A0A087XC39_POEFO Loading...

Complex I assembly factor TIMMDC1, mitochondrial

Chaperone protein involved in the assembly of the mitochondrial NADH:ubiquinone oxidoreductase complex (complex I). Participates in constructing the membrane arm of complex I.

AlphaFold DB , UniProt , Accession A0A087XC39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 296 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
1M43.3Very low38.5Very low250 Ų250145.5 Ų145.5100%1.23284%0.838SS**  01110-60.9-167.598.300106.6
2S37.2Very low38.2Very low127 Ų127143.8 Ų143.889%0.88883%0.832SS**  trans-98.2139.1-160.4-161.60000112.1
3T44.7Very low37.7Very low140 Ų140139.5 Ų139.586%0.85982%0.823SS**  trans-74149.6174.944.60000112.2
4G37.2Very low38Very low66 Ų66141.4 Ų141.468%0.6882%0.823SS**  trans-168.9122.516900000111.9
5P42.9Very low37.8Very low124 Ų124138.3 Ų138.381%0.80581%0.81SS**  trans-90.9125.117632.7-27.1000110.8Q7P5-Q7 PolarHBondContact O-N 2.96Å; P5-Q7 VanDerWaalsContact O-N 3.11Å
6F38Very low38.3Very low215 Ų215144.9 Ų144.994%0.94382%0.817SS**  trans-7995.3173.1-93.9-86.2000110.7G8F6-G8 PolarHBondContact O-N 2.9Å
7Q39.5Very low38.7Very low187 Ų187146.6 Ų146.687%0.87481%0.813SS**  trans-82.895.5165.6-157.5169.37.800108.2P5 L9P5-Q7 PolarHBondContact O-N 2.96Å; P5-Q7 VanDerWaalsContact O-N 3.11Å; Q7-L9 PolarHBondContact O-N 3.34Å
8G34.8Very low38.6Very low68 Ų68148.8 Ų148.870%0.70181%0.813SS**  trans-88.891.4-179.100000112.6F6 V10F6-G8 PolarHBondContact O-N 2.9Å; G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.08Å
9L34.7Very low38.7Very low140 Ų140147.4 Ų147.473%0.73381%0.814SS**  trans-59.694169.8-169.4103.9000111.2Q7 Q11Q7-L9 PolarHBondContact O-N 3.34Å; L9-Q11 HydrophobicContact CD2-CB 3.85Å; L9-Q11 VanDerWaalsContact CD2-OE1 3.31Å; L9-Q11 HydrophobicContact CG-CB 4.28Å; L9-Q11 PolarHBondContact O-N 3.17Å
10V36.3Very low38.8Very low127 Ų127149.5 Ų149.577%0.7782%0.815SS**  trans-84.475.3167.2-1750000109G8 T12G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.08Å; V10-T12 VanDerWaalsContact C-N 3.34Å; V10-T12 HydrophobicContact CG1-CG2 4.07Å; V10-T12 PolarHBondContact O-N 2.94Å
11Q35.5Very low38.8Very low157 Ų157150 Ų15073%0.73482%0.816SS**  trans-66.490.8162.8-171.5170.312.100107.9L9 A13L9-Q11 HydrophobicContact CD2-CB 3.85Å; L9-Q11 VanDerWaalsContact CD2-OE1 3.31Å; L9-Q11 HydrophobicContact CG-CB 4.28Å; L9-Q11 PolarHBondContact O-N 3.17Å; Q11-A13 PolarHBondContact O-N 3.13Å
12T33.9Very low38.5Very low125 Ų125146 Ų14677%0.76780%0.798SS**  trans-73.697.9171.532.50000108.8V10 M14V10-T12 VanDerWaalsContact C-N 3.34Å; V10-T12 HydrophobicContact CG1-CG2 4.07Å; V10-T12 PolarHBondContact O-N 2.94Å; T12-M14 PolarHBondContact O-N 2.94Å
13A32.7Very low38.3Very low87 Ų87145.9 Ų145.972%0.71980%0.795SS**  trans-46.5123.2168.900000111Q11Q11-A13 PolarHBondContact O-N 3.13Å
14M41.8Very low37.8Very low167 Ų167151 Ų15182%0.82380%0.798SS**  trans-61.4126.5167.5-71.2-79-7900109T12 R16T12-M14 PolarHBondContact O-N 2.94Å; M14-R16 PolarHBondContact O-N 3.08Å
15P34.8Very low37.6Very low95 Ų95153.6 Ų153.662%0.61780%0.801SS**  trans-76.9112.9176.729.7-31.8000110F17P15-F17 HydrophobicContact CB-CD2 3.57Å; P15-F17 HydrophobicContact CB-CE2 3.44Å; P15-F17 VanDerWaalsContact CB-CE2 3.44Å; P15-F17 HydrophobicContact CB-CZ 4.44Å; P15-F17 HydrophobicContact CG-CD2 4.01Å; P15-F17 HydrophobicContact CG-CE2 3.96Å; P15-F17 PolarHBondContact O-N 3.27Å
16R45.8Very low37Very low244 Ų244155.7 Ų155.792%0.92181%0.806SS**  trans-68.176.6167.3-71.8177.3166.5142.2-4.3109.6M14 F18M14-R16 PolarHBondContact O-N 3.08Å; R16-F18 PolarHBondContact O-N 3.03Å
17F44.6Very low36.8Very low174 Ų174149.7 Ų149.776%0.76380%0.796SS**  trans-89.380.5170.5-78.4-70.8000110.1P15P15-F17 HydrophobicContact CB-CD2 3.57Å; P15-F17 HydrophobicContact CB-CE2 3.44Å; P15-F17 VanDerWaalsContact CB-CE2 3.44Å; P15-F17 HydrophobicContact CB-CZ 4.44Å; P15-F17 HydrophobicContact CG-CD2 4.01Å; P15-F17 HydrophobicContact CG-CE2 3.96Å; P15-F17 PolarHBondContact O-N 3.27Å
18F36.7Very low36.5Very low185 Ų185145.9 Ų145.981%0.81180%0.796SS**  trans-170.279.2153.3-98.1-70.2000108R16R16-F18 PolarHBondContact O-N 3.03Å
19C40.3Very low36.3Very low122 Ų122149.9 Ų149.982%0.82480%0.801SS**  trans-134.358.1166-81.80000108.6L21C19-L21 PolarHBondContact O-N 2.92Å
20F41.2Very low36.3Very low189 Ų189150.1 Ų150.183%0.82981%0.808SS**  trans-82.999.6162.1-83.6-74.8000108.5
21L38.2Very low35.9Very low160 Ų160147.9 Ų147.984%0.83880%0.803SS**  trans3.2116.3144.3-63.4158.3000116.1C19C19-L21 PolarHBondContact O-N 2.92Å
22L37.6Very low35.6Very low166 Ų166145.4 Ų145.487%0.86981%0.809SS**  trans-116.5128.1153.4-79.3171.8000108.7
23P32.8Very low35.3Very low125 Ų125142.9 Ų142.981%0.81281%0.808SS**PPolyproline II helixtrans-68.9161.1166.3-16.930.9000112.8
24R34.4Very low35Very low247 Ų247147.7 Ų147.793%0.93282%0.816SS**PPolyproline II helixtrans-78.7151.7-163.1-171.4179.6170.399.1-1.6112.9
25V33.9Very low34.5Very low121 Ų121147.8 Ų147.873%0.73382%0.816SS**PPolyproline II helixtrans-54.7148.3176.2169.60000113.9
26D29.8Very low34.8Very low169 Ų169148.6 Ų148.690%0.90482%0.821SS**  trans-134.7140.7137-114-38.4000111.4
27A33.6Very low33.9Very low89 Ų89141.9 Ų141.974%0.73681%0.812SS**  trans-90.9149.9-17200000111.4
28A32.7Very low33.1Very low106 Ų106139 Ų13988%0.87681%0.814SS**  trans-140.4118.3156.900000109.1
29D30.5Very low32.7Very low153 Ų153136 Ų13682%0.81882%0.815SS**  trans-87.2125.7176.5-157.5-24.1000107.6
30V34.7Very low32Very low145 Ų145135.3 Ų135.388%0.87981%0.812SS**  trans-144.7122159.2-177.80000109.3
31A29Very low31.1Very low79 Ų79131.9 Ų131.965%0.65381%0.812SS**  trans-79.4165.3-172.900000115.1
32A27.7Very low30.5Very low106 Ų106129.3 Ų129.388%0.87681%0.807SS**  trans71129.1141.700000120.2
33G27.6Very low30.1Very low72 Ų72127.1 Ų127.174%0.74281%0.805SS**  trans173.873.5166.400000114.7
34Q28.4Very low29.8Very low187 Ų187126.5 Ų126.587%0.87480%0.804SS**  trans25128.4147.1-121.8100.2-18.300122.5
35M29.5Very low29.6Very low169 Ų169121.2 Ų121.283%0.83380%0.799SS**  trans-67.1164.1138.7-77.8-97.6-79.500110
36P41.4Very low29.3Very low112 Ų112120.9 Ų120.973%0.72780%0.803SS**  cis-136.3-169.239.137.1-13.2000111.2
37S27.2Very low29.6Very low104 Ų104118.6 Ų118.673%0.72780%0.797SS**  cis-173.515836.429.40000110
38S28.6Very low29.9Very low114 Ų114119.6 Ų119.680%0.79781%0.805SS**  trans-34.5143.9163.749.60000118.7
39S27.1Very low29.8Very low120 Ų120119 Ų11984%0.83980%0.801SS**  trans-154.8126.4142.555.80000111.7
40S25.3Very low30Very low109 Ų109115.3 Ų115.376%0.76280%0.799SS**  trans-78175.5177.144.40000114.3
41S23.7Very low30.2Very low117 Ų117114 Ų11482%0.81880%0.795SS**  trans80.5136.2170.875.30000114.5
42S25.3Very low30.9Very low105 Ų105115.1 Ų115.173%0.73479%0.79SS**  cis-156.8140.43647.90000112.1
43S28.6Very low31.6Very low120 Ų120112.8 Ų112.884%0.83977%0.766SS**  trans-58.1132.9159.348.30000112.1
44S26.5Very low32.7Very low113 Ų113119.5 Ų119.579%0.7978%0.775SS**  trans-141.899157.360.10000109.9
45T30.5Very low33.7Very low135 Ų135118 Ų11883%0.82877%0.773SS**  trans-65131.7161.230.40000111.2
46S27.9Very low34.6Very low115 Ų115111.3 Ų111.380%0.80474%0.74SS**  trans173.7158.9144.6-79.60000109.9
47P36Very low34.8Very low121 Ų121108.8 Ų108.879%0.78674%0.735SS**  -117.5177-66.224.3-3.5000110.9A49P47-A49 PolarHBondContact O-N 2.87Å
48A39.8Very low35.6Very low109 Ų109111.2 Ų111.290%0.90173%0.732SS**  trans-51.5126.1-178.800000114.1
49A31.4Very low36.6Very low95 Ų95109.9 Ų109.979%0.78572%0.721SS**  trans-129133.9159.600000107.6P47P47-A49 PolarHBondContact O-N 2.87Å
50G34.6Very low37.6Very low75 Ų75111.3 Ų111.377%0.77371%0.714SS**  trans-43.4134.3-167.900000114.3L52G50-L52 PolarHBondContact O-N 3.49Å
51S37.4Very low38.5Very low116 Ų116111.4 Ų111.481%0.81170%0.701SS**  trans-55.5106179.751.60000111.6
52L44.1Very low39.8Very low104 Ų104108.2 Ų108.255%0.54568%0.677SS.*  trans-54.7135.1157.9-95.4124.3000108.8G50 K54 I56G50-L52 PolarHBondContact O-N 3.49Å; L52-K54 PolarHBondContact O-N 3.22Å; L52-I56 HydrophobicContact CD2-CB 4.18Å; L52-I56 HydrophobicContact CD2-CG2 3.78Å
53P43.3Very low41Very low57 Ų57111 Ų11137%0.3768%0.684SS.*  trans-61.4137.3176.920.7-26.9000109.8N55 I56 W247P53-N55 PolarHBondContact O-N 2.89Å; P53-I56 HydrophobicContact CG-CD1 3.94Å; P53-I56 PolarHBondContact O-N 3.41Å; P53-W247 HydrophobicContact CB-CH2 4.35Å; P53-W247 HydrophobicContact CG-CE3 4.37Å; P53-W247 HydrophobicContact CG-CH2 3.4Å; P53-W247 VanDerWaalsContact CG-CH2 3.4Å; P53-W247 HydrophobicContact CG-CZ2 4.18Å; P53-W247 HydrophobicContact CG-CZ3 3.53Å
54K50.3Low42.2Very low212 Ų212109.1 Ų109.192%0.92267%0.668SS**THydrogen-bonded Turntrans-53.5-11.7-178.4-73.6173.7176.51720115L52L52-K54 PolarHBondContact O-N 3.22Å
55N49Very low43.8Very low157 Ų157104.5 Ų104.584%0.8464%0.638SS**THydrogen-bonded Turntrans-87.8-6.8177.8-80.6-56.1000114.5P53P53-N55 PolarHBondContact O-N 2.89Å
56I48.9Very low45.3Very low27 Ų27105.5 Ų105.514%0.13863%0.627CS.*SBendtrans-100.396.9167.3-80.379.8000105L52 P53 K58 W247L52-I56 HydrophobicContact CD2-CB 4.18Å; L52-I56 HydrophobicContact CD2-CG2 3.78Å; P53-I56 HydrophobicContact CG-CD1 3.94Å; P53-I56 PolarHBondContact O-N 3.41Å; I56-K58 PolarHBondContact O-N 3.44Å; I56-K58 VanDerWaalsContact O-N 3.13Å; I56-W247 HydrophobicContact CD1-CD2 3.51Å; I56-W247 HydrophobicContact CD1-CE3 4.15Å; I56-W247 HydrophobicContact CD1-CG 4.03Å; I56-W247 HydrophobicContact CD1-CH2 3.78Å; I56-W247 HydrophobicContact CD1-CZ2 3.08Å; I56-W247 HydrophobicContact CD1-CZ3 4.27Å; I56-W247 HydrophobicContact CG1-CD2 4.09Å; I56-W247 HydrophobicContact CG1-CG 4.09Å; I56-W247 HydrophobicContact CG1-CZ2 4.35Å
57G44.6Very low46.9Very low60 Ų60105.4 Ų105.462%0.61961%0.613SS**  trans-50.3122.2169.100000108.7
58K45.3Very low48.3Very low155 Ų155100.7 Ų100.767%0.67458%0.58SS**  trans-54147.4170.5-75.4176.8174.9-175.50108.8I56 E60I56-K58 PolarHBondContact O-N 3.44Å; I56-K58 VanDerWaalsContact O-N 3.13Å; K58-E60 PolarHBondContact O-N 3.37Å; K58-E60 VanDerWaalsContact O-N 3.14Å
59P48.8Very low49.4Very low86 Ų8698.3 Ų98.356%0.55855%0.551SS**SBendtrans-68.4-7.9174.830.3-34.6000112.3Y240P59-Y240 HydrophobicContact CB-CD1 4.38Å; P59-Y240 HydrophobicContact CB-CD2 4.03Å; P59-Y240 HydrophobicContact CB-CE1 4.16Å; P59-Y240 HydrophobicContact CB-CE2 3.83Å; P59-Y240 HydrophobicContact CB-CG 4.3Å; P59-Y240 WeakPolarHBondContact CD-OH 3.43Å; P59-Y240 HydrophobicContact CG-CE1 3.97Å; P59-Y240 HydrophobicContact CG-CE2 3.86Å
60E48.8Very low50.9Low149 Ų14999.5 Ų99.570%0.69654%0.539SS*.SBendtrans-81.5129.3170-76.1-174.9141.200110K58K58-E60 PolarHBondContact O-N 3.37Å; K58-E60 VanDerWaalsContact O-N 3.14Å
61F43.1Very low52.3Low111 Ų111101.7 Ų101.749%0.48753%0.533SS..  trans-32.7121175.1-57.9-68.3000110.3D63 N172F61-D63 PolarHBondContact O-N 3.34Å; F61-N172 WeakPolarHBondContact CD1-ND2 3.2Å; F61-N172 WeakPolarHBondContact CD1-OD1 3.22Å; F61-N172 VanDerWaalsContact CE1-CG 3.46Å; F61-N172 VanDerWaalsContact CE1-ND2 3.26Å; F61-N172 WeakPolarHBondContact CE1-ND2 3.29Å; F61-N172 WeakPolarHBondContact CE1-OD1 3.48Å; F61-N172 VanDerWaalsContact CG-ND2 3.27Å; F61-N172 WeakPolarHBondContact CG-ND2 3.36Å
62P51.3Low53.4Low50 Ų5098 Ų9833%0.32550%0.504SS..  trans-55.2118.616322.1-29.9000105.6T64 Q67 R68P62-T64 PolarHBondContact O-N 2.96Å; P62-Q67 HydrophobicContact CB-CB 4.16Å; P62-R68 HydrophobicContact CG-CB 4.27Å; P62-R68 HydrophobicContact CG-CG 4.12Å
63D50.4Low54Low165 Ų165101.7 Ų101.788%0.88252%0.516SS*.SBendtrans-58.5-10.2-169.5-63.8-46.7000112.9F61F61-D63 PolarHBondContact O-N 3.34Å
64T55.2Low54.6Low80 Ų80105.3 Ų105.349%0.49153%0.532SS..SBendtrans-113.8112.5-179-51.40000111.5P62 W66 Q67P62-T64 PolarHBondContact O-N 2.96Å; T64-W66 HydrophobicContact CG2-CB 4.27Å; T64-W66 PolarHBondContact O-N 2.8Å; T64-Q67 PolarHBondContact O-N 2.87Å
65G58.8Low54.4Low16 Ų16105.3 Ų105.317%0.16553%0.526CS..Hα-helixtrans-55.7-18.8-177.900000116R68 I69G65-R68 WeakPolarHBondContact O-CB 3.35Å; G65-I69 WeakPolarHBondContact O-CG1 3.39Å; G65-I69 PolarHBondContact O-N 3.05Å
66W61.5Low54.3Low155 Ų155102.7 Ų102.759%0.58751%0.512SS*.Hα-helixtrans-73-37.5175.5-174.5-120.7000113.8T64 R68 I69 K70T64-W66 HydrophobicContact CG2-CB 4.27Å; T64-W66 PolarHBondContact O-N 2.8Å; W66-R68 PolarHBondContact O-N 2.94Å; W66-I69 HydrophobicContact CE3-CD1 4.33Å; W66-I69 PolarHBondContact O-N 2.94Å; W66-K70 PolarHBondContact O-N 3.4Å
67Q62.5Low54.2Low113 Ų113110.9 Ų110.953%0.52855%0.55SS..Hα-helixtrans-65.6-31.7176.2-73.9179.1-11.900110.8P62 T64 K70 D71P62-Q67 HydrophobicContact CB-CB 4.16Å; T64-Q67 PolarHBondContact O-N 2.87Å; Q67-K70 PolarHBondContact O-N 2.81Å; Q67-D71 WeakPolarHBondContact O-CB 3.33Å; Q67-D71 PolarHBondContact O-N 3.46Å
68R65Low54.1Low23 Ų23115.8 Ų115.89%0.08756%0.559CS.*Hα-helixtrans-71.1-31.7178.6-141.3176.2-171.3-155.11.8114.6P62 G65 W66 I72 V169 N172P62-R68 HydrophobicContact CG-CB 4.27Å; P62-R68 HydrophobicContact CG-CG 4.12Å; G65-R68 WeakPolarHBondContact O-CB 3.35Å; W66-R68 PolarHBondContact O-N 2.94Å; R68-I72 WeakPolarHBondContact O-CD1 3.4Å; R68-I72 WeakPolarHBondContact O-CG1 3.27Å; R68-V169 HydrophobicContact CB-CG1 3.73Å; R68-V169 WeakPolarHBondContact CD-O 3.24Å; R68-V169 HydrophobicContact CG-CG1 3.51Å; R68-V169 PolarHBondContact NH1-O 2.79Å; R68-N172 VanDerWaalsContact CZ-OD1 3.26Å; R68-N172 PolarHBondContact NH1-ND2 3.13Å; R68-N172 PolarHBondContact NH1-OD1 3.44Å; R68-N172 PolarHBondContact NH2-OD1 2.94Å; R68-N172 VanDerWaalsContact NH2-OD1 3.07Å
69I63.7Low53.9Low58 Ų58116.7 Ų116.730%0.29757%0.565SS.*Hα-helixtrans-72.2-37.8172.9-67166.9000110G65 W66 I72 F73 Y170G65-I69 WeakPolarHBondContact O-CG1 3.39Å; G65-I69 PolarHBondContact O-N 3.05Å; W66-I69 HydrophobicContact CE3-CD1 4.33Å; W66-I69 PolarHBondContact O-N 2.94Å; I69-I72 PolarHBondContact O-N 3.29Å; I69-F73 PolarHBondContact O-N 3.26Å; I69-Y170 HydrophobicContact CD1-CD2 4.21Å
70K62.8Low53.7Low120 Ų120123 Ų12352%0.52258%0.578SS.*Hα-helixtrans-66-40.6175.3-71.7-174-162.5176.20112.3W66 Q67 I72 F73 D74W66-K70 PolarHBondContact O-N 3.4Å; Q67-K70 PolarHBondContact O-N 2.81Å; K70-I72 PolarHBondContact O-N 3.45Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 PolarHBondContact O-N 3.21Å; K70-D74 PolarHBondContact O-N 2.91Å
71D63.3Low53.4Low122 Ų122119.6 Ų119.665%0.65257%0.569SS**Hα-helixtrans-60.1-27.6179.2-166.554.6000113.2Q67Q67-D71 WeakPolarHBondContact O-CB 3.33Å; Q67-D71 PolarHBondContact O-N 3.46Å
72I61.5Low54.2Low38 Ų38116.6 Ų116.620%0.19556%0.562CS.*Hα-helixtrans-79.1-28.7175.3-64.8162.8000112.2R68 I69 K70 E84 V169R68-I72 WeakPolarHBondContact O-CD1 3.4Å; R68-I72 WeakPolarHBondContact O-CG1 3.27Å; I69-I72 PolarHBondContact O-N 3.29Å; K70-I72 PolarHBondContact O-N 3.45Å; I72-E84 VanDerWaalsContact CD1-OE2 3.22Å; I72-E84 WeakPolarHBondContact CD1-OE2 3.27Å; I72-E84 WeakPolarHBondContact CG1-OE2 3.48Å; I72-V169 HydrophobicContact CD1-CB 4.01Å; I72-V169 HydrophobicContact CD1-CG1 3.62Å; I72-V169 HydrophobicContact CD1-CG2 3.48Å; I72-V169 VanDerWaalsContact CD1-CG2 3.48Å
73F56.8Low54.6Low182 Ų182119.8 Ų119.880%0.79857%0.572SS**Hα-helixtrans-93.5-19.2-178-126.7-89.7000112.7I69 K70 R75I69-F73 PolarHBondContact O-N 3.26Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 PolarHBondContact O-N 3.21Å; F73-R75 PolarHBondContact O-N 2.94Å
74D54.6Low55.2Low133 Ų133112.9 Ų112.971%0.71154%0.535SS*.SBendtrans-69.1117.1174-1450000108.1K70 D76K70-D74 PolarHBondContact O-N 2.91Å; D74-D76 PolarHBondContact O-N 3.43Å; D74-D76 VanDerWaalsContact O-N 3.12Å
75R45.7Very low55.5Low212 Ų212112.2 Ų112.280%0.853%0.53SS*.  trans-8596.1-169.2-177166.4146.3164.9-6.2105.7F73 E77F73-R75 PolarHBondContact O-N 2.94Å; R75-E77 PolarHBondContact O-N 2.9Å
76D48.8Very low55.7Low101 Ų101114.8 Ų114.854%0.5454%0.539SS..  trans-43.4126177.2-131.8-20.7000108.2D74 M78 Q79 K243D74-D76 PolarHBondContact O-N 3.43Å; D74-D76 VanDerWaalsContact O-N 3.12Å; D76-M78 PolarHBondContact O-N 3.48Å; D76-Q79 PolarHBondContact O-N 3.38Å; D76-K243 IonicContact OD2-NZ 3.68Å
77E46.1Very low56Low199 Ų199110.8 Ų110.893%0.9353%0.532SS*.SBendtrans-55.5-12.5-167.4-71.1-178.7148.700113.3R75R75-E77 PolarHBondContact O-N 2.9Å
78M41.5Very low56.4Low164 Ų164106.5 Ų106.581%0.80851%0.513SS*.SBendtrans-96.739.1179.5-117157.6-179.300114.5D76 R80D76-M78 PolarHBondContact O-N 3.48Å; M78-R80 PolarHBondContact O-N 2.99Å
79Q41.4Very low56.6Low173 Ų173110.5 Ų110.581%0.80853%0.534SS*.  trans49.29164.5-66.4-166.7-2.200118.6D76 P81D76-Q79 PolarHBondContact O-N 3.38Å; Q79-P81 VanDerWaalsContact O-CD 3.24Å; Q79-P81 WeakPolarHBondContact O-CD 3.47Å
80R44.3Very low57Low218 Ų218114.1 Ų114.182%0.82355%0.548SS*.  trans-88.8109.4175.6-80.1-169.1177.7-176.22.8108.1M78 S82M78-R80 PolarHBondContact O-N 2.99Å; R80-S82 PolarHBondContact O-N 3.06Å
81P44.2Very low57.5Low78 Ų78111.1 Ų111.151%0.50654%0.541SS..  trans-59.2129.5172.525.4-32.7000108.4Q79 E83 M86Q79-P81 VanDerWaalsContact O-CD 3.24Å; Q79-P81 WeakPolarHBondContact O-CD 3.47Å; P81-E83 PolarHBondContact O-N 3.06Å; P81-M86 HydrophobicContact CG-CE 3.6Å
82S58.2Low58Low49 Ų49105.6 Ų105.634%0.34351%0.513SS..  trans-45.2131.8178.7176.10000110.5R80 E84 V85 M86R80-S82 PolarHBondContact O-N 3.06Å; S82-E84 PolarHBondContact O-N 3.32Å; S82-V85 PolarHBondContact O-N 3.31Å; S82-M86 PolarHBondContact O-N 3.36Å; S82-M86 VanDerWaalsContact O-N 3.15Å
83E60.8Low58.8Low116 Ų116108.3 Ų108.354%0.54253%0.527SS..Hα-helixtrans-55.9-25.1-176.5-64.5-167.6153.600112.4P81 T87P81-E83 PolarHBondContact O-N 3.06Å; E83-T87 VanDerWaalsContact O-CB 3.3Å; E83-T87 WeakPolarHBondContact O-CB 3.34Å; E83-T87 PolarHBondContact O-N 3.42Å; E83-T87 PolarHBondContact O-OG1 3.31Å
84E61.8Low60Low21 Ų21105.3 Ų105.310%0.09852%0.518CS..Hα-helixtrans-64.2-45.6173.7-62.8-168.5171.900111.8I72 S82 T87 V88 T165 R232 R236I72-E84 VanDerWaalsContact CD1-OE2 3.22Å; I72-E84 WeakPolarHBondContact CD1-OE2 3.27Å; I72-E84 WeakPolarHBondContact CG1-OE2 3.48Å; S82-E84 PolarHBondContact O-N 3.32Å; E84-T87 PolarHBondContact O-N 3.43Å; E84-V88 VanDerWaalsContact O-CG2 3.25Å; E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.32Å; E84-T165 HydrophobicContact CB-CG2 4.36Å; E84-R232 VanDerWaalsContact CD-NH2 3.27Å; E84-R232 IonicContact OE1-CZ 3.93Å; E84-R232 IonicContact OE1-NE 3.93Å; E84-R232 IonicContact OE1-NH2 3.85Å; E84-R232 PolarHBondContact OE1-NH2 2.95Å; E84-R236 IonicContact OE1-CZ 3.61Å; E84-R236 IonicContact OE1-NH1 3.64Å; E84-R236 IonicContact OE1-NH2 3.15Å; E84-R236 PolarHBondContact OE1-NH2 2.96Å; E84-R236 VanDerWaalsContact OE1-NH2 3.15Å
85V61.7Low61.1Low65 Ų6599.5 Ų99.539%0.39449%0.49SS..Hα-helixtrans-69.1-40.2178.6-178.40000110.7S82 T87 V88 M89S82-V85 PolarHBondContact O-N 3.31Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3Å; V85-V88 PolarHBondContact O-N 3.2Å; V85-M89 WeakPolarHBondContact O-CB 3.44Å; V85-M89 PolarHBondContact O-N 3.16Å
86M63.4Low62.8Low71 Ų7190.4 Ų90.435%0.3546%0.46SS..Hα-helixtrans-63.6-39.2175.8-173.963.667.700111.6P81 S82 M89 K90P81-M86 HydrophobicContact CG-CE 3.6Å; S82-M86 PolarHBondContact O-N 3.36Å; S82-M86 VanDerWaalsContact O-N 3.15Å; M86-M89 PolarHBondContact O-N 3.37Å; M86-K90 VanDerWaalsContact O-CG 3.31Å; M86-K90 WeakPolarHBondContact O-CG 3.32Å; M86-K90 PolarHBondContact O-N 3.05Å
87T67.6Low64.6Low70 Ų7091.9 Ų91.943%0.42946%0.462SS..Hα-helixtrans-67.8-43.2176.1-58.30000111.2E83 E84 V85 M89 K90 C91E83-T87 VanDerWaalsContact O-CB 3.3Å; E83-T87 WeakPolarHBondContact O-CB 3.34Å; E83-T87 PolarHBondContact O-N 3.42Å; E83-T87 PolarHBondContact O-OG1 3.31Å; E84-T87 PolarHBondContact O-N 3.43Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3Å; T87-M89 VanDerWaalsContact C-N 3.3Å; T87-M89 PolarHBondContact O-N 2.96Å; T87-K90 PolarHBondContact O-N 3.35Å; T87-C91 PolarHBondContact O-N 3.24Å; T87-C91 PolarHBondContact O-SG 2.83Å; T87-C91 VanDerWaalsContact O-SG 3.33Å
88V72Confident66.5Low24 Ų2486.7 Ų86.715%0.14544%0.444CS..Hα-helixtrans-59.3-42173.2169.80000111.1E84 V85 C91 G92E84-V88 VanDerWaalsContact O-CG2 3.25Å; E84-V88 WeakPolarHBondContact O-CG2 3.4Å; E84-V88 PolarHBondContact O-N 3.32Å; V85-V88 PolarHBondContact O-N 3.2Å; V88-C91 PolarHBondContact O-N 2.94Å; V88-G92 PolarHBondContact O-N 3.44Å
89M68.2Low68.5Low107 Ų10779 Ų7953%0.52741%0.407SS..Hα-helixtrans-63.8-44.5176.5-170.9-176-66.500111.8V85 M86 T87 C91 G92 I93V85-M89 WeakPolarHBondContact O-CB 3.44Å; V85-M89 PolarHBondContact O-N 3.16Å; M86-M89 PolarHBondContact O-N 3.37Å; T87-M89 VanDerWaalsContact C-N 3.3Å; T87-M89 PolarHBondContact O-N 2.96Å; M89-C91 PolarHBondContact O-N 3.4Å; M89-G92 PolarHBondContact O-N 2.98Å; M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 WeakPolarHBondContact O-CG1 3.37Å; M89-I93 PolarHBondContact O-N 3.3Å
90K72.6Confident70.6Confident134 Ų13473 Ų7358%0.58338%0.378SS*.Hα-helixtrans-60.7-43175.1-73.7171.9-179.8176.10111.8M86 T87 I93 L94M86-K90 VanDerWaalsContact O-CG 3.31Å; M86-K90 WeakPolarHBondContact O-CG 3.32Å; M86-K90 PolarHBondContact O-N 3.05Å; T87-K90 PolarHBondContact O-N 3.35Å; K90-I93 PolarHBondContact O-N 3.22Å; K90-L94 WeakPolarHBondContact O-CB 3.17Å; K90-L94 PolarHBondContact O-N 2.93Å
91C72.2Confident72.6Confident57 Ų5766.6 Ų66.639%0.38536%0.36SS..Hα-helixtrans-63.1-40.3174-690000112.2T87 V88 M89 L94 G95T87-C91 PolarHBondContact O-N 3.24Å; T87-C91 PolarHBondContact O-SG 2.83Å; T87-C91 VanDerWaalsContact O-SG 3.33Å; V88-C91 PolarHBondContact O-N 2.94Å; M89-C91 PolarHBondContact O-N 3.4Å; C91-L94 PolarHBondContact O-N 3.13Å; C91-G95 PolarHBondContact O-N 3.01Å
92G75.7Confident74.5Confident5 Ų571 Ų715%0.05237%0.368CS..Hα-helixtrans-61-45.4174.200000112.9V88 M89 G95 A96V88-G92 PolarHBondContact O-N 3.44Å; M89-G92 PolarHBondContact O-N 2.98Å; G92-G95 PolarHBondContact O-N 3.02Å; G92-A96 WeakPolarHBondContact O-CB 3.4Å; G92-A96 PolarHBondContact O-N 3.05Å
93I76.8Confident75.7Confident95 Ų9569.2 Ų69.249%0.48736%0.356SS..Hα-helixtrans-64.4-43.6177.1-65.5163.5000110.8M89 K90 A96 F97M89-I93 HydrophobicContact CG-CD1 4.14Å; M89-I93 WeakPolarHBondContact O-CG1 3.37Å; M89-I93 PolarHBondContact O-N 3.3Å; K90-I93 PolarHBondContact O-N 3.22Å; I93-A96 WeakPolarHBondContact O-CB 3.24Å; I93-A96 PolarHBondContact O-N 3.49Å; I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 PolarHBondContact O-N 3.24Å
94L82.1Confident76.7Confident119 Ų11963.7 Ų63.762%0.62333%0.331SS*.Hα-helixtrans-62.8-44.5177.4-171.364.3000111K90 C91 A96 F97 T98K90-L94 WeakPolarHBondContact O-CB 3.17Å; K90-L94 PolarHBondContact O-N 2.93Å; C91-L94 PolarHBondContact O-N 3.13Å; L94-A96 PolarHBondContact O-N 2.88Å; L94-F97 WeakPolarHBondContact O-CB 3.32Å; L94-F97 PolarHBondContact O-N 3.06Å; L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 2.81Å; L94-T98 VanDerWaalsContact O-OG1 3.07Å
95G78.4Confident77.6Confident12 Ų1267.3 Ų67.312%0.12435%0.35CS..Hα-helixtrans-62.6-39.2175.100000113.1C91 G92 F97 T98 G99 V153C91-G95 PolarHBondContact O-N 3.01Å; G92-G95 PolarHBondContact O-N 3.02Å; G95-F97 VanDerWaalsContact C-N 3.32Å; G95-F97 PolarHBondContact O-N 3.42Å; G95-T98 PolarHBondContact O-N 2.8Å; G95-G99 PolarHBondContact O-N 3.16Å; G95-V153 WeakPolarHBondContact O-CG1 3.49Å
96A80.9Confident78.3Confident20 Ų2067.4 Ų67.417%0.16535%0.352CS..Hα-helixtrans-62-40.4174.300000111.8G92 I93 L94 F100 S150G92-A96 WeakPolarHBondContact O-CB 3.4Å; G92-A96 PolarHBondContact O-N 3.05Å; I93-A96 WeakPolarHBondContact O-CB 3.24Å; I93-A96 PolarHBondContact O-N 3.49Å; L94-A96 PolarHBondContact O-N 2.88Å; A96-F100 VanDerWaalsContact O-CB 3.23Å; A96-F100 WeakPolarHBondContact O-CB 3.27Å; A96-F100 PolarHBondContact O-N 3.31Å; A96-S150 PolarHBondContact O-OG 2.87Å
97F86.3Confident78.8Confident133 Ų13364.6 Ų64.658%0.58334%0.341SS*.Hα-helixtrans-65-49.4174.4-107.4-86.3000111.6I93 L94 G95 G99 F100 L101I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 PolarHBondContact O-N 3.24Å; L94-F97 WeakPolarHBondContact O-CB 3.32Å; L94-F97 PolarHBondContact O-N 3.06Å; G95-F97 VanDerWaalsContact C-N 3.32Å; G95-F97 PolarHBondContact O-N 3.42Å; F97-G99 VanDerWaalsContact C-N 3.32Å; F97-G99 PolarHBondContact O-N 2.79Å; F97-F100 WeakPolarHBondContact O-CB 3.26Å; F97-F100 PolarHBondContact O-N 2.81Å; F97-L101 HydrophobicContact CD1-CD1 4.04Å; F97-L101 WeakPolarHBondContact O-CD1 3.3Å; F97-L101 PolarHBondContact O-N 2.8Å
98T86.4Confident78.9Confident90 Ų9062.5 Ų62.555%0.55233%0.33SS*.Hα-helixtrans-59.7-43.2177.5-540000111.5L94 G95 F100 L101 Y102L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 2.81Å; L94-T98 VanDerWaalsContact O-OG1 3.07Å; G95-T98 PolarHBondContact O-N 2.8Å; T98-F100 PolarHBondContact O-N 2.83Å; T98-L101 PolarHBondContact O-N 3.01Å; T98-Y102 VanDerWaalsContact O-CB 3.25Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 2.83Å
99G83.9Confident78.8Confident3 Ų370.1 Ų70.13%0.03136%0.356CS..Hα-helixtrans-66.2-35176.600000113.5G95 F97 G103G95-G99 PolarHBondContact O-N 3.16Å; F97-G99 VanDerWaalsContact C-N 3.32Å; F97-G99 PolarHBondContact O-N 2.79Å; G99-G103 PolarHBondContact O-N 2.8Å
100F85Confident79.1Confident46 Ų4669.2 Ų69.220%0.20235%0.353CS..Hα-helixtrans-67.8-45.3175.1-177.1-102.4000111.8A96 F97 T98 G104 F142 L143 G146A96-F100 VanDerWaalsContact O-CB 3.23Å; A96-F100 WeakPolarHBondContact O-CB 3.27Å; A96-F100 PolarHBondContact O-N 3.31Å; F97-F100 WeakPolarHBondContact O-CB 3.26Å; F97-F100 PolarHBondContact O-N 2.81Å; T98-F100 PolarHBondContact O-N 2.83Å; F100-G104 WeakPolarHBondContact O-CA 3.5Å; F100-G104 PolarHBondContact O-N 2.89Å; F100-F142 HydrophobicContact CD1-CE1 4.18Å; F100-F142 HydrophobicContact CD1-CZ 4.02Å; F100-F142 HydrophobicContact CE1-CD1 4.2Å; F100-F142 AromaticContact CE1-CE1 3.2Å; F100-F142 HydrophobicContact CE1-CE1 3.2Å; F100-F142 AromaticContact CE1-CZ 3.48Å; F100-F142 HydrophobicContact CE1-CZ 3.48Å; F100-F142 VanDerWaalsContact CE1-CZ 3.48Å; F100-F142 AromaticContact CZ-CD1 3.99Å; F100-F142 HydrophobicContact CZ-CD1 3.99Å; F100-F142 AromaticContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CE1 3.43Å; F100-F142 VanDerWaalsContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CZ 4.05Å; F100-L143 HydrophobicContact CZ-CD1 4.15Å; F100-G146 VanDerWaalsContact CD2-C 3.44Å
101L85.7Confident78.9Confident83 Ų8364.2 Ų64.244%0.43534%0.337SS..Hα-helixtrans-63.4-47.5175.4-89.179.4000111.1F97 T98 G103 G104 L105F97-L101 HydrophobicContact CD1-CD1 4.04Å; F97-L101 WeakPolarHBondContact O-CD1 3.3Å; F97-L101 PolarHBondContact O-N 2.8Å; T98-L101 PolarHBondContact O-N 3.01Å; L101-G103 PolarHBondContact O-N 3.33Å; L101-G104 PolarHBondContact O-N 2.82Å; L101-L105 HydrophobicContact CB-CD1 4.42Å; L101-L105 WeakPolarHBondContact O-CB 2.94Å; L101-L105 WeakPolarHBondContact O-CD1 3.17Å; L101-L105 WeakPolarHBondContact O-CG 3.27Å; L101-L105 PolarHBondContact O-N 3.28Å
102Y85.8Confident78.5Confident172 Ų17268.8 Ų68.868%0.67535%0.346SS*.Hα-helixtrans-61.3-41.9-179.7-176.4-99.5000112.4T98 P106T98-Y102 VanDerWaalsContact O-CB 3.25Å; T98-Y102 WeakPolarHBondContact O-CB 3.48Å; T98-Y102 PolarHBondContact O-N 2.83Å; Y102-P106 WeakPolarHBondContact O-CD 3.31Å; Y102-P106 WeakPolarHBondContact O-CG 3.27Å
103G82.9Confident78.1Confident10 Ų1074.2 Ų74.210%0.10337%0.37CS..Hα-helixtrans-77.7-28.7177.400000114.4G99 L101G99-G103 PolarHBondContact O-N 2.8Å; L101-G103 PolarHBondContact O-N 3.33Å
104G81.9Confident77.7Confident0 Ų077 Ų770%037%0.374CS..Hα-helixtrans-83.8-42.8-175.300000114.2F100 L101 A107 A108 F142F100-G104 WeakPolarHBondContact O-CA 3.5Å; F100-G104 PolarHBondContact O-N 2.89Å; L101-G104 PolarHBondContact O-N 2.82Å; G104-A107 PolarHBondContact O-N 3.49Å; G104-A108 PolarHBondContact O-N 3.36Å; G104-F142 VanDerWaalsContact C-CE2 3.49Å; G104-F142 VanDerWaalsContact CA-CE2 3.46Å; G104-F142 VanDerWaalsContact O-CD2 3.31Å; G104-F142 WeakPolarHBondContact O-CD2 3.5Å
105L79.2Confident76.9Confident97 Ų9773.5 Ų73.551%0.50835%0.353SS..Hα-helixtrans-54.6-50-177.4-81.9158.7000114.7L101 A107 A108 R109L101-L105 HydrophobicContact CB-CD1 4.42Å; L101-L105 WeakPolarHBondContact O-CB 2.94Å; L101-L105 WeakPolarHBondContact O-CD1 3.17Å; L101-L105 WeakPolarHBondContact O-CG 3.27Å; L101-L105 PolarHBondContact O-N 3.28Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.89Å; L105-A108 PolarHBondContact O-N 3.26Å; L105-R109 PolarHBondContact O-N 2.93Å
106P77.5Confident76.4Confident67 Ų6776.8 Ų76.844%0.43537%0.367SS..Hα-helixtrans-67.8-35178.125.3-32.8000112.2Y102 R109 L110Y102-P106 WeakPolarHBondContact O-CD 3.31Å; Y102-P106 WeakPolarHBondContact O-CG 3.27Å; P106-R109 PolarHBondContact O-N 3.25Å; P106-L110 PolarHBondContact O-N 2.65Å
107A73.9Confident75.8Confident13 Ų1382.8 Ų82.811%0.10739%0.392CS..Hα-helixtrans-67.2-38.5178.700000112.4G104 L105 R109 L110 A111 Y145G104-A107 PolarHBondContact O-N 3.49Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-A107 PolarHBondContact O-N 2.89Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-L110 PolarHBondContact O-N 3.07Å; A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.08Å; A107-Y145 HydrophobicContact CB-CD2 3.92Å; A107-Y145 HydrophobicContact CB-CG 3.89Å
108A68.8Low74.9Confident26 Ų2681.9 Ų81.922%0.21539%0.392CS..Hα-helixtrans-64.2-39.5175.400000112G104 L105 R112 F142G104-A108 PolarHBondContact O-N 3.36Å; L105-A108 PolarHBondContact O-N 3.26Å; A108-R112 VanDerWaalsContact O-CB 3.32Å; A108-R112 WeakPolarHBondContact O-CB 3.33Å; A108-R112 PolarHBondContact O-N 3.39Å; A108-F142 HydrophobicContact CB-CB 4.32Å; A108-F142 HydrophobicContact CB-CD2 4.22Å
109R71.6Confident73.7Confident183 Ų18378.7 Ų78.769%0.69137%0.373SS*.Hα-helixtrans-67-45.5176.9-70.8-173.2177.6178.30.2112L105 P106 A107 R112 Q113L105-R109 PolarHBondContact O-N 2.93Å; P106-R109 PolarHBondContact O-N 3.25Å; A107-R109 VanDerWaalsContact C-N 3.35Å; R109-R112 PolarHBondContact O-N 3.42Å; R109-Q113 WeakPolarHBondContact O-CG 3.23Å; R109-Q113 PolarHBondContact O-N 2.94Å
110L72.4Confident72.5Confident88 Ų8886.6 Ų86.646%0.46141%0.409SS..Hα-helixtrans-63.4-42.1177.1-82.4157.1000112.4P106 A107 Q113 R114P106-L110 PolarHBondContact O-N 2.65Å; A107-L110 PolarHBondContact O-N 3.07Å; L110-Q113 PolarHBondContact O-N 3.2Å; L110-R114 WeakPolarHBondContact O-CG 3.17Å; L110-R114 PolarHBondContact O-N 3.27Å
111A69.7Low71.1Confident29 Ų2988.7 Ų88.724%0.2444%0.435CS..Hα-helixtrans-64.7-41.3176.700000111.8A107 Y115A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.08Å; A111-Y115 WeakPolarHBondContact O-CB 3.47Å; A111-Y115 PolarHBondContact O-N 2.86Å
112R62.9Low69.8Low153 Ų15390.3 Ų90.358%0.57744%0.441SS*.Hα-helixtrans-64.8-43.3176.8-170.7-177.6-179-166.81112.2A108 R109 Y115 I116A108-R112 VanDerWaalsContact O-CB 3.32Å; A108-R112 WeakPolarHBondContact O-CB 3.33Å; A108-R112 PolarHBondContact O-N 3.39Å; R109-R112 PolarHBondContact O-N 3.42Å; R112-Y115 PolarHBondContact O-N 2.86Å; R112-I116 HydrophobicContact CG-CD1 4.23Å; R112-I116 VanDerWaalsContact O-CG1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 2.89Å; R112-I116 VanDerWaalsContact O-N 3.07Å
113Q68.2Low68.2Low120 Ų12090.7 Ų90.756%0.56145%0.451SS*.Hα-helixtrans-64.2-43.7177.7-76.1177.2-30.600112.2R109 L110 Y115 I116 Q117R109-Q113 WeakPolarHBondContact O-CG 3.23Å; R109-Q113 PolarHBondContact O-N 2.94Å; L110-Q113 PolarHBondContact O-N 3.2Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 PolarHBondContact O-N 3.04Å; Q113-I116 PolarHBondContact O-N 3.41Å; Q113-Q117 WeakPolarHBondContact O-CG 3.48Å; Q113-Q117 PolarHBondContact O-N 3.49Å; Q113-Q117 VanDerWaalsContact O-N 3.14Å
114R68Low66.9Low153 Ų15394.2 Ų94.258%0.57746%0.461SS*.Hα-helixtrans-64.4-38.6175.4-72.9179-174.8176.61.3112.1L110 Q117 I118L110-R114 WeakPolarHBondContact O-CG 3.17Å; L110-R114 PolarHBondContact O-N 3.27Å; R114-Q117 PolarHBondContact O-N 3.02Å; R114-I118 WeakPolarHBondContact O-CB 3.42Å; R114-I118 WeakPolarHBondContact O-CD1 3.21Å; R114-I118 VanDerWaalsContact O-CG1 3.27Å; R114-I118 WeakPolarHBondContact O-CG1 3.42Å; R114-I118 PolarHBondContact O-N 3.24Å
115Y64.9Low65.8Low46 Ų46102.3 Ų102.318%0.1850%0.502CS..Hα-helixtrans-60.9-45.3175.8-170.9-96.6000111.4A111 R112 Q113 Q117 I118 S119 S133 A134 A137A111-Y115 WeakPolarHBondContact O-CB 3.47Å; A111-Y115 PolarHBondContact O-N 2.86Å; R112-Y115 PolarHBondContact O-N 2.86Å; Q113-Y115 VanDerWaalsContact C-N 3.33Å; Q113-Y115 PolarHBondContact O-N 3.04Å; Y115-Q117 VanDerWaalsContact C-N 3.35Å; Y115-Q117 PolarHBondContact O-N 3.08Å; Y115-I118 PolarHBondContact O-N 3.28Å; Y115-S119 WeakPolarHBondContact O-CB 3.41Å; Y115-S119 PolarHBondContact O-N 3.34Å; Y115-S119 PolarHBondContact O-OG 3.21Å; Y115-S133 WeakPolarHBondContact OH-CB 3.45Å; Y115-S133 PolarHBondContact OH-OG 2.75Å; Y115-A134 HydrophobicContact CD1-CB 3.38Å; Y115-A134 HydrophobicContact CE1-CB 3.47Å; Y115-A134 VanDerWaalsContact CE1-CB 3.47Å; Y115-A134 HydrophobicContact CG-CB 4.23Å; Y115-A137 HydrophobicContact CD2-CB 4.24Å
116I68.3Low65Low81 Ų81100 Ų10042%0.41549%0.494SS..Hα-helixtrans-62.2-40.6178.7-66.3163.1000111.8R112 Q113 S119 Q120R112-I116 HydrophobicContact CG-CD1 4.23Å; R112-I116 VanDerWaalsContact O-CG1 3.31Å; R112-I116 WeakPolarHBondContact O-CG1 3.35Å; R112-I116 PolarHBondContact O-N 2.89Å; R112-I116 VanDerWaalsContact O-N 3.07Å; Q113-I116 PolarHBondContact O-N 3.41Å; I116-S119 WeakPolarHBondContact CA-OG 3.27Å; I116-S119 PolarHBondContact O-OG 3.14Å; I116-Q120 WeakPolarHBondContact O-CG 3.18Å; I116-Q120 PolarHBondContact O-N 2.92Å; I116-Q120 VanDerWaalsContact O-N 3.13Å
117Q69.2Low64.2Low146 Ų146107.6 Ų107.668%0.68251%0.514SS*.Hα-helixtrans-66.7-39.7178.3-72.8178.1-9.800112.7Q113 R114 Y115Q113-Q117 WeakPolarHBondContact O-CG 3.48Å; Q113-Q117 PolarHBondContact O-N 3.49Å; Q113-Q117 VanDerWaalsContact O-N 3.14Å; R114-Q117 PolarHBondContact O-N 3.02Å; Y115-Q117 VanDerWaalsContact C-N 3.35Å; Y115-Q117 PolarHBondContact O-N 3.08Å
118I66.2Low64Low114 Ų114111.8 Ų111.859%0.58554%0.537SS*.Hα-helixtrans-77.6-38179.8-63.8165000110.5R114 Y115 Q120 A121R114-I118 WeakPolarHBondContact O-CB 3.42Å; R114-I118 WeakPolarHBondContact O-CD1 3.21Å; R114-I118 VanDerWaalsContact O-CG1 3.27Å; R114-I118 WeakPolarHBondContact O-CG1 3.42Å; R114-I118 PolarHBondContact O-N 3.24Å; Y115-I118 PolarHBondContact O-N 3.28Å; I118-Q120 VanDerWaalsContact C-N 3.31Å; I118-Q120 PolarHBondContact O-N 3.45Å; I118-A121 WeakPolarHBondContact O-CB 3.35Å; I118-A121 PolarHBondContact O-N 2.79Å; I118-A121 VanDerWaalsContact O-N 3.12Å
119S61Low64Low23 Ų23116.8 Ų116.816%0.16156%0.556CS.*Hα-helixtrans-71.9-22.4-179.570.50000113.2Y115 I116 A121 E122 Y124Y115-S119 WeakPolarHBondContact O-CB 3.41Å; Y115-S119 PolarHBondContact O-N 3.34Å; Y115-S119 PolarHBondContact O-OG 3.21Å; I116-S119 WeakPolarHBondContact CA-OG 3.27Å; I116-S119 PolarHBondContact O-OG 3.14Å; S119-A121 PolarHBondContact O-N 2.98Å; S119-E122 PolarHBondContact O-N 3.5Å; S119-E122 VanDerWaalsContact O-O 3.09Å; S119-Y124 WeakPolarHBondContact O-CE2 3.31Å
120Q58.4Low63.8Low168 Ų168109.2 Ų109.279%0.78553%0.533SS*.THydrogen-bonded Turntrans-66.1-14.7171.3-82.6-170.1-6.300112.8I116 I118I116-Q120 WeakPolarHBondContact O-CG 3.18Å; I116-Q120 PolarHBondContact O-N 2.92Å; I116-Q120 VanDerWaalsContact O-N 3.13Å; I118-Q120 VanDerWaalsContact C-N 3.31Å; I118-Q120 PolarHBondContact O-N 3.45Å
121A56.8Low63.6Low91 Ų91109.1 Ų109.175%0.75254%0.536SS*.THydrogen-bonded Turntrans-93.5-8.5175.100000114I118 S119I118-A121 WeakPolarHBondContact O-CB 3.35Å; I118-A121 PolarHBondContact O-N 2.79Å; I118-A121 VanDerWaalsContact O-N 3.12Å; S119-A121 PolarHBondContact O-N 2.98Å
122E57.9Low63.6Low117 Ų117117.2 Ų117.255%0.54756%0.56SS.*SBendtrans-113.4121.2177.8-78-179169.800110.4S119 Y124S119-E122 PolarHBondContact O-N 3.5Å; S119-E122 VanDerWaalsContact O-O 3.09Å; E122-Y124 HydrophobicContact CB-CD2 4.44Å; E122-Y124 HydrophobicContact CB-CE2 3.72Å; E122-Y124 WeakPolarHBondContact O-CD2 3.25Å; E122-Y124 VanDerWaalsContact O-CE2 3.29Å; E122-Y124 WeakPolarHBondContact O-CE2 3.43Å; E122-Y124 PolarHBondContact O-N 3.37Å; E122-Y124 VanDerWaalsContact O-N 3.13Å; E122-Y124 PolarHBondContact OE2-OH 2.9Å
123M51.9Low64Low180 Ų180111.9 Ų111.989%0.88755%0.547SS*.  trans-72.6102.3174.6-76.6-143.9-72.700110.5
124Y55.3Low64.1Low83 Ų83107 Ų10733%0.32553%0.527SS..  trans-84.4132.5175.2-62.8-83.1000111.7S119 E122 S126 A130S119-Y124 WeakPolarHBondContact O-CE2 3.31Å; E122-Y124 HydrophobicContact CB-CD2 4.44Å; E122-Y124 HydrophobicContact CB-CE2 3.72Å; E122-Y124 WeakPolarHBondContact O-CD2 3.25Å; E122-Y124 VanDerWaalsContact O-CE2 3.29Å; E122-Y124 WeakPolarHBondContact O-CE2 3.43Å; E122-Y124 PolarHBondContact O-N 3.37Å; E122-Y124 VanDerWaalsContact O-N 3.13Å; E122-Y124 PolarHBondContact OE2-OH 2.9Å; Y124-S126 PolarHBondContact O-N 2.85Å; Y124-A130 HydrophobicContact CD2-CB 4.46Å; Y124-A130 HydrophobicContact CG-CB 4.32Å
125M59.3Low64.3Low171 Ų171104.9 Ų104.984%0.84252%0.523SS*.SBendtrans-71.2-11.8179.5-67.2-70.710100114
126S62.3Low64.9Low49 Ų49106.7 Ų106.734%0.34354%0.536SS..  trans-149.9134.4-179.6174.80000113.1Y124 V128Y124-S126 PolarHBondContact O-N 2.85Å; S126-V128 PolarHBondContact O-N 3.5Å; S126-V128 PolarHBondContact OG-N 3.23Å
127R61.8Low65.1Low226 Ų226104.6 Ų104.685%0.85353%0.531SS*.Hα-helixtrans-61.8-29.8175.5-75.8-168.1-168.7-104.23.5113V131R127-V131 WeakPolarHBondContact O-CG2 3.43Å; R127-V131 PolarHBondContact O-N 3.04Å
128V68.5Low65.3Low100 Ų10098.3 Ų98.361%0.60650%0.504SS*.Hα-helixtrans-75.7-37.6-172.9-175.80000111.2S126 V131 R132S126-V128 PolarHBondContact O-N 3.5Å; S126-V128 PolarHBondContact OG-N 3.23Å; V128-V131 PolarHBondContact O-N 3.44Å; V128-R132 PolarHBondContact O-N 2.85Å; V128-R132 VanDerWaalsContact O-N 3.14Å
129E68.6Low65.9Low131 Ų13197.5 Ų97.561%0.61250%0.5SS*.Hα-helixtrans-70.3-37176.9-73.4-172.2145.300112.4V131 R132 S133E129-V131 VanDerWaalsContact C-N 3.29Å; E129-V131 PolarHBondContact O-N 3.48Å; E129-R132 PolarHBondContact O-N 2.84Å; E129-S133 WeakPolarHBondContact O-CB 3.02Å; E129-S133 PolarHBondContact O-N 3.48Å; E129-S133 PolarHBondContact O-OG 2.76Å
130A68Low66.8Low25 Ų25104 Ų10421%0.20752%0.521CS..Hα-helixtrans-62.2-35.8174.900000112.4Y124 S133 A134Y124-A130 HydrophobicContact CD2-CB 4.46Å; Y124-A130 HydrophobicContact CG-CB 4.32Å; A130-S133 WeakPolarHBondContact CA-OG 3.49Å; A130-S133 PolarHBondContact O-OG 3.18Å; A130-A134 WeakPolarHBondContact O-CB 3.41Å; A130-A134 PolarHBondContact O-N 3.31Å
131V67.4Low67.6Low86 Ų8696.6 Ų96.652%0.52149%0.489SS..Hα-helixtrans-73.2-42176.7173.80000111.2R127 V128 E129 A134 H135R127-V131 WeakPolarHBondContact O-CG2 3.43Å; R127-V131 PolarHBondContact O-N 3.04Å; V128-V131 PolarHBondContact O-N 3.44Å; E129-V131 VanDerWaalsContact C-N 3.29Å; E129-V131 PolarHBondContact O-N 3.48Å; V131-A134 PolarHBondContact O-N 2.96Å; V131-H135 PolarHBondContact O-CD2 2.92Å; V131-H135 PolarHBondContact O-N 3.26Å; V131-H135 VanDerWaalsContact O-N 3.07Å
132R71.1Confident68.7Low199 Ų19994.7 Ų94.775%0.75146%0.464SS*.Hα-helixtrans-65.7-40.5-179.6-123.2174.8-172158.12.4112.6V128 E129 H135 N136V128-R132 PolarHBondContact O-N 2.85Å; V128-R132 VanDerWaalsContact O-N 3.14Å; E129-R132 PolarHBondContact O-N 2.84Å; R132-H135 PolarHBondContact O-N 3.01Å; R132-N136 WeakPolarHBondContact O-CB 3.37Å; R132-N136 PolarHBondContact O-N 3.32Å
133S70.3Confident70Confident41 Ų4193.9 Ų93.929%0.28746%0.463SS..Hα-helixtrans-68.5-41.3176.646.70000112.3Y115 E129 A130 H135 N136 A137Y115-S133 WeakPolarHBondContact OH-CB 3.45Å; Y115-S133 PolarHBondContact OH-OG 2.75Å; E129-S133 WeakPolarHBondContact O-CB 3.02Å; E129-S133 PolarHBondContact O-N 3.48Å; E129-S133 PolarHBondContact O-OG 2.76Å; A130-S133 WeakPolarHBondContact CA-OG 3.49Å; A130-S133 PolarHBondContact O-OG 3.18Å; S133-H135 VanDerWaalsContact C-N 3.34Å; S133-H135 PolarHBondContact O-N 3.32Å; S133-N136 PolarHBondContact O-N 3.12Å; S133-A137 WeakPolarHBondContact O-CB 3.38Å; S133-A137 PolarHBondContact O-N 3.12Å
134A69.8Low71.4Confident18 Ų1894.9 Ų94.915%0.14946%0.457CS..Hα-helixtrans-58.7-43.1172.700000112.5Y115 A130 V131 A138Y115-A134 HydrophobicContact CD1-CB 3.38Å; Y115-A134 HydrophobicContact CE1-CB 3.47Å; Y115-A134 VanDerWaalsContact CE1-CB 3.47Å; Y115-A134 HydrophobicContact CG-CB 4.23Å; A130-A134 WeakPolarHBondContact O-CB 3.41Å; A130-A134 PolarHBondContact O-N 3.31Å; V131-A134 PolarHBondContact O-N 2.96Å; A134-A138 VanDerWaalsContact O-CB 3.31Å; A134-A138 WeakPolarHBondContact O-CB 3.43Å; A134-A138 PolarHBondContact O-N 3.42Å
135H73Confident72.5Confident108 Ų10896.9 Ų96.950%0.547%0.465SS..Hα-helixtrans-67.9-42.9177.6-90.4-75.3000112.4V131 R132 S133 A137 A138 I139V131-H135 PolarHBondContact O-CD2 2.92Å; V131-H135 PolarHBondContact O-N 3.26Å; V131-H135 VanDerWaalsContact O-N 3.07Å; R132-H135 PolarHBondContact O-N 3.01Å; S133-H135 VanDerWaalsContact C-N 3.34Å; S133-H135 PolarHBondContact O-N 3.32Å; H135-A137 VanDerWaalsContact C-N 3.33Å; H135-A137 PolarHBondContact O-N 2.9Å; H135-A138 PolarHBondContact O-N 3.41Å; H135-I139 WeakPolarHBondContact O-CB 3.42Å; H135-I139 WeakPolarHBondContact O-CD1 3.18Å; H135-I139 WeakPolarHBondContact O-CG1 3.37Å; H135-I139 PolarHBondContact O-N 2.9Å
136N76.7Confident73.7Confident84 Ų8488.7 Ų88.745%0.44943%0.425SS..Hα-helixtrans-63.8-39.3177.9-163.6-7000111.3R132 S133 R140R132-N136 WeakPolarHBondContact O-CB 3.37Å; R132-N136 PolarHBondContact O-N 3.32Å; S133-N136 PolarHBondContact O-N 3.12Å; N136-R140 VanDerWaalsContact CG-NH2 3.32Å; N136-R140 PolarHBondContact ND2-NH2 3.04Å; N136-R140 WeakPolarHBondContact O-CB 3.48Å; N136-R140 PolarHBondContact O-N 3.08Å; N136-R140 VanDerWaalsContact O-N 3.09Å; N136-R140 PolarHBondContact OD1-NH2 2.99Å
137A73.3Confident74.7Confident37 Ų3795.6 Ų95.631%0.30644%0.443SS..Hα-helixtrans-66.1-41.9173.800000112.6Y115 S133 H135 R140 G141Y115-A137 HydrophobicContact CD2-CB 4.24Å; S133-A137 WeakPolarHBondContact O-CB 3.38Å; S133-A137 PolarHBondContact O-N 3.12Å; H135-A137 VanDerWaalsContact C-N 3.33Å; H135-A137 PolarHBondContact O-N 2.9Å; A137-R140 PolarHBondContact O-N 3.29Å; A137-G141 PolarHBondContact O-N 3.49Å
138A73.4Confident75.7Confident14 Ų1492.4 Ų92.412%0.11643%0.431CS..Hα-helixtrans-65.2-42.3177.300000112.5A134 H135 G141 F142A134-A138 VanDerWaalsContact O-CB 3.31Å; A134-A138 WeakPolarHBondContact O-CB 3.43Å; A134-A138 PolarHBondContact O-N 3.42Å; H135-A138 PolarHBondContact O-N 3.41Å; A138-G141 PolarHBondContact O-N 3.45Å; A138-F142 WeakPolarHBondContact O-CB 3.36Å; A138-F142 PolarHBondContact O-N 3.06Å
139I79.2Confident76.4Confident97 Ų9794.2 Ų94.250%0.49743%0.427SS..Hα-helixtrans-64.9-41.9177.8-68.7163.9000110.6H135 G141 F142 L143H135-I139 WeakPolarHBondContact O-CB 3.42Å; H135-I139 WeakPolarHBondContact O-CD1 3.18Å; H135-I139 WeakPolarHBondContact O-CG1 3.37Å; H135-I139 PolarHBondContact O-N 2.9Å; I139-G141 VanDerWaalsContact C-N 3.33Å; I139-G141 PolarHBondContact O-N 3.5Å; I139-F142 WeakPolarHBondContact O-CB 3.49Å; I139-F142 PolarHBondContact O-N 2.88Å; I139-L143 PolarHBondContact O-N 2.92Å
140R78.7Confident77.1Confident159 Ų15988.9 Ų88.960%0.640%0.404SS*.Hα-helixtrans-66.2-36.3178.2-138176.5-62.4172.20.7112N136 A137 R144N136-R140 VanDerWaalsContact CG-NH2 3.32Å; N136-R140 PolarHBondContact ND2-NH2 3.04Å; N136-R140 WeakPolarHBondContact O-CB 3.48Å; N136-R140 PolarHBondContact O-N 3.08Å; N136-R140 VanDerWaalsContact O-N 3.09Å; N136-R140 PolarHBondContact OD1-NH2 2.99Å; A137-R140 PolarHBondContact O-N 3.29Å; R140-R144 WeakPolarHBondContact O-CB 3.25Å; R140-R144 PolarHBondContact O-N 2.67Å
141G76.3Confident77.9Confident12 Ų1294.1 Ų94.112%0.12442%0.419CS..Hα-helixtrans-65.1-47.7170.700000112.2A137 A138 I139 L143 R144 Y145A137-G141 PolarHBondContact O-N 3.49Å; A138-G141 PolarHBondContact O-N 3.45Å; I139-G141 VanDerWaalsContact C-N 3.33Å; I139-G141 PolarHBondContact O-N 3.5Å; G141-L143 PolarHBondContact O-N 2.88Å; G141-R144 PolarHBondContact O-N 3.1Å; G141-Y145 VanDerWaalsContact O-CD2 3.26Å; G141-Y145 WeakPolarHBondContact O-CD2 3.45Å; G141-Y145 PolarHBondContact O-N 3.47Å; G141-Y145 VanDerWaalsContact O-N 3.1Å
142F80.8Confident78.7Confident52 Ų5296 Ų9623%0.22842%0.416CS..Hα-helixtrans-56.3-48.5178.3179.6-100.3000112.3F100 G104 A108 A138 I139 G146F100-F142 HydrophobicContact CD1-CE1 4.18Å; F100-F142 HydrophobicContact CD1-CZ 4.02Å; F100-F142 HydrophobicContact CE1-CD1 4.2Å; F100-F142 AromaticContact CE1-CE1 3.2Å; F100-F142 HydrophobicContact CE1-CE1 3.2Å; F100-F142 AromaticContact CE1-CZ 3.48Å; F100-F142 HydrophobicContact CE1-CZ 3.48Å; F100-F142 VanDerWaalsContact CE1-CZ 3.48Å; F100-F142 AromaticContact CZ-CD1 3.99Å; F100-F142 HydrophobicContact CZ-CD1 3.99Å; F100-F142 AromaticContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CE1 3.43Å; F100-F142 VanDerWaalsContact CZ-CE1 3.43Å; F100-F142 HydrophobicContact CZ-CZ 4.05Å; G104-F142 VanDerWaalsContact C-CE2 3.49Å; G104-F142 VanDerWaalsContact CA-CE2 3.46Å; G104-F142 VanDerWaalsContact O-CD2 3.31Å; G104-F142 WeakPolarHBondContact O-CD2 3.5Å; A108-F142 HydrophobicContact CB-CB 4.32Å; A108-F142 HydrophobicContact CB-CD2 4.22Å; A138-F142 WeakPolarHBondContact O-CB 3.36Å; A138-F142 PolarHBondContact O-N 3.06Å; I139-F142 WeakPolarHBondContact O-CB 3.49Å; I139-F142 PolarHBondContact O-N 2.88Å; F142-G146 WeakPolarHBondContact O-CA 3.48Å; F142-G146 PolarHBondContact O-N 3.32Å
143L83.8Confident79.2Confident99 Ų9988.3 Ų88.352%0.51839%0.392SS..Hα-helixtrans-65.4-45.8179.7-117.971.4000112.4F100 I139 G141 Y145 W147F100-L143 HydrophobicContact CZ-CD1 4.15Å; I139-L143 PolarHBondContact O-N 2.92Å; G141-L143 PolarHBondContact O-N 2.88Å; L143-Y145 PolarHBondContact O-N 2.97Å; L143-W147 WeakPolarHBondContact O-CB 3.44Å; L143-W147 PolarHBondContact O-N 3.41Å
144R81.3Confident79.7Confident202 Ų20288 Ų8876%0.76239%0.389SS*.Hα-helixtrans-68.7-39.2-173.6-161172.5-165.3138.71.7112.4R140 G141R140-R144 WeakPolarHBondContact O-CB 3.25Å; R140-R144 PolarHBondContact O-N 2.67Å; G141-R144 PolarHBondContact O-N 3.1Å
145Y78.8Confident80.4Confident124 Ų12490.8 Ų90.849%0.48640%0.404SS..Hα-helixtrans-82.3-38.8177.7-72.4-79.5000112.1A107 G141 L143 R148 W149A107-Y145 HydrophobicContact CB-CD2 3.92Å; A107-Y145 HydrophobicContact CB-CG 3.89Å; G141-Y145 VanDerWaalsContact O-CD2 3.26Å; G141-Y145 WeakPolarHBondContact O-CD2 3.45Å; G141-Y145 PolarHBondContact O-N 3.47Å; G141-Y145 VanDerWaalsContact O-N 3.1Å; L143-Y145 PolarHBondContact O-N 2.97Å; Y145-R148 PolarHBondContact O-N 3.46Å; Y145-W149 PolarHBondContact O-N 2.82Å
146G83.6Confident80.8Confident0 Ų088.8 Ų88.80%040%0.397CS..Hα-helixtrans-61.5-44.3175.400000112.4F100 F142 R148 W149 S150F100-G146 VanDerWaalsContact CD2-C 3.44Å; F142-G146 WeakPolarHBondContact O-CA 3.48Å; F142-G146 PolarHBondContact O-N 3.32Å; G146-R148 PolarHBondContact O-N 3.38Å; G146-W149 PolarHBondContact O-N 3.29Å; G146-S150 WeakPolarHBondContact O-CB 3.26Å; G146-S150 PolarHBondContact O-N 3.1Å
147W84Confident81Confident194 Ų19486.7 Ų86.774%0.73539%0.387SS*.Hα-helixtrans-60.5-44.5177.7-176.7-98.7000112.1L143 W149 S150 W151L143-W147 WeakPolarHBondContact O-CB 3.44Å; L143-W147 PolarHBondContact O-N 3.41Å; W147-W149 VanDerWaalsContact C-N 3.28Å; W147-W149 PolarHBondContact O-N 2.92Å; W147-S150 PolarHBondContact O-N 3.39Å; W147-W151 PolarHBondContact O-N 3.5Å
148R83.6Confident81.3Confident158 Ų15887.7 Ų87.760%0.59639%0.389SS*.Hα-helixtrans-73-19.2-175-149.8155.275.4108.3-2.1113.9Y145 G146 W151Y145-R148 PolarHBondContact O-N 3.46Å; G146-R148 PolarHBondContact O-N 3.38Å; R148-W151 VanDerWaalsContact C-CD1 3.49Å; R148-W151 PolarHBondContact O-NE1 2.92Å
149W81.9Confident81.7Confident139 Ų13989.8 Ų89.853%0.52740%0.398SS..Hα-helixtrans-94.1-36.3172-89.477.8000112.5Y145 G146 W147 W151 R152 V153Y145-W149 PolarHBondContact O-N 2.82Å; G146-W149 PolarHBondContact O-N 3.29Å; W147-W149 VanDerWaalsContact C-N 3.28Å; W147-W149 PolarHBondContact O-N 2.92Å; W149-W151 PolarHBondContact O-N 3.15Å; W149-R152 PolarHBondContact O-N 3.43Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.65Å; W149-V153 VanDerWaalsContact O-N 3.13Å
150S84.5Confident81.4Confident19 Ų1987.2 Ų87.213%0.13338%0.384CS..Hα-helixtrans-60-43.1-178.3-176.90000112.7A96 G146 W147 R152 V153 S154A96-S150 PolarHBondContact O-OG 2.87Å; G146-S150 WeakPolarHBondContact O-CB 3.26Å; G146-S150 PolarHBondContact O-N 3.1Å; W147-S150 PolarHBondContact O-N 3.39Å; S150-R152 VanDerWaalsContact C-N 3.3Å; S150-R152 PolarHBondContact O-N 3.41Å; S150-V153 PolarHBondContact O-N 3.27Å; S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.34Å; S150-S154 PolarHBondContact O-N 3.46Å
151W84.2Confident81.2Confident135 Ų13580.3 Ų80.351%0.51136%0.36SS..Hα-helixtrans-63.4-34.9178.577.8-85000112.9W147 R148 W149 V155W147-W151 PolarHBondContact O-N 3.5Å; R148-W151 VanDerWaalsContact C-CD1 3.49Å; R148-W151 PolarHBondContact O-NE1 2.92Å; W149-W151 PolarHBondContact O-N 3.15Å; W151-V155 HydrophobicContact CE3-CG2 4.49Å; W151-V155 VanDerWaalsContact O-CG2 3.27Å; W151-V155 WeakPolarHBondContact O-CG2 3.46Å; W151-V155 PolarHBondContact O-N 2.84Å
152R83.9Confident81Confident124 Ų12483 Ų8347%0.46838%0.376SS..Hα-helixtrans-68.2-46.3177.3-64.1-168.2173.8-164.5-2111.3W149 S150 S154 V155 I156W149-R152 PolarHBondContact O-N 3.43Å; S150-R152 VanDerWaalsContact C-N 3.3Å; S150-R152 PolarHBondContact O-N 3.41Å; R152-S154 VanDerWaalsContact C-N 3.35Å; R152-V155 PolarHBondContact O-N 3.3Å; R152-I156 WeakPolarHBondContact O-CD1 3.49Å; R152-I156 VanDerWaalsContact O-CG1 3.24Å; R152-I156 WeakPolarHBondContact O-CG1 3.24Å; R152-I156 PolarHBondContact O-N 3.12Å
153V81.9Confident80.5Confident39 Ų3981.8 Ų81.824%0.23637%0.373CS..Hα-helixtrans-64.7-42.6178.2178.30000110.4G95 W149 S150 V155 I156 V157G95-V153 WeakPolarHBondContact O-CG1 3.49Å; W149-V153 WeakPolarHBondContact O-CG2 3.38Å; W149-V153 PolarHBondContact O-N 2.65Å; W149-V153 VanDerWaalsContact O-N 3.13Å; S150-V153 PolarHBondContact O-N 3.27Å; V153-V155 PolarHBondContact O-N 3.43Å; V153-I156 PolarHBondContact O-N 3.27Å; V153-V157 HydrophobicContact CG1-CG2 4.08Å; V153-V157 WeakPolarHBondContact O-CB 3.5Å; V153-V157 VanDerWaalsContact O-CG2 3.29Å; V153-V157 WeakPolarHBondContact O-CG2 3.33Å; V153-V157 PolarHBondContact O-N 2.95Å
154S81.9Confident79.5Confident34 Ų3478.1 Ų78.124%0.23836%0.356CS..Hα-helixtrans-59.3-47.5177.6-177.20000112.1S150 R152 I156 V157 T158S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.34Å; S150-S154 PolarHBondContact O-N 3.46Å; R152-S154 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 3.36Å; S154-V157 PolarHBondContact O-N 3.13Å; S154-T158 VanDerWaalsContact O-CB 3.24Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 3.36Å; S154-T158 PolarHBondContact O-OG1 3.22Å
155V83.9Confident78.8Confident76 Ų7670.3 Ų70.346%0.46133%0.331SS..Hα-helixtrans-62.4-44.8176.9170.40000111.2W151 R152 V153 L159W151-V155 HydrophobicContact CE3-CG2 4.49Å; W151-V155 VanDerWaalsContact O-CG2 3.27Å; W151-V155 WeakPolarHBondContact O-CG2 3.46Å; W151-V155 PolarHBondContact O-N 2.84Å; R152-V155 PolarHBondContact O-N 3.3Å; V153-V155 PolarHBondContact O-N 3.43Å; V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 PolarHBondContact O-N 3.02Å
156I81.4Confident78.1Confident67 Ų6765.6 Ų65.634%0.34432%0.32SS..Hα-helixtrans-63.6-46.6179.5-68.7166.3000111.1R152 V153 S154 L159 F160R152-I156 WeakPolarHBondContact O-CD1 3.49Å; R152-I156 VanDerWaalsContact O-CG1 3.24Å; R152-I156 WeakPolarHBondContact O-CG1 3.24Å; R152-I156 PolarHBondContact O-N 3.12Å; V153-I156 PolarHBondContact O-N 3.27Å; S154-I156 PolarHBondContact O-N 3.36Å; I156-L159 PolarHBondContact O-N 3.38Å; I156-F160 VanDerWaalsContact O-CB 3.3Å; I156-F160 WeakPolarHBondContact O-CB 3.3Å; I156-F160 PolarHBondContact O-N 2.8Å
157V80.4Confident77.2Confident40 Ų4067.7 Ų67.724%0.24233%0.331CS..Hα-helixtrans-66.1-43.2-179.51680000111.4V153 S154 F160 S161V153-V157 HydrophobicContact CG1-CG2 4.08Å; V153-V157 WeakPolarHBondContact O-CB 3.5Å; V153-V157 VanDerWaalsContact O-CG2 3.29Å; V153-V157 WeakPolarHBondContact O-CG2 3.33Å; V153-V157 PolarHBondContact O-N 2.95Å; S154-V157 PolarHBondContact O-N 3.13Å; V157-F160 PolarHBondContact O-N 3.07Å; V157-S161 VanDerWaalsContact O-CB 3.27Å; V157-S161 WeakPolarHBondContact O-CB 3.37Å; V157-S161 PolarHBondContact O-N 3.08Å; V157-S161 PolarHBondContact O-OG 3.08Å
158T80.8Confident76.2Confident57 Ų5759.9 Ų59.935%0.3531%0.308SS..Hα-helixtrans-64.2-43.8178.1-560000110.6S154 S161 S162S154-T158 VanDerWaalsContact O-CB 3.24Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 3.36Å; S154-T158 PolarHBondContact O-OG1 3.22Å; T158-S161 PolarHBondContact O-N 3.02Å; T158-S162 VanDerWaalsContact O-CB 3.29Å; T158-S162 WeakPolarHBondContact O-CB 3.37Å; T158-S162 PolarHBondContact O-N 3.4Å
159L80.3Confident75.1Confident58 Ų5852.7 Ų52.730%0.30428%0.281SS..Hα-helixtrans-64.9-46.3177.8-171.465.2000111.3V155 I156 S161 S162 V163 T186 L189V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 PolarHBondContact O-N 3.02Å; I156-L159 PolarHBondContact O-N 3.38Å; L159-S161 VanDerWaalsContact C-N 3.35Å; L159-S161 PolarHBondContact O-N 3.47Å; L159-S162 PolarHBondContact O-N 3.19Å; L159-V163 WeakPolarHBondContact O-CB 3.11Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.27Å; L159-V163 PolarHBondContact O-N 2.85Å; L159-T186 HydrophobicContact CB-CG2 4.1Å; L159-T186 HydrophobicContact CD2-CG2 3.9Å; L159-T186 HydrophobicContact CG-CG2 4.01Å; L159-L189 HydrophobicContact CD2-CD2 4.19Å
160F73.8Confident74Confident44 Ų4452.9 Ų52.919%0.19328%0.283CS..Hα-helixtrans-59.3-45.6175.6179.1-101.1000112I156 V157 V163 S164 Y179 A182 T186 V213I156-F160 VanDerWaalsContact O-CB 3.3Å; I156-F160 WeakPolarHBondContact O-CB 3.3Å; I156-F160 PolarHBondContact O-N 2.8Å; V157-F160 PolarHBondContact O-N 3.07Å; F160-V163 PolarHBondContact O-N 3.49Å; F160-S164 VanDerWaalsContact O-CB 3.24Å; F160-S164 WeakPolarHBondContact O-CB 3.23Å; F160-S164 PolarHBondContact O-N 3.39Å; F160-S164 PolarHBondContact O-OG 3.42Å; F160-Y179 HydrophobicContact CE1-CD1 4.36Å; F160-Y179 AromaticContact CZ-CD1 3.89Å; F160-Y179 HydrophobicContact CZ-CD1 3.89Å; F160-A182 HydrophobicContact CD2-CB 4.2Å; F160-A182 HydrophobicContact CE2-CB 3.98Å; F160-T186 WeakPolarHBondContact CA-OG1 3.07Å; F160-T186 HydrophobicContact CB-CG2 4.16Å; F160-V213 HydrophobicContact CE1-CG1 4.18Å; F160-V213 HydrophobicContact CZ-CG1 3.84Å
161S74.1Confident72.7Confident14 Ų1457.7 Ų57.710%0.09830%0.298CS..Hα-helixtrans-65-45.1-179.4-580000110.7V157 T158 L159 V163 S164 T165V157-S161 VanDerWaalsContact O-CB 3.27Å; V157-S161 WeakPolarHBondContact O-CB 3.37Å; V157-S161 PolarHBondContact O-N 3.08Å; V157-S161 PolarHBondContact O-OG 3.08Å; T158-S161 PolarHBondContact O-N 3.02Å; L159-S161 VanDerWaalsContact C-N 3.35Å; L159-S161 PolarHBondContact O-N 3.47Å; S161-V163 PolarHBondContact O-N 3.11Å; S161-S164 WeakPolarHBondContact CA-OG 3.44Å; S161-S164 PolarHBondContact O-N 2.87Å; S161-S164 PolarHBondContact O-OG 2.93Å; S161-T165 PolarHBondContact O-N 2.8Å; S161-T165 PolarHBondContact O-OG1 3.37Å; S161-T165 VanDerWaalsContact O-OG1 3.04Å
162S73.1Confident71.4Confident67 Ų6754.8 Ų54.847%0.46929%0.293SS..Hα-helixtrans-59.1-47.4175.1178.20000112.5T158 L159 T165 G166T158-S162 VanDerWaalsContact O-CB 3.29Å; T158-S162 WeakPolarHBondContact O-CB 3.37Å; T158-S162 PolarHBondContact O-N 3.4Å; L159-S162 PolarHBondContact O-N 3.19Å; S162-T165 PolarHBondContact O-N 2.81Å; S162-G166 PolarHBondContact O-N 3.29Å
163V69.1Low69.9Low27 Ų2756.5 Ų56.516%0.16430%0.303CS..Hα-helixtrans-66.3-39.8178.3176.20000111.2L159 F160 S161 G166 L167 A182 V185L159-V163 WeakPolarHBondContact O-CB 3.11Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.27Å; L159-V163 PolarHBondContact O-N 2.85Å; F160-V163 PolarHBondContact O-N 3.49Å; S161-V163 PolarHBondContact O-N 3.11Å; V163-G166 PolarHBondContact O-N 2.95Å; V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.49Å; V163-L167 PolarHBondContact O-N 3.45Å; V163-A182 HydrophobicContact CB-CB 4.34Å; V163-A182 HydrophobicContact CG1-CB 3.78Å; V163-V185 HydrophobicContact CG1-CB 4.3Å; V163-V185 HydrophobicContact CG1-CG1 4.24Å; V163-V185 HydrophobicContact CG2-CG1 4.43Å
164S63.3Low68.6Low23 Ų2360 Ų6016%0.16132%0.321CS..Hα-helixtrans-63.6-43178.274.40000112.2F160 S161 L167 A168F160-S164 VanDerWaalsContact O-CB 3.24Å; F160-S164 WeakPolarHBondContact O-CB 3.23Å; F160-S164 PolarHBondContact O-N 3.39Å; F160-S164 PolarHBondContact O-OG 3.42Å; S161-S164 WeakPolarHBondContact CA-OG 3.44Å; S161-S164 PolarHBondContact O-N 2.87Å; S161-S164 PolarHBondContact O-OG 2.93Å; S164-L167 PolarHBondContact O-N 2.88Å; S164-A168 VanDerWaalsContact O-CB 3.27Å; S164-A168 WeakPolarHBondContact O-CB 3.23Å; S164-A168 PolarHBondContact O-N 3.35Å
165T65.7Low67.4Low38 Ų3860.7 Ų60.723%0.23333%0.329CS..Hα-helixtrans-66.7-45175.6-56.90000110.4E84 S161 S162 L167 A168 V169E84-T165 HydrophobicContact CB-CG2 4.36Å; S161-T165 PolarHBondContact O-N 2.8Å; S161-T165 PolarHBondContact O-OG1 3.37Å; S161-T165 VanDerWaalsContact O-OG1 3.04Å; S162-T165 PolarHBondContact O-N 2.81Å; T165-L167 PolarHBondContact O-N 3.48Å; T165-A168 PolarHBondContact O-N 3.02Å; T165-V169 HydrophobicContact CG2-CG2 4.49Å; T165-V169 WeakPolarHBondContact O-CB 3.46Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 3.43Å
166G64.5Low66.3Low25 Ų2559.6 Ų59.626%0.25832%0.322SS..Hα-helixtrans-59.6-42176.700000113.3S162 V163 Y170S162-G166 PolarHBondContact O-N 3.29Å; V163-G166 PolarHBondContact O-N 2.95Å; G166-Y170 VanDerWaalsContact O-CB 3.3Å; G166-Y170 WeakPolarHBondContact O-CB 3.1Å; G166-Y170 PolarHBondContact O-N 3.45Å
167L65.4Low65.5Low43 Ų4358.8 Ų58.823%0.22532%0.322CS..Hα-helixtrans-74-39177.9-105.974.5000113.4V163 S164 T165 V169 Y170 R171 N178 A181V163-L167 HydrophobicContact CG1-CD1 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.49Å; V163-L167 PolarHBondContact O-N 3.45Å; S164-L167 PolarHBondContact O-N 2.88Å; T165-L167 PolarHBondContact O-N 3.48Å; L167-V169 PolarHBondContact O-N 3.23Å; L167-Y170 PolarHBondContact O-N 3.37Å; L167-R171 PolarHBondContact O-N 2.93Å; L167-N178 HydrophobicContact CB-CB 4.43Å; L167-A181 HydrophobicContact CD2-CB 3.47Å; L167-A181 VanDerWaalsContact CD2-CB 3.47Å
168A61.8Low65.2Low31 Ų3157.2 Ų57.226%0.25631%0.312SS..Hα-helixtrans-59.8-41.3175.900000110.6S164 T165 N172S164-A168 VanDerWaalsContact O-CB 3.27Å; S164-A168 WeakPolarHBondContact O-CB 3.23Å; S164-A168 PolarHBondContact O-N 3.35Å; T165-A168 PolarHBondContact O-N 3.02Å; A168-N172 PolarHBondContact O-N 2.83Å
169V61.5Low64.9Low6 Ų657.5 Ų57.54%0.03631%0.307CS..Hα-helixtrans-69.2-42.2175.8173.40000111.2R68 I72 T165 L167R68-V169 HydrophobicContact CB-CG1 3.73Å; R68-V169 WeakPolarHBondContact CD-O 3.24Å; R68-V169 HydrophobicContact CG-CG1 3.51Å; R68-V169 PolarHBondContact NH1-O 2.79Å; I72-V169 HydrophobicContact CD1-CB 4.01Å; I72-V169 HydrophobicContact CD1-CG1 3.62Å; I72-V169 HydrophobicContact CD1-CG2 3.48Å; I72-V169 VanDerWaalsContact CD1-CG2 3.48Å; T165-V169 HydrophobicContact CG2-CG2 4.49Å; T165-V169 WeakPolarHBondContact O-CB 3.46Å; T165-V169 WeakPolarHBondContact O-CG2 3.22Å; T165-V169 PolarHBondContact O-N 3.43Å; L167-V169 PolarHBondContact O-N 3.23Å
170Y58.9Low64.9Low143 Ų14356.5 Ų56.556%0.56130%0.304SS*.Hα-helixtrans-67.3-40.4-178.2-175.1-102.9000113.1I69 G166 L167I69-Y170 HydrophobicContact CD1-CD2 4.21Å; G166-Y170 VanDerWaalsContact O-CB 3.3Å; G166-Y170 WeakPolarHBondContact O-CB 3.1Å; G166-Y170 PolarHBondContact O-N 3.45Å; L167-Y170 PolarHBondContact O-N 3.37Å
171R56.8Low65.1Low121 Ų12155.8 Ų55.846%0.45731%0.306SS..Hα-helixtrans-102.2-10-167.9-155.8142.472.2160.15.4115.4L167 K173 S177 N178L167-R171 PolarHBondContact O-N 2.93Å; R171-K173 WeakPolarHBondContact O-CB 3.48Å; R171-K173 PolarHBondContact O-N 2.84Å; R171-S177 PolarHBondContact NH2-OG 2.84Å; R171-N178 PolarHBondContact NE-OD1 2.95Å; R171-N178 PolarHBondContact NH2-OD1 3.21Å
172N55.9Low65.2Low74 Ų7455.1 Ų55.140%0.39630%0.302SS..  trans53.113.9175.7-110.5-16.5000115.4F61 R68 A168F61-N172 WeakPolarHBondContact CD1-ND2 3.2Å; F61-N172 WeakPolarHBondContact CD1-OD1 3.22Å; F61-N172 VanDerWaalsContact CE1-CG 3.46Å; F61-N172 VanDerWaalsContact CE1-ND2 3.26Å; F61-N172 WeakPolarHBondContact CE1-ND2 3.29Å; F61-N172 WeakPolarHBondContact CE1-OD1 3.48Å; F61-N172 VanDerWaalsContact CG-ND2 3.27Å; F61-N172 WeakPolarHBondContact CG-ND2 3.36Å; R68-N172 VanDerWaalsContact CZ-OD1 3.26Å; R68-N172 PolarHBondContact NH1-ND2 3.13Å; R68-N172 PolarHBondContact NH1-OD1 3.44Å; R68-N172 PolarHBondContact NH2-OD1 2.94Å; R68-N172 VanDerWaalsContact NH2-OD1 3.07Å; A168-N172 PolarHBondContact O-N 2.83Å
173K53.6Low65.6Low159 Ų15952.2 Ų52.269%0.69128%0.282SS*.  trans-135.394.7-173.4-126.4148.8174.6174.70106R171 A175 N178R171-K173 WeakPolarHBondContact O-CB 3.48Å; R171-K173 PolarHBondContact O-N 2.84Å; K173-A175 VanDerWaalsContact C-N 3.34Å; K173-A175 PolarHBondContact O-N 2.95Å; K173-N178 PolarHBondContact O-ND2 3.31Å
174D53.5Low66.4Low114 Ų11451.5 Ų51.561%0.6128%0.279SS*.  trans-76.687.4-178.5-57.1-39.4000108.7
175A57.5Low67.3Low48 Ų4854 Ų5440%0.39729%0.293SS..SBendtrans-123.7157.3170.500000109.5K173 S177 N178K173-A175 VanDerWaalsContact C-N 3.34Å; K173-A175 PolarHBondContact O-N 2.95Å; A175-S177 PolarHBondContact O-N 3.33Å; A175-N178 PolarHBondContact O-N 2.84Å
176V60.4Low68.2Low53 Ų5352.4 Ų52.432%0.32128%0.283SS..Hα-helixtrans-39.9-30.4169.7-158.90000112N178 Y179 V180 I218V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 3.14Å; V176-Y179 PolarHBondContact O-N 2.92Å; V176-Y179 VanDerWaalsContact O-N 3.08Å; V176-V180 HydrophobicContact CG1-CG2 4.48Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.31Å; V176-I218 HydrophobicContact CG2-CD1 3.76Å
177S65.6Low69.1Low49 Ų4953.2 Ų53.234%0.34328%0.283SS..Hα-helixtrans-52.8-34172.876.30000115.5R171 A175 A181R171-S177 PolarHBondContact NH2-OG 2.84Å; A175-S177 PolarHBondContact O-N 3.33Å; S177-A181 VanDerWaalsContact O-CB 3.23Å; S177-A181 WeakPolarHBondContact O-CB 3.46Å; S177-A181 PolarHBondContact O-N 3.36Å
178N74.8Confident70Confident7 Ų751.3 Ų51.34%0.03727%0.274CS..Hα-helixtrans-74.4-35.2177.8-64.5-20.8000110.9L167 R171 K173 A175 V176 A182L167-N178 HydrophobicContact CB-CB 4.43Å; R171-N178 PolarHBondContact NE-OD1 2.95Å; R171-N178 PolarHBondContact NH2-OD1 3.21Å; K173-N178 PolarHBondContact O-ND2 3.31Å; A175-N178 PolarHBondContact O-N 2.84Å; V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 3.14Å; N178-A182 WeakPolarHBondContact O-CB 3.18Å; N178-A182 PolarHBondContact O-N 3.47Å
179Y73.9Confident71.1Confident63 Ų6354.5 Ų54.525%0.24729%0.286CS..Hα-helixtrans-70.4-37.9173.2-68.7-71.7000111.8F160 V176 G183 V217F160-Y179 HydrophobicContact CE1-CD1 4.36Å; F160-Y179 AromaticContact CZ-CD1 3.89Å; F160-Y179 HydrophobicContact CZ-CD1 3.89Å; V176-Y179 PolarHBondContact O-N 2.92Å; V176-Y179 VanDerWaalsContact O-N 3.08Å; Y179-G183 PolarHBondContact O-N 2.88Å; Y179-V217 HydrophobicContact CE2-CG1 4.45Å
180V78.9Confident72Confident37 Ų3759.3 Ų59.322%0.22431%0.307CS..Hα-helixtrans-63.4-48.8172.9173.80000111V176 G183 A184 A207 I211V176-V180 HydrophobicContact CG1-CG2 4.48Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.31Å; V180-G183 PolarHBondContact O-N 2.88Å; V180-A184 WeakPolarHBondContact O-CB 3.48Å; V180-A184 PolarHBondContact O-N 2.85Å; V180-A207 HydrophobicContact CG1-CB 3.8Å; V180-I211 HydrophobicContact CG2-CB 4.5Å; V180-I211 HydrophobicContact CG2-CG1 3.59Å
181A77.9Confident73.1Confident30 Ų3056.8 Ų56.825%0.24830%0.296CS..Hα-helixtrans-65.5-41.2177.800000111.8L167 S177 G183 A184 V185L167-A181 HydrophobicContact CD2-CB 3.47Å; L167-A181 VanDerWaalsContact CD2-CB 3.47Å; S177-A181 VanDerWaalsContact O-CB 3.23Å; S177-A181 WeakPolarHBondContact O-CB 3.46Å; S177-A181 PolarHBondContact O-N 3.36Å; A181-G183 PolarHBondContact O-N 3.18Å; A181-A184 PolarHBondContact O-N 3.45Å; A181-V185 WeakPolarHBondContact O-CB 3.45Å; A181-V185 VanDerWaalsContact O-CG2 3.25Å; A181-V185 WeakPolarHBondContact O-CG2 3.43Å; A181-V185 PolarHBondContact O-N 3.17Å
182A77.9Confident74.2Confident0 Ų054.4 Ų54.40%029%0.292CS..Hα-helixtrans-63.7-40.6175.600000112F160 V163 N178 T186F160-A182 HydrophobicContact CD2-CB 4.2Å; F160-A182 HydrophobicContact CE2-CB 3.98Å; V163-A182 HydrophobicContact CB-CB 4.34Å; V163-A182 HydrophobicContact CG1-CB 3.78Å; N178-A182 WeakPolarHBondContact O-CB 3.18Å; N178-A182 PolarHBondContact O-N 3.47Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 2.78Å; A182-T186 PolarHBondContact O-OG1 3.41Å
183G81.2Confident75.3Confident5 Ų558.4 Ų58.45%0.05231%0.313CS..Hα-helixtrans-63.3-45.817400000112.1Y179 V180 A181 V185 T186 V187 G206Y179-G183 PolarHBondContact O-N 2.88Å; V180-G183 PolarHBondContact O-N 2.88Å; A181-G183 PolarHBondContact O-N 3.18Å; G183-V185 PolarHBondContact O-N 2.75Å; G183-T186 PolarHBondContact O-N 2.86Å; G183-V187 WeakPolarHBondContact O-CB 3.39Å; G183-V187 VanDerWaalsContact O-CG2 3.3Å; G183-V187 WeakPolarHBondContact O-CG2 3.33Å; G183-V187 PolarHBondContact O-N 3.45Å; G183-G206 VanDerWaalsContact C-C 3.47Å; G183-G206 CarbonylContact C-O 3.47Å; G183-G206 WeakPolarHBondContact O-CA 3.45Å
184A84.7Confident76.5Confident13 Ų1357.2 Ų57.211%0.10731%0.314CS..Hα-helixtrans-59.8-46.7176.700000112.1V180 A181 G188 A207V180-A184 WeakPolarHBondContact O-CB 3.48Å; V180-A184 PolarHBondContact O-N 2.85Å; A181-A184 PolarHBondContact O-N 3.45Å; A184-G188 WeakPolarHBondContact O-CA 3.47Å; A184-G188 PolarHBondContact O-N 3.03Å; A184-A207 HydrophobicContact CB-CB 4.11Å
185V83.1Confident78.2Confident75 Ų7553.4 Ų53.446%0.45530%0.302SS..Hα-helixtrans-67.5-47.3179.2171.80000111.1V163 A181 G183 L189V163-V185 HydrophobicContact CG1-CB 4.3Å; V163-V185 HydrophobicContact CG1-CG1 4.24Å; V163-V185 HydrophobicContact CG2-CG1 4.43Å; A181-V185 WeakPolarHBondContact O-CB 3.45Å; A181-V185 VanDerWaalsContact O-CG2 3.25Å; A181-V185 WeakPolarHBondContact O-CG2 3.43Å; A181-V185 PolarHBondContact O-N 3.17Å; G183-V185 PolarHBondContact O-N 2.75Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 PolarHBondContact O-N 2.84Å
186T83.8Confident79.5Confident5 Ų558.3 Ų58.33%0.03132%0.321CS..Hα-helixtrans-64.2-47.9-176.8-56.10000111.5L159 F160 A182 G183 F190L159-T186 HydrophobicContact CB-CG2 4.1Å; L159-T186 HydrophobicContact CD2-CG2 3.9Å; L159-T186 HydrophobicContact CG-CG2 4.01Å; F160-T186 WeakPolarHBondContact CA-OG1 3.07Å; F160-T186 HydrophobicContact CB-CG2 4.16Å; A182-T186 WeakPolarHBondContact O-CB 3.36Å; A182-T186 PolarHBondContact O-N 2.78Å; A182-T186 PolarHBondContact O-OG1 3.41Å; G183-T186 PolarHBondContact O-N 2.86Å; T186-F190 WeakPolarHBondContact O-CB 3.27Å; T186-F190 PolarHBondContact O-N 3.04Å
187V84.6Confident80.7Confident42 Ų4266.8 Ų66.826%0.25535%0.347SS..Hα-helixtrans-75.6-36.7-178.1-177.70000111G183 F190 R191 G202G183-V187 WeakPolarHBondContact O-CB 3.39Å; G183-V187 VanDerWaalsContact O-CG2 3.3Å; G183-V187 WeakPolarHBondContact O-CG2 3.33Å; G183-V187 PolarHBondContact O-N 3.45Å; V187-F190 PolarHBondContact O-N 3.45Å; V187-R191 PolarHBondContact O-N 3.16Å; V187-R191 VanDerWaalsContact O-N 3.1Å; V187-G202 WeakPolarHBondContact CB-O 3.33Å; V187-G202 WeakPolarHBondContact CG1-O 3.45Å
188G84.6Confident81.7Confident3 Ų365 Ų653%0.03134%0.336CS..Hα-helixtrans-59.5-47.1172.600000111.9A184 R191 L192A184-G188 WeakPolarHBondContact O-CA 3.47Å; A184-G188 PolarHBondContact O-N 3.03Å; G188-R191 PolarHBondContact O-N 3.44Å; G188-L192 PolarHBondContact O-N 3.39Å; G188-L192 VanDerWaalsContact O-N 3.08Å
189L84Confident82.3Confident97 Ų9767.7 Ų67.751%0.50835%0.35SS..Hα-helixtrans-66.4-40.6179.4-161.980.9000111.8L159 V185 R191 L192L159-L189 HydrophobicContact CD2-CD2 4.19Å; V185-L189 WeakPolarHBondContact O-CB 3.41Å; V185-L189 PolarHBondContact O-N 2.84Å; L189-R191 VanDerWaalsContact C-N 3.26Å; L189-R191 PolarHBondContact O-N 3.41Å; L189-L192 HydrophobicContact CB-CD1 4.48Å; L189-L192 HydrophobicContact CD1-CD1 3.42Å; L189-L192 VanDerWaalsContact CD1-CD1 3.42Å; L189-L192 HydrophobicContact CG-CD1 4.12Å; L189-L192 WeakPolarHBondContact O-CB 3.19Å; L189-L192 PolarHBondContact O-N 3.12Å
190F81Confident83.1Confident108 Ų10869 Ų6947%0.47437%0.365SS..Hα-helixtrans-63.4-33.3176.6-174.4-100.4000112.6T186 V187T186-F190 WeakPolarHBondContact O-CB 3.27Å; T186-F190 PolarHBondContact O-N 3.04Å; V187-F190 PolarHBondContact O-N 3.45Å
191R80.8Confident83.6Confident89 Ų8969.4 Ų69.434%0.33637%0.372SS..Hα-helixtrans-90.6-1.4179.1-102.8-179.2161.4-179-2.8115V187 G188 L189 N193 L194 G198 I205V187-R191 PolarHBondContact O-N 3.16Å; V187-R191 VanDerWaalsContact O-N 3.1Å; G188-R191 PolarHBondContact O-N 3.44Å; L189-R191 VanDerWaalsContact C-N 3.26Å; L189-R191 PolarHBondContact O-N 3.41Å; R191-N193 PolarHBondContact O-N 3Å; R191-L194 HydrophobicContact CG-CD1 4.39Å; R191-L194 PolarHBondContact O-N 3.29Å; R191-L194 VanDerWaalsContact O-N 3.08Å; R191-G198 WeakPolarHBondContact CB-O 3.28Å; R191-I205 VanDerWaalsContact NH1-CD1 3.3Å
192L80.9Confident84Confident71 Ų7168 Ų6837%0.37236%0.36SS..G310 helixtrans-57.7-32173.6-88.3170.8000113G188 L189 L194 G195 L199G188-L192 PolarHBondContact O-N 3.39Å; G188-L192 VanDerWaalsContact O-N 3.08Å; L189-L192 HydrophobicContact CB-CD1 4.48Å; L189-L192 HydrophobicContact CD1-CD1 3.42Å; L189-L192 VanDerWaalsContact CD1-CD1 3.42Å; L189-L192 HydrophobicContact CG-CD1 4.12Å; L189-L192 WeakPolarHBondContact O-CB 3.19Å; L189-L192 PolarHBondContact O-N 3.12Å; L192-L194 PolarHBondContact O-N 3.06Å; L192-G195 PolarHBondContact O-N 3.5Å; L192-L199 HydrophobicContact CD1-CD1 4.09Å; L192-L199 HydrophobicContact CD2-CB 3.75Å; L192-L199 HydrophobicContact CD2-CD1 3.28Å; L192-L199 HydrophobicContact CD2-CG 4.12Å; L192-L199 HydrophobicContact CG-CB 4.19Å; L192-L199 HydrophobicContact CG-CD1 3.65Å; L192-L199 HydrophobicContact CG-CG 4.46Å
193N77.6Confident84.5Confident158 Ų15870.1 Ų70.185%0.84538%0.375SS*.G310 helixtrans-67.8-4-179.9-151.310.7000113.1R191R191-N193 PolarHBondContact O-N 3Å
194L80.2Confident84.9Confident134 Ų13474.4 Ų74.470%0.70240%0.4SS*.G310 helixtrans-107.38.9172.1-67.690.5000112.9R191 L192R191-L194 HydrophobicContact CG-CD1 4.39Å; R191-L194 PolarHBondContact O-N 3.29Å; R191-L194 VanDerWaalsContact O-N 3.08Å; L192-L194 PolarHBondContact O-N 3.06Å
195G88.5Confident85.1Confident35 Ų3577.5 Ų77.536%0.36141%0.414SS..  trans99.5176.9177.900000115L192 R197 G198 L199L192-G195 PolarHBondContact O-N 3.5Å; G195-R197 VanDerWaalsContact C-N 3.32Å; G195-R197 PolarHBondContact O-N 2.88Å; G195-G198 WeakPolarHBondContact O-CA 3.28Å; G195-G198 PolarHBondContact O-N 2.88Å; G195-L199 PolarHBondContact O-N 3.37Å
196L85.3Confident85.3Confident150 Ų15074 Ų7479%0.78539%0.392SS*.Hα-helixtrans-59.3-37-177.3-86.5102.5000113.6G198 L199 V200L196-G198 VanDerWaalsContact C-N 3.26Å; L196-G198 PolarHBondContact O-N 2.96Å; L196-L199 PolarHBondContact O-N 2.93Å; L196-V200 PolarHBondContact O-N 2.89Å; L196-V200 VanDerWaalsContact O-N 3.16Å
197R84.6Confident85.4Confident232 Ų23275 Ų7588%0.87540%0.401SS*.Hα-helixtrans-64.8-33.6175.7-70.7-176.7169.9179.3-2.9111.9G195 A201G195-R197 VanDerWaalsContact C-N 3.32Å; G195-R197 PolarHBondContact O-N 2.88Å; R197-A201 WeakPolarHBondContact O-CB 3.31Å; R197-A201 PolarHBondContact O-N 3.08Å; R197-A201 VanDerWaalsContact O-N 3.16Å
198G87.3Confident85.6Confident11 Ų1175.7 Ų75.711%0.11341%0.412CS..Hα-helixtrans-64.5-40.8173.500000112R191 G195 L196 G202R191-G198 WeakPolarHBondContact CB-O 3.28Å; G195-G198 WeakPolarHBondContact O-CA 3.28Å; G195-G198 PolarHBondContact O-N 2.88Å; L196-G198 VanDerWaalsContact C-N 3.26Å; L196-G198 PolarHBondContact O-N 2.96Å; G198-G202 WeakPolarHBondContact O-CA 3.33Å; G198-G202 PolarHBondContact O-N 2.98Å
199L88.1Confident85.6Confident64 Ų6480.4 Ų80.434%0.33544%0.436SS..Hα-helixtrans-63.6-47176.1171.2144.3000112.3L192 G195 L196 G202 S203L192-L199 HydrophobicContact CD1-CD1 4.09Å; L192-L199 HydrophobicContact CD2-CB 3.75Å; L192-L199 HydrophobicContact CD2-CD1 3.28Å; L192-L199 HydrophobicContact CD2-CG 4.12Å; L192-L199 HydrophobicContact CG-CB 4.19Å; L192-L199 HydrophobicContact CG-CD1 3.65Å; L192-L199 HydrophobicContact CG-CG 4.46Å; G195-L199 PolarHBondContact O-N 3.37Å; L196-L199 PolarHBondContact O-N 2.93Å; L199-G202 PolarHBondContact O-N 3.21Å; L199-S203 VanDerWaalsContact O-CB 3.27Å; L199-S203 WeakPolarHBondContact O-CB 3.46Å; L199-S203 PolarHBondContact O-N 2.74Å
200V89.4Confident85.5Confident91 Ų9175.9 Ų75.955%0.55241%0.413SS*.Hα-helixtrans-64.9-47.8-177.9178.60000110.4L196 G202 S203 V204L196-V200 PolarHBondContact O-N 2.89Å; L196-V200 VanDerWaalsContact O-N 3.16Å; V200-G202 VanDerWaalsContact C-N 3.33Å; V200-G202 PolarHBondContact O-N 2.99Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 3.15Å
201A90.3Very high85.7Confident45 Ų4575.3 Ų75.337%0.37241%0.413SS..Hα-helixtrans-63.7-39.1176.500000112.1R197 I205R197-A201 WeakPolarHBondContact O-CB 3.31Å; R197-A201 PolarHBondContact O-N 3.08Å; R197-A201 VanDerWaalsContact O-N 3.16Å; A201-I205 WeakPolarHBondContact O-CB 3.2Å; A201-I205 VanDerWaalsContact O-CD1 3.31Å; A201-I205 WeakPolarHBondContact O-CD1 3.41Å; A201-I205 WeakPolarHBondContact O-CG1 3.41Å; A201-I205 PolarHBondContact O-N 3.18Å
202G87Confident85.9Confident0 Ų074.6 Ų74.60%042%0.42CS..Hα-helixtrans-64.5-40.5176.200000112.8V187 G198 L199 V200 G206V187-G202 WeakPolarHBondContact CB-O 3.33Å; V187-G202 WeakPolarHBondContact CG1-O 3.45Å; G198-G202 WeakPolarHBondContact O-CA 3.33Å; G198-G202 PolarHBondContact O-N 2.98Å; L199-G202 PolarHBondContact O-N 3.21Å; V200-G202 VanDerWaalsContact C-N 3.33Å; V200-G202 PolarHBondContact O-N 2.99Å; G202-G206 WeakPolarHBondContact O-CA 3.42Å; G202-G206 PolarHBondContact O-N 2.9Å
203S87.4Confident85.8Confident44 Ų4474.1 Ų74.131%0.30842%0.42SS..Hα-helixtrans-65.8-45.8177.2-179.40000111.7L199 V200 G206 A207L199-S203 VanDerWaalsContact O-CB 3.27Å; L199-S203 WeakPolarHBondContact O-CB 3.46Å; L199-S203 PolarHBondContact O-N 2.74Å; V200-S203 PolarHBondContact O-N 3.32Å; S203-G206 PolarHBondContact O-N 3.25Å; S203-A207 WeakPolarHBondContact O-CB 3.3Å; S203-A207 PolarHBondContact O-N 3.12Å
204V90.1Very high85.6Confident96 Ų9666.6 Ų66.658%0.58238%0.38SS*.Hα-helixtrans-62.3-46.6177.8175.50000111V200 A207 A208V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 3.15Å; V204-A207 PolarHBondContact O-N 3.47Å; V204-A208 WeakPolarHBondContact O-CB 3.4Å; V204-A208 PolarHBondContact O-N 3.01Å
205I89.3Confident85.7Confident77 Ų7762.9 Ų62.940%0.39537%0.369SS..Hα-helixtrans-65.5-41.8177.2-67.8163.4000110.6R191 A201 A207 A208 L209R191-I205 VanDerWaalsContact NH1-CD1 3.3Å; A201-I205 WeakPolarHBondContact O-CB 3.2Å; A201-I205 VanDerWaalsContact O-CD1 3.31Å; A201-I205 WeakPolarHBondContact O-CD1 3.41Å; A201-I205 WeakPolarHBondContact O-CG1 3.41Å; A201-I205 PolarHBondContact O-N 3.18Å; I205-A207 VanDerWaalsContact C-N 3.35Å; I205-A207 PolarHBondContact O-N 2.85Å; I205-A208 PolarHBondContact O-N 3.27Å; I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.35Å; I205-L209 WeakPolarHBondContact O-CB 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.27Å; I205-L209 PolarHBondContact O-N 2.77Å
206G85.9Confident85.3Confident1 Ų167.6 Ų67.61%0.0138%0.383CS..Hα-helixtrans-63.3-39.2177.700000112.9G183 G202 S203 G210G183-G206 VanDerWaalsContact C-C 3.47Å; G183-G206 CarbonylContact C-O 3.47Å; G183-G206 WeakPolarHBondContact O-CA 3.45Å; G202-G206 WeakPolarHBondContact O-CA 3.42Å; G202-G206 PolarHBondContact O-N 2.9Å; S203-G206 PolarHBondContact O-N 3.25Å; G206-G210 PolarHBondContact O-N 3.24Å
207A87.3Confident84.7Confident26 Ų2662.3 Ų62.322%0.21536%0.357CS..Hα-helixtrans-64-47.7173.700000111.1V180 A184 S203 V204 I205 L209 G210 I211V180-A207 HydrophobicContact CG1-CB 3.8Å; A184-A207 HydrophobicContact CB-CB 4.11Å; S203-A207 WeakPolarHBondContact O-CB 3.3Å; S203-A207 PolarHBondContact O-N 3.12Å; V204-A207 PolarHBondContact O-N 3.47Å; I205-A207 VanDerWaalsContact C-N 3.35Å; I205-A207 PolarHBondContact O-N 2.85Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 3.31Å; A207-G210 PolarHBondContact O-N 2.87Å; A207-G210 VanDerWaalsContact O-N 3.12Å; A207-I211 PolarHBondContact O-N 3.4Å
208A88.5Confident84.3Confident58 Ų5854.9 Ų54.948%0.47933%0.333SS..Hα-helixtrans-61.2-40.6178.800000112.3V204 I205 P212V204-A208 WeakPolarHBondContact O-CB 3.4Å; V204-A208 PolarHBondContact O-N 3.01Å; I205-A208 PolarHBondContact O-N 3.27Å; A208-P212 WeakPolarHBondContact O-CD 3.3Å
209L84.9Confident83.8Confident102 Ų10255.8 Ų55.853%0.53434%0.343SS..Hα-helixtrans-74.5-24.2175.4-68.1176000113.1I205 A207 I211 P212 V213I205-L209 HydrophobicContact CG2-CD1 3.89Å; I205-L209 HydrophobicContact CG2-CG 4.35Å; I205-L209 WeakPolarHBondContact O-CB 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.27Å; I205-L209 PolarHBondContact O-N 2.77Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 3.31Å; L209-I211 VanDerWaalsContact C-N 3.3Å; L209-I211 PolarHBondContact O-N 3.24Å; L209-P212 VanDerWaalsContact O-CD 3.27Å; L209-P212 WeakPolarHBondContact O-CD 3.24Å; L209-P212 WeakPolarHBondContact O-CG 3.48Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.47Å; L209-V213 PolarHBondContact O-N 3.48Å
210G81.8Confident83.1Confident2 Ų257.3 Ų57.32%0.02135%0.351CS..Hα-helixtrans-68.3-26.7176.100000113.6G206 A207 G214G206-G210 PolarHBondContact O-N 3.24Å; A207-G210 PolarHBondContact O-N 2.87Å; A207-G210 VanDerWaalsContact O-N 3.12Å; G210-G214 PolarHBondContact O-N 3.46Å
211I83.6Confident82.2Confident96 Ų9655.6 Ų55.649%0.49234%0.337SS..Hα-helixtrans-64-57.8177.4-58.5171.7000112V180 A207 L209 V213 G214 A215V180-I211 HydrophobicContact CG2-CB 4.5Å; V180-I211 HydrophobicContact CG2-CG1 3.59Å; A207-I211 PolarHBondContact O-N 3.4Å; L209-I211 VanDerWaalsContact C-N 3.3Å; L209-I211 PolarHBondContact O-N 3.24Å; I211-V213 VanDerWaalsContact C-N 3.27Å; I211-V213 PolarHBondContact O-N 2.96Å; I211-G214 PolarHBondContact O-N 3.01Å; I211-A215 WeakPolarHBondContact O-CB 3.25Å; I211-A215 PolarHBondContact O-N 2.93Å
212P85.5Confident81.3Confident73 Ų7357.7 Ų57.747%0.47435%0.349SS..Hα-helixtrans-65.8-31.4179.625.5-34.4000112.1A208 L209 A215 M216A208-P212 WeakPolarHBondContact O-CD 3.3Å; L209-P212 VanDerWaalsContact O-CD 3.27Å; L209-P212 WeakPolarHBondContact O-CD 3.24Å; L209-P212 WeakPolarHBondContact O-CG 3.48Å; P212-A215 PolarHBondContact O-N 3.33Å; P212-M216 WeakPolarHBondContact O-CB 3.37Å; P212-M216 PolarHBondContact O-N 2.71Å
213V78.5Confident80.5Confident62 Ų6265 Ų6538%0.37639%0.388SS..Hα-helixtrans-64.6-47.2173.4172.20000110.8F160 L209 I211 A215 M216 V217F160-V213 HydrophobicContact CE1-CG1 4.18Å; F160-V213 HydrophobicContact CZ-CG1 3.84Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.47Å; L209-V213 PolarHBondContact O-N 3.48Å; I211-V213 VanDerWaalsContact C-N 3.27Å; I211-V213 PolarHBondContact O-N 2.96Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 3.43Å; V213-M216 PolarHBondContact O-N 2.99Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.43Å
214G75.2Confident79.6Confident0 Ų067.9 Ų67.90%040%0.403CS..Hα-helixtrans-61.7-41.8175.500000112.4G210 I211 V217 I218G210-G214 PolarHBondContact O-N 3.46Å; I211-G214 PolarHBondContact O-N 3.01Å; G214-V217 PolarHBondContact O-N 3.2Å; G214-I218 VanDerWaalsContact O-CG1 3.28Å; G214-I218 WeakPolarHBondContact O-CG1 3.27Å; G214-I218 PolarHBondContact O-N 3.31Å
215A80.6Confident77.8Confident56 Ų5666.5 Ų66.546%0.46341%0.409SS..Hα-helixtrans-64.2-41175.400000112.3I211 P212 V213 I218 G219I211-A215 WeakPolarHBondContact O-CB 3.25Å; I211-A215 PolarHBondContact O-N 2.93Å; P212-A215 PolarHBondContact O-N 3.33Å; V213-A215 VanDerWaalsContact C-N 3.34Å; V213-A215 PolarHBondContact O-N 3.43Å; A215-I218 PolarHBondContact O-N 3.07Å; A215-G219 PolarHBondContact O-N 2.88Å
216M80.4Confident76.1Confident133 Ų13368.2 Ų68.266%0.65542%0.415SS*.Hα-helixtrans-66.9-39.6177.8-176.8144.6161.900111.8P212 V213 G219 L220P212-M216 WeakPolarHBondContact O-CB 3.37Å; P212-M216 PolarHBondContact O-N 2.71Å; V213-M216 PolarHBondContact O-N 2.99Å; M216-G219 PolarHBondContact O-N 3.19Å; M216-L220 HydrophobicContact CE-CD1 4.37Å; M216-L220 HydrophobicContact CG-CD1 3.91Å; M216-L220 WeakPolarHBondContact O-CB 3.5Å; M216-L220 WeakPolarHBondContact O-CD1 3.49Å; M216-L220 PolarHBondContact O-N 3.13Å
217V74.1Confident74.6Confident39 Ų3971.5 Ų71.524%0.23644%0.435CS..Hα-helixtrans-63.1-44.9173.9170.60000110.9Y179 V213 G214 G219 L220 Q221Y179-V217 HydrophobicContact CE2-CG1 4.45Å; V213-V217 VanDerWaalsContact O-CG2 3.31Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.43Å; G214-V217 PolarHBondContact O-N 3.2Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 3.33Å; V217-L220 PolarHBondContact O-N 2.82Å; V217-Q221 VanDerWaalsContact CG1-NE2 3.28Å; V217-Q221 WeakPolarHBondContact O-CB 3.41Å; V217-Q221 WeakPolarHBondContact O-CG 3.38Å; V217-Q221 PolarHBondContact O-N 3.48Å
218I75.1Confident73Confident76 Ų7675.3 Ų75.339%0.3945%0.447SS..Hα-helixtrans-61.9-43.3175.4-68166000110.5V176 G214 A215 Q221 S222V176-I218 HydrophobicContact CG2-CD1 3.76Å; G214-I218 VanDerWaalsContact O-CG1 3.28Å; G214-I218 WeakPolarHBondContact O-CG1 3.27Å; G214-I218 PolarHBondContact O-N 3.31Å; A215-I218 PolarHBondContact O-N 3.07Å; I218-Q221 WeakPolarHBondContact O-CB 3.4Å; I218-Q221 PolarHBondContact O-N 3.03Å; I218-S222 PolarHBondContact O-N 2.72Å; I218-S222 PolarHBondContact O-OG 3.19Å; I218-S222 VanDerWaalsContact O-OG 3.12Å
219G77.6Confident71.3Confident31 Ų3179.7 Ų79.732%0.3245%0.451SS..Hα-helixtrans-62.5-44177.300000113.2A215 M216 V217 Q221 S222 L223A215-G219 PolarHBondContact O-N 2.88Å; M216-G219 PolarHBondContact O-N 3.19Å; V217-G219 VanDerWaalsContact C-N 3.33Å; V217-G219 PolarHBondContact O-N 3.33Å; G219-Q221 VanDerWaalsContact C-N 3.31Å; G219-Q221 PolarHBondContact O-N 2.81Å; G219-S222 PolarHBondContact O-N 2.87Å; G219-L223 WeakPolarHBondContact O-CG 3.41Å; G219-L223 PolarHBondContact O-N 3.41Å
220L73.1Confident70Confident96 Ų9678.2 Ų78.250%0.50344%0.441SS..Hα-helixtrans-62-38.8173.9-93.5143.1000111.9M216 V217 L223 T224M216-L220 HydrophobicContact CE-CD1 4.37Å; M216-L220 HydrophobicContact CG-CD1 3.91Å; M216-L220 WeakPolarHBondContact O-CB 3.5Å; M216-L220 WeakPolarHBondContact O-CD1 3.49Å; M216-L220 PolarHBondContact O-N 3.13Å; V217-L220 PolarHBondContact O-N 2.82Å; L220-L223 PolarHBondContact O-N 2.88Å; L220-T224 WeakPolarHBondContact O-CB 3.49Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.49Å
221Q70Confident69Low55 Ų5584.2 Ų84.226%0.25746%0.463SS..Hα-helixtrans-67.9-37.7175.1-71.5171.79.900112.2V217 I218 G219 L223 T224 F228V217-Q221 VanDerWaalsContact CG1-NE2 3.28Å; V217-Q221 WeakPolarHBondContact O-CB 3.41Å; V217-Q221 WeakPolarHBondContact O-CG 3.38Å; V217-Q221 PolarHBondContact O-N 3.48Å; I218-Q221 WeakPolarHBondContact O-CB 3.4Å; I218-Q221 PolarHBondContact O-N 3.03Å; G219-Q221 VanDerWaalsContact C-N 3.31Å; G219-Q221 PolarHBondContact O-N 2.81Å; Q221-L223 VanDerWaalsContact C-N 3.33Å; Q221-T224 PolarHBondContact O-N 3.31Å; Q221-F228 HydrophobicContact CG-CB 4.32Å
222S71.7Confident67.9Low89 Ų8982.3 Ų82.362%0.62245%0.45SS*.Hα-helixtrans-64.8-36.9173.8-62.90000112.3I218 G219I218-S222 PolarHBondContact O-N 2.72Å; I218-S222 PolarHBondContact O-OG 3.19Å; I218-S222 VanDerWaalsContact O-OG 3.12Å; G219-S222 PolarHBondContact O-N 2.87Å
223L69.9Low66.6Low154 Ų15483.4 Ų83.481%0.80645%0.445SS*.Hα-helixtrans-74.9-28.6178-70.2172.2000113.5G219 L220 Q221 G225G219-L223 WeakPolarHBondContact O-CG 3.41Å; G219-L223 PolarHBondContact O-N 3.41Å; L220-L223 PolarHBondContact O-N 2.88Å; Q221-L223 VanDerWaalsContact C-N 3.33Å; L223-G225 PolarHBondContact O-N 3.48Å
224T67.5Low65.9Low103 Ų10386.5 Ų86.563%0.63245%0.449SS*.THydrogen-bonded Turntrans-80.3-3.6-178.9-50.30000112.1L220 Q221 E226L220-T224 WeakPolarHBondContact O-CB 3.49Å; L220-T224 PolarHBondContact O-N 3.37Å; L220-T224 PolarHBondContact O-OG1 3.49Å; Q221-T224 PolarHBondContact O-N 3.31Å; T224-E226 PolarHBondContact O-N 2.91Å
225G54.2Low65.3Low68 Ų6888.5 Ų88.570%0.70146%0.459SS*.SBendtrans72.7-21.5170.600000115.7L223L223-G225 PolarHBondContact O-N 3.48Å
226E51.9Low64.4Low112 Ų11290.9 Ų90.952%0.52346%0.456SS..SBendtrans-110.4108.9172.3-74.7-167.7135.300110.3T224 F228T224-E226 PolarHBondContact O-N 2.91Å; E226-F228 PolarHBondContact O-N 2.92Å
227T54.8Low63.8Low70 Ų7092.4 Ų92.443%0.42945%0.454SS..  trans-61.3124.8175.560.70000109.7R229 E230 R231T227-R229 PolarHBondContact O-N 3.37Å; T227-E230 WeakPolarHBondContact O-CB 3.19Å; T227-E230 PolarHBondContact O-N 2.86Å; T227-R231 PolarHBondContact O-N 2.91Å
228F53.1Low63.8Low107 Ų10795.8 Ų95.847%0.46947%0.467SS..Hα-helixtrans-53.3-25.3178-153.8-94.8000112Q221 E226 R232Q221-F228 HydrophobicContact CG-CB 4.32Å; E226-F228 PolarHBondContact O-N 2.92Å; F228-R232 WeakPolarHBondContact O-CB 3.47Å; F228-R232 PolarHBondContact O-N 3.41Å
229R54Low63.5Low149 Ų14996.3 Ų96.356%0.56247%0.471SS*.Hα-helixtrans-68.3-28.6175.6-150.7-17772.591-0.5114.1T227 R233T227-R229 PolarHBondContact O-N 3.37Å; R229-R233 VanDerWaalsContact CZ-NH2 3.28Å; R229-R233 PolarHBondContact O-NE 2.66Å; R229-R233 PolarHBondContact O-NH2 3.04Å
230E58.3Low62.9Low71 Ų7198.2 Ų98.233%0.33247%0.469SS..Hα-helixtrans-83.2-47.2174.2-15570.3-162.500109.4T227 R232 R233 R234T227-E230 WeakPolarHBondContact O-CB 3.19Å; T227-E230 PolarHBondContact O-N 2.86Å; E230-R232 PolarHBondContact O-N 3.25Å; E230-R233 PolarHBondContact O-N 2.92Å; E230-R233 VanDerWaalsContact O-N 3.13Å; E230-R233 IonicContact OE2-CZ 2.79Å; E230-R233 IonicContact OE2-NH1 3.16Å; E230-R233 IonicContact OE2-NH2 3.97Å; E230-R233 PolarHBondContact OE2-NH2 3.47Å; E230-R234 WeakPolarHBondContact O-CG 3.44Å; E230-R234 PolarHBondContact O-N 3.35Å
231R59.3Low63.2Low128 Ų12899.7 Ų99.748%0.48347%0.473SS..Hα-helixtrans-58.7-46.2177.7-170.3175.4178.21525.8112.6T227 R233 R234 E235T227-R231 PolarHBondContact O-N 2.91Å; R231-R233 VanDerWaalsContact C-N 3.29Å; R231-R233 PolarHBondContact O-N 3.41Å; R231-R234 PolarHBondContact O-N 3.37Å; R231-R234 VanDerWaalsContact O-N 3.14Å; R231-E235 HydrophobicContact CG-CG 4.28Å; R231-E235 VanDerWaalsContact CG-OE1 3.27Å; R231-E235 WeakPolarHBondContact CG-OE1 3.23Å; R231-E235 IonicContact CZ-OE1 3.91Å; R231-E235 IonicContact NE-OE1 2.93Å; R231-E235 PolarHBondContact NE-OE1 2.71Å; R231-E235 WeakPolarHBondContact O-CB 3.27Å; R231-E235 WeakPolarHBondContact O-CG 3.48Å; R231-E235 PolarHBondContact O-N 3.02Å
232R60.4Low63.5Low57 Ų57102.2 Ų102.222%0.21549%0.488CS..Hα-helixtrans-64.2-31.7176.9-158.881.4-166.5130.54.1113E84 F228 E230 E235 R236E84-R232 VanDerWaalsContact CD-NH2 3.27Å; E84-R232 IonicContact OE1-CZ 3.93Å; E84-R232 IonicContact OE1-NE 3.93Å; E84-R232 IonicContact OE1-NH2 3.85Å; E84-R232 PolarHBondContact OE1-NH2 2.95Å; F228-R232 WeakPolarHBondContact O-CB 3.47Å; F228-R232 PolarHBondContact O-N 3.41Å; E230-R232 PolarHBondContact O-N 3.25Å; R232-E235 IonicContact NH1-OE2 2.65Å; R232-E235 PolarHBondContact NH1-OE2 3.11Å; R232-E235 VanDerWaalsContact NH1-OE2 3.16Å; R232-R236 WeakPolarHBondContact O-CG 3.39Å; R232-R236 PolarHBondContact O-N 3.08Å
233R58.8Low63.7Low96 Ų96103.4 Ų103.436%0.36248%0.482SS..Hα-helixtrans-75.5-32.6175.1-93.7-176.3-72144.812.2111.8R229 E230 R231 R237R229-R233 VanDerWaalsContact CZ-NH2 3.28Å; R229-R233 PolarHBondContact O-NE 2.66Å; R229-R233 PolarHBondContact O-NH2 3.04Å; E230-R233 PolarHBondContact O-N 2.92Å; E230-R233 VanDerWaalsContact O-N 3.13Å; E230-R233 IonicContact OE2-CZ 2.79Å; E230-R233 IonicContact OE2-NH1 3.16Å; E230-R233 IonicContact OE2-NH2 3.97Å; E230-R233 PolarHBondContact OE2-NH2 3.47Å; R231-R233 VanDerWaalsContact C-N 3.29Å; R231-R233 PolarHBondContact O-N 3.41Å; R233-R237 VanDerWaalsContact O-CG 3.23Å; R233-R237 WeakPolarHBondContact O-CG 3.38Å; R233-R237 PolarHBondContact O-N 2.85Å
234R63.6Low64.1Low126 Ų12699.5 Ų99.548%0.47546%0.461SS..Hα-helixtrans-73.3-52175.4-70.2178.4-173.4178.31.3111.7E230 R231 R236 R237 E238E230-R234 WeakPolarHBondContact O-CG 3.44Å; E230-R234 PolarHBondContact O-N 3.35Å; R231-R234 PolarHBondContact O-N 3.37Å; R231-R234 VanDerWaalsContact O-N 3.14Å; R234-R236 VanDerWaalsContact C-N 3.25Å; R234-R236 PolarHBondContact O-N 3.39Å; R234-R237 WeakPolarHBondContact O-CA 3.32Å; R234-R237 WeakPolarHBondContact O-CB 3.31Å; R234-R237 PolarHBondContact O-N 3.4Å; R234-E238 WeakPolarHBondContact O-CG 3.29Å; R234-E238 PolarHBondContact O-N 3.39Å
235E63.8Low64.9Low43 Ų4397.1 Ų97.120%0.20145%0.452CS..Hα-helixtrans-55-40178.3-71.7170.417800111.9R231 R232 L239R231-E235 HydrophobicContact CG-CG 4.28Å; R231-E235 VanDerWaalsContact CG-OE1 3.27Å; R231-E235 WeakPolarHBondContact CG-OE1 3.23Å; R231-E235 IonicContact CZ-OE1 3.91Å; R231-E235 IonicContact NE-OE1 2.93Å; R231-E235 PolarHBondContact NE-OE1 2.71Å; R231-E235 WeakPolarHBondContact O-CB 3.27Å; R231-E235 WeakPolarHBondContact O-CG 3.48Å; R231-E235 PolarHBondContact O-N 3.02Å; R232-E235 IonicContact NH1-OE2 2.65Å; R232-E235 PolarHBondContact NH1-OE2 3.11Å; R232-E235 VanDerWaalsContact NH1-OE2 3.16Å; E235-L239 WeakPolarHBondContact O-CB 3.37Å; E235-L239 VanDerWaalsContact O-CG 3.3Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.5Å
236R59.9Low66.1Low106 Ų10699.4 Ų99.440%0.445%0.445SS..Hα-helixtrans-72.5-31.3175.9-71-172.9-157.3-106.6-0.9113.7E84 R232 R234 Y240E84-R236 IonicContact OE1-CZ 3.61Å; E84-R236 IonicContact OE1-NH1 3.64Å; E84-R236 IonicContact OE1-NH2 3.15Å; E84-R236 PolarHBondContact OE1-NH2 2.96Å; E84-R236 VanDerWaalsContact OE1-NH2 3.15Å; R232-R236 WeakPolarHBondContact O-CG 3.39Å; R232-R236 PolarHBondContact O-N 3.08Å; R234-R236 VanDerWaalsContact C-N 3.25Å; R234-R236 PolarHBondContact O-N 3.39Å; R236-Y240 WeakPolarHBondContact O-CB 3.39Å; R236-Y240 PolarHBondContact O-N 2.87Å; R236-Y240 VanDerWaalsContact O-N 3.1Å
237R68.6Low67.2Low164 Ų16498 Ų9862%0.61943%0.434SS*.Hα-helixtrans-68.8-45.6173.7-77.5172.5-167.9-105.41.8110.3R233 R234 L239 Y240 E241R233-R237 VanDerWaalsContact O-CG 3.23Å; R233-R237 WeakPolarHBondContact O-CG 3.38Å; R233-R237 PolarHBondContact O-N 2.85Å; R234-R237 WeakPolarHBondContact O-CA 3.32Å; R234-R237 WeakPolarHBondContact O-CB 3.31Å; R234-R237 PolarHBondContact O-N 3.4Å; R237-L239 VanDerWaalsContact C-N 3.35Å; R237-L239 PolarHBondContact O-N 2.91Å; R237-Y240 PolarHBondContact O-N 3.48Å; R237-Y240 VanDerWaalsContact O-N 3.12Å; R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.2Å; R237-E241 PolarHBondContact O-N 3.38Å
238E74.2Confident68.6Low110 Ų11097.5 Ų97.551%0.51443%0.434SS..Hα-helixtrans-59.3-45.7177.4-69.4167.2-16400111.1R234 Y240 E241 L242R234-E238 WeakPolarHBondContact O-CG 3.29Å; R234-E238 PolarHBondContact O-N 3.39Å; E238-Y240 VanDerWaalsContact C-N 3.33Å; E238-Y240 PolarHBondContact O-N 3.39Å; E238-E241 PolarHBondContact O-N 3.21Å; E238-L242 VanDerWaalsContact O-CG 3.3Å; E238-L242 WeakPolarHBondContact O-CG 3.24Å; E238-L242 PolarHBondContact O-N 3.43Å
239L68.4Low70.2Confident87 Ų8794.6 Ų94.646%0.45543%0.43SS..Hα-helixtrans-62.6-37.5175-75.8166.5000113.1E235 R237 K243E235-L239 WeakPolarHBondContact O-CB 3.37Å; E235-L239 VanDerWaalsContact O-CG 3.3Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.5Å; R237-L239 VanDerWaalsContact C-N 3.35Å; R237-L239 PolarHBondContact O-N 2.91Å; L239-K243 PolarHBondContact O-N 3.27Å; L239-K243 VanDerWaalsContact O-N 3.08Å
240Y66.4Low71.5Confident72 Ų7294.3 Ų94.328%0.28243%0.429SS..Hα-helixtrans-70.7-41.7178.3-179.2-105.5000111.9P59 R236 R237 E238 L242 K243 L244P59-Y240 HydrophobicContact CB-CD1 4.38Å; P59-Y240 HydrophobicContact CB-CD2 4.03Å; P59-Y240 HydrophobicContact CB-CE1 4.16Å; P59-Y240 HydrophobicContact CB-CE2 3.83Å; P59-Y240 HydrophobicContact CB-CG 4.3Å; P59-Y240 WeakPolarHBondContact CD-OH 3.43Å; P59-Y240 HydrophobicContact CG-CE1 3.97Å; P59-Y240 HydrophobicContact CG-CE2 3.86Å; R236-Y240 WeakPolarHBondContact O-CB 3.39Å; R236-Y240 PolarHBondContact O-N 2.87Å; R236-Y240 VanDerWaalsContact O-N 3.1Å; R237-Y240 PolarHBondContact O-N 3.48Å; R237-Y240 VanDerWaalsContact O-N 3.12Å; E238-Y240 VanDerWaalsContact C-N 3.33Å; E238-Y240 PolarHBondContact O-N 3.39Å; Y240-L242 VanDerWaalsContact C-N 3.31Å; Y240-L242 PolarHBondContact O-N 3.07Å; Y240-K243 PolarHBondContact O-N 2.91Å; Y240-L244 HydrophobicContact CD1-CD1 3.69Å; Y240-L244 HydrophobicContact CD1-CG 4.24Å; Y240-L244 HydrophobicContact CE1-CD1 3.17Å; Y240-L244 HydrophobicContact CE1-CD2 4.47Å; Y240-L244 HydrophobicContact CE1-CG 3.81Å; Y240-L244 HydrophobicContact CE2-CG 4.34Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 WeakPolarHBondContact O-CG 3.25Å; Y240-L244 PolarHBondContact O-N 3.39Å
241E77.9Confident72.6Confident126 Ų12695.8 Ų95.859%0.58944%0.438SS*.Hα-helixtrans-61.4-40.1175-74.6176.3-172.600111.3R237 E238 L244 A245R237-E241 WeakPolarHBondContact O-CB 3.41Å; R237-E241 WeakPolarHBondContact O-CG 3.2Å; R237-E241 PolarHBondContact O-N 3.38Å; E238-E241 PolarHBondContact O-N 3.21Å; E241-L244 PolarHBondContact O-N 3.39Å; E241-A245 WeakPolarHBondContact O-CB 3.4Å; E241-A245 PolarHBondContact O-N 2.99Å
242L76.1Confident73.9Confident109 Ų10996.3 Ų96.357%0.57145%0.446SS*.Hα-helixtrans-63.5-46.1173.5-70.5173.2000112.4E238 Y240 L244 A245 E246E238-L242 VanDerWaalsContact O-CG 3.3Å; E238-L242 WeakPolarHBondContact O-CG 3.24Å; E238-L242 PolarHBondContact O-N 3.43Å; Y240-L242 VanDerWaalsContact C-N 3.31Å; Y240-L242 PolarHBondContact O-N 3.07Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.35Å; L242-A245 WeakPolarHBondContact O-CB 3.23Å; L242-A245 PolarHBondContact O-N 3.47Å; L242-E246 WeakPolarHBondContact O-CG 3.48Å; L242-E246 PolarHBondContact O-N 3.39Å
243K77.2Confident75Confident113 Ų11398.6 Ų98.649%0.49146%0.462SS..Hα-helixtrans-63.4-38.2177-74.9-167.6176.4-167.10112D76 L239 Y240 W247D76-K243 IonicContact OD2-NZ 3.68Å; L239-K243 PolarHBondContact O-N 3.27Å; L239-K243 VanDerWaalsContact O-N 3.08Å; Y240-K243 PolarHBondContact O-N 2.91Å; K243-W247 WeakPolarHBondContact O-CB 3.1Å; K243-W247 PolarHBondContact O-N 2.87Å
244L77.8Confident76.3Confident73 Ų7397.7 Ų97.738%0.38247%0.468SS..Hα-helixtrans-64-42.6173.8-81.9177.5000111.8Y240 E241 L242 W247 S248Y240-L244 HydrophobicContact CD1-CD1 3.69Å; Y240-L244 HydrophobicContact CD1-CG 4.24Å; Y240-L244 HydrophobicContact CE1-CD1 3.17Å; Y240-L244 HydrophobicContact CE1-CD2 4.47Å; Y240-L244 HydrophobicContact CE1-CG 3.81Å; Y240-L244 HydrophobicContact CE2-CG 4.34Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 WeakPolarHBondContact O-CG 3.25Å; Y240-L244 PolarHBondContact O-N 3.39Å; E241-L244 PolarHBondContact O-N 3.39Å; L242-L244 VanDerWaalsContact C-N 3.32Å; L242-L244 PolarHBondContact O-N 3.35Å; L244-W247 PolarHBondContact O-N 3.43Å; L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 2.89Å; L244-S248 PolarHBondContact O-OG 2.92Å
245A83.4Confident77.5Confident53 Ų5397.1 Ų97.144%0.43847%0.474SS..Hα-helixtrans-61.6-47.9177.700000111E241 L242 W247 S248 A249E241-A245 WeakPolarHBondContact O-CB 3.4Å; E241-A245 PolarHBondContact O-N 2.99Å; L242-A245 WeakPolarHBondContact O-CB 3.23Å; L242-A245 PolarHBondContact O-N 3.47Å; A245-W247 VanDerWaalsContact C-N 3.3Å; A245-W247 PolarHBondContact O-N 3.38Å; A245-S248 PolarHBondContact O-N 3.5Å; A245-S248 PolarHBondContact O-OG 3.32Å; A245-A249 PolarHBondContact O-N 3.29Å
246E79.9Confident78.7Confident116 Ų116101.5 Ų101.554%0.54249%0.494SS..Hα-helixtrans-59.3-40.5175.8-72.5-179.7-178.600112.3L242 A249 R250L242-E246 WeakPolarHBondContact O-CG 3.48Å; L242-E246 PolarHBondContact O-N 3.39Å; E246-A249 PolarHBondContact O-N 2.95Å; E246-R250 WeakPolarHBondContact O-CG 3.4Å; E246-R250 PolarHBondContact O-N 3.44Å; E246-R250 VanDerWaalsContact O-N 3.08Å
247W75.6Confident79.9Confident81 Ų81101.5 Ų101.531%0.30750%0.502SS..Hα-helixtrans-67.6-43.7176.8-9883.4000113.1P53 I56 K243 L244 A245 A249 R250 L251P53-W247 HydrophobicContact CB-CH2 4.35Å; P53-W247 HydrophobicContact CG-CE3 4.37Å; P53-W247 HydrophobicContact CG-CH2 3.4Å; P53-W247 VanDerWaalsContact CG-CH2 3.4Å; P53-W247 HydrophobicContact CG-CZ2 4.18Å; P53-W247 HydrophobicContact CG-CZ3 3.53Å; I56-W247 HydrophobicContact CD1-CD2 3.51Å; I56-W247 HydrophobicContact CD1-CE3 4.15Å; I56-W247 HydrophobicContact CD1-CG 4.03Å; I56-W247 HydrophobicContact CD1-CH2 3.78Å; I56-W247 HydrophobicContact CD1-CZ2 3.08Å; I56-W247 HydrophobicContact CD1-CZ3 4.27Å; I56-W247 HydrophobicContact CG1-CD2 4.09Å; I56-W247 HydrophobicContact CG1-CG 4.09Å; I56-W247 HydrophobicContact CG1-CZ2 4.35Å; K243-W247 WeakPolarHBondContact O-CB 3.1Å; K243-W247 PolarHBondContact O-N 2.87Å; L244-W247 PolarHBondContact O-N 3.43Å; A245-W247 VanDerWaalsContact C-N 3.3Å; A245-W247 PolarHBondContact O-N 3.38Å; W247-A249 PolarHBondContact O-N 3.4Å; W247-R250 PolarHBondContact O-N 3.02Å; W247-R250 VanDerWaalsContact O-N 3.13Å; W247-L251 HydrophobicContact CE3-CD1 3.58Å; W247-L251 HydrophobicContact CZ3-CD1 4.05Å; W247-L251 VanDerWaalsContact O-CD1 3.25Å; W247-L251 WeakPolarHBondContact O-CD1 3.48Å; W247-L251 PolarHBondContact O-N 3.18Å
248S83.9Confident80.7Confident61 Ų6198.3 Ų98.343%0.42750%0.496SS..Hα-helixtrans-60-38.817773.50000111.3L244 A245 L251 Q252L244-S248 WeakPolarHBondContact O-CB 3.44Å; L244-S248 PolarHBondContact O-N 2.89Å; L244-S248 PolarHBondContact O-OG 2.92Å; A245-S248 PolarHBondContact O-N 3.5Å; A245-S248 PolarHBondContact O-OG 3.32Å; S248-L251 PolarHBondContact O-N 2.83Å; S248-Q252 WeakPolarHBondContact O-CG 3.13Å; S248-Q252 PolarHBondContact O-N 3.2Å; S248-Q252 VanDerWaalsContact O-N 3.08Å
249A86.3Confident81.4Confident46 Ų4697.5 Ų97.538%0.3850%0.495SS..Hα-helixtrans-65.5-40.517500000112.3A245 E246 W247 Q252 L253A245-A249 PolarHBondContact O-N 3.29Å; E246-A249 PolarHBondContact O-N 2.95Å; W247-A249 PolarHBondContact O-N 3.4Å; A249-Q252 PolarHBondContact O-N 3.5Å; A249-L253 PolarHBondContact O-N 2.86Å
250R81.1Confident82Confident143 Ų14396 Ų9654%0.5449%0.492SS..Hα-helixtrans-66-37.6176-72.9177.1179.2-169.41.4112.7E246 W247 T254E246-R250 WeakPolarHBondContact O-CG 3.4Å; E246-R250 PolarHBondContact O-N 3.44Å; E246-R250 VanDerWaalsContact O-N 3.08Å; W247-R250 PolarHBondContact O-N 3.02Å; W247-R250 VanDerWaalsContact O-N 3.13Å; R250-T254 PolarHBondContact O-N 2.93Å; R250-T254 PolarHBondContact O-OG1 3.36Å
251L82.4Confident82.7Confident101 Ų10197.6 Ų97.653%0.52951%0.505SS..Hα-helixtrans-64.2-45.4175.1-95.188.2000111.1W247 S248 L253 T254 D255W247-L251 HydrophobicContact CE3-CD1 3.58Å; W247-L251 HydrophobicContact CZ3-CD1 4.05Å; W247-L251 VanDerWaalsContact O-CD1 3.25Å; W247-L251 WeakPolarHBondContact O-CD1 3.48Å; W247-L251 PolarHBondContact O-N 3.18Å; S248-L251 PolarHBondContact O-N 2.83Å; L251-L253 VanDerWaalsContact C-N 3.32Å; L251-L253 PolarHBondContact O-N 3.21Å; L251-T254 PolarHBondContact O-N 3.47Å; L251-T254 VanDerWaalsContact O-N 3.11Å; L251-D255 WeakPolarHBondContact O-CB 3.39Å; L251-D255 PolarHBondContact O-N 3.32Å
252Q86.6Confident82.9Confident140 Ų14096.8 Ų96.865%0.65450%0.504SS*.Hα-helixtrans-58-44.4178.8-74.8177.6-5.300112.3S248 A249 T254 D255 E256S248-Q252 WeakPolarHBondContact O-CG 3.13Å; S248-Q252 PolarHBondContact O-N 3.2Å; S248-Q252 VanDerWaalsContact O-N 3.08Å; A249-Q252 PolarHBondContact O-N 3.5Å; Q252-T254 PolarHBondContact O-N 3.06Å; Q252-D255 PolarHBondContact O-N 3.5Å; Q252-E256 WeakPolarHBondContact O-CB 3.26Å; Q252-E256 PolarHBondContact O-N 3.1Å
253L83.9Confident82.9Confident104 Ų10496.6 Ų96.655%0.54550%0.503SS..Hα-helixtrans-62.7-43.1175.3-67.9177.1000111.8A249 L251 D255 E256 L257A249-L253 PolarHBondContact O-N 2.86Å; L251-L253 VanDerWaalsContact C-N 3.32Å; L251-L253 PolarHBondContact O-N 3.21Å; L253-D255 VanDerWaalsContact C-N 3.32Å; L253-D255 PolarHBondContact O-N 2.94Å; L253-E256 PolarHBondContact O-N 3.37Å; L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 WeakPolarHBondContact O-CD1 3.48Å; L253-L257 PolarHBondContact O-N 2.88Å
254T85.9Confident82.5Confident78 Ų7895.4 Ų95.448%0.47951%0.509SS..Hα-helixtrans-65.2-38.5179.8-51.30000111.5R250 L251 Q252 L257 I258R250-T254 PolarHBondContact O-N 2.93Å; R250-T254 PolarHBondContact O-OG1 3.36Å; L251-T254 PolarHBondContact O-N 3.47Å; L251-T254 VanDerWaalsContact O-N 3.11Å; Q252-T254 PolarHBondContact O-N 3.06Å; T254-L257 WeakPolarHBondContact O-CB 3.4Å; T254-L257 PolarHBondContact O-N 3.48Å; T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.26Å; T254-I258 WeakPolarHBondContact O-CG1 3.13Å; T254-I258 PolarHBondContact O-N 3.05Å
255D87.7Confident82Confident114 Ų11495.4 Ų95.461%0.6151%0.512SS*.Hα-helixtrans-68.3-40.8178.9-142.528.2000111.1L251 Q252 L253 L257 I258 D259L251-D255 WeakPolarHBondContact O-CB 3.39Å; L251-D255 PolarHBondContact O-N 3.32Å; Q252-D255 PolarHBondContact O-N 3.5Å; L253-D255 VanDerWaalsContact C-N 3.32Å; L253-D255 PolarHBondContact O-N 2.94Å; D255-L257 PolarHBondContact O-N 2.95Å; D255-I258 PolarHBondContact O-N 2.87Å; D255-D259 WeakPolarHBondContact O-CB 3.42Å; D255-D259 PolarHBondContact O-N 3.26Å
256E88.8Confident81.3Confident135 Ų13598 Ų9863%0.63152%0.515SS*.Hα-helixtrans-63.2-40.1172.6-174.5-179.517700112.2Q252 L253 D259 S260Q252-E256 WeakPolarHBondContact O-CB 3.26Å; Q252-E256 PolarHBondContact O-N 3.1Å; L253-E256 PolarHBondContact O-N 3.37Å; E256-D259 PolarHBondContact O-N 3.35Å; E256-S260 WeakPolarHBondContact O-CB 3.31Å; E256-S260 PolarHBondContact O-N 3.46Å; E256-S260 PolarHBondContact O-OG 3.04Å
257L86.1Confident80.6Confident106 Ų10696.6 Ų96.656%0.55552%0.515SS*.Hα-helixtrans-63.8-39.7173.1-89138.4000112L253 T254 D255 S260 L261L253-L257 WeakPolarHBondContact O-CB 3.34Å; L253-L257 WeakPolarHBondContact O-CD1 3.48Å; L253-L257 PolarHBondContact O-N 2.88Å; T254-L257 WeakPolarHBondContact O-CB 3.4Å; T254-L257 PolarHBondContact O-N 3.48Å; D255-L257 PolarHBondContact O-N 2.95Å; L257-S260 WeakPolarHBondContact CA-OG 3.38Å; L257-S260 PolarHBondContact O-OG 3.41Å; L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CD1 3.32Å; L257-L261 PolarHBondContact O-N 3.46Å
258I86Confident80.1Confident96 Ų9698.1 Ų98.149%0.49253%0.526SS..Hα-helixtrans-69.6-42.8176.8-71.1165.8000110.9T254 D255 L261 N262T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.26Å; T254-I258 WeakPolarHBondContact O-CG1 3.13Å; T254-I258 PolarHBondContact O-N 3.05Å; D255-I258 PolarHBondContact O-N 2.87Å; I258-L261 WeakPolarHBondContact O-CB 3.36Å; I258-L261 PolarHBondContact O-N 3.09Å; I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.14Å
259D87.4Confident79.4Confident93 Ų93100.3 Ų100.350%0.49753%0.53SS..Hα-helixtrans-66.2-43179.3-165.946.5000111.4D255 E256 L261 N262 I263D255-D259 WeakPolarHBondContact O-CB 3.42Å; D255-D259 PolarHBondContact O-N 3.26Å; E256-D259 PolarHBondContact O-N 3.35Å; D259-L261 VanDerWaalsContact C-N 3.34Å; D259-L261 PolarHBondContact O-N 2.95Å; D259-N262 PolarHBondContact O-N 3.33Å; D259-I263 WeakPolarHBondContact O-CB 3.4Å; D259-I263 WeakPolarHBondContact O-CD1 3.47Å; D259-I263 VanDerWaalsContact O-CG1 3.24Å; D259-I263 WeakPolarHBondContact O-CG1 3.32Å; D259-I263 PolarHBondContact O-N 3.49Å
260S82.3Confident78.7Confident55 Ų55100.5 Ų100.539%0.38553%0.526SS..Hα-helixtrans-63.9-36.2173.458.20000113.3E256 L257 S264E256-S260 WeakPolarHBondContact O-CB 3.31Å; E256-S260 PolarHBondContact O-N 3.46Å; E256-S260 PolarHBondContact O-OG 3.04Å; L257-S260 WeakPolarHBondContact CA-OG 3.38Å; L257-S260 PolarHBondContact O-OG 3.41Å; S260-S264 WeakPolarHBondContact O-CB 3.45Å; S260-S264 PolarHBondContact O-N 3.07Å; S260-S264 PolarHBondContact O-OG 3.36Å
261L80.9Confident78.5Confident106 Ų10697.8 Ų97.856%0.55552%0.522SS*.Hα-helixtrans-64.8-44.2170.6-91.4157.6000111.3L257 I258 D259 I263 S264 V265L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CD1 3.32Å; L257-L261 PolarHBondContact O-N 3.46Å; I258-L261 WeakPolarHBondContact O-CB 3.36Å; I258-L261 PolarHBondContact O-N 3.09Å; D259-L261 VanDerWaalsContact C-N 3.34Å; D259-L261 PolarHBondContact O-N 2.95Å; L261-I263 VanDerWaalsContact C-N 3.35Å; L261-I263 PolarHBondContact O-N 2.97Å; L261-S264 PolarHBondContact O-N 3.36Å; L261-V265 VanDerWaalsContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.5Å; L261-V265 PolarHBondContact O-N 3.03Å
262N81.4Confident78.4Confident109 Ų10998.2 Ų98.258%0.58352%0.52SS*.Hα-helixtrans-66.5-34178.2-174.161.1000112.8I258 D259 V265I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.14Å; D259-N262 PolarHBondContact O-N 3.33Å; N262-V265 CarbonylContact O-C 3.27Å; N262-V265 VanDerWaalsContact O-C 3.27Å
263I75.9Confident78.1Confident106 Ų10695.9 Ų95.954%0.54451%0.512SS..Hα-helixtrans-69.9-38.8173.6-68.6162.7000111D259 L261D259-I263 WeakPolarHBondContact O-CB 3.4Å; D259-I263 WeakPolarHBondContact O-CD1 3.47Å; D259-I263 VanDerWaalsContact O-CG1 3.24Å; D259-I263 WeakPolarHBondContact O-CG1 3.32Å; D259-I263 PolarHBondContact O-N 3.49Å; L261-I263 VanDerWaalsContact C-N 3.35Å; L261-I263 PolarHBondContact O-N 2.97Å
264S69.3Low78Confident88 Ų8896 Ų9662%0.61551%0.513SS*.Hα-helixtrans-71.9-35.9176.5-58.60000111.9S260 L261 Q266S260-S264 WeakPolarHBondContact O-CB 3.45Å; S260-S264 PolarHBondContact O-N 3.07Å; S260-S264 PolarHBondContact O-OG 3.36Å; L261-S264 PolarHBondContact O-N 3.36Å; S264-Q266 PolarHBondContact O-N 3.32Å; S264-Q266 VanDerWaalsContact O-N 3.12Å
265V66.3Low77.8Confident72 Ų7298.6 Ų98.644%0.43652%0.519SS..SBendtrans-86.163.4171.8-175.90000107.7L261 N262 T270L261-V265 VanDerWaalsContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CB 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.5Å; L261-V265 PolarHBondContact O-N 3.03Å; N262-V265 CarbonylContact O-C 3.27Å; N262-V265 VanDerWaalsContact O-C 3.27Å; V265-T270 HydrophobicContact CG1-CG2 3.38Å
266Q70Confident77.6Confident109 Ų10999.2 Ų99.251%0.50952%0.516SS..  trans-58.6137.2168.2-98.4-175.716.100108.9S264 E268 E269 T270S264-Q266 PolarHBondContact O-N 3.32Å; S264-Q266 VanDerWaalsContact O-N 3.12Å; Q266-E268 HydrophobicContact CB-CB 4.4Å; Q266-E268 PolarHBondContact O-N 2.88Å; Q266-E269 HydrophobicContact CB-CG 4.26Å; Q266-E269 PolarHBondContact O-N 3.04Å; Q266-T270 PolarHBondContact O-N 2.94Å
267P64.1Low77.3Confident85 Ų8597 Ų9755%0.55251%0.508SS*.Hα-helixtrans-56.6-27.8176.123-33000111.6T270 N271P267-T270 WeakPolarHBondContact CA-OG1 3.44Å; P267-T270 PolarHBondContact O-N 2.95Å; P267-T270 PolarHBondContact O-OG1 3.31Å; P267-N271 WeakPolarHBondContact O-CB 3.38Å; P267-N271 PolarHBondContact O-N 3.27Å; P267-N271 PolarHBondContact O-ND2 3.12Å
268E65.6Low77.1Confident114 Ų11498.7 Ų98.753%0.53351%0.513SS..Hα-helixtrans-62-41.5173.2-70-66.5148.800113.5Q266 K272Q266-E268 HydrophobicContact CB-CB 4.4Å; Q266-E268 PolarHBondContact O-N 2.88Å; E268-K272 VanDerWaalsContact O-CD 3.31Å; E268-K272 WeakPolarHBondContact O-CD 3.43Å; E268-K272 WeakPolarHBondContact O-CG 3.31Å; E268-K272 PolarHBondContact O-N 3.26Å
269E69.8Low77Confident107 Ų107100 Ų10050%0.552%0.517SS..Hα-helixtrans-71.1-42.3176.9-64-96.6126.200110.1Q266 N271 K272 D273Q266-E269 HydrophobicContact CB-CG 4.26Å; Q266-E269 PolarHBondContact O-N 3.04Å; E269-N271 PolarHBondContact O-N 3.42Å; E269-K272 PolarHBondContact O-N 3.41Å; E269-D273 PolarHBondContact O-N 3.45Å
270T71.7Confident76.5Confident50 Ų50101 Ų10131%0.30752%0.522SS..Hα-helixtrans-65.8-36.317958.60000113.5V265 Q266 P267 D273 L274V265-T270 HydrophobicContact CG1-CG2 3.38Å; Q266-T270 PolarHBondContact O-N 2.94Å; P267-T270 WeakPolarHBondContact CA-OG1 3.44Å; P267-T270 PolarHBondContact O-N 2.95Å; P267-T270 PolarHBondContact O-OG1 3.31Å; T270-D273 PolarHBondContact O-N 2.95Å; T270-L274 WeakPolarHBondContact O-CB 3.44Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.38Å; T270-L274 PolarHBondContact O-N 3.02Å
271N77.1Confident76.2Confident86 Ų86105 Ų10546%0.4654%0.538SS..Hα-helixtrans-68.7-41.7175.7-79.1-57.2000110.6P267 E269 D273 L274 E275P267-N271 WeakPolarHBondContact O-CB 3.38Å; P267-N271 PolarHBondContact O-N 3.27Å; P267-N271 PolarHBondContact O-ND2 3.12Å; E269-N271 PolarHBondContact O-N 3.42Å; N271-D273 VanDerWaalsContact C-N 3.34Å; N271-D273 PolarHBondContact O-N 3.37Å; N271-L274 PolarHBondContact O-N 3.16Å; N271-E275 WeakPolarHBondContact O-CG 3.2Å; N271-E275 PolarHBondContact O-N 3.13Å
272K79Confident76Confident110 Ų110104.1 Ų104.148%0.47854%0.541SS..Hα-helixtrans-61.7-40.6174.2-71166.5-168.4165.70112.3E268 E269 K276E268-K272 VanDerWaalsContact O-CD 3.31Å; E268-K272 WeakPolarHBondContact O-CD 3.43Å; E268-K272 WeakPolarHBondContact O-CG 3.31Å; E268-K272 PolarHBondContact O-N 3.26Å; E269-K272 PolarHBondContact O-N 3.41Å; K272-K276 VanDerWaalsContact O-CB 3.32Å; K272-K276 WeakPolarHBondContact O-CB 3.43Å; K272-K276 PolarHBondContact O-N 3.42Å
273D81.5Confident75.8Confident91 Ų91103.8 Ų103.849%0.48754%0.539SS..Hα-helixtrans-68.3-38.5176.9-76-24.6000112E269 T270 N271 K276 I277E269-D273 PolarHBondContact O-N 3.45Å; T270-D273 PolarHBondContact O-N 2.95Å; N271-D273 VanDerWaalsContact C-N 3.34Å; N271-D273 PolarHBondContact O-N 3.37Å; D273-K276 PolarHBondContact O-N 2.79Å; D273-I277 WeakPolarHBondContact O-CB 3.13Å; D273-I277 WeakPolarHBondContact O-CD1 3.2Å; D273-I277 WeakPolarHBondContact O-CG1 3.34Å; D273-I277 PolarHBondContact O-N 2.62Å
274L80.4Confident75.5Confident107 Ų107104.2 Ų104.256%0.5655%0.548SS*.Hα-helixtrans-63.9-46174-78.5168.9000111.9T270 N271 K276 I277 E278T270-L274 WeakPolarHBondContact O-CB 3.44Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.38Å; T270-L274 PolarHBondContact O-N 3.02Å; N271-L274 PolarHBondContact O-N 3.16Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 2.97Å; L274-I277 PolarHBondContact O-N 3.34Å; L274-E278 PolarHBondContact O-N 3.32Å
275E83.3Confident74.9Confident132 Ų132110.8 Ų110.862%0.61756%0.56SS**Hα-helixtrans-58.9-42.7174.8-74.9179.4173.300111.2N271 I277 E278 E279N271-E275 WeakPolarHBondContact O-CG 3.2Å; N271-E275 PolarHBondContact O-N 3.13Å; E275-I277 PolarHBondContact O-N 3.07Å; E275-E278 PolarHBondContact O-N 3.01Å; E275-E279 WeakPolarHBondContact O-CB 3.38Å; E275-E279 PolarHBondContact O-N 3.47Å
276K81.9Confident74.4Confident126 Ų126114.6 Ų114.655%0.54858%0.578SS.*Hα-helixtrans-67.5-35.4177.8-165.5174.2-174177.30112.8K272 D273 L274 L280K272-K276 VanDerWaalsContact O-CB 3.32Å; K272-K276 WeakPolarHBondContact O-CB 3.43Å; K272-K276 PolarHBondContact O-N 3.42Å; D273-K276 PolarHBondContact O-N 2.79Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 2.97Å; K276-L280 WeakPolarHBondContact O-CB 3.45Å; K276-L280 VanDerWaalsContact O-CG 3.24Å; K276-L280 WeakPolarHBondContact O-CG 3.29Å; K276-L280 PolarHBondContact O-N 3.13Å
277I82.9Confident73.3Confident90 Ų90115.6 Ų115.646%0.46259%0.587SS.*Hα-helixtrans-67.5-40.4173.7-70.5162.3000110.3D273 L274 E275 L280 L281D273-I277 WeakPolarHBondContact O-CB 3.13Å; D273-I277 WeakPolarHBondContact O-CD1 3.2Å; D273-I277 WeakPolarHBondContact O-CG1 3.34Å; D273-I277 PolarHBondContact O-N 2.62Å; L274-I277 PolarHBondContact O-N 3.34Å; E275-I277 PolarHBondContact O-N 3.07Å; I277-L280 PolarHBondContact O-N 2.71Å; I277-L281 HydrophobicContact CG2-CD1 3.74Å; I277-L281 HydrophobicContact CG2-CG 4.39Å; I277-L281 WeakPolarHBondContact O-CB 3.09Å; I277-L281 VanDerWaalsContact O-CG 3.27Å; I277-L281 WeakPolarHBondContact O-CG 3.48Å; I277-L281 PolarHBondContact O-N 3.24Å
278E82.4Confident72.4Confident140 Ų140118.3 Ų118.365%0.65460%0.596SS**Hα-helixtrans-67-38.1176.3-167.2170-172.900111.9L274 E275 L281 S282L274-E278 PolarHBondContact O-N 3.32Å; E275-E278 PolarHBondContact O-N 3.01Å; E278-L281 PolarHBondContact O-N 3.34Å; E278-S282 WeakPolarHBondContact O-CB 3.34Å; E278-S282 PolarHBondContact O-N 3.42Å; E278-S282 PolarHBondContact O-OG 3.19Å
279E83.5Confident71.6Confident124 Ų124122.9 Ų122.958%0.57962%0.615SS**Hα-helixtrans-62.2-45.4171.1-168.4-176.4-175.200111.5E275 L281 S282 L283E275-E279 WeakPolarHBondContact O-CB 3.38Å; E275-E279 PolarHBondContact O-N 3.47Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.4Å; E279-S282 WeakPolarHBondContact CA-OG 3.38Å; E279-S282 PolarHBondContact O-N 3.02Å; E279-S282 PolarHBondContact O-OG 3.44Å; E279-L283 HydrophobicContact CG-CD1 4.5Å; E279-L283 WeakPolarHBondContact O-CD1 3.42Å; E279-L283 PolarHBondContact O-N 3.01Å
280L77.9Confident70.5Confident115 Ų115124.5 Ų124.560%0.60263%0.627SS**Hα-helixtrans-67.1-31.8177-72.8173.9000113.3K276 I277K276-L280 WeakPolarHBondContact O-CB 3.45Å; K276-L280 VanDerWaalsContact O-CG 3.24Å; K276-L280 WeakPolarHBondContact O-CG 3.29Å; K276-L280 PolarHBondContact O-N 3.13Å; I277-L280 PolarHBondContact O-N 2.71Å
281L75.8Confident69.3Low137 Ų137126.9 Ų126.972%0.71765%0.645SS**Hα-helixtrans-77.5-29.5176.2-77.4166.5000112.8I277 E278 E279I277-L281 HydrophobicContact CG2-CD1 3.74Å; I277-L281 HydrophobicContact CG2-CG 4.39Å; I277-L281 WeakPolarHBondContact O-CB 3.09Å; I277-L281 VanDerWaalsContact O-CG 3.27Å; I277-L281 WeakPolarHBondContact O-CG 3.48Å; I277-L281 PolarHBondContact O-N 3.24Å; E278-L281 PolarHBondContact O-N 3.34Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 3.4Å
282S76Confident67.6Low88 Ų88128.1 Ų128.162%0.61566%0.66SS**Hα-helixtrans-82.1-17175.859.30000113.2E278 E279E278-S282 WeakPolarHBondContact O-CB 3.34Å; E278-S282 PolarHBondContact O-N 3.42Å; E278-S282 PolarHBondContact O-OG 3.19Å; E279-S282 WeakPolarHBondContact CA-OG 3.38Å; E279-S282 PolarHBondContact O-N 3.02Å; E279-S282 PolarHBondContact O-OG 3.44Å
283L78Confident66Low102 Ų102128 Ų12853%0.53467%0.674SS.*SBendtrans-61.4131165.6-108.178.7000110E279 R285E279-L283 HydrophobicContact CG-CD1 4.5Å; E279-L283 WeakPolarHBondContact O-CD1 3.42Å; E279-L283 PolarHBondContact O-N 3.01Å; L283-R285 PolarHBondContact O-N 2.66Å
284P68.5Low64.3Low115 Ų115132.8 Ų132.875%0.74769%0.693SS**  trans-58.6126.517722.6-30.6000109.4N286P284-N286 PolarHBondContact O-N 3.14Å
285R57.8Low62.5Low226 Ų226133 Ų13385%0.85370%0.704SS**  trans-48.9109.5174.5-171.4168.1-177.1169-0.3108.2L283 N287L283-R285 PolarHBondContact O-N 2.66Å; R285-N287 PolarHBondContact O-N 3.32Å
286N55.7Low60.3Low153 Ų153139.8 Ų139.882%0.81874%0.736SS**  trans-61.1108179.3-168.811.5000107.5P284 D288P284-N286 PolarHBondContact O-N 3.14Å; N286-D288 PolarHBondContact O-N 3.31Å; N286-D288 VanDerWaalsContact O-N 3.13Å
287N47.5Very low59.2Low130 Ų130140.5 Ų140.570%0.69575%0.745SS**  trans-60.1115.5177.7-76.2-23.5000108.7R285 K289R285-N287 PolarHBondContact O-N 3.32Å; N287-K289 PolarHBondContact O-N 3.35Å; N287-K289 VanDerWaalsContact O-N 3.08Å
288D43.6Very low58Low142 Ų142143.2 Ų143.276%0.75976%0.76SS**  trans21.982.9131.6-47.8-23.6000114.4N286 N290N286-D288 PolarHBondContact O-N 3.31Å; N286-D288 VanDerWaalsContact O-N 3.13Å; D288-N290 PolarHBondContact O-N 3.3Å
289K50.3Low56.6Low210 Ų210143.3 Ų143.391%0.91377%0.766SS**  trans-67.791.9145.1-83.5-176.4179.3172.90106.6N287N287-K289 PolarHBondContact O-N 3.35Å; N287-K289 VanDerWaalsContact O-N 3.08Å
290N46.5Very low55Low141 Ų141144.5 Ų144.575%0.75478%0.777SS**  trans-139.4110.3152.4-122.27.7000111.5D288D288-N290 PolarHBondContact O-N 3.3Å
291S46.7Very low53.6Low100 Ų100146.3 Ų146.370%0.69979%0.788SS**  trans53.1102.7138.158.10000119.6
292S40.1Very low52.1Low111 Ų111146.9 Ų146.978%0.77679%0.792SS**  175.6102.8120.356.80000110
293S45.6Very low50.4Low109 Ų109151.1 Ų151.176%0.76281%0.805SS**  91106.195.1-58.60000114.4
294Q46.8Very low48.3Very low190 Ų190154.9 Ų154.989%0.88883%0.826SS**  50.8105.9126.4-165.4176.3-0.200119.3
295S42.7Very low46.6Very low113 Ų113158.3 Ų158.379%0.7983%0.832SS**  trans179.2127.8137.646.80000113.6
296Q36.5Very low45.6Very low274 Ų274152.1 Ų152.1100%1.2883%0.831SS**  trans86.60167.4-65.8-167.2-24.700118.6

Retrieved 296 of 296 residues in 334.3 ms (Link to these results)