T287 WeakPolarHBondContact CA-OG1 3.4Å; G285-T287 PolarHBondContact O-N 2.79Å; G285-T287 PolarHBondContact O-OG1 3.04Å
288R50.8Low68.6Low224 Ų22483.2 Ų83.285%0.84542%0.424SS*.SBendtrans-149.80.4-166.4-77.7-166167.3163.2-5.6122.5D290R288-D290 PolarHBondContact O-N 2.95Å
289S56.3Low69.3Low49 Ų4983.1 Ų83.134%0.34342%0.424SS..  trans-91.296.9178.959.90000111.9N291 V292S289-N291 PolarHBondContact O-N 3.29Å; S289-V292 PolarHBondContact O-N 3.02Å; S289-V292 WeakPolarHBondContact OG-CG2 3.46Å
290D60Low70.5Confident131 Ų13181.9 Ų81.970%0.70141%0.414SS*.THydrogen-bonded Turntrans-66.8-7.9172.1-70.7-26.8000113.1R288R288-D290 PolarHBondContact O-N 2.95Å
291N67.3Low71.6Confident162 Ų16278.2 Ų78.287%0.86640%0.399SS*.THydrogen-bonded Turntrans-94.87.7179.1-72.50.6000114.6S289S289-N291 PolarHBondContact O-N 3.29Å
292V78.6Confident72.9Confident30 Ų3081.2 Ų81.218%0.18241%0.411CS..  trans-91.1122179.4172.20000110.3S289 W294 M297S289-V292 PolarHBondContact O-N 3.02Å; S289-V292 WeakPolarHBondContact OG-CG2 3.46Å; V292-W294 HydrophobicContact CB-CZ2 4.39Å; V292-W294 HydrophobicContact CG1-CD2 4.15Å; V292-W294 HydrophobicContact CG1-CE3 4.48Å; V292-W294 HydrophobicContact CG1-CG 4.44Å; V292-W294 HydrophobicContact CG1-CZ2 4.31Å; V292-W294 PolarHBondContact O-N 3.36Å; V292-M297 HydrophobicContact CG1-CB 4.29Å; V292-M297 HydrophobicContact CG1-CE 4.09Å
293D87.3Confident74.2Confident96 Ų9680.8 Ų80.851%0.51341%0.414SS..  trans-69.496.8164.1-177.7-11.5000109.2K295 L296 M297D293-K295 PolarHBondContact O-N 3.45Å; D293-K295 WeakPolarHBondContact OD1-CB 3.49Å; D293-K295 PolarHBondContact OD1-N 2.89Å; D293-L296 HydrophobicContact CB-CB 4.01Å; D293-L296 PolarHBondContact O-N 3.2Å; D293-L296 PolarHBondContact OD1-N 2.81Å; D293-L296 WeakPolarHBondContact OD2-CB 3.45Å; D293-M297 WeakPolarHBondContact O-CB 3.48Å; D293-M297 PolarHBondContact O-N 3.29Å
294W88.9Confident75.5Confident15 Ų1580.7 Ų80.76%0.05741%0.409CS..Hα-helixtrans-66.8-25.3-178.5-72.492.9000113.2M264 W267 K268 C271 L286 V292 M297 Y298M264-W294 HydrophobicContact CG-CG 4.29Å; W267-W294 HydrophobicContact CB-CB 3.63Å; K268-W294 HydrophobicContact CB-CB 4.43Å; K268-W294 HydrophobicContact CB-CD2 3.69Å; K268-W294 HydrophobicContact CB-CE3 4.16Å; K268-W294 HydrophobicContact CB-CG 3.79Å; K268-W294 HydrophobicContact CD-CD2 4.37Å; K268-W294 HydrophobicContact CD-CZ2 4Å; K268-W294 HydrophobicContact CG-CD2 3.81Å; K268-W294 HydrophobicContact CG-CE3 4.09Å; K268-W294 HydrophobicContact CG-CG 4.4Å; K268-W294 HydrophobicContact CG-CH2 4.34Å; K268-W294 HydrophobicContact CG-CZ2 4.02Å; K268-W294 HydrophobicContact CG-CZ3 4.35Å; C271-W294 HydrophobicContact CB-CE3 4.24Å; C271-W294 HydrophobicContact CB-CZ3 4.5Å; L286-W294 HydrophobicContact CD2-CH2 3.3Å; L286-W294 HydrophobicContact CD2-CZ2 4.22Å; L286-W294 HydrophobicContact CD2-CZ3 3.46Å; L286-W294 VanDerWaalsContact CD2-CZ3 3.46Å; L286-W294 HydrophobicContact CG-CH2 4.26Å; V292-W294 HydrophobicContact CB-CZ2 4.39Å; V292-W294 HydrophobicContact CG1-CD2 4.15Å; V292-W294 HydrophobicContact CG1-CE3 4.48Å; V292-W294 HydrophobicContact CG1-CG 4.44Å; V292-W294 HydrophobicContact CG1-CZ2 4.31Å; V292-W294 PolarHBondContact O-N 3.36Å; W294-M297 HydrophobicContact CE3-CG 4.48Å; W294-Y298 WeakPolarHBondContact O-CB 3.5Å; W294-Y298 PolarHBondContact O-N 3.44Å
295K91.4Very high77Confident52 Ų5280.7 Ų80.723%0.22640%0.404CS..Hα-helixtrans-72.8-47.5177-177.7177.1-179-173.70109.9E262 W267 D293 M297 Y298 F299E262-K295 IonicContact OE1-NZ 3.59Å; E262-K295 PolarHBondContact OE1-NZ 3.29Å; E262-K295 WeakPolarHBondContact OE2-CD 3.19Å; E262-K295 IonicContact OE2-NZ 3.23Å; E262-K295 PolarHBondContact OE2-NZ 2.94Å; W267-K295 HydrophobicContact CB-CB 4.48Å; W267-K295 HydrophobicContact CD2-CB 3.76Å; W267-K295 HydrophobicContact CD2-CD 4.49Å; W267-K295 HydrophobicContact CD2-CG 3.82Å; W267-K295 HydrophobicContact CE3-CB 4.26Å; W267-K295 HydrophobicContact CE3-CG 4.12Å; W267-K295 HydrophobicContact CG-CB 3.82Å; W267-K295 HydrophobicContact CG-CG 4.38Å; W267-K295 HydrophobicContact CH2-CG 4.1Å; W267-K295 HydrophobicContact CZ2-CD 3.89Å; W267-K295 HydrophobicContact CZ2-CG 3.8Å; W267-K295 HydrophobicContact CZ3-CG 4.25Å; D293-K295 PolarHBondContact O-N 3.45Å; D293-K295 WeakPolarHBondContact OD1-CB 3.49Å; D293-K295 PolarHBondContact OD1-N 2.89Å; K295-M297 VanDerWaalsContact C-N 3.31Å; K295-M297 PolarHBondContact O-N 3.34Å; K295-Y298 WeakPolarHBondContact O-CB 3.4Å; K295-Y298 PolarHBondContact O-N 2.96Å; K295-F299 HydrophobicContact CG-CD2 4.38Å; K295-F299 HydrophobicContact CG-CE2 4.09Å; K295-F299 VanDerWaalsContact O-CD2 3.24Å; K295-F299 WeakPolarHBondContact O-CD2 3.28Å; K295-F299 PolarHBondContact O-N 3.32Å
296L90.8Very high78.4Confident108 Ų10883.8 Ų83.857%0.56542%0.419SS*.Hα-helixtrans-61.4-41.6172.7-178.662.2000111.7D293 Y298 F299 T300D293-L296 HydrophobicContact CB-CB 4.01Å; D293-L296 PolarHBondContact O-N 3.2Å; D293-L296 PolarHBondContact OD1-N 2.81Å; D293-L296 WeakPolarHBondContact OD2-CB 3.45Å; L296-Y298 VanDerWaalsContact C-N 3.33Å; L296-Y298 PolarHBondContact O-N 2.88Å; L296-F299 PolarHBondContact O-N 3.47Å; L296-T300 WeakPolarHBondContact O-CB 3.43Å; L296-T300 PolarHBondContact O-N 2.94Å; L296-T300 PolarHBondContact O-OG1 3.29Å
297M88.5Confident79.9Confident43 Ų4384.7 Ų84.721%0.21242%0.423CS..Hα-helixtrans-59.6-43.4176-17560.367.200111.4F280 V292 D293 W294 K295 F299 T300 L301F280-M297 HydrophobicContact CE1-SD 4.44Å; V292-M297 HydrophobicContact CG1-CB 4.29Å; V292-M297 HydrophobicContact CG1-CE 4.09Å; D293-M297 WeakPolarHBondContact O-CB 3.48Å; D293-M297 PolarHBondContact O-N 3.29Å; W294-M297 HydrophobicContact CE3-CG 4.48Å; K295-M297 VanDerWaalsContact C-N 3.31Å; K295-M297 PolarHBondContact O-N 3.34Å; M297-F299 PolarHBondContact O-N 3.06Å; M297-T300 WeakPolarHBondContact O-CB 3.28Å; M297-T300 PolarHBondContact O-N 3.38Å; M297-L301 HydrophobicContact CG-CD1 4.02Å; M297-L301 HydrophobicContact CG-CG 4.38Å; M297-L301 WeakPolarHBondContact O-CG 3.46Å; M297-L301 PolarHBondContact O-N 3.04Å; M297-L301 HydrophobicContact SD-CD1 4.36Å; M297-L301 HydrophobicContact SD-CG 4.23Å
298Y90.6Very high81.5Confident0 Ų083.1 Ų83.10%041%0.406CS..Hα-helixtrans-55.9-52.7177.6178.7-92.5000111.9A244 W267 L270 C271 H274 F275 W294 K295 L296 T300 L301 Q302 M307A244-Y298 HydrophobicContact CB-CD1 4.03Å; A244-Y298 HydrophobicContact CB-CE1 3.3Å; W267-Y298 HydrophobicContact CE3-CD1 4.25Å; W267-Y298 AromaticContact CE3-CG 3.99Å; W267-Y298 HydrophobicContact CE3-CG 3.99Å; W267-Y298 AromaticContact CZ3-CD1 3.79Å; W267-Y298 HydrophobicContact CZ3-CD1 3.79Å; W267-Y298 HydrophobicContact CZ3-CE1 4.34Å; W267-Y298 HydrophobicContact CZ3-CG 4.01Å; L270-Y298 HydrophobicContact CB-CD2 4.47Å; L270-Y298 HydrophobicContact CB-CE2 4.5Å; L270-Y298 HydrophobicContact CD2-CD2 3.85Å; L270-Y298 HydrophobicContact CD2-CE1 4.37Å; L270-Y298 HydrophobicContact CD2-CE2 3.53Å; L270-Y298 HydrophobicContact CD2-CG 4.38Å; L270-Y298 HydrophobicContact CG-CD2 3.97Å; L270-Y298 HydrophobicContact CG-CE2 3.57Å; C271-Y298 VanDerWaalsContact SG-CA 3.54Å; C271-Y298 VanDerWaalsContact SG-CB 3.56Å; H274-Y298 AromaticContact CD2-CE2 3.81Å; F275-Y298 AromaticContact CE2-CD2 3.93Å; F275-Y298 HydrophobicContact CE2-CD2 3.93Å; F275-Y298 AromaticContact CE2-CE2 3.99Å; F275-Y298 HydrophobicContact CE2-CE2 3.99Å; F275-Y298 HydrophobicContact CZ-CE2 4.5Å; W294-Y298 WeakPolarHBondContact O-CB 3.5Å; W294-Y298 PolarHBondContact O-N 3.44Å; K295-Y298 WeakPolarHBondContact O-CB 3.4Å; K295-Y298 PolarHBondContact O-N 2.96Å; L296-Y298 VanDerWaalsContact C-N 3.33Å; L296-Y298 PolarHBondContact O-N 2.88Å; Y298-T300 VanDerWaalsContact C-N 3.27Å; Y298-T300 PolarHBondContact O-N 3.27Å; Y298-L301 PolarHBondContact O-N 3.42Å; Y298-Q302 WeakPolarHBondContact O-CB 3.36Å; Y298-Q302 PolarHBondContact O-N 2.89Å; Y298-M307 HydrophobicContact CE1-CE 4.19Å; Y298-M307 WeakPolarHBondContact OH-CE 3.43Å
299F91.6Very high82.9Confident66 Ų6676.6 Ų76.629%0.28939%0.385SS..Hα-helixtrans-66.9-29.7179.8-73.5-66.4000112.9A244 I248 W267 K295 L296 M297 Q302 K303A244-F299 HydrophobicContact CB-CZ 4.3Å; I248-F299 HydrophobicContact CD1-CE2 4.24Å; I248-F299 HydrophobicContact CD1-CZ 3.67Å; W267-F299 HydrophobicContact CH2-CE2 4.15Å; W267-F299 HydrophobicContact CH2-CZ 4.31Å; W267-F299 HydrophobicContact CZ3-CE2 4.18Å; W267-F299 HydrophobicContact CZ3-CZ 4.42Å; K295-F299 HydrophobicContact CG-CD2 4.38Å; K295-F299 HydrophobicContact CG-CE2 4.09Å; K295-F299 VanDerWaalsContact O-CD2 3.24Å; K295-F299 WeakPolarHBondContact O-CD2 3.28Å; K295-F299 PolarHBondContact O-N 3.32Å; L296-F299 PolarHBondContact O-N 3.47Å; M297-F299 PolarHBondContact O-N 3.06Å; F299-Q302 VanDerWaalsContact CD1-OE1 3.26Å; F299-K303 WeakPolarHBondContact O-CG 3.49Å; F299-K303 PolarHBondContact O-N 2.95Å
300T89.5Confident84Confident58 Ų5877.4 Ų77.436%0.35638%0.384SS..Hα-helixtrans-66.7-48.4173-56.40000110.5L296 M297 Y298 Q302 K303 H304L296-T300 WeakPolarHBondContact O-CB 3.43Å; L296-T300 PolarHBondContact O-N 2.94Å; L296-T300 PolarHBondContact O-OG1 3.29Å; M297-T300 WeakPolarHBondContact O-CB 3.28Å; M297-T300 PolarHBondContact O-N 3.38Å; Y298-T300 VanDerWaalsContact C-N 3.27Å; Y298-T300 PolarHBondContact O-N 3.27Å; T300-Q302 PolarHBondContact O-N 2.7Å; T300-K303 PolarHBondContact O-N 3.47Å; T300-H304 PolarHBondContact O-CD2 3.17Å
301L87.4Confident85.2Confident9 Ų973.4 Ų73.45%0.04736%0.359CS..Hα-helixtrans-63.9-39.6178-69.8173.2000112.4F275 F280 M297 Y298 K303 H304 Y305F275-L301 HydrophobicContact CB-CD1 4.4Å; F275-L301 HydrophobicContact CD1-CB 4.4Å; F275-L301 HydrophobicContact CD2-CB 3.83Å; F275-L301 HydrophobicContact CD2-CD1 3.62Å; F275-L301 HydrophobicContact CD2-CG 4.37Å; F275-L301 HydrophobicContact CE1-CB 4.2Å; F275-L301 HydrophobicContact CE2-CB 3.61Å; F275-L301 HydrophobicContact CE2-CD1 4.14Å; F275-L301 HydrophobicContact CG-CB 4.24Å; F275-L301 HydrophobicContact CG-CD1 4.13Å; F275-L301 HydrophobicContact CZ-CB 3.81Å; F280-L301 HydrophobicContact CD1-CD2 3.71Å; F280-L301 HydrophobicContact CE1-CD2 3.79Å; M297-L301 HydrophobicContact CG-CD1 4.02Å; M297-L301 HydrophobicContact CG-CG 4.38Å; M297-L301 WeakPolarHBondContact O-CG 3.46Å; M297-L301 PolarHBondContact O-N 3.04Å; M297-L301 HydrophobicContact SD-CD1 4.36Å; M297-L301 HydrophobicContact SD-CG 4.23Å; Y298-L301 PolarHBondContact O-N 3.42Å; L301-K303 PolarHBondContact O-N 3.34Å; L301-H304 PolarHBondContact O-N 3.44Å; L301-Y305 HydrophobicContact CD2-CD2 3.95Å; L301-Y305 HydrophobicContact CD2-CE2 3.93Å; L301-Y305 PolarHBondContact O-N 3Å
302Q89.3Confident85.9Confident81 Ų8167.3 Ų67.338%0.37933%0.334SS..Hα-helixtrans-56.8-32.5177.1178.1178.99.400112.9Y298 F299 T300 M307Y298-Q302 WeakPolarHBondContact O-CB 3.36Å; Y298-Q302 PolarHBondContact O-N 2.89Å; F299-Q302 VanDerWaalsContact CD1-OE1 3.26Å; T300-Q302 PolarHBondContact O-N 2.7Å; Q302-M307 HydrophobicContact CB-CE 4.22Å; Q302-M307 HydrophobicContact CG-CE 3.44Å; Q302-M307 VanDerWaalsContact CG-CE 3.44Å
303K88.1Confident86.2Confident174 Ų17466.9 Ų66.976%0.75733%0.331SS*.Hα-helixtrans-72-29.5177.9-69.8174.6-175-178.90113F299 T300 L301F299-K303 WeakPolarHBondContact O-CG 3.49Å; F299-K303 PolarHBondContact O-N 2.95Å; T300-K303 PolarHBondContact O-N 3.47Å; L301-K303 PolarHBondContact O-N 3.34Å
304H83.8Confident86.4Confident138 Ų13863.3 Ų63.364%0.63931%0.312SS*.Hα-helixtrans-102.9-25.1-172.8-65.4-65000113.6T300 L301T300-H304 PolarHBondContact O-CD2 3.17Å; L301-H304 PolarHBondContact O-N 3.44Å
305Y83.5Confident86.5Confident73 Ų7362.6 Ų62.629%0.28631%0.31SS..SBendtrans-128.7136.5-175.2-59.2-76.3000111.2K278 L301K278-Y305 HydrophobicContact CD-CD1 4.16Å; K278-Y305 HydrophobicContact CG-CD1 4.25Å; K278-Y305 HydrophobicContact CG-CG 4.43Å; L301-Y305 HydrophobicContact CD2-CD2 3.95Å; L301-Y305 HydrophobicContact CD2-CE2 3.93Å; L301-Y305 PolarHBondContact O-N 3Å
306P81.8Confident86.4Confident96 Ų9661.2 Ų61.262%0.62330%0.304SS*.  trans-64.1140.2172.627.9-33.9000109.8
307M82.9Confident86.4Confident58 Ų5856.9 Ų56.929%0.28628%0.281SS..  trans-65.5151.1174.7-68.7-167.9-169.500111.4Y298 Q302 E309Y298-M307 HydrophobicContact CE1-CE 4.19Å; Y298-M307 WeakPolarHBondContact OH-CE 3.43Å; Q302-M307 HydrophobicContact CB-CE 4.22Å; Q302-M307 HydrophobicContact CG-CE 3.44Å; Q302-M307 VanDerWaalsContact CG-CE 3.44Å; M307-E309 PolarHBondContact O-N 3.36Å
308K83.1Confident86.4Confident82 Ų8254.9 Ų54.936%0.35727%0.271SS..  trans-63.1114.5168.5-169169.7-167.9151.60110.4F273 D277 Q310F273-K308 VanDerWaalsContact O-CD 3.29Å; F273-K308 WeakPolarHBondContact O-CD 3.43Å; D277-K308 IonicContact OD2-NZ 2.67Å; D277-K308 PolarHBondContact OD2-NZ 3.31Å; K308-Q310 HydrophobicContact CG-CG 4.38Å
309E80.3Confident86.2Confident87 Ų8760.4 Ų60.441%0.40730%0.295SS..  trans-78.8131.4172.7-62.8-175.8153.400110.1M307 Y311M307-E309 PolarHBondContact O-N 3.36Å; E309-Y311 HydrophobicContact CB-CE2 3.84Å; E309-Y311 PolarHBondContact OE2-OH 2.93Å
310Q78.8Confident85.8Confident66 Ų6661.9 Ų61.931%0.30830%0.303SS..  trans-137.9132.9173.3-68.9179.312.700109.5F273 K308F273-Q310 HydrophobicContact CZ-CG 4.46Å; K308-Q310 HydrophobicContact CG-CG 4.38Å
311Y86.1Confident85.5Confident48 Ų4860.4 Ų60.419%0.18829%0.294CS..  trans-124.9152.5179.5-54.1-75.5000109.2N121 Y122 K125 E309 T314 P356N121-Y311 HydrophobicContact CB-CD1 4.19Å; Y122-Y311 VanDerWaalsContact CA-CD1 3.43Å; Y122-Y311 HydrophobicContact CD2-CD1 4.4Å; Y122-Y311 AromaticContact CD2-CD2 3.74Å; Y122-Y311 HydrophobicContact CD2-CD2 3.74Å; Y122-Y311 HydrophobicContact CD2-CE2 4.12Å; Y122-Y311 AromaticContact CD2-CG 3.9Å; Y122-Y311 HydrophobicContact CD2-CG 3.9Å; Y122-Y311 HydrophobicContact CG-CG 4.38Å; K125-Y311 HydrophobicContact CB-CE1 4.1Å; K125-Y311 VanDerWaalsContact CG-OH 3.3Å; K125-Y311 WeakPolarHBondContact CG-OH 3Å; E309-Y311 HydrophobicContact CB-CE2 3.84Å; E309-Y311 PolarHBondContact OE2-OH 2.93Å; Y311-T314 HydrophobicContact CD2-CG2 4.03Å; Y311-T314 HydrophobicContact CG-CG2 4.33Å; Y311-P356 HydrophobicContact CE1-CG 4.44Å; Y311-P356 HydrophobicContact CE2-CG 3.78Å
312G81.2Confident85.4Confident33 Ų3360.6 Ų60.634%0.3430%0.296SS..SBendtrans-64.8-4717900000111.6R118R118-G312 WeakPolarHBondContact O-CA 3.3Å; R118-G312 PolarHBondContact O-N 3.49Å
313D86.3Confident85.3Confident22 Ų2256.9 Ų56.912%0.11828%0.279CS..SBendtrans-138.8150.1171-81.9-33.4000110R118 R119R118-D313 HydrophobicContact CB-CB 4.11Å; R118-D313 WeakPolarHBondContact CD-OD2 3.4Å; R118-D313 PolarHBondContact O-N 3.18Å; R119-D313 HydrophobicContact CG-CB 3.75Å
314T89.9Confident85.3Confident20 Ų2048.6 Ų48.612%0.12324%0.243CC..  trans-130.8165.7-178.566.30000111.9Y122 Y311 H316 P353 I354Y122-T314 HydrophobicContact CD2-CG2 3.77Å; Y122-T314 HydrophobicContact CE2-CG2 4.07Å; Y311-T314 HydrophobicContact CD2-CG2 4.03Å; Y311-T314 HydrophobicContact CG-CG2 4.33Å; T314-H316 PolarHBondContact O-CE1 2.85Å; T314-H316 PolarHBondContact O-ND1 2.66Å; T314-P353 WeakPolarHBondContact OG1-CB 3.37Å; T314-I354 WeakPolarHBondContact CB-O 3.43Å
315L91.2Very high85.6Confident0 Ų042.1 Ų42.10%021%0.213CC..EExtended strand (participates in β ladder)trans-62.1147.8161.9-76.3170000110.1L108 F110 Y122 L324 F325 W326 I354 F359L108-L315 HydrophobicContact CD1-CD1 4.13Å; L108-L315 HydrophobicContact CD1-CD2 4.37Å; F110-L315 HydrophobicContact CE1-CD1 4.29Å; F110-L315 HydrophobicContact CZ-CD1 4.23Å; Y122-L315 HydrophobicContact CE1-CB 4.48Å; Y122-L315 HydrophobicContact CE1-CD1 4.04Å; Y122-L315 HydrophobicContact CE1-CG 4.11Å; L315-L324 HydrophobicContact CB-CD1 3.9Å; L315-L324 HydrophobicContact CD1-CD1 4.49Å; L315-F325 WeakPolarHBondContact CD2-O 3.49Å; L315-W326 HydrophobicContact CD1-CH2 4.38Å; L315-W326 HydrophobicContact CD1-CZ2 4.35Å; L315-W326 HydrophobicContact CD2-CD2 3.45Å; L315-W326 VanDerWaalsContact CD2-CD2 3.45Å; L315-W326 HydrophobicContact CD2-CE3 3.75Å; L315-W326 HydrophobicContact CD2-CG 3.86Å; L315-W326 HydrophobicContact CD2-CH2 4.23Å; L315-W326 HydrophobicContact CD2-CZ2 3.96Å; L315-W326 HydrophobicContact CD2-CZ3 4.13Å; L315-W326 HydrophobicContact CG-CD2 4.07Å; L315-W326 HydrophobicContact CG-CE3 3.9Å; L315-W326 HydrophobicContact CG-CH2 3.83Å; L315-W326 HydrophobicContact CG-CZ2 3.98Å; L315-W326 HydrophobicContact CG-CZ3 3.79Å; L315-I354 PolarHBondContact O-N 2.71Å; L315-F359 HydrophobicContact CD1-CD2 3.46Å; L315-F359 VanDerWaalsContact CD1-CD2 3.46Å; L315-F359 HydrophobicContact CD1-CE2 3.59Å; L315-F359 HydrophobicContact CD1-CG 4.43Å
316H90.4Very high85.7Confident24 Ų2439.8 Ų39.811%0.11120%0.204CC..EExtended strand (participates in β ladder)trans-122.8138.5177.8-73.263.2000109.7T314 L324 F325 K327 M352T314-H316 PolarHBondContact O-CE1 2.85Å; T314-H316 PolarHBondContact O-ND1 2.66Å; H316-L324 WeakPolarHBondContact O-CA 3.48Å; H316-L324 WeakPolarHBondContact O-CD1 3.35Å; H316-F325 HydrophobicContact CB-CE1 4.24Å; H316-F325 HydrophobicContact CB-CZ 4.15Å; H316-F325 PolarHBondContact N-O 3.21Å; H316-F325 PolarHBondContact O-N 3.42Å; H316-K327 HydrophobicContact CB-CB 4.49Å; H316-K327 WeakPolarHBondContact ND1-CB 3.37Å; H316-M352 WeakPolarHBondContact CA-O 3.5Å
317F89.6Confident85.6Confident17 Ų1737.8 Ų37.88%0.07519%0.185CC..EExtended strand (participates in β ladder)trans-112.5128.3172.5173-104.6000110.6V87 K319 T323 L324 M352 I354V87-F317 HydrophobicContact CB-CD2 4.39Å; V87-F317 HydrophobicContact CB-CE2 3.9Å; V87-F317 HydrophobicContact CG1-CE2 4.4Å; F317-K319 HydrophobicContact CD1-CG 4.2Å; F317-K319 HydrophobicContact CE1-CG 4.14Å; F317-T323 WeakPolarHBondContact CA-O 3.39Å; F317-L324 HydrophobicContact CB-CD1 4.26Å; F317-M352 PolarHBondContact N-O 2.87Å; F317-M352 PolarHBondContact O-N 3.36Å; F317-I354 HydrophobicContact CB-CD1 3.17Å; F317-I354 HydrophobicContact CB-CG1 4.05Å; F317-I354 HydrophobicContact CG-CD1 4.24Å
318C88.7Confident84.9Confident0 Ų038.2 Ų38.20%019%0.189CC..EExtended strand (participates in β ladder)trans-88.4116.6173.5-174.60000109.3H320 C321 S322 T323 H340 L351C318-H320 PolarHBondContact O-N 3.26Å; C318-C321 VanDerWaalsContact CB-SG 3.54Å; C318-C321 PolarHBondContact SG-SG 2.93Å; C318-S322 WeakPolarHBondContact O-CA 3.5Å; C318-S322 PolarHBondContact O-N 2.96Å; C318-T323 PolarHBondContact N-O 2.82Å; C318-H340 VanDerWaalsContact CB-NE2 3.35Å; C318-H340 WeakPolarHBondContact CB-NE2 3.49Å; C318-H340 PolarHBondContact SG-NE2 3.01Å; C318-H340 VanDerWaalsContact SG-NE2 3.39Å; C318-L351 HydrophobicContact CB-CD2 3.85Å
319K86.4Confident83.8Confident117 Ų11740.2 Ų40.251%0.50919%0.194SC..THydrogen-bonded Turntrans-68.4-20.4179.2-65.3179.5-177174.20113.3F317 C350F317-K319 HydrophobicContact CD1-CG 4.2Å; F317-K319 HydrophobicContact CE1-CG 4.14Å; K319-C350 PolarHBondContact N-O 3.4Å
320H84Confident82.6Confident97 Ų9739.9 Ų39.945%0.44919%0.192SC..THydrogen-bonded Turntrans-79.1-59.2-177.3-177.9-94.5000111.8C318 T343 C350C318-H320 PolarHBondContact O-N 3.26Å; H320-T343 PolarHBondContact CE1-OG1 3.3Å; H320-C350 HydrophobicContact CB-CB 4.09Å
321C82.8Confident81.3Confident26 Ų2639 Ų3918%0.17619%0.192CC..THydrogen-bonded Turntrans-95.33.4-179.955.40000113.7Y86 C318 T323 H340Y86-C321 WeakPolarHBondContact CD2-O 3.44Å; Y86-C321 WeakPolarHBondContact CE2-O 3.36Å; C318-C321 VanDerWaalsContact CB-SG 3.54Å; C318-C321 PolarHBondContact SG-SG 2.93Å; C321-T323 VanDerWaalsContact C-N 3.27Å; C321-T323 HydrophobicContact CB-CG2 4.29Å; C321-T323 PolarHBondContact O-N 3.31Å; C321-T323 PolarHBondContact SG-OG1 2.99Å; C321-H340 PolarHBondContact SG-CD2 3.17Å
322S85.9Confident79.7Confident13 Ų1338.4 Ų38.49%0.09120%0.197CC..THydrogen-bonded Turntrans53.341.5-179.9-47.50000113.4V87 C318V87-S322 PolarHBondContact N-O 2.79Å; V87-S322 WeakPolarHBondContact O-CB 3.18Å; C318-S322 WeakPolarHBondContact O-CA 3.5Å; C318-S322 PolarHBondContact O-N 2.96Å
323T86.6Confident78.2Confident4 Ų443.5 Ų43.53%0.02522%0.215CC..EExtended strand (participates in β ladder)trans-108.4144.5179.755.60000111.7W84 I85 Y86 F317 C318 C321 H340W84-T323 HydrophobicContact CE3-CG2 3.77Å; W84-T323 HydrophobicContact CZ3-CG2 4.22Å; I85-T323 CarbonylContact O-C 3.57Å; I85-T323 WeakPolarHBondContact O-CA 3.42Å; Y86-T323 HydrophobicContact CD2-CG2 4.4Å; F317-T323 WeakPolarHBondContact CA-O 3.39Å; C318-T323 PolarHBondContact N-O 2.82Å; C321-T323 VanDerWaalsContact C-N 3.27Å; C321-T323 HydrophobicContact CB-CG2 4.29Å; C321-T323 PolarHBondContact O-N 3.31Å; C321-T323 PolarHBondContact SG-OG1 2.99Å; T323-H340 PolarHBondContact OG1-CD2 3.44Å
324L89.2Confident76.3Confident0 Ų051.1 Ų51.10%025%0.248CC..EExtended strand (participates in β ladder)trans-114.6129.3177.3-179.266.2000110.1W84 I85 V87 L108 L315 H316 F317 I354 F359 F363W84-L324 CarbonylContact C-O 3.6Å; W84-L324 VanDerWaalsContact CA-O 3.32Å; W84-L324 WeakPolarHBondContact CA-O 3.33Å; I85-L324 HydrophobicContact CD1-CB 4.49Å; I85-L324 HydrophobicContact CD1-CD2 4.12Å; I85-L324 HydrophobicContact CG1-CB 3.82Å; I85-L324 HydrophobicContact CG1-CD2 4.33Å; I85-L324 HydrophobicContact CG1-CG 4.44Å; I85-L324 PolarHBondContact N-O 3.1Å; I85-L324 PolarHBondContact O-N 3.37Å; V87-L324 HydrophobicContact CG2-CB 3.6Å; V87-L324 HydrophobicContact CG2-CD2 4.1Å; L108-L324 HydrophobicContact CD1-CD2 3.99Å; L108-L324 HydrophobicContact CD1-CG 4.34Å; L315-L324 HydrophobicContact CB-CD1 3.9Å; L315-L324 HydrophobicContact CD1-CD1 4.49Å; H316-L324 WeakPolarHBondContact O-CA 3.48Å; H316-L324 WeakPolarHBondContact O-CD1 3.35Å; F317-L324 HydrophobicContact CB-CD1 4.26Å; L324-I354 HydrophobicContact CD1-CD1 3.29Å; L324-F359 HydrophobicContact CD2-CD2 3.67Å; L324-F359 HydrophobicContact CD2-CE2 3.51Å; L324-F363 HydrophobicContact CD2-CZ 4.18Å
325F88.3Confident74.5Confident1 Ų155.9 Ų55.90%0.00427%0.271CS..EExtended strand (participates in β ladder)trans-157.4164.7-174.365.9-79.3000112.6K83 W84 L315 H316 K327 F338 H340 L351K83-F325 WeakPolarHBondContact O-CB 3.33Å; W84-F325 HydrophobicContact CB-CB 3.7Å; L315-F325 WeakPolarHBondContact CD2-O 3.49Å; H316-F325 HydrophobicContact CB-CE1 4.24Å; H316-F325 HydrophobicContact CB-CZ 4.15Å; H316-F325 PolarHBondContact N-O 3.21Å; H316-F325 PolarHBondContact O-N 3.42Å; F325-K327 HydrophobicContact CE2-CB 4.26Å; F325-F338 WeakPolarHBondContact CE2-O 3.46Å; F325-F338 WeakPolarHBondContact CZ-O 3.3Å; F325-H340 HydrophobicContact CD1-CB 4.07Å; F325-H340 AromaticContact CD1-CG 3.94Å; F325-H340 AromaticContact CD1-ND1 3.93Å; F325-H340 HydrophobicContact CE1-CB 4.28Å; F325-H340 AromaticContact CE1-CE1 3.54Å; F325-H340 AromaticContact CE1-CG 3.65Å; F325-H340 AromaticContact CE1-ND1 3.25Å; F325-H340 VanDerWaalsContact CE1-ND1 3.25Å; F325-H340 WeakPolarHBondContact CE1-ND1 3.33Å; F325-H340 AromaticContact CE2-ND1 3.85Å; F325-H340 HydrophobicContact CG-CB 4.36Å; F325-H340 AromaticContact CZ-CE1 3.55Å; F325-H340 AromaticContact CZ-ND1 3.21Å; F325-H340 WeakPolarHBondContact CZ-ND1 3.41Å; F325-L351 HydrophobicContact CE1-CD2 3.68Å; F325-L351 HydrophobicContact CZ-CD1 4.31Å; F325-L351 HydrophobicContact CZ-CD2 3.59Å
326W86.8Confident72.7Confident24 Ų2464.2 Ų64.29%0.09131%0.308CS..EExtended strand (participates in β ladder)trans-81.5116.3169.2-66.9111.7000109.8D109 F110 A113 R119 Y122 V123 L315 D328D109-W326 PolarHBondContact O-NE1 2.94Å; F110-W326 HydrophobicContact CD1-CH2 4.39Å; F110-W326 AromaticContact CD1-CZ2 3.63Å; F110-W326 HydrophobicContact CD1-CZ2 3.63Å; F110-W326 HydrophobicContact CE1-CH2 4.23Å; F110-W326 AromaticContact CE1-CZ2 3.62Å; F110-W326 HydrophobicContact CE1-CZ2 3.62Å; A113-W326 HydrophobicContact CB-CD2 4.3Å; A113-W326 HydrophobicContact CB-CH2 4.07Å; A113-W326 HydrophobicContact CB-CZ2 3.58Å; R119-W326 HydrophobicContact CB-CZ3 4.33Å; R119-W326 HydrophobicContact CG-CE3 4.26Å; R119-W326 HydrophobicContact CG-CZ3 4.17Å; Y122-W326 AromaticContact CD1-CH2 3.61Å; Y122-W326 HydrophobicContact CD1-CH2 3.61Å; Y122-W326 AromaticContact CD1-CZ3 3.93Å; Y122-W326 HydrophobicContact CD1-CZ3 3.93Å; Y122-W326 AromaticContact CE1-CH2 3.78Å; Y122-W326 HydrophobicContact CE1-CH2 3.78Å; Y122-W326 HydrophobicContact CE1-CZ3 4.15Å; V123-W326 HydrophobicContact CG2-CH2 3.74Å; V123-W326 HydrophobicContact CG2-CZ2 4.08Å; L315-W326 HydrophobicContact CD1-CH2 4.38Å; L315-W326 HydrophobicContact CD1-CZ2 4.35Å; L315-W326 HydrophobicContact CD2-CD2 3.45Å; L315-W326 VanDerWaalsContact CD2-CD2 3.45Å; L315-W326 HydrophobicContact CD2-CE3 3.75Å; L315-W326 HydrophobicContact CD2-CG 3.86Å; L315-W326 HydrophobicContact CD2-CH2 4.23Å; L315-W326 HydrophobicContact CD2-CZ2 3.96Å; L315-W326 HydrophobicContact CD2-CZ3 4.13Å; L315-W326 HydrophobicContact CG-CD2 4.07Å; L315-W326 HydrophobicContact CG-CE3 3.9Å; L315-W326 HydrophobicContact CG-CH2 3.83Å; L315-W326 HydrophobicContact CG-CZ2 3.98Å; L315-W326 HydrophobicContact CG-CZ3 3.79Å; W326-D328 PolarHBondContact O-N 2.83Å; W326-D328 VanDerWaalsContact O-N 3.09Å
327K78.4Confident71.2Confident54 Ų5467.9 Ų67.924%0.23533%0.328CS..  trans-68.4112173.3-172.7165.3-177.1160.70108.4R119 H316 F325 R329 D348 L351R119-K327 PolarHBondContact NH2-O 3.12Å; H316-K327 HydrophobicContact CB-CB 4.49Å; H316-K327 WeakPolarHBondContact ND1-CB 3.37Å; F325-K327 HydrophobicContact CE2-CB 4.26Å; K327-R329 PolarHBondContact O-N 2.88Å; K327-D348 IonicContact NZ-OD1 3.51Å; K327-D348 PolarHBondContact NZ-OD1 2.93Å; K327-L351 HydrophobicContact CD-CD1 4.45Å
328D69.9Low69.7Low67 Ų6770.6 Ų70.636%0.35834%0.34SS..  trans-87.9106.1172-164.2-26000109.2W326 H330 V331 A332W326-D328 PolarHBondContact O-N 2.83Å; W326-D328 VanDerWaalsContact O-N 3.09Å; D328-H330 PolarHBondContact O-N 2.69Å; D328-H330 WeakPolarHBondContact OD1-CB 3.36Å; D328-H330 PolarHBondContact OD1-N 3.44Å; D328-V331 HydrophobicContact CB-CB 4.17Å; D328-V331 HydrophobicContact CB-CG2 4.18Å; D328-A332 WeakPolarHBondContact O-CB 3.49Å; D328-A332 PolarHBondContact O-N 3.31Å; D328-A332 VanDerWaalsContact O-N 3.14Å
329R58.8Low68.6Low125 Ų12572 Ų7247%0.47236%0.355SS..Hα-helixtrans-66.9-23-177.9-140.4173.7-175.8-176.52111.9K327 L333K327-R329 PolarHBondContact O-N 2.88Å; R329-L333 WeakPolarHBondContact O-CD1 3.35Å; R329-L333 WeakPolarHBondContact O-CG 3.32Å
330H54.5Low67.9Low79 Ų7967.3 Ų67.337%0.36633%0.334SS..Hα-helixtrans-79.1-46.1179.4-72.6-71.3000111.3D328 L333 F334D328-H330 PolarHBondContact O-N 2.69Å; D328-H330 WeakPolarHBondContact OD1-CB 3.36Å; D328-H330 PolarHBondContact OD1-N 3.44Å; H330-L333 PolarHBondContact O-N 3.15Å; H330-F334 WeakPolarHBondContact O-CD2 3.13Å; H330-F334 PolarHBondContact O-N 3.47Å
331V52.6Low67.3Low49 Ų4966.5 Ų66.530%0.29734%0.338SS..Hα-helixtrans-67.9-39.7178.8176.60000111.8D328 L333 F334 L335 D337D328-V331 HydrophobicContact CB-CB 4.17Å; D328-V331 HydrophobicContact CB-CG2 4.18Å; V331-L333 VanDerWaalsContact C-N 3.28Å; V331-L333 PolarHBondContact O-N 2.96Å; V331-F334 PolarHBondContact O-N 3.48Å; V331-L335 HydrophobicContact CG1-CB 4.33Å; V331-L335 HydrophobicContact CG1-CD1 4.17Å; V331-L335 PolarHBondContact O-N 2.89Å; V331-D337 HydrophobicContact CG1-CB 3.8Å
332A51.7Low67.1Low35 Ų3566.5 Ų66.529%0.28934%0.338SS..Hα-helixtrans-62.2-32.9-179.900000113.3D328D328-A332 WeakPolarHBondContact O-CB 3.49Å; D328-A332 PolarHBondContact O-N 3.31Å; D328-A332 VanDerWaalsContact O-N 3.14Å
333L50Low66.7Low140 Ų14071.7 Ų71.773%0.73337%0.369SS*.Hα-helixtrans-79.6-28.6-179.9-75.6170.3000113.3R329 H330 V331R329-L333 WeakPolarHBondContact O-CD1 3.35Å; R329-L333 WeakPolarHBondContact O-CG 3.32Å; H330-L333 PolarHBondContact O-N 3.15Å; V331-L333 VanDerWaalsContact C-N 3.28Å; V331-L333 PolarHBondContact O-N 2.96Å
334F47.4Very low66.2Low182 Ų18272.8 Ų72.880%0.79838%0.377SS*.Hα-helixtrans-100.7-34.8-175-79.8-79.5000114H330 V331H330-F334 WeakPolarHBondContact O-CD2 3.13Å; H330-F334 PolarHBondContact O-N 3.47Å; V331-F334 PolarHBondContact O-N 3.48Å
335L50.9Low65.3Low119 Ų11981.1 Ų81.162%0.62342%0.422SS*.Hα-helixtrans-114.6-3.9-169.4-68.6170.3000114.5V331 D337V331-L335 HydrophobicContact CG1-CB 4.33Å; V331-L335 HydrophobicContact CG1-CD1 4.17Å; V331-L335 PolarHBondContact O-N 2.89Å; L335-D337 HydrophobicContact CB-CB 4.23Å; L335-D337 PolarHBondContact O-N 3.34Å
336K53.8Low64.7Low176 Ų17685.1 Ų85.177%0.76544%0.443SS*.  trans5119.5-167.3-70.6-178.6176.4178.90113.3F338K336-F338 VanDerWaalsContact O-CD2 3.29Å; K336-F338 WeakPolarHBondContact O-CD2 3.41Å; K336-F338 WeakPolarHBondContact O-CE2 3.16Å; K336-F338 PolarHBondContact O-N 2.87Å
337D58.8Low64Low100 Ų10084.5 Ų84.554%0.53544%0.442SS..  trans-82.4111171.8-90.5-25.7000108.3V331 L335 G339V331-D337 HydrophobicContact CG1-CB 3.8Å; L335-D337 HydrophobicContact CB-CB 4.23Å; L335-D337 PolarHBondContact O-N 3.34Å; D337-G339 PolarHBondContact O-N 2.96Å; D337-G339 VanDerWaalsContact O-N 3.07Å
338F58.3Low63.9Low75 Ų7585.8 Ų85.833%0.32945%0.451SS..  trans-74.79.1-179.1-62.8-84.5000113.4F325 K336 H340 P347F325-F338 WeakPolarHBondContact CE2-O 3.46Å; F325-F338 WeakPolarHBondContact CZ-O 3.3Å; K336-F338 VanDerWaalsContact O-CD2 3.29Å; K336-F338 WeakPolarHBondContact O-CD2 3.41Å; K336-F338 WeakPolarHBondContact O-CE2 3.16Å; K336-F338 PolarHBondContact O-N 2.87Å; F338-H340 PolarHBondContact O-N 3.31Å; F338-H340 PolarHBondContact O-ND1 3.06Å; F338-P347 HydrophobicContact CD1-CB 3.82Å; F338-P347 HydrophobicContact CD1-CG 4.21Å; F338-P347 HydrophobicContact CD2-CB 4.27Å; F338-P347 HydrophobicContact CD2-CG 3.93Å; F338-P347 HydrophobicContact CE1-CB 4.02Å; F338-P347 HydrophobicContact CE1-CG 4.08Å; F338-P347 HydrophobicContact CE2-CB 4.46Å; F338-P347 HydrophobicContact CE2-CG 3.81Å; F338-P347 HydrophobicContact CG-CB 3.95Å; F338-P347 HydrophobicContact CG-CG 4.13Å; F338-P347 HydrophobicContact CZ-CB 4.34Å; F338-P347 HydrophobicContact CZ-CG 3.88Å
339G65.5Low64.4Low30 Ų3086.5 Ų86.531%0.30946%0.462SS..SBendtrans75.70.6179.400000115.2D337D337-G339 PolarHBondContact O-N 2.96Å; D337-G339 VanDerWaalsContact O-N 3.07Å
340H71.3Confident65.5Low17 Ų1781.7 Ų81.78%0.07945%0.447CS..SBendtrans-158.6154.7-179.469.1-66.5000111.3W84 C318 C321 T323 F325 F338 C342W84-H340 HydrophobicContact CB-CB 4.03Å; W84-H340 HydrophobicContact CG-CB 4.01Å; C318-H340 VanDerWaalsContact CB-NE2 3.35Å; C318-H340 WeakPolarHBondContact CB-NE2 3.49Å; C318-H340 PolarHBondContact SG-NE2 3.01Å; C318-H340 VanDerWaalsContact SG-NE2 3.39Å; C321-H340 PolarHBondContact SG-CD2 3.17Å; T323-H340 PolarHBondContact OG1-CD2 3.44Å; F325-H340 HydrophobicContact CD1-CB 4.07Å; F325-H340 AromaticContact CD1-CG 3.94Å; F325-H340 AromaticContact CD1-ND1 3.93Å; F325-H340 HydrophobicContact CE1-CB 4.28Å; F325-H340 AromaticContact CE1-CE1 3.54Å; F325-H340 AromaticContact CE1-CG 3.65Å; F325-H340 AromaticContact CE1-ND1 3.25Å; F325-H340 VanDerWaalsContact CE1-ND1 3.25Å; F325-H340 WeakPolarHBondContact CE1-ND1 3.33Å; F325-H340 AromaticContact CE2-ND1 3.85Å; F325-H340 HydrophobicContact CG-CB 4.36Å; F325-H340 AromaticContact CZ-CE1 3.55Å; F325-H340 AromaticContact CZ-ND1 3.21Å; F325-H340 WeakPolarHBondContact CZ-ND1 3.41Å; F338-H340 PolarHBondContact O-N 3.31Å; F338-H340 PolarHBondContact O-ND1 3.06Å; H340-C342 VanDerWaalsContact C-N 3.31Å; H340-C342 VanDerWaalsContact NE2-CB 3.31Å; H340-C342 WeakPolarHBondContact NE2-CB 3.42Å; H340-C342 PolarHBondContact O-N 3.35Å
341P72.6Confident67Low81 Ų8179.2 Ų79.253%0.52644%0.436SS..  trans-80.474-17633.3-36.7000111.2W84W84-P341 HydrophobicContact CD2-CG 4.39Å; W84-P341 HydrophobicContact CH2-CG 3.99Å; W84-P341 HydrophobicContact CZ2-CG 3.51Å; W84-P341 VanDerWaalsContact NE1-CD 3.33Å
342C78.1Confident68.7Low26 Ų2679.5 Ų79.518%0.17644%0.435CS..  trans-93.2135174.7-164.90000111.4H340 S344H340-C342 VanDerWaalsContact C-N 3.31Å; H340-C342 VanDerWaalsContact NE2-CB 3.31Å; H340-C342 WeakPolarHBondContact NE2-CB 3.42Å; H340-C342 PolarHBondContact O-N 3.35Å; C342-S344 VanDerWaalsContact SG-CB 3.6Å
343T77.4Confident70.6Confident122 Ų12281.5 Ų81.575%0.74845%0.445SS*.  trans-97.39175.753.30000113.5H320H320-T343 PolarHBondContact CE1-OG1 3.3Å
344S75.6Confident72.5Confident26 Ų2675 Ų7518%0.18241%0.411CS..  trans-69140.6177.7-179.30000111.3C342 D346 P347C342-S344 VanDerWaalsContact SG-CB 3.6Å; S344-D346 PolarHBondContact O-N 3.41Å; S344-D346 PolarHBondContact OG-N 2.92Å; S344-D346 PolarHBondContact OG-O 3Å; S344-D346 VanDerWaalsContact OG-O 3.14Å; S344-P347 WeakPolarHBondContact O-CD 3.29Å; S344-P347 WeakPolarHBondContact O-CG 3.44Å
345N69.7Low74.7Confident176 Ų17668.5 Ų68.594%0.94139%0.388SS*.SBendtrans-64.5-28.1174.2-67.4-20000112.6
346D77.3Confident76.7Confident85 Ų8562.8 Ų62.846%0.45536%0.358SS..SBendtrans-131.990.7170.6-178.80.1000109.6S344 D348 S349S344-D346 PolarHBondContact O-N 3.41Å; S344-D346 PolarHBondContact OG-N 2.92Å; S344-D346 PolarHBondContact OG-O 3Å; S344-D346 VanDerWaalsContact OG-O 3.14Å; D346-D348 VanDerWaalsContact C-N 3.35Å; D346-D348 PolarHBondContact O-N 3.45Å; D346-D348 PolarHBondContact OD1-N 3.17Å; D346-S349 PolarHBondContact O-OG 3.43Å; D346-S349 PolarHBondContact OD1-N 3.36Å; D346-S349 WeakPolarHBondContact OD2-CB 3.18Å
347P72.1Confident78.5Confident11 Ų1157.3 Ų57.37%0.07134%0.336CS..THydrogen-bonded Turntrans-64.7-35.7-179-23.735.2000113.2F338 S344 S349 C350 L351F338-P347 HydrophobicContact CD1-CB 3.82Å; F338-P347 HydrophobicContact CD1-CG 4.21Å; F338-P347 HydrophobicContact CD2-CB 4.27Å; F338-P347 HydrophobicContact CD2-CG 3.93Å; F338-P347 HydrophobicContact CE1-CB 4.02Å; F338-P347 HydrophobicContact CE1-CG 4.08Å; F338-P347 HydrophobicContact CE2-CB 4.46Å; F338-P347 HydrophobicContact CE2-CG 3.81Å; F338-P347 HydrophobicContact CG-CB 3.95Å; F338-P347 HydrophobicContact CG-CG 4.13Å; F338-P347 HydrophobicContact CZ-CB 4.34Å; F338-P347 HydrophobicContact CZ-CG 3.88Å; S344-P347 WeakPolarHBondContact O-CD 3.29Å; S344-P347 WeakPolarHBondContact O-CG 3.44Å; P347-S349 VanDerWaalsContact C-N 3.33Å; P347-S349 PolarHBondContact O-N 3.44Å; P347-C350 WeakPolarHBondContact O-CB 3.36Å; P347-C350 PolarHBondContact O-N 3.42Å; P347-L351 WeakPolarHBondContact O-CG 3.24Å; P347-L351 PolarHBondContact O-N 2.92Å
348D75.7Confident80Confident80 Ų8055.8 Ų55.843%0.42833%0.325SS..G310 helixtrans-67.1-34.6-175.5-84.5-48.3000111.8K327 D346 C350 L351K327-D348 IonicContact NZ-OD1 3.51Å; K327-D348 PolarHBondContact NZ-OD1 2.93Å; D346-D348 VanDerWaalsContact C-N 3.35Å; D346-D348 PolarHBondContact O-N 3.45Å; D346-D348 PolarHBondContact OD1-N 3.17Å; D348-C350 PolarHBondContact O-N 3.33Å; D348-L351 PolarHBondContact O-N 3.43Å
349S81.2Confident81.6Confident83 Ų8352.2 Ų52.258%0.5831%0.309SS*.G310 helixtrans-59.7-26.3172.472.40000113.7D346 P347D346-S349 PolarHBondContact O-OG 3.43Å; D346-S349 PolarHBondContact OD1-N 3.36Å; D346-S349 WeakPolarHBondContact OD2-CB 3.18Å; P347-S349 VanDerWaalsContact C-N 3.33Å; P347-S349 PolarHBondContact O-N 3.44Å
350C82.1Confident82.8Confident24 Ų2450.9 Ų50.916%0.16230%0.295CS..G310 helixtrans-91.6-10-176.5-61.90000113K319 H320 P347 D348K319-C350 PolarHBondContact N-O 3.4Å; H320-C350 HydrophobicContact CB-CB 4.09Å; P347-C350 WeakPolarHBondContact O-CB 3.36Å; P347-C350 PolarHBondContact O-N 3.42Å; D348-C350 PolarHBondContact O-N 3.33Å
351L85.9Confident83.7Confident26 Ų2653.1 Ų53.114%0.13631%0.308CS..EExtended strand (participates in β ladder)trans-85.2133.4-175.7-67.4178.6000111.6C318 F325 K327 P347 D348C318-L351 HydrophobicContact CB-CD2 3.85Å; F325-L351 HydrophobicContact CE1-CD2 3.68Å; F325-L351 HydrophobicContact CZ-CD1 4.31Å; F325-L351 HydrophobicContact CZ-CD2 3.59Å; K327-L351 HydrophobicContact CD-CD1 4.45Å; P347-L351 WeakPolarHBondContact O-CG 3.24Å; P347-L351 PolarHBondContact O-N 2.92Å; D348-L351 PolarHBondContact O-N 3.43Å
352M88.5Confident84.4Confident56 Ų5650.4 Ų50.428%0.27629%0.289SS..EExtended strand (participates in β ladder)trans-124.6124173.8-179176.5152.600109.9H316 F317 H358H316-M352 WeakPolarHBondContact CA-O 3.5Å; F317-M352 PolarHBondContact N-O 2.87Å; F317-M352 PolarHBondContact O-N 3.36Å; M352-H358 WeakPolarHBondContact CE-CE1 3.41Å
353P89.9Confident84.8Confident77 Ų7750.2 Ų50.250%0.529%0.285SS..EExtended strand (participates in β ladder)trans-66.4140.1170.129.3-33.7000109.7T314T314-P353 WeakPolarHBondContact OG1-CB 3.37Å
354I91.6Very high84.8Confident3 Ų349.6 Ų49.62%0.01527%0.272CS..  trans-107.9134.2-177.3-75.2167.7000109.4Y122 T314 L315 F317 L324 H358 F359 L362Y122-I354 WeakPolarHBondContact CE2-O 3.42Å; T314-I354 WeakPolarHBondContact CB-O 3.43Å; L315-I354 PolarHBondContact O-N 2.71Å; F317-I354 HydrophobicContact CB-CD1 3.17Å; F317-I354 HydrophobicContact CB-CG1 4.05Å; F317-I354 HydrophobicContact CG-CD1 4.24Å; L324-I354 HydrophobicContact CD1-CD1 3.29Å; I354-H358 HydrophobicContact CG2-CB 4.09Å; I354-F359 HydrophobicContact CG2-CB 3.68Å; I354-F359 VanDerWaalsContact CG2-N 3.28Å; I354-L362 HydrophobicContact CD1-CD1 3.62Å
355S92.1Very high84.1Confident45 Ų4558 Ų5832%0.31531%0.306SS..  trans-79.9157.3167.3670000110.8Q357 H358 F359S355-Q357 PolarHBondContact O-N 2.93Å; S355-H358 PolarHBondContact O-N 3.33Å; S355-H358 WeakPolarHBondContact OG-CB 3.22Å; S355-H358 PolarHBondContact OG-N 3.06Å; S355-F359 PolarHBondContact O-N 3.2Å
356P93.2Very high84.9Confident0 Ų052.2 Ų52.20%027%0.274CS..Hα-helixtrans-53.7-37.9177.5-30.239000113.9Y122 K125 L126 L129 Y311 F359 I360Y122-P356 HydrophobicContact CD2-CG 3.69Å; Y122-P356 HydrophobicContact CE2-CB 4.49Å; Y122-P356 VanDerWaalsContact CE2-CD 3.46Å; Y122-P356 HydrophobicContact CE2-CG 3.61Å; Y122-P356 HydrophobicContact CG-CG 4.33Å; K125-P356 HydrophobicContact CB-CG 4.26Å; K125-P356 HydrophobicContact CG-CB 4.4Å; K125-P356 HydrophobicContact CG-CG 4.2Å; L126-P356 HydrophobicContact CB-CB 4Å; L126-P356 HydrophobicContact CD1-CB 4.39Å; L129-P356 HydrophobicContact CD1-CB 3.72Å; Y311-P356 HydrophobicContact CE1-CG 4.44Å; Y311-P356 HydrophobicContact CE2-CG 3.78Å; P356-F359 WeakPolarHBondContact O-CB 3.17Å; P356-F359 PolarHBondContact O-N 3.13Å; P356-I360 PolarHBondContact O-N 3.11Å
357Q91.4Very high85.3Confident61 Ų6150.4 Ų50.429%0.28526%0.264SS..Hα-helixtrans-68.3-45.9176.4-173.655.654.200111.8L129 S355 F359 I360 D361L129-Q357 HydrophobicContact CD1-CB 4.14Å; S355-Q357 PolarHBondContact O-N 2.93Å; Q357-F359 VanDerWaalsContact C-N 3.27Å; Q357-F359 PolarHBondContact O-N 2.92Å; Q357-I360 WeakPolarHBondContact O-CB 3.4Å; Q357-I360 PolarHBondContact O-N 3.42Å; Q357-I360 VanDerWaalsContact O-N 3.08Å; Q357-D361 PolarHBondContact NE2-OD1 3.37Å; Q357-D361 PolarHBondContact O-N 2.92Å
358H90.9Very high86Confident68 Ų6852.6 Ų52.632%0.31528%0.275SS..Hα-helixtrans-61.4-38.3177.3-169.5150.2000110.3M352 I354 S355 I360 D361 L362M352-H358 WeakPolarHBondContact CE-CE1 3.41Å; I354-H358 HydrophobicContact CG2-CB 4.09Å; S355-H358 PolarHBondContact O-N 3.33Å; S355-H358 WeakPolarHBondContact OG-CB 3.22Å; S355-H358 PolarHBondContact OG-N 3.06Å; H358-I360 VanDerWaalsContact C-N 3.28Å; H358-I360 PolarHBondContact O-N 3.26Å; H358-D361 CarbonylContact O-C 3.54Å; H358-D361 PolarHBondContact O-N 3.41Å; H358-L362 WeakPolarHBondContact O-CG 3.38Å; H358-L362 PolarHBondContact O-N 3.07Å
359F92.1Very high86.6Confident0 Ų051 Ų510%027%0.266CS..Hα-helixtrans-53.5-45.8173.6172.8-88.6000112L101 A104 L108 F110 L126 L315 L324 I354 S355 P356 Q357 L362 F363L101-F359 HydrophobicContact CD1-CD1 4.05Å; L101-F359 HydrophobicContact CD1-CE1 3.47Å; L101-F359 VanDerWaalsContact CD1-CE1 3.47Å; L101-F359 HydrophobicContact CD1-CZ 4.33Å; A104-F359 HydrophobicContact CB-CE2 4.5Å; A104-F359 HydrophobicContact CB-CZ 4.01Å; L108-F359 HydrophobicContact CD1-CE2 3.78Å; L108-F359 HydrophobicContact CD1-CZ 4.29Å; F110-F359 HydrophobicContact CZ-CE2 4.22Å; F110-F359 AromaticContact CZ-CZ 3.93Å; F110-F359 HydrophobicContact CZ-CZ 3.93Å; L126-F359 HydrophobicContact CD1-CB 4.39Å; L126-F359 HydrophobicContact CD1-CD1 3.42Å; L126-F359 VanDerWaalsContact CD1-CD1 3.42Å; L126-F359 HydrophobicContact CD1-CE1 4.01Å; L126-F359 HydrophobicContact CD1-CG 4.19Å; L126-F359 HydrophobicContact CD2-CD1 3.8Å; L126-F359 HydrophobicContact CD2-CE1 3.85Å; L126-F359 HydrophobicContact CD2-CG 4.26Å; L126-F359 HydrophobicContact CD2-CZ 4.38Å; L126-F359 HydrophobicContact CG-CD1 4.25Å; L126-F359 HydrophobicContact CG-CE1 4.49Å; L315-F359 HydrophobicContact CD1-CD2 3.46Å; L315-F359 VanDerWaalsContact CD1-CD2 3.46Å; L315-F359 HydrophobicContact CD1-CE2 3.59Å; L315-F359 HydrophobicContact CD1-CG 4.43Å; L324-F359 HydrophobicContact CD2-CD2 3.67Å; L324-F359 HydrophobicContact CD2-CE2 3.51Å; I354-F359 HydrophobicContact CG2-CB 3.68Å; I354-F359 VanDerWaalsContact CG2-N 3.28Å; S355-F359 PolarHBondContact O-N 3.2Å; P356-F359 WeakPolarHBondContact O-CB 3.17Å; P356-F359 PolarHBondContact O-N 3.13Å; Q357-F359 VanDerWaalsContact C-N 3.27Å; Q357-F359 PolarHBondContact O-N 2.92Å; F359-L362 PolarHBondContact O-N 3.05Å; F359-F363 HydrophobicContact CD1-CE2 4.44Å; F359-F363 HydrophobicContact CD2-CE2 4.23Å; F359-F363 HydrophobicContact CE1-CE2 4.19Å; F359-F363 AromaticContact CE2-CE2 3.93Å; F359-F363 HydrophobicContact CE2-CE2 3.93Å; F359-F363 HydrophobicContact CE2-CZ 4.5Å; F359-F363 HydrophobicContact CG-CE2 4.48Å; F359-F363 AromaticContact CZ-CE2 3.91Å; F359-F363 HydrophobicContact CZ-CE2 3.91Å; F359-F363 WeakPolarHBondContact O-CD2 3.48Å; F359-F363 VanDerWaalsContact O-CE2 3.25Å; F359-F363 WeakPolarHBondContact O-CE2 3.44Å
360I91.1Very high86.9Confident1 Ų149 Ų491%0.00525%0.246CC..Hα-helixtrans-66.1-43177.1-63.5164.9000110.3L101 L126 L129 I130 Q134 P356 Q357 H358 L362 F363L101-I360 HydrophobicContact CD2-CG2 4.42Å; L126-I360 HydrophobicContact CD1-CD1 4.08Å; L126-I360 HydrophobicContact CD1-CG1 3.86Å; L129-I360 HydrophobicContact CB-CD1 3.5Å; L129-I360 VanDerWaalsContact CB-CD1 3.5Å; L129-I360 HydrophobicContact CD1-CD1 4.19Å; I130-I360 HydrophobicContact CG1-CD1 4.26Å; I130-I360 HydrophobicContact CG1-CG1 4.45Å; Q134-I360 HydrophobicContact CG-CG2 3.79Å; P356-I360 PolarHBondContact O-N 3.11Å; Q357-I360 WeakPolarHBondContact O-CB 3.4Å; Q357-I360 PolarHBondContact O-N 3.42Å; Q357-I360 VanDerWaalsContact O-N 3.08Å; H358-I360 VanDerWaalsContact C-N 3.28Å; H358-I360 PolarHBondContact O-N 3.26Å; I360-L362 PolarHBondContact O-N 3.36Å; I360-F363 PolarHBondContact O-N 3.4Å; I360-F363 VanDerWaalsContact O-N 3.08Å
361D89.9Confident87.3Confident65 Ų6550.7 Ų50.735%0.34825%0.252SS..Hα-helixtrans-64.5-26.5-177.9-60-26.3000112.9Q357 H358 F363 K364Q357-D361 PolarHBondContact NE2-OD1 3.37Å; Q357-D361 PolarHBondContact O-N 2.92Å; H358-D361 CarbonylContact O-C 3.54Å; H358-D361 PolarHBondContact O-N 3.41Å; D361-F363 PolarHBondContact O-N 3.07Å; D361-F363 VanDerWaalsContact O-N 3.12Å; D361-K364 PolarHBondContact O-N 2.86Å; D361-K364 VanDerWaalsContact OD1-CE 3.3Å; D361-K364 WeakPolarHBondContact OD1-CE 3.42Å; D361-K364 IonicContact OD1-NZ 3.95Å; D361-K364 PolarHBondContact OD1-NZ 3.28Å
362L87.6Confident87.4Confident24 Ų2452.4 Ų52.413%0.12626%0.26CS..THydrogen-bonded Turntrans-60.3-18.6172.9-72.9177.4000113.9V87 I354 H358 F359 I360 F365V87-L362 HydrophobicContact CG1-CB 4.26Å; I354-L362 HydrophobicContact CD1-CD1 3.62Å; H358-L362 WeakPolarHBondContact O-CG 3.38Å; H358-L362 PolarHBondContact O-N 3.07Å; F359-L362 PolarHBondContact O-N 3.05Å; I360-L362 PolarHBondContact O-N 3.36Å; L362-F365 WeakPolarHBondContact O-CE2 3.46Å; L362-F365 WeakPolarHBondContact O-CZ 3.18Å
363F86.3Confident87.3Confident22 Ų2252.2 Ų52.210%0.09626%0.259CS..THydrogen-bonded Turntrans-117.48.5-176.9-53.6-75.8000112.8I85 V87 C99 L101 A104 L324 F359 I360 D361 F365I85-F363 HydrophobicContact CD1-CZ 4.31Å; V87-F363 HydrophobicContact CG1-CE1 4.26Å; V87-F363 HydrophobicContact CG2-CE1 4.24Å; V87-F363 HydrophobicContact CG2-CZ 4.13Å; C99-F363 WeakPolarHBondContact O-CD1 3.28Å; C99-F363 VanDerWaalsContact SG-CE1 3.58Å; L101-F363 HydrophobicContact CB-CB 3.94Å; L101-F363 HydrophobicContact CB-CD2 4.37Å; L101-F363 HydrophobicContact CB-CG 4.29Å; L101-F363 HydrophobicContact CD1-CD2 3.87Å; L101-F363 HydrophobicContact CD1-CE2 4.45Å; A104-F363 HydrophobicContact CB-CE1 3.86Å; A104-F363 HydrophobicContact CB-CE2 3.8Å; A104-F363 HydrophobicContact CB-CZ 3.38Å; L324-F363 HydrophobicContact CD2-CZ 4.18Å; F359-F363 HydrophobicContact CD1-CE2 4.44Å; F359-F363 HydrophobicContact CD2-CE2 4.23Å; F359-F363 HydrophobicContact CE1-CE2 4.19Å; F359-F363 AromaticContact CE2-CE2 3.93Å; F359-F363 HydrophobicContact CE2-CE2 3.93Å; F359-F363 HydrophobicContact CE2-CZ 4.5Å; F359-F363 HydrophobicContact CG-CE2 4.48Å; F359-F363 AromaticContact CZ-CE2 3.91Å; F359-F363 HydrophobicContact CZ-CE2 3.91Å; F359-F363 WeakPolarHBondContact O-CD2 3.48Å; F359-F363 VanDerWaalsContact O-CE2 3.25Å; F359-F363 WeakPolarHBondContact O-CE2 3.44Å; I360-F363 PolarHBondContact O-N 3.4Å; I360-F363 VanDerWaalsContact O-N 3.08Å; D361-F363 PolarHBondContact O-N 3.07Å; D361-F363 VanDerWaalsContact O-N 3.12Å; F363-F365 PolarHBondContact O-N 3.04Å
364K76.9Confident87.1Confident108 Ų10850.1 Ų50.147%0.4724%0.239SC..  trans-84.489.1171.7-70.7-178.4-179.91650108.5D361D361-K364 PolarHBondContact O-N 2.86Å; D361-K364 VanDerWaalsContact OD1-CE 3.3Å; D361-K364 WeakPolarHBondContact OD1-CE 3.42Å; D361-K364 IonicContact OD1-NZ 3.95Å; D361-K364 PolarHBondContact OD1-NZ 3.28Å
365F61.6Low86.6Confident204 Ų20454.4 Ų54.490%0.89526%0.259SS*.  trans-121.10174-64.5-67.8000111.5L362 F363L362-F365 WeakPolarHBondContact O-CE2 3.46Å; L362-F365 WeakPolarHBondContact O-CZ 3.18Å; F363-F365 PolarHBondContact O-N 3.04Å

Retrieved 365 of 365 residues in 88.2 ms (Link to these results)

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