A0A060YFR7_ONCMY Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A060YFR7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110537380, Length 332 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
1M36Very low31.9Very low252 Ų252142.5 Ų142.5100%1.24184%0.835SS**  094.10-80.4175.6172.100107.9
2A32.3Very low32.1Very low101 Ų101142.6 Ų142.684%0.83584%0.837SS**  trans-133.7105.8169.300000104.8
3G31.4Very low31.9Very low81 Ų81145.7 Ų145.784%0.83584%0.839SS**  trans-84.7115.7-179.700000109.3
4V31.9Very low32.1Very low127 Ų127148.7 Ų148.777%0.7784%0.841SS**  trans-77.3121.3165.3177.90000106.3E6V4-E6 HydrophobicContact CG1-CG 4.26Å
5F29.5Very low31.9Very low195 Ų195149.3 Ų149.386%0.85584%0.841SS**  trans-99.297.1170.8-132.5-89.8000107V7F5-V7 HydrophobicContact CD1-CG2 4.5Å
6E29.7Very low32.1Very low175 Ų175151.2 Ų151.282%0.81884%0.841SS**  trans-72.8125.8163.7-77.1176.3155.900107.5V4V4-E6 HydrophobicContact CG1-CG 4.26Å
7V34.6Very low31.9Very low121 Ų121146.5 Ų146.573%0.73384%0.835SS**  trans-98.5102.5169.7179.40000106.8F5F5-V7 HydrophobicContact CD1-CG2 4.5Å
8E27.8Very low32Very low170 Ų170148.7 Ų148.779%0.79484%0.842SS**  trans-68.9122170.2-147.6163.1-166.600108.1D10E8-D10 PolarHBondContact O-N 2.83Å
9V34.8Very low32.1Very low138 Ų138144.6 Ų144.684%0.83684%0.836SS**  trans-9688.7174.8-1760000106.9
10D29.4Very low32Very low137 Ų137146.1 Ų146.173%0.73384%0.835SS**  trans-70.4131.8169.9-94.5-27.9000110.4E8E8-D10 PolarHBondContact O-N 2.83Å
11G33.8Very low32.4Very low71 Ų71148.6 Ų148.673%0.73284%0.839SS**  trans-67.4149175.600000112
12V33.7Very low32.3Very low143 Ų143143.6 Ų143.687%0.86782%0.817SS**  trans-129.2137165.7178.70000109.5
13E29.8Very low32.6Very low183 Ų183147.3 Ų147.386%0.85582%0.818SS**  trans-67.8162.6-164.8-67.2165.4130.800115.2
14H34.4Very low33.1Very low188 Ų188149.5 Ų149.587%0.8782%0.817SS**  trans-59.5128.4163.6-86.4-102.7000111.5
15D29.7Very low33.5Very low158 Ų158150.8 Ų150.885%0.84582%0.82SS**  trans-140.8144151.9-163.917.1000111.5
16H35.1Very low34.3Very low179 Ų179150.7 Ų150.783%0.82982%0.822SS**  trans-85.2129.4-172.5-75.7-84.6000111.7
17G28.9Very low35.7Very low72 Ų72147.3 Ų147.374%0.74281%0.813SS**  trans171.998.8166.500000116.7
18L32.6Very low36.6Very low185 Ų185146.9 Ų146.997%0.96981%0.806SS**  trans27.9109.9146.2-73.7145.8000120.3
19G34.7Very low38Very low71 Ų71142.4 Ų142.473%0.73279%0.787SS**  88.293.4127.600000118.9
20H30.3Very low39.3Very low174 Ų174139.4 Ų139.481%0.80677%0.773SS**  -173.1136.2125.5-119.8-81.9000109.7D22H20-D22 PolarHBondContact O-N 3.32Å
21H40.3Very low40.8Very low199 Ų199141.1 Ų141.192%0.92178%0.776SS**  trans-70.5103.3166.7-85.5-84.9000108.3
22D34.3Very low42.2Very low147 Ų147140.4 Ų140.479%0.78676%0.755SS**  trans-105124.5166.9-80.9-32.9000109.8H20H20-D22 PolarHBondContact O-N 3.32Å
23E37.4Very low43.9Very low180 Ų180136 Ų13684%0.84173%0.731SS**  trans-55.6149.1169.4-72.3-177.1119.600110.9N25E23-N25 PolarHBondContact O-N 2.95Å
24P42.2Very low46Very low126 Ų126132.6 Ų132.682%0.81872%0.724SS**  trans-66.1112.8179.526.8-31.4000110.2Q26P24-Q26 PolarHBondContact O-N 3.24Å
25N40.6Very low47.8Very low155 Ų155129.8 Ų129.883%0.82971%0.712SS**  trans-21.4102.9168.2-94.1-28.3000113.6E23 V27E23-N25 PolarHBondContact O-N 2.95Å; N25-V27 PolarHBondContact O-N 3.41Å; N25-V27 VanDerWaalsContact O-N 3.14Å
26Q46Very low49.8Very low192 Ų192126.8 Ų126.890%0.89769%0.693SS**  trans-66.8105.4156.1-86.1-176.4-5.700107.5P24 D28P24-Q26 PolarHBondContact O-N 3.24Å; Q26-D28 PolarHBondContact O-N 3.34Å; Q26-D28 VanDerWaalsContact O-N 3.08Å
27V59.1Low51.7Low104 Ų104121.9 Ų121.963%0.6367%0.669SS**  trans-59113.1171.3178.60000108.2N25 L29N25-V27 PolarHBondContact O-N 3.41Å; N25-V27 VanDerWaalsContact O-N 3.14Å; V27-L29 PolarHBondContact O-N 3.02Å
28D54Low53.7Low112 Ų112126.2 Ų126.260%0.59966%0.663SS**  trans-70.898.6178.4-170.2-6.7000110.2Q26 S30Q26-D28 PolarHBondContact O-N 3.34Å; Q26-D28 VanDerWaalsContact O-N 3.08Å; D28-S30 VanDerWaalsContact CG-OG 3.31Å; D28-S30 PolarHBondContact O-N 3.14Å; D28-S30 WeakPolarHBondContact OD1-CB 3.46Å; D28-S30 PolarHBondContact OD1-N 2.86Å; D28-S30 PolarHBondContact OD1-OG 3.03Å; D28-S30 PolarHBondContact OD2-OG 3.22Å
29L57.6Low56Low76 Ų76125 Ų12540%0.39865%0.646SS.*THydrogen-bonded Turntrans-73.81.5-176.2-69.6160.9000113.4V27 L32 K37 L40V27-L29 PolarHBondContact O-N 3.02Å; L29-L32 HydrophobicContact CD2-CD1 4.03Å; L29-K37 WeakPolarHBondContact O-CE 3.26Å; L29-K37 PolarHBondContact O-NZ 3.19Å; L29-L40 HydrophobicContact CD2-CD2 3.62Å
30S61.3Low58Low76 Ų76125.3 Ų125.353%0.53163%0.63SS.*THydrogen-bonded Turntrans-77.9-25.8-175.964.70000113.6D28D28-S30 VanDerWaalsContact CG-OG 3.31Å; D28-S30 PolarHBondContact O-N 3.14Å; D28-S30 WeakPolarHBondContact OD1-CB 3.46Å; D28-S30 PolarHBondContact OD1-N 2.86Å; D28-S30 PolarHBondContact OD1-OG 3.03Å; D28-S30 PolarHBondContact OD2-OG 3.22Å
31H61.1Low60.1Low172 Ų172123 Ų12380%0.79662%0.62SS**SBendtrans-96-0.5-173.1-88.5-84.4000116.2
32L62.6Low61.6Low57 Ų57118 Ų11830%0.29860%0.596SS.*SBendtrans-84.9143.1-177.3-70.4161.5000112.4L29 E36 K37 L40L29-L32 HydrophobicContact CD2-CD1 4.03Å; L32-E36 HydrophobicContact CB-CB 4.25Å; L32-E36 HydrophobicContact CD2-CB 4.01Å; L32-K37 HydrophobicContact CB-CG 3.75Å; L32-K37 WeakPolarHBondContact O-CE 3.33Å; L32-L40 HydrophobicContact CD1-CD2 4.35Å
33S70.6Confident63.5Low50 Ų50113.6 Ų113.635%0.3558%0.581SS.*  trans-63.1154171.369.40000110.9E35 E36 K37S33-E35 PolarHBondContact O-N 2.76Å; S33-E35 VanDerWaalsContact O-N 3.13Å; S33-E36 WeakPolarHBondContact CB-OE2 3.45Å; S33-E36 PolarHBondContact N-OE2 3.27Å; S33-E36 PolarHBondContact O-N 3.49Å; S33-E36 VanDerWaalsContact OG-CG 3.28Å; S33-E36 WeakPolarHBondContact OG-CG 3.39Å; S33-E36 PolarHBondContact OG-OE2 2.85Å; S33-K37 PolarHBondContact O-N 2.74Å
34P72.9Confident65.2Low111 Ų111112.8 Ų112.872%0.72157%0.57SS**Hα-helixtrans-55-33.6-177.7-26.234.2000114W38P34-W38 PolarHBondContact O-N 3.46Å; P34-W38 VanDerWaalsContact O-N 3.13Å
35E72Confident66.1Low130 Ų130112 Ų11261%0.60756%0.556SS**Hα-helixtrans-71.4-37.2177.5-65.6-173.1-175.700112.7S33 W38 R39S33-E35 PolarHBondContact O-N 2.76Å; S33-E35 VanDerWaalsContact O-N 3.13Å; E35-W38 PolarHBondContact O-N 2.82Å; E35-R39 VanDerWaalsContact O-CG 3.3Å; E35-R39 WeakPolarHBondContact O-CG 2.98Å; E35-R39 PolarHBondContact O-N 3.46Å; E35-R39 IonicContact OE2-NH2 3.8Å
36E71.9Confident67.3Low95 Ų95109.2 Ų109.244%0.44454%0.538SS..Hα-helixtrans-71.7-36.8177.6-69.7163.9147.600111.4L32 S33 W38 R39 L40L32-E36 HydrophobicContact CB-CB 4.25Å; L32-E36 HydrophobicContact CD2-CB 4.01Å; S33-E36 WeakPolarHBondContact CB-OE2 3.45Å; S33-E36 PolarHBondContact N-OE2 3.27Å; S33-E36 PolarHBondContact O-N 3.49Å; S33-E36 VanDerWaalsContact OG-CG 3.28Å; S33-E36 WeakPolarHBondContact OG-CG 3.39Å; S33-E36 PolarHBondContact OG-OE2 2.85Å; E36-W38 VanDerWaalsContact C-N 3.34Å; E36-R39 PolarHBondContact O-N 3Å; E36-L40 VanDerWaalsContact O-CB 3.24Å; E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.09Å
37K75.9Confident68.3Low76 Ų76103.5 Ų103.533%0.3352%0.524SS..Hα-helixtrans-60.2-45.5170.6-68.6-173.3-171.4-168.20111.2L29 L32 S33 L40 E41L29-K37 WeakPolarHBondContact O-CE 3.26Å; L29-K37 PolarHBondContact O-NZ 3.19Å; L32-K37 HydrophobicContact CB-CG 3.75Å; L32-K37 WeakPolarHBondContact O-CE 3.33Å; S33-K37 PolarHBondContact O-N 2.74Å; K37-L40 PolarHBondContact O-N 3.35Å; K37-E41 WeakPolarHBondContact O-CB 3.09Å; K37-E41 WeakPolarHBondContact O-CG 3.45Å; K37-E41 PolarHBondContact O-N 3.43Å
38W70.9Confident68.5Low163 Ų163106 Ų10662%0.61753%0.527SS*.Hα-helixtrans-65.4-41.5178.9-169.276.8000112.2P34 E35 E36 E41 H42P34-W38 PolarHBondContact O-N 3.46Å; P34-W38 VanDerWaalsContact O-N 3.13Å; E35-W38 PolarHBondContact O-N 2.82Å; E36-W38 VanDerWaalsContact C-N 3.34Å; W38-E41 PolarHBondContact O-N 3.3Å; W38-H42 WeakPolarHBondContact O-CB 3.27Å; W38-H42 PolarHBondContact O-N 3.5Å
39R80.4Confident68.7Low160 Ų160104.1 Ų104.160%0.60451%0.514SS*.Hα-helixtrans-64.6-40.8174.3-72.8177.8-165.3-178.59.2112.1E35 E36 A43E35-R39 VanDerWaalsContact O-CG 3.3Å; E35-R39 WeakPolarHBondContact O-CG 2.98Å; E35-R39 PolarHBondContact O-N 3.46Å; E35-R39 IonicContact OE2-NH2 3.8Å; E36-R39 PolarHBondContact O-N 3Å; R39-A43 WeakPolarHBondContact O-CB 3.25Å; R39-A43 PolarHBondContact O-N 3.11Å
40L76.1Confident68.9Low77 Ų77109.2 Ų109.240%0.40353%0.533SS..Hα-helixtrans-68-42.8178-159.484.3000111.1L29 L32 E36 K37 A43 R44L29-L40 HydrophobicContact CD2-CD2 3.62Å; L32-L40 HydrophobicContact CD1-CD2 4.35Å; E36-L40 VanDerWaalsContact O-CB 3.24Å; E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.09Å; K37-L40 PolarHBondContact O-N 3.35Å; L40-A43 PolarHBondContact O-N 2.96Å; L40-R44 VanDerWaalsContact O-CB 3.23Å; L40-R44 WeakPolarHBondContact O-CB 3.46Å; L40-R44 PolarHBondContact O-N 2.76Å
41E75Confident68.8Low126 Ų126108.2 Ų108.259%0.58953%0.534SS*.Hα-helixtrans-63.7-44.1173.8-80.2179.8171.500111.9K37 W38 R44 M45K37-E41 WeakPolarHBondContact O-CB 3.09Å; K37-E41 WeakPolarHBondContact O-CG 3.45Å; K37-E41 PolarHBondContact O-N 3.43Å; W38-E41 PolarHBondContact O-N 3.3Å; E41-R44 CarbonylContact O-C 3.6Å; E41-R44 PolarHBondContact O-N 3.41Å; E41-M45 WeakPolarHBondContact O-CB 3.23Å; E41-M45 VanDerWaalsContact O-CG 3.24Å; E41-M45 WeakPolarHBondContact O-CG 3.4Å; E41-M45 PolarHBondContact O-N 2.95Å
42H72.6Confident69Low92 Ų92103.7 Ų103.743%0.42651%0.514SS..Hα-helixtrans-63.7-43.7176.3-167.3-110.2000111W38 R44 M45 H46W38-H42 WeakPolarHBondContact O-CB 3.27Å; W38-H42 PolarHBondContact O-N 3.5Å; H42-R44 VanDerWaalsContact C-N 3.32Å; H42-R44 PolarHBondContact O-N 3.06Å; H42-M45 WeakPolarHBondContact O-CB 3.36Å; H42-M45 PolarHBondContact O-N 2.96Å; H42-H46 AromaticContact CD2-NE2 3.74Å; H42-H46 AromaticContact CE1-CD2 3.4Å; H42-H46 PolarHBondContact CE1-CD2 3.08Å; H42-H46 AromaticContact CE1-NE2 2.95Å; H42-H46 PolarHBondContact CE1-NE2 2.93Å; H42-H46 AromaticContact CG-CD2 3.82Å; H42-H46 AromaticContact CG-NE2 3.93Å; H42-H46 AromaticContact ND1-CD2 3.38Å; H42-H46 PolarHBondContact ND1-CD2 3.01Å; H42-H46 AromaticContact ND1-NE2 3.47Å; H42-H46 PolarHBondContact ND1-NE2 2.7Å; H42-H46 AromaticContact NE2-CD2 3.78Å; H42-H46 AromaticContact NE2-NE2 3.09Å; H42-H46 PolarHBondContact NE2-NE2 3.06Å; H42-H46 PolarHBondContact O-CD2 3.27Å; H42-H46 PolarHBondContact O-N 3.2Å
43A74.3Confident69.3Low56 Ų56107 Ų10746%0.46353%0.527SS..Hα-helixtrans-63.2-36.9173.600000112.2R39 L40 H46 A47R39-A43 WeakPolarHBondContact O-CB 3.25Å; R39-A43 PolarHBondContact O-N 3.11Å; L40-A43 PolarHBondContact O-N 2.96Å; A43-H46 PolarHBondContact O-N 2.93Å; A43-A47 WeakPolarHBondContact O-CB 3.22Å; A43-A47 PolarHBondContact O-N 2.95Å
44R72.6Confident69.5Low162 Ų162107.2 Ų107.261%0.61153%0.532SS*.Hα-helixtrans-71.6-34.8176.8-152176.1-160.4174.16.2112.2L40 E41 H42 K48L40-R44 VanDerWaalsContact O-CB 3.23Å; L40-R44 WeakPolarHBondContact O-CB 3.46Å; L40-R44 PolarHBondContact O-N 2.76Å; E41-R44 CarbonylContact O-C 3.6Å; E41-R44 PolarHBondContact O-N 3.41Å; H42-R44 VanDerWaalsContact C-N 3.32Å; H42-R44 PolarHBondContact O-N 3.06Å; R44-K48 WeakPolarHBondContact O-CB 3.27Å; R44-K48 WeakPolarHBondContact O-CG 3.24Å; R44-K48 PolarHBondContact O-N 3.28Å
45M61.2Low69.6Low109 Ų109104.2 Ų104.254%0.53751%0.509SS..Hα-helixtrans-64.3-49.1170.5-74.9-78.3-69.800110.9E41 H42 A47 K48 H49E41-M45 WeakPolarHBondContact O-CB 3.23Å; E41-M45 VanDerWaalsContact O-CG 3.24Å; E41-M45 WeakPolarHBondContact O-CG 3.4Å; E41-M45 PolarHBondContact O-N 2.95Å; H42-M45 WeakPolarHBondContact O-CB 3.36Å; H42-M45 PolarHBondContact O-N 2.96Å; M45-A47 PolarHBondContact O-N 3.02Å; M45-K48 PolarHBondContact O-N 2.95Å; M45-H49 VanDerWaalsContact O-CG 3.31Å; M45-H49 PolarHBondContact O-N 3.48Å; M45-H49 VanDerWaalsContact O-N 3.07Å; M45-H49 PolarHBondContact O-ND1 3.45Å
46H64.8Low70Confident98 Ų98102.1 Ų102.145%0.45450%0.499SS..Hα-helixtrans-64.2-39.7176.5-77.7-60.3000112.6H42 A43 K48 H49 K50H42-H46 AromaticContact CD2-NE2 3.74Å; H42-H46 AromaticContact CE1-CD2 3.4Å; H42-H46 PolarHBondContact CE1-CD2 3.08Å; H42-H46 AromaticContact CE1-NE2 2.95Å; H42-H46 PolarHBondContact CE1-NE2 2.93Å; H42-H46 AromaticContact CG-CD2 3.82Å; H42-H46 AromaticContact CG-NE2 3.93Å; H42-H46 AromaticContact ND1-CD2 3.38Å; H42-H46 PolarHBondContact ND1-CD2 3.01Å; H42-H46 AromaticContact ND1-NE2 3.47Å; H42-H46 PolarHBondContact ND1-NE2 2.7Å; H42-H46 AromaticContact NE2-CD2 3.78Å; H42-H46 AromaticContact NE2-NE2 3.09Å; H42-H46 PolarHBondContact NE2-NE2 3.06Å; H42-H46 PolarHBondContact O-CD2 3.27Å; H42-H46 PolarHBondContact O-N 3.2Å; A43-H46 PolarHBondContact O-N 2.93Å; H46-K48 PolarHBondContact O-N 3.39Å; H46-H49 PolarHBondContact O-N 3.3Å; H46-H49 VanDerWaalsContact O-N 3.1Å; H46-K50 PolarHBondContact O-N 3.24Å
47A66.6Low70.6Confident72 Ų72100.5 Ų100.560%0.59550%0.502SS*.Hα-helixtrans-65.7-36.7175.500000112.4A43 M45 H49A43-A47 WeakPolarHBondContact O-CB 3.22Å; A43-A47 PolarHBondContact O-N 2.95Å; M45-A47 PolarHBondContact O-N 3.02Å; A47-H49 VanDerWaalsContact C-N 3.26Å; A47-H49 PolarHBondContact O-N 2.83Å
48K63.4Low71.1Confident157 Ų157101.7 Ų101.768%0.68351%0.509SS*.Hα-helixtrans-67.6-23.8171.1-80.8-177.9176.8-175.90113R44 M45 H46R44-K48 WeakPolarHBondContact O-CB 3.27Å; R44-K48 WeakPolarHBondContact O-CG 3.24Å; R44-K48 PolarHBondContact O-N 3.28Å; M45-K48 PolarHBondContact O-N 2.95Å; H46-K48 PolarHBondContact O-N 3.39Å
49H59.8Low71.8Confident71 Ų7195.8 Ų95.833%0.32949%0.489SS..Hα-helixtrans-96.2-18.1-176.9-68.14.7000113.9M45 H46 A47 G51 H52 E53M45-H49 VanDerWaalsContact O-CG 3.31Å; M45-H49 PolarHBondContact O-N 3.48Å; M45-H49 VanDerWaalsContact O-N 3.07Å; M45-H49 PolarHBondContact O-ND1 3.45Å; H46-H49 PolarHBondContact O-N 3.3Å; H46-H49 VanDerWaalsContact O-N 3.1Å; A47-H49 VanDerWaalsContact C-N 3.26Å; A47-H49 PolarHBondContact O-N 2.83Å; H49-G51 VanDerWaalsContact C-N 3.28Å; H49-G51 PolarHBondContact O-N 2.97Å; H49-G51 VanDerWaalsContact O-N 3.14Å; H49-H52 PolarHBondContact O-N 3.31Å; H49-E53 HydrophobicContact CB-CG 4.4Å; H49-E53 WeakPolarHBondContact O-CG 3.49Å; H49-E53 PolarHBondContact O-N 2.94Å
50K60.6Low72.1Confident184 Ų18491.9 Ų91.980%0.848%0.482SS*.THydrogen-bonded Turntrans-61-26.4-174-147.5175.1-176.9-178.70115.5H46H46-K50 PolarHBondContact O-N 3.24Å
51G59.5Low72.8Confident55 Ų5593.4 Ų93.457%0.56749%0.49SS*.THydrogen-bonded Turntrans-103.4-20.2170.600000114.2H49H49-G51 VanDerWaalsContact C-N 3.28Å; H49-G51 PolarHBondContact O-N 2.97Å; H49-G51 VanDerWaalsContact O-N 3.14Å
52H64.9Low73.6Confident77 Ų7789 Ų8936%0.35647%0.471SS..Hα-helixtrans-78.8-30.4-178.2-166.5-128.5000112H49 M55 H56H49-H52 PolarHBondContact O-N 3.31Å; H52-M55 PolarHBondContact O-N 3.09Å; H52-H56 AromaticContact CD2-NE2 3.93Å; H52-H56 AromaticContact CE1-CD2 3.69Å; H52-H56 AromaticContact CE1-CE1 3.36Å; H52-H56 PolarHBondContact CE1-CE1 3.19Å; H52-H56 AromaticContact CE1-NE2 2.79Å; H52-H56 PolarHBondContact CE1-NE2 3.06Å; H52-H56 AromaticContact CG-CD2 3.99Å; H52-H56 AromaticContact CG-NE2 3.81Å; H52-H56 AromaticContact ND1-CD2 3.52Å; H52-H56 AromaticContact ND1-CE1 3.96Å; H52-H56 AromaticContact ND1-NE2 3.11Å; H52-H56 PolarHBondContact ND1-NE2 3.37Å; H52-H56 VanDerWaalsContact ND1-NE2 3.11Å; H52-H56 AromaticContact NE2-CE1 3.43Å; H52-H56 PolarHBondContact NE2-CE1 3.41Å; H52-H56 AromaticContact NE2-NE2 3.34Å; H52-H56 PolarHBondContact NE2-NE2 3.06Å; H52-H56 WeakPolarHBondContact O-CB 3.49Å; H52-H56 PolarHBondContact O-CD2 3.32Å; H52-H56 VanDerWaalsContact O-CG 3.27Å; H52-H56 PolarHBondContact O-N 3.36Å
53E69.1Low74.4Confident125 Ų12587.5 Ų87.558%0.58447%0.465SS*.Hα-helixtrans-67.1-38.5175.8-74.9-176.4178.900112.8H49 H56 A57H49-E53 HydrophobicContact CB-CG 4.4Å; H49-E53 WeakPolarHBondContact O-CG 3.49Å; H49-E53 PolarHBondContact O-N 2.94Å; E53-H56 PolarHBondContact O-N 3.49Å; E53-A57 VanDerWaalsContact O-CB 3.3Å; E53-A57 WeakPolarHBondContact O-CB 3.08Å; E53-A57 PolarHBondContact O-N 3.44Å
54A75.2Confident75.3Confident55 Ų5589.3 Ų89.346%0.45547%0.466SS..Hα-helixtrans-65.7-44.3175.200000111.1H56 A57 E58A54-H56 PolarHBondContact O-N 2.91Å; A54-A57 PolarHBondContact O-N 3.28Å; A54-E58 WeakPolarHBondContact O-CG 3.26Å; A54-E58 PolarHBondContact O-N 2.91Å
55M75.3Confident76.3Confident49 Ų4984.9 Ų84.924%0.24146%0.457CS..Hα-helixtrans-62.9-42.4176.3-163.9179.786.400112H52 E58 M59 L331H52-M55 PolarHBondContact O-N 3.09Å; M55-E58 PolarHBondContact O-N 3.47Å; M55-M59 HydrophobicContact CE-CE 3.42Å; M55-M59 VanDerWaalsContact CE-CE 3.42Å; M55-M59 HydrophobicContact CG-CE 3.74Å; M55-M59 WeakPolarHBondContact O-CG 3.23Å; M55-M59 PolarHBondContact O-N 2.56Å; M55-M59 HydrophobicContact SD-CE 4.26Å; M55-L331 HydrophobicContact CG-CD2 4.17Å
56H80.1Confident77.9Confident86 Ų8680.6 Ų80.640%0.39844%0.437SS..Hα-helixtrans-65-40.3173.4-75.7-33.9000113.1H52 E53 A54 E58 M59 V60H52-H56 AromaticContact CD2-NE2 3.93Å; H52-H56 AromaticContact CE1-CD2 3.69Å; H52-H56 AromaticContact CE1-CE1 3.36Å; H52-H56 PolarHBondContact CE1-CE1 3.19Å; H52-H56 AromaticContact CE1-NE2 2.79Å; H52-H56 PolarHBondContact CE1-NE2 3.06Å; H52-H56 AromaticContact CG-CD2 3.99Å; H52-H56 AromaticContact CG-NE2 3.81Å; H52-H56 AromaticContact ND1-CD2 3.52Å; H52-H56 AromaticContact ND1-CE1 3.96Å; H52-H56 AromaticContact ND1-NE2 3.11Å; H52-H56 PolarHBondContact ND1-NE2 3.37Å; H52-H56 VanDerWaalsContact ND1-NE2 3.11Å; H52-H56 AromaticContact NE2-CE1 3.43Å; H52-H56 PolarHBondContact NE2-CE1 3.41Å; H52-H56 AromaticContact NE2-NE2 3.34Å; H52-H56 PolarHBondContact NE2-NE2 3.06Å; H52-H56 WeakPolarHBondContact O-CB 3.49Å; H52-H56 PolarHBondContact O-CD2 3.32Å; H52-H56 VanDerWaalsContact O-CG 3.27Å; H52-H56 PolarHBondContact O-N 3.36Å; E53-H56 PolarHBondContact O-N 3.49Å; A54-H56 PolarHBondContact O-N 2.91Å; H56-E58 VanDerWaalsContact C-N 3.31Å; H56-E58 PolarHBondContact O-N 2.84Å; H56-M59 PolarHBondContact O-N 2.78Å; H56-V60 WeakPolarHBondContact O-CB 3.43Å; H56-V60 VanDerWaalsContact O-CG2 3.27Å; H56-V60 WeakPolarHBondContact O-CG2 3.26Å; H56-V60 PolarHBondContact O-N 2.85Å
57A84.8Confident79.2Confident60 Ų6078.3 Ų78.350%0.49643%0.428SS..Hα-helixtrans-62.6-40.9176.700000111.2E53 A54 V60 L61E53-A57 VanDerWaalsContact O-CB 3.3Å; E53-A57 WeakPolarHBondContact O-CB 3.08Å; E53-A57 PolarHBondContact O-N 3.44Å; A54-A57 PolarHBondContact O-N 3.28Å; A57-V60 PolarHBondContact O-N 3.34Å; A57-L61 WeakPolarHBondContact O-CB 3.49Å; A57-L61 PolarHBondContact O-N 3.2Å
58E85.4Confident80.4Confident101 Ų10178.9 Ų78.947%0.47242%0.423SS..Hα-helixtrans-63.6-47.7174.9-73.3178.4-173.600112A54 M55 H56 V60 L61 I62 L331A54-E58 WeakPolarHBondContact O-CG 3.26Å; A54-E58 PolarHBondContact O-N 2.91Å; M55-E58 PolarHBondContact O-N 3.47Å; H56-E58 VanDerWaalsContact C-N 3.31Å; H56-E58 PolarHBondContact O-N 2.84Å; E58-V60 VanDerWaalsContact C-N 3.33Å; E58-V60 PolarHBondContact O-N 3.15Å; E58-L61 PolarHBondContact O-N 3.01Å; E58-I62 VanDerWaalsContact O-CG1 3.27Å; E58-I62 WeakPolarHBondContact O-CG1 3.05Å; E58-I62 PolarHBondContact O-N 3.22Å; E58-L331 VanDerWaalsContact OE2-CD2 3.27Å; E58-L331 WeakPolarHBondContact OE2-CD2 3.28Å
59M85.9Confident82Confident40 Ų4076 Ų7620%0.19742%0.415CS..Hα-helixtrans-58.8-42.6175.9-71.1-172.9-13300112.8M55 H56 I62 L63 L331M55-M59 HydrophobicContact CE-CE 3.42Å; M55-M59 VanDerWaalsContact CE-CE 3.42Å; M55-M59 HydrophobicContact CG-CE 3.74Å; M55-M59 WeakPolarHBondContact O-CG 3.23Å; M55-M59 PolarHBondContact O-N 2.56Å; M55-M59 HydrophobicContact SD-CE 4.26Å; H56-M59 PolarHBondContact O-N 2.78Å; M59-I62 PolarHBondContact O-N 3.01Å; M59-L63 WeakPolarHBondContact O-CB 3.42Å; M59-L63 PolarHBondContact O-N 3.44Å; M59-L331 WeakPolarHBondContact CE-O 3.36Å; M59-L331 HydrophobicContact CG-CB 4.48Å
60V87.2Confident83.6Confident77 Ų7773.5 Ų73.547%0.46741%0.406SS..Hα-helixtrans-67.7-401791710000110.8H56 A57 E58 L63 I64H56-V60 WeakPolarHBondContact O-CB 3.43Å; H56-V60 VanDerWaalsContact O-CG2 3.27Å; H56-V60 WeakPolarHBondContact O-CG2 3.26Å; H56-V60 PolarHBondContact O-N 2.85Å; A57-V60 PolarHBondContact O-N 3.34Å; E58-V60 VanDerWaalsContact C-N 3.33Å; E58-V60 PolarHBondContact O-N 3.15Å; V60-L63 WeakPolarHBondContact O-CB 3.42Å; V60-L63 PolarHBondContact O-N 3.17Å; V60-I64 HydrophobicContact CG1-CD1 3.84Å; V60-I64 HydrophobicContact CG1-CG1 4.42Å; V60-I64 VanDerWaalsContact O-CG1 3.31Å; V60-I64 WeakPolarHBondContact O-CG1 3.49Å; V60-I64 PolarHBondContact O-N 2.92Å
61L90.6Very high85Confident110 Ų11068.6 Ų68.658%0.57639%0.386SS*.Hα-helixtrans-63.1-45.8176.1-174.867.1000111.1A57 E58 L63 I64 V65A57-L61 WeakPolarHBondContact O-CB 3.49Å; A57-L61 PolarHBondContact O-N 3.2Å; E58-L61 PolarHBondContact O-N 3.01Å; L61-L63 VanDerWaalsContact C-N 3.31Å; L61-L63 PolarHBondContact O-N 3.3Å; L61-I64 PolarHBondContact O-N 2.78Å; L61-V65 HydrophobicContact CD1-CG2 4.49Å; L61-V65 WeakPolarHBondContact O-CB 3.49Å; L61-V65 WeakPolarHBondContact O-CG2 3.24Å; L61-V65 PolarHBondContact O-N 3.01Å
62I90.8Very high86.7Confident34 Ų3471 Ų7117%0.17439%0.385CS..Hα-helixtrans-58.8-44.9175.3-68.3165.4000110.3E58 M59 T66 V322 I325 N326 L329 L331E58-I62 VanDerWaalsContact O-CG1 3.27Å; E58-I62 WeakPolarHBondContact O-CG1 3.05Å; E58-I62 PolarHBondContact O-N 3.22Å; M59-I62 PolarHBondContact O-N 3.01Å; I62-T66 WeakPolarHBondContact O-CB 3.01Å; I62-T66 PolarHBondContact O-N 2.99Å; I62-T66 PolarHBondContact O-OG1 3.09Å; I62-V322 HydrophobicContact CG2-CG1 4.37Å; I62-I325 HydrophobicContact CG2-CB 4.5Å; I62-I325 HydrophobicContact CG2-CG2 3.88Å; I62-N326 WeakPolarHBondContact CD1-OD1 3.19Å; I62-L329 HydrophobicContact CD1-CD1 3.7Å; I62-L331 HydrophobicContact CD1-CD1 3.59Å
63L90.5Very high88.1Confident59 Ų5971.3 Ų71.331%0.30939%0.393SS..Hα-helixtrans-58.7-50.2176.7175.363000111.7M59 V60 L61 T66 L67 V322M59-L63 WeakPolarHBondContact O-CB 3.42Å; M59-L63 PolarHBondContact O-N 3.44Å; V60-L63 WeakPolarHBondContact O-CB 3.42Å; V60-L63 PolarHBondContact O-N 3.17Å; L61-L63 VanDerWaalsContact C-N 3.31Å; L61-L63 PolarHBondContact O-N 3.3Å; L63-T66 PolarHBondContact O-N 3.11Å; L63-L67 HydrophobicContact CD1-CD1 3.79Å; L63-L67 HydrophobicContact CD1-CG 4.04Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.49Å; L63-L67 WeakPolarHBondContact O-CB 3.27Å; L63-L67 VanDerWaalsContact O-CG 3.24Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3Å; L63-V322 HydrophobicContact CB-CG1 4.2Å; L63-V322 HydrophobicContact CD1-CB 4.42Å; L63-V322 HydrophobicContact CD1-CG1 4.22Å; L63-V322 HydrophobicContact CD1-CG2 3.95Å
64I92.9Very high89.2Confident94 Ų9466 Ų6648%0.48237%0.368SS..Hα-helixtrans-62.1-48.8-178.7-68.8167.5000110.7V60 L61 T66 L67 V68V60-I64 HydrophobicContact CG1-CD1 3.84Å; V60-I64 HydrophobicContact CG1-CG1 4.42Å; V60-I64 VanDerWaalsContact O-CG1 3.31Å; V60-I64 WeakPolarHBondContact O-CG1 3.49Å; V60-I64 PolarHBondContact O-N 2.92Å; L61-I64 PolarHBondContact O-N 2.78Å; I64-T66 VanDerWaalsContact C-N 3.34Å; I64-T66 PolarHBondContact O-N 2.99Å; I64-L67 PolarHBondContact O-N 2.81Å; I64-V68 WeakPolarHBondContact O-CG2 3.35Å; I64-V68 PolarHBondContact O-N 3.36Å
65V94.4Very high89.9Confident70 Ų7066.4 Ų66.442%0.42437%0.365SS..Hα-helixtrans-61-45.3179.4171.50000110.5L61 L67 V68 I69L61-V65 HydrophobicContact CD1-CG2 4.49Å; L61-V65 WeakPolarHBondContact O-CB 3.49Å; L61-V65 WeakPolarHBondContact O-CG2 3.24Å; L61-V65 PolarHBondContact O-N 3.01Å; V65-L67 PolarHBondContact O-N 3.41Å; V65-V68 PolarHBondContact O-N 3.26Å; V65-I69 HydrophobicContact CG1-CD1 3.7Å; V65-I69 HydrophobicContact CG1-CG1 4.43Å; V65-I69 VanDerWaalsContact O-CG1 3.32Å; V65-I69 WeakPolarHBondContact O-CG1 3.46Å; V65-I69 PolarHBondContact O-N 2.86Å
66T93.1Very high90.8Very high18 Ų1870.3 Ų70.311%0.1138%0.382CS..Hα-helixtrans-64.2-41.5179-55.30000111.7I62 L63 I64 I69 A70 I318 L321 V322I62-T66 WeakPolarHBondContact O-CB 3.01Å; I62-T66 PolarHBondContact O-N 2.99Å; I62-T66 PolarHBondContact O-OG1 3.09Å; L63-T66 PolarHBondContact O-N 3.11Å; I64-T66 VanDerWaalsContact C-N 3.34Å; I64-T66 PolarHBondContact O-N 2.99Å; T66-I69 PolarHBondContact O-N 2.71Å; T66-A70 WeakPolarHBondContact O-CB 3.14Å; T66-A70 PolarHBondContact O-N 2.87Å; T66-I318 HydrophobicContact CG2-CG2 4.25Å; T66-L321 HydrophobicContact CG2-CD2 4.05Å; T66-V322 HydrophobicContact CG2-CG2 3.64Å
67L92.3Very high91.5Very high51 Ų5169.5 Ų69.527%0.26738%0.376SS..Hα-helixtrans-61.3-43.9175.6-76.3167.5000111.8L63 I64 V65 Q71 Y310 I318L63-L67 HydrophobicContact CD1-CD1 3.79Å; L63-L67 HydrophobicContact CD1-CG 4.04Å; L63-L67 HydrophobicContact CG-CD1 3.85Å; L63-L67 HydrophobicContact CG-CG 4.49Å; L63-L67 WeakPolarHBondContact O-CB 3.27Å; L63-L67 VanDerWaalsContact O-CG 3.24Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3Å; I64-L67 PolarHBondContact O-N 2.81Å; V65-L67 PolarHBondContact O-N 3.41Å; L67-Q71 WeakPolarHBondContact O-CB 3.45Å; L67-Q71 PolarHBondContact O-N 3.19Å; L67-Y310 WeakPolarHBondContact CD2-OH 3.21Å; L67-I318 HydrophobicContact CD2-CD1 4.47Å; L67-I318 HydrophobicContact CD2-CG2 3.73Å; L67-I318 HydrophobicContact CG-CG2 4.32Å
68V93.8Very high91.8Very high83 Ų8370.4 Ų70.450%0.50337%0.369SS..Hα-helixtrans-64.2-48.2178.2172.20000111I64 V65 Q71 L72I64-V68 WeakPolarHBondContact O-CG2 3.35Å; I64-V68 PolarHBondContact O-N 3.36Å; V65-V68 PolarHBondContact O-N 3.26Å; V68-Q71 PolarHBondContact O-N 3.09Å; V68-L72 HydrophobicContact CG1-CD1 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.44Å; V68-L72 PolarHBondContact O-N 2.88Å; V68-L72 VanDerWaalsContact O-N 3.07Å
69I95.2Very high92Very high98 Ų9873 Ų7350%0.50338%0.381SS..Hα-helixtrans-61.6-47.3178.5-67.3170.5000110.4V65 T66 Q71 L72 V73V65-I69 HydrophobicContact CG1-CD1 3.7Å; V65-I69 HydrophobicContact CG1-CG1 4.43Å; V65-I69 VanDerWaalsContact O-CG1 3.32Å; V65-I69 WeakPolarHBondContact O-CG1 3.46Å; V65-I69 PolarHBondContact O-N 2.86Å; T66-I69 PolarHBondContact O-N 2.71Å; I69-Q71 VanDerWaalsContact C-N 3.29Å; I69-Q71 PolarHBondContact O-N 3.32Å; I69-L72 PolarHBondContact O-N 3.25Å; I69-V73 HydrophobicContact CG2-CG2 4.39Å; I69-V73 WeakPolarHBondContact O-CG2 3.5Å; I69-V73 PolarHBondContact O-N 3.4Å
70A93.3Very high92.4Very high18 Ų1880.7 Ų80.715%0.14941%0.408CS..Hα-helixtrans-57.7-43.8177.600000111.2T66 L72 V73 L74 I318T66-A70 WeakPolarHBondContact O-CB 3.14Å; T66-A70 PolarHBondContact O-N 2.87Å; A70-L72 PolarHBondContact O-N 3.44Å; A70-V73 PolarHBondContact O-N 3.19Å; A70-L74 WeakPolarHBondContact O-CB 3.45Å; A70-L74 VanDerWaalsContact O-CG 3.23Å; A70-L74 WeakPolarHBondContact O-CG 3.39Å; A70-L74 PolarHBondContact O-N 3.39Å; A70-I318 HydrophobicContact CB-CD1 3.76Å; A70-I318 HydrophobicContact CB-CG1 3.91Å; A70-I318 HydrophobicContact CB-CG2 4.4Å
71Q91.7Very high92.6Very high81 Ų8182 Ų8238%0.37941%0.409SS..Hα-helixtrans-61.6-43.5178.4-169.164.614.800112.2L67 V68 I69 L74 V75L67-Q71 WeakPolarHBondContact O-CB 3.45Å; L67-Q71 PolarHBondContact O-N 3.19Å; V68-Q71 PolarHBondContact O-N 3.09Å; I69-Q71 VanDerWaalsContact C-N 3.29Å; I69-Q71 PolarHBondContact O-N 3.32Å; Q71-L74 PolarHBondContact O-N 3.47Å; Q71-V75 WeakPolarHBondContact O-CB 3.29Å; Q71-V75 VanDerWaalsContact O-CG2 3.25Å; Q71-V75 WeakPolarHBondContact O-CG2 3.37Å; Q71-V75 PolarHBondContact O-N 2.93Å
72L93.8Very high92.4Very high105 Ų10580 Ų8055%0.5540%0.402SS..Hα-helixtrans-62.1-45.2176.4-68.3174.9000111.5V68 I69 A70 V75 Q76V68-L72 HydrophobicContact CG1-CD1 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.44Å; V68-L72 PolarHBondContact O-N 2.88Å; V68-L72 VanDerWaalsContact O-N 3.07Å; I69-L72 PolarHBondContact O-N 3.25Å; A70-L72 PolarHBondContact O-N 3.44Å; L72-V75 PolarHBondContact O-N 2.98Å; L72-Q76 WeakPolarHBondContact O-CB 3.34Å; L72-Q76 WeakPolarHBondContact O-CG 3.38Å; L72-Q76 PolarHBondContact O-N 3.23Å
73V93.9Very high92.1Very high84 Ų8487 Ų8751%0.50943%0.431SS..Hα-helixtrans-62.3-46.2178.3171.60000111.1I69 A70 V75 Q76 W77I69-V73 HydrophobicContact CG2-CG2 4.39Å; I69-V73 WeakPolarHBondContact O-CG2 3.5Å; I69-V73 PolarHBondContact O-N 3.4Å; A70-V73 PolarHBondContact O-N 3.19Å; V73-V75 PolarHBondContact O-N 2.85Å; V73-Q76 PolarHBondContact O-N 2.99Å; V73-W77 VanDerWaalsContact O-CB 3.31Å; V73-W77 WeakPolarHBondContact O-CB 3.49Å; V73-W77 PolarHBondContact O-N 3.43Å
74L92.3Very high92.1Very high13 Ų1386.8 Ų86.87%0.06843%0.434CS..Hα-helixtrans-63.6-42.1179.8-70.6174.8000112A70 Q71 W77 K78 Y85 Y310 W314 I318A70-L74 WeakPolarHBondContact O-CB 3.45Å; A70-L74 VanDerWaalsContact O-CG 3.23Å; A70-L74 WeakPolarHBondContact O-CG 3.39Å; A70-L74 PolarHBondContact O-N 3.39Å; Q71-L74 PolarHBondContact O-N 3.47Å; L74-W77 HydrophobicContact CD2-CE3 4.33Å; L74-W77 PolarHBondContact O-N 2.65Å; L74-K78 WeakPolarHBondContact O-CB 2.88Å; L74-K78 PolarHBondContact O-N 3.38Å; L74-Y85 HydrophobicContact CD2-CE2 4.25Å; L74-Y310 HydrophobicContact CD1-CD2 4.21Å; L74-Y310 HydrophobicContact CD1-CE2 4.13Å; L74-W314 HydrophobicContact CD1-CB 4.09Å; L74-W314 HydrophobicContact CD1-CD2 3.93Å; L74-W314 HydrophobicContact CD1-CE3 4.23Å; L74-W314 HydrophobicContact CD1-CG 3.86Å; L74-W314 HydrophobicContact CD2-CD2 3.56Å; L74-W314 HydrophobicContact CD2-CE3 3.64Å; L74-W314 HydrophobicContact CD2-CG 4.28Å; L74-W314 HydrophobicContact CD2-CH2 3.77Å; L74-W314 HydrophobicContact CD2-CZ2 3.66Å; L74-W314 HydrophobicContact CD2-CZ3 3.74Å; L74-W314 HydrophobicContact CG-CD2 4.42Å; L74-I318 HydrophobicContact CD1-CD1 4.47Å
75V91.4Very high92Very high63 Ų6383.3 Ų83.338%0.38242%0.415SS..Hα-helixtrans-64.8-46.1176.7171.40000110.9Q71 L72 V73 W77 K78 Q79Q71-V75 WeakPolarHBondContact O-CB 3.29Å; Q71-V75 VanDerWaalsContact O-CG2 3.25Å; Q71-V75 WeakPolarHBondContact O-CG2 3.37Å; Q71-V75 PolarHBondContact O-N 2.93Å; L72-V75 PolarHBondContact O-N 2.98Å; V73-V75 PolarHBondContact O-N 2.85Å; V75-W77 VanDerWaalsContact C-N 3.34Å; V75-W77 PolarHBondContact O-N 3.01Å; V75-K78 PolarHBondContact O-N 3.35Å; V75-Q79 WeakPolarHBondContact O-CG 3.45Å; V75-Q79 PolarHBondContact O-N 3.27Å
76Q94.3Very high91.6Very high132 Ų13283.5 Ų83.562%0.61741%0.414SS*.Hα-helixtrans-62.8-40.7177-73.7-172.135.900112L72 V73 Q79 R80L72-Q76 WeakPolarHBondContact O-CB 3.34Å; L72-Q76 WeakPolarHBondContact O-CG 3.38Å; L72-Q76 PolarHBondContact O-N 3.23Å; V73-Q76 PolarHBondContact O-N 2.99Å; Q76-Q79 PolarHBondContact O-N 2.68Å; Q76-R80 WeakPolarHBondContact O-CB 3.13Å; Q76-R80 PolarHBondContact O-N 2.99Å
77W94.4Very high91.3Very high68 Ų6887.9 Ų87.926%0.25844%0.436SS..Hα-helixtrans-64.2-45.4177.4-175.313.5000111.7V73 L74 V75 Q79 R80 H81 S84 Y85 V88 W314V73-W77 VanDerWaalsContact O-CB 3.31Å; V73-W77 WeakPolarHBondContact O-CB 3.49Å; V73-W77 PolarHBondContact O-N 3.43Å; L74-W77 HydrophobicContact CD2-CE3 4.33Å; L74-W77 PolarHBondContact O-N 2.65Å; V75-W77 VanDerWaalsContact C-N 3.34Å; V75-W77 PolarHBondContact O-N 3.01Å; W77-Q79 VanDerWaalsContact C-N 3.27Å; W77-Q79 PolarHBondContact O-N 3.34Å; W77-R80 PolarHBondContact O-N 2.9Å; W77-H81 CarbonylContact O-C 3.43Å; W77-H81 PolarHBondContact O-N 3.46Å; W77-S84 WeakPolarHBondContact CZ2-OG 3.27Å; W77-S84 PolarHBondContact NE1-OG 3.04Å; W77-Y85 HydrophobicContact CD2-CD2 4.24Å; W77-Y85 HydrophobicContact CE3-CD2 4.3Å; W77-Y85 HydrophobicContact CG-CD2 4.38Å; W77-V88 HydrophobicContact CH2-CB 3.87Å; W77-V88 HydrophobicContact CH2-CG1 3.84Å; W77-V88 HydrophobicContact CH2-CG2 3.76Å; W77-V88 HydrophobicContact CZ2-CB 4.22Å; W77-V88 HydrophobicContact CZ2-CG2 3.84Å; W77-V88 HydrophobicContact CZ3-CG1 4.47Å; W77-W314 HydrophobicContact CE3-CH2 4.31Å; W77-W314 HydrophobicContact CH2-CH2 4.24Å; W77-W314 AromaticContact CZ3-CH2 3.51Å; W77-W314 HydrophobicContact CZ3-CH2 3.51Å; W77-W314 HydrophobicContact CZ3-CZ2 4Å; W77-W314 HydrophobicContact CZ3-CZ3 4.48Å
78K89.9Confident91.2Very high80 Ų8087.5 Ų87.535%0.34844%0.436SS..Hα-helixtrans-58.4-39.3175.7-174.9177.7-178.4-179.90112L74 V75 P82 Y85 D306L74-K78 WeakPolarHBondContact O-CB 2.88Å; L74-K78 PolarHBondContact O-N 3.38Å; V75-K78 PolarHBondContact O-N 3.35Å; K78-P82 WeakPolarHBondContact O-CA 3.41Å; K78-Y85 HydrophobicContact CB-CD1 4.01Å; K78-Y85 HydrophobicContact CB-CD2 4.06Å; K78-Y85 HydrophobicContact CB-CE1 4.24Å; K78-Y85 HydrophobicContact CB-CE2 4.25Å; K78-Y85 HydrophobicContact CB-CG 3.94Å; K78-Y85 HydrophobicContact CD-CD1 4.32Å; K78-Y85 HydrophobicContact CD-CE1 3.92Å; K78-Y85 HydrophobicContact CG-CD1 3.84Å; K78-Y85 HydrophobicContact CG-CE1 3.97Å; K78-Y85 HydrophobicContact CG-CG 4.28Å; K78-D306 IonicContact NZ-OD2 2.7Å; K78-D306 PolarHBondContact NZ-OD2 3.11Å
79Q91.3Very high91.1Very high155 Ų15583.6 Ų83.672%0.72441%0.412SS*.Hα-helixtrans-72.3-44.5178.4-71.21799.700112.8V75 Q76 W77V75-Q79 WeakPolarHBondContact O-CG 3.45Å; V75-Q79 PolarHBondContact O-N 3.27Å; Q76-Q79 PolarHBondContact O-N 2.68Å; W77-Q79 VanDerWaalsContact C-N 3.27Å; W77-Q79 PolarHBondContact O-N 3.34Å
80R92.7Very high90.8Very high202 Ų20279.5 Ų79.576%0.76239%0.391SS*.Hα-helixtrans-82.8-38.5-172.6-162.7172.5-178.7122.9-1.8113.2Q76 W77Q76-R80 WeakPolarHBondContact O-CB 3.13Å; Q76-R80 PolarHBondContact O-N 2.99Å; W77-R80 PolarHBondContact O-N 2.9Å
81H92.3Very high90.7Very high105 Ų10584.8 Ų84.849%0.48641%0.411SS..  trans-134.968.3-177.7-58.3-69.8000111.8W77 K83 S84 Y85W77-H81 CarbonylContact O-C 3.43Å; W77-H81 PolarHBondContact O-N 3.46Å; H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 2.97Å; H81-S84 PolarHBondContact O-N 3.43Å; H81-S84 VanDerWaalsContact O-N 3.15Å; H81-Y85 PolarHBondContact O-N 2.76Å
82P86.3Confident90.7Very high66 Ų6682.1 Ų82.143%0.42940%0.399SS..Hα-helixtrans-59.2-36.4-174.821.9-33.7000113.4K78 N86K78-P82 WeakPolarHBondContact O-CA 3.41Å; P82-N86 WeakPolarHBondContact O-CB 3.48Å; P82-N86 PolarHBondContact O-N 2.92Å; P82-N86 PolarHBondContact O-ND2 3.44Å
83K84.9Confident90.6Very high183 Ų18377.1 Ų77.180%0.79637%0.373SS*.Hα-helixtrans-63.5-45.4178-68.8-173.6176.5-177.90112.4H81 L87H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 2.97Å; K83-L87 WeakPolarHBondContact O-CB 3.39Å; K83-L87 PolarHBondContact O-N 3.48Å
84S90.4Very high90.4Very high54 Ų5476.7 Ų76.738%0.37836%0.362SS..Hα-helixtrans-68-45.7179.8172.90000110.7W77 H81 N86 L87 V88W77-S84 WeakPolarHBondContact CZ2-OG 3.27Å; W77-S84 PolarHBondContact NE1-OG 3.04Å; H81-S84 PolarHBondContact O-N 3.43Å; H81-S84 VanDerWaalsContact O-N 3.15Å; S84-N86 PolarHBondContact O-N 3.26Å; S84-L87 PolarHBondContact O-N 2.9Å; S84-V88 WeakPolarHBondContact O-CG2 3.39Å; S84-V88 PolarHBondContact O-N 3.02Å
85Y89.9Confident90.3Very high21 Ų2179.2 Ų79.28%0.08238%0.377CS..Hα-helixtrans-56.4-47.9175.3174-91.4000112.2L74 W77 K78 H81 L87 V88 T89 W314L74-Y85 HydrophobicContact CD2-CE2 4.25Å; W77-Y85 HydrophobicContact CD2-CD2 4.24Å; W77-Y85 HydrophobicContact CE3-CD2 4.3Å; W77-Y85 HydrophobicContact CG-CD2 4.38Å; K78-Y85 HydrophobicContact CB-CD1 4.01Å; K78-Y85 HydrophobicContact CB-CD2 4.06Å; K78-Y85 HydrophobicContact CB-CE1 4.24Å; K78-Y85 HydrophobicContact CB-CE2 4.25Å; K78-Y85 HydrophobicContact CB-CG 3.94Å; K78-Y85 HydrophobicContact CD-CD1 4.32Å; K78-Y85 HydrophobicContact CD-CE1 3.92Å; K78-Y85 HydrophobicContact CG-CD1 3.84Å; K78-Y85 HydrophobicContact CG-CE1 3.97Å; K78-Y85 HydrophobicContact CG-CG 4.28Å; H81-Y85 PolarHBondContact O-N 2.76Å; Y85-L87 PolarHBondContact O-N 3.47Å; Y85-V88 PolarHBondContact O-N 2.94Å; Y85-T89 VanDerWaalsContact O-CB 3.28Å; Y85-T89 WeakPolarHBondContact O-CB 3.44Å; Y85-T89 PolarHBondContact O-N 3.09Å; Y85-T89 PolarHBondContact O-OG1 3.33Å; Y85-W314 HydrophobicContact CE2-CZ2 4.45Å
86N85.7Confident90.3Very high74 Ų7477.1 Ų77.140%0.39637%0.365SS..Hα-helixtrans-64.2-40.6179.6-73.2-10.7000111.8P82 S84 L90P82-N86 WeakPolarHBondContact O-CB 3.48Å; P82-N86 PolarHBondContact O-N 2.92Å; P82-N86 PolarHBondContact O-ND2 3.44Å; S84-N86 PolarHBondContact O-N 3.26Å; N86-L90 VanDerWaalsContact O-CB 3.26Å; N86-L90 WeakPolarHBondContact O-CB 3.47Å; N86-L90 PolarHBondContact O-N 3.08Å
87L87.4Confident90.1Very high109 Ų10971.3 Ų71.357%0.57134%0.339SS*.Hα-helixtrans-64.3-47178.2-174.971000111.8K83 S84 Y85 L90 F91K83-L87 WeakPolarHBondContact O-CB 3.39Å; K83-L87 PolarHBondContact O-N 3.48Å; S84-L87 PolarHBondContact O-N 2.9Å; Y85-L87 PolarHBondContact O-N 3.47Å; L87-L90 PolarHBondContact O-N 2.96Å; L87-F91 WeakPolarHBondContact O-CB 3.16Å; L87-F91 PolarHBondContact O-N 3.43Å
88V91.5Very high89.9Confident44 Ų4470.7 Ų70.727%0.26734%0.34SS..Hα-helixtrans-65.7-43.9179173.30000110.8W77 S84 Y85 L90 F91 Q92 W314W77-V88 HydrophobicContact CH2-CB 3.87Å; W77-V88 HydrophobicContact CH2-CG1 3.84Å; W77-V88 HydrophobicContact CH2-CG2 3.76Å; W77-V88 HydrophobicContact CZ2-CB 4.22Å; W77-V88 HydrophobicContact CZ2-CG2 3.84Å; W77-V88 HydrophobicContact CZ3-CG1 4.47Å; S84-V88 WeakPolarHBondContact O-CG2 3.39Å; S84-V88 PolarHBondContact O-N 3.02Å; Y85-V88 PolarHBondContact O-N 2.94Å; V88-L90 VanDerWaalsContact C-N 3.33Å; V88-L90 PolarHBondContact O-N 3.46Å; V88-F91 PolarHBondContact O-N 2.67Å; V88-Q92 HydrophobicContact CG1-CG 4.37Å; V88-Q92 WeakPolarHBondContact O-CG 3.26Å; V88-Q92 PolarHBondContact O-N 3.07Å; V88-W314 HydrophobicContact CG1-CH2 3.9Å; V88-W314 HydrophobicContact CG1-CZ2 4.07Å
89T91.3Very high90Very high1 Ų172.9 Ų72.91%0.00635%0.347CS..Hα-helixtrans-62.3-42.1177.7-56.20000111Y85 Q92 M93 R309 A313 W314Y85-T89 VanDerWaalsContact O-CB 3.28Å; Y85-T89 WeakPolarHBondContact O-CB 3.44Å; Y85-T89 PolarHBondContact O-N 3.09Å; Y85-T89 PolarHBondContact O-OG1 3.33Å; T89-Q92 PolarHBondContact O-N 3.48Å; T89-M93 HydrophobicContact CG2-CG 4.34Å; T89-M93 WeakPolarHBondContact O-CB 3.33Å; T89-M93 WeakPolarHBondContact O-CG 3.3Å; T89-M93 PolarHBondContact O-N 3.47Å; T89-R309 HydrophobicContact CG2-CB 3.85Å; T89-R309 HydrophobicContact CG2-CG 4.05Å; T89-A313 HydrophobicContact CG2-CB 4.43Å; T89-W314 PolarHBondContact OG1-NE1 2.89Å
90L88.9Confident89.9Confident12 Ų1269.9 Ų69.96%0.06333%0.332CS..Hα-helixtrans-63-43.3176.3-17865.4000111.7N86 L87 V88 M93 W94 L197 D200 F201 M204N86-L90 VanDerWaalsContact O-CB 3.26Å; N86-L90 WeakPolarHBondContact O-CB 3.47Å; N86-L90 PolarHBondContact O-N 3.08Å; L87-L90 PolarHBondContact O-N 2.96Å; V88-L90 VanDerWaalsContact C-N 3.33Å; V88-L90 PolarHBondContact O-N 3.46Å; L90-M93 PolarHBondContact O-N 3.04Å; L90-W94 PolarHBondContact O-N 2.94Å; L90-L197 HydrophobicContact CD1-CD2 3.83Å; L90-D200 HydrophobicContact CD1-CB 3.97Å; L90-F201 HydrophobicContact CD1-CD2 4.19Å; L90-F201 HydrophobicContact CD1-CE2 3.93Å; L90-F201 HydrophobicContact CD1-CZ 4.43Å; L90-F201 HydrophobicContact CD2-CE1 4.43Å; L90-F201 HydrophobicContact CD2-CZ 4.34Å; L90-M204 HydrophobicContact CD2-CE 3.27Å
91F91.5Very high89.7Confident129 Ų12960.6 Ų60.657%0.56630%0.298SS*.Hα-helixtrans-61.3-46.5176177.9-101.6000111.7L87 V88 W94 V95L87-F91 WeakPolarHBondContact O-CB 3.16Å; L87-F91 PolarHBondContact O-N 3.43Å; V88-F91 PolarHBondContact O-N 2.67Å; F91-W94 WeakPolarHBondContact O-CB 3.44Å; F91-W94 PolarHBondContact O-N 2.96Å; F91-W94 VanDerWaalsContact O-N 3.09Å; F91-V95 HydrophobicContact CD1-CG2 4.3Å; F91-V95 HydrophobicContact CD2-CG2 4.19Å; F91-V95 HydrophobicContact CE1-CG2 3.88Å; F91-V95 HydrophobicContact CE2-CG2 3.75Å; F91-V95 HydrophobicContact CG-CG2 4.46Å; F91-V95 HydrophobicContact CZ-CG2 3.59Å; F91-V95 WeakPolarHBondContact O-CG2 3.31Å; F91-V95 PolarHBondContact O-N 3.37Å
92Q91.7Very high89.7Confident25 Ų2558.6 Ų58.612%0.11729%0.293CS..Hα-helixtrans-63-43.4176.6-73.5176.6-8.400112.3V88 T89 W94 V95 V96 A313V88-Q92 HydrophobicContact CG1-CG 4.37Å; V88-Q92 WeakPolarHBondContact O-CG 3.26Å; V88-Q92 PolarHBondContact O-N 3.07Å; T89-Q92 PolarHBondContact O-N 3.48Å; Q92-W94 PolarHBondContact O-N 3.39Å; Q92-W94 VanDerWaalsContact O-N 3.08Å; Q92-V95 PolarHBondContact O-N 3.48Å; Q92-V96 HydrophobicContact CB-CG2 4.32Å; Q92-V96 VanDerWaalsContact O-CB 3.28Å; Q92-V96 WeakPolarHBondContact O-CB 3.44Å; Q92-V96 WeakPolarHBondContact O-CG2 3.28Å; Q92-V96 PolarHBondContact O-N 3.42Å; Q92-A313 HydrophobicContact CB-CB 3.82Å
93M90.6Very high89.9Confident0 Ų062 Ų620%030%0.301CS..Hα-helixtrans-57.9-22.2174.3-76.7-71.3-64.300112.8T89 L90 P97 Y193 V196 L197 R309 V312 A313T89-M93 HydrophobicContact CG2-CG 4.34Å; T89-M93 WeakPolarHBondContact O-CB 3.33Å; T89-M93 WeakPolarHBondContact O-CG 3.3Å; T89-M93 PolarHBondContact O-N 3.47Å; L90-M93 PolarHBondContact O-N 3.04Å; M93-P97 VanDerWaalsContact O-CD 3.3Å; M93-P97 WeakPolarHBondContact O-CD 3.46Å; M93-P97 WeakPolarHBondContact O-CG 3.46Å; M93-Y193 HydrophobicContact CE-CD2 3.85Å; M93-Y193 HydrophobicContact CE-CE2 3.92Å; M93-Y193 WeakPolarHBondContact O-CE2 3.28Å; M93-Y193 PolarHBondContact O-OH 3.25Å; M93-V196 HydrophobicContact CE-CB 4.11Å; M93-V196 HydrophobicContact CE-CG1 3.81Å; M93-L197 HydrophobicContact CB-CD2 3.87Å; M93-R309 HydrophobicContact CG-CG 4.44Å; M93-R309 HydrophobicContact SD-CG 4.28Å; M93-V312 HydrophobicContact CE-CG1 4.41Å; M93-V312 HydrophobicContact SD-CB 3.91Å; M93-V312 HydrophobicContact SD-CG1 3.95Å; M93-A313 HydrophobicContact CG-CB 3.87Å; M93-A313 HydrophobicContact SD-CB 3.87Å
94W89.6Confident90.1Very high74 Ų7459.6 Ų59.628%0.2830%0.296SS..Hα-helixtrans-90-46177.1-146-0.1000112.2L90 F91 Q92 W113 S117 F201L90-W94 PolarHBondContact O-N 2.94Å; F91-W94 WeakPolarHBondContact O-CB 3.44Å; F91-W94 PolarHBondContact O-N 2.96Å; F91-W94 VanDerWaalsContact O-N 3.09Å; Q92-W94 PolarHBondContact O-N 3.39Å; Q92-W94 VanDerWaalsContact O-N 3.08Å; W94-W113 AromaticContact CD1-CE2 3.34Å; W94-W113 AromaticContact CD1-CZ2 3.04Å; W94-W113 AromaticContact CD1-NE1 3.35Å; W94-W113 VanDerWaalsContact CD1-NE1 3.35Å; W94-W113 HydrophobicContact CG-CZ2 4.07Å; W94-W113 AromaticContact NE1-CE2 3.4Å; W94-W113 AromaticContact NE1-CH2 3.7Å; W94-W113 AromaticContact NE1-CZ2 3.04Å; W94-W113 AromaticContact NE1-NE1 3.75Å; W94-S117 PolarHBondContact NE1-OG 2.94Å; W94-F201 HydrophobicContact CE3-CZ 4.22Å; W94-F201 HydrophobicContact CH2-CZ 4.15Å; W94-F201 AromaticContact CZ3-CZ 3.91Å; W94-F201 HydrophobicContact CZ3-CZ 3.91Å
95V91.3Very high90.1Very high66 Ų6663.2 Ų63.240%0.431%0.307SS..Hα-helixtrans-79.3-44.2-174.5174.30000113.1F91 Q92 L98 Y99F91-V95 HydrophobicContact CD1-CG2 4.3Å; F91-V95 HydrophobicContact CD2-CG2 4.19Å; F91-V95 HydrophobicContact CE1-CG2 3.88Å; F91-V95 HydrophobicContact CE2-CG2 3.75Å; F91-V95 HydrophobicContact CG-CG2 4.46Å; F91-V95 HydrophobicContact CZ-CG2 3.59Å; F91-V95 WeakPolarHBondContact O-CG2 3.31Å; F91-V95 PolarHBondContact O-N 3.37Å; Q92-V95 PolarHBondContact O-N 3.48Å; V95-L98 WeakPolarHBondContact O-CB 3.36Å; V95-L98 PolarHBondContact O-N 2.95Å; V95-Y99 PolarHBondContact O-N 3.11Å
96V91.7Very high90.1Very high20 Ų2066.4 Ų66.412%0.12132%0.319CS..Hα-helixtrans-62.9-51.1-172.6173.60000111.3Q92 L98 Y99 F100 V312 P316Q92-V96 HydrophobicContact CB-CG2 4.32Å; Q92-V96 VanDerWaalsContact O-CB 3.28Å; Q92-V96 WeakPolarHBondContact O-CB 3.44Å; Q92-V96 WeakPolarHBondContact O-CG2 3.28Å; Q92-V96 PolarHBondContact O-N 3.42Å; V96-L98 VanDerWaalsContact C-N 3.29Å; V96-L98 PolarHBondContact O-N 3.05Å; V96-Y99 PolarHBondContact O-N 3.09Å; V96-F100 HydrophobicContact CG1-CD2 3.79Å; V96-F100 HydrophobicContact CG1-CE2 3.67Å; V96-F100 VanDerWaalsContact O-CD2 3.28Å; V96-F100 WeakPolarHBondContact O-CD2 3.27Å; V96-F100 PolarHBondContact O-N 3.42Å; V96-F100 VanDerWaalsContact O-N 3.16Å; V96-V312 WeakPolarHBondContact CG1-O 3.45Å; V96-P316 HydrophobicContact CG1-CB 3.99Å; V96-P316 HydrophobicContact CG1-CG 3.88Å
97P89.4Confident90.3Very high10 Ų1071.2 Ų71.27%0.06533%0.331CS..Hα-helixtrans-61.3-36.9175.7-25.838000112.9M93 F100 T101 F109 Y193 V312M93-P97 VanDerWaalsContact O-CD 3.3Å; M93-P97 WeakPolarHBondContact O-CD 3.46Å; M93-P97 WeakPolarHBondContact O-CG 3.46Å; P97-F100 PolarHBondContact O-N 3.42Å; P97-T101 VanDerWaalsContact O-CB 3.28Å; P97-T101 WeakPolarHBondContact O-CB 3.37Å; P97-T101 WeakPolarHBondContact O-CG2 3.45Å; P97-T101 PolarHBondContact O-N 3.47Å; P97-T101 PolarHBondContact O-OG1 2.97Å; P97-F109 HydrophobicContact CB-CE1 4.11Å; P97-F109 HydrophobicContact CB-CZ 3.88Å; P97-Y193 HydrophobicContact CB-CE2 4.34Å; P97-Y193 HydrophobicContact CG-CE2 3.73Å; P97-V312 HydrophobicContact CG-CG1 3.7Å
98L90.2Very high90.4Very high54 Ų5475.6 Ų75.628%0.28334%0.34SS..Hα-helixtrans-63.3-43.5177.8-173.370.6000111.5V95 V96 T101 T102 L110 W113V95-L98 WeakPolarHBondContact O-CB 3.36Å; V95-L98 PolarHBondContact O-N 2.95Å; V96-L98 VanDerWaalsContact C-N 3.29Å; V96-L98 PolarHBondContact O-N 3.05Å; L98-T101 PolarHBondContact O-OG1 2.9Å; L98-T102 HydrophobicContact CD1-CG2 4.38Å; L98-T102 WeakPolarHBondContact O-CB 3.29Å; L98-T102 VanDerWaalsContact O-CG2 3.25Å; L98-T102 WeakPolarHBondContact O-CG2 3.33Å; L98-T102 PolarHBondContact O-N 2.83Å; L98-T102 PolarHBondContact O-OG1 2.68Å; L98-L110 HydrophobicContact CD1-CD2 3.71Å; L98-W113 HydrophobicContact CB-CZ2 4.18Å; L98-W113 HydrophobicContact CD1-CD2 4.12Å; L98-W113 HydrophobicContact CD1-CE3 3.95Å; L98-W113 HydrophobicContact CD1-CH2 3.92Å; L98-W113 HydrophobicContact CD1-CZ2 3.99Å; L98-W113 HydrophobicContact CD1-CZ3 3.89Å; L98-W113 HydrophobicContact CD2-CH2 3.69Å; L98-W113 HydrophobicContact CD2-CZ2 3.88Å; L98-W113 HydrophobicContact CD2-CZ3 4.34Å; L98-W113 HydrophobicContact CG-CH2 4.32Å; L98-W113 HydrophobicContact CG-CZ2 4.24Å
99Y91.4Very high90.4Very high127 Ų12773.5 Ų73.550%0.49833%0.327SS..Hα-helixtrans-60-50.4176.8174.1-99.8000112V95 V96 T102 K103V95-Y99 PolarHBondContact O-N 3.11Å; V96-Y99 PolarHBondContact O-N 3.09Å; Y99-T102 PolarHBondContact O-OG1 3.45Å; Y99-K103 HydrophobicContact CE2-CG 4.36Å; Y99-K103 WeakPolarHBondContact O-CG 3.37Å; Y99-K103 PolarHBondContact O-N 3.33Å
100F89.3Confident90.5Very high91 Ų9174.7 Ų74.740%0.39933%0.334SS..Hα-helixtrans-67.6-42.5-179.5-75.8-69.4000112.6V96 P97 T102 K103 L104 P316V96-F100 HydrophobicContact CG1-CD2 3.79Å; V96-F100 HydrophobicContact CG1-CE2 3.67Å; V96-F100 VanDerWaalsContact O-CD2 3.28Å; V96-F100 WeakPolarHBondContact O-CD2 3.27Å; V96-F100 PolarHBondContact O-N 3.42Å; V96-F100 VanDerWaalsContact O-N 3.16Å; P97-F100 PolarHBondContact O-N 3.42Å; F100-T102 PolarHBondContact O-N 2.93Å; F100-K103 PolarHBondContact O-N 3.07Å; F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 VanDerWaalsContact O-CG 3.27Å; F100-L104 WeakPolarHBondContact O-CG 3.34Å; F100-L104 PolarHBondContact O-N 2.84Å; F100-P316 HydrophobicContact CE2-CB 3.65Å; F100-P316 HydrophobicContact CE2-CG 4.13Å; F100-P316 HydrophobicContact CZ-CB 3.99Å
101T89.3Confident90.7Very high8 Ų878.2 Ų78.25%0.04936%0.356CS..Hα-helixtrans-72-29-176.555.30000113.3P97 L98 H105 W106 F109 L110P97-T101 VanDerWaalsContact O-CB 3.28Å; P97-T101 WeakPolarHBondContact O-CB 3.37Å; P97-T101 WeakPolarHBondContact O-CG2 3.45Å; P97-T101 PolarHBondContact O-N 3.47Å; P97-T101 PolarHBondContact O-OG1 2.97Å; L98-T101 PolarHBondContact O-OG1 2.9Å; T101-H105 PolarHBondContact O-N 3.32Å; T101-W106 HydrophobicContact CG2-CB 4.47Å; T101-W106 HydrophobicContact CG2-CE3 4Å; T101-W106 PolarHBondContact O-N 3.37Å; T101-F109 HydrophobicContact CG2-CB 4.25Å; T101-F109 HydrophobicContact CG2-CD1 3.53Å; T101-F109 HydrophobicContact CG2-CE1 3.97Å; T101-F109 HydrophobicContact CG2-CG 3.88Å; T101-F109 WeakPolarHBondContact OG1-CD1 3.38Å; T101-L110 WeakPolarHBondContact OG1-CD2 3.36Å
102T90.9Very high90.8Very high63 Ų6374.9 Ų74.939%0.38735%0.346SS..Hα-helixtrans-69.4-42.6170.150.80000111.9L98 Y99 F100 H105 L110L98-T102 HydrophobicContact CD1-CG2 4.38Å; L98-T102 WeakPolarHBondContact O-CB 3.29Å; L98-T102 VanDerWaalsContact O-CG2 3.25Å; L98-T102 WeakPolarHBondContact O-CG2 3.33Å; L98-T102 PolarHBondContact O-N 2.83Å; L98-T102 PolarHBondContact O-OG1 2.68Å; Y99-T102 PolarHBondContact O-OG1 3.45Å; F100-T102 PolarHBondContact O-N 2.93Å; T102-H105 PolarHBondContact O-N 3.49Å; T102-L110 HydrophobicContact CG2-CD1 4.13Å; T102-L110 HydrophobicContact CG2-CD2 3.75Å
103K90.6Very high90.9Very high138 Ų13875.2 Ų75.260%0.635%0.346SS*.Hα-helixtrans-64.1-37.5175.2-72.6-71.7-174.2176.10113.1Y99 F100 H105Y99-K103 HydrophobicContact CE2-CG 4.36Å; Y99-K103 WeakPolarHBondContact O-CG 3.37Å; Y99-K103 PolarHBondContact O-N 3.33Å; F100-K103 PolarHBondContact O-N 3.07Å; K103-H105 VanDerWaalsContact C-N 3.3Å
104L89.8Confident91.1Very high131 Ų13181.4 Ų81.469%0.68637%0.373SS*.THydrogen-bonded Turntrans-86.65.2179-63.6172.8000113.4F100 W106F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 VanDerWaalsContact O-CG 3.27Å; F100-L104 WeakPolarHBondContact O-CG 3.34Å; F100-L104 PolarHBondContact O-N 2.84Å; L104-W106 PolarHBondContact O-N 3.38Å
105H89.8Confident91.3Very high130 Ų13082.6 Ų82.660%0.60238%0.384SS*.THydrogen-bonded Turntrans51.336.7-178.2-63.8-67.6000114.6T101 T102 K103 W107T101-H105 PolarHBondContact O-N 3.32Å; T102-H105 PolarHBondContact O-N 3.49Å; K103-H105 VanDerWaalsContact C-N 3.3Å; H105-W107 VanDerWaalsContact C-N 3.33Å; H105-W107 PolarHBondContact O-N 3.06Å
106W90.3Very high91.4Very high89 Ų8980 Ų8034%0.33737%0.368SS..  trans-83.974.2-177.6-1626.4000112T101 L104 R108 F109 L110T101-W106 HydrophobicContact CG2-CB 4.47Å; T101-W106 HydrophobicContact CG2-CE3 4Å; T101-W106 PolarHBondContact O-N 3.37Å; L104-W106 PolarHBondContact O-N 3.38Å; W106-R108 VanDerWaalsContact C-N 3.3Å; W106-R108 PolarHBondContact O-N 3.44Å; W106-F109 HydrophobicContact CD2-CB 4.16Å; W106-F109 HydrophobicContact CE3-CB 4.49Å; W106-F109 HydrophobicContact CG-CB 4.2Å; W106-F109 PolarHBondContact O-N 3.48Å; W106-F109 VanDerWaalsContact O-N 3.15Å; W106-L110 PolarHBondContact O-N 3.49Å
107W90.1Very high91.6Very high175 Ų17579.6 Ų79.666%0.66337%0.365SS*.Hα-helixtrans-57.6-34.9-172.2-66.2108.8000115.1H105 F109 L110 V111H105-W107 VanDerWaalsContact C-N 3.33Å; H105-W107 PolarHBondContact O-N 3.06Å; W107-F109 VanDerWaalsContact C-N 3.33Å; W107-F109 PolarHBondContact O-N 3.3Å; W107-L110 HydrophobicContact CD2-CD1 4.49Å; W107-L110 HydrophobicContact CE3-CD1 3.84Å; W107-L110 HydrophobicContact CZ3-CD1 4.05Å; W107-L110 PolarHBondContact O-N 3.42Å; W107-V111 WeakPolarHBondContact O-CG2 3.2Å; W107-V111 PolarHBondContact O-N 3.35Å
108R90.4Very high91.8Very high200 Ų20082.8 Ų82.876%0.75538%0.384SS*.Hα-helixtrans-60.3-43.7178.7-62-179.5-174.7162.81.9111.6W106 T112W106-R108 VanDerWaalsContact C-N 3.3Å; W106-R108 PolarHBondContact O-N 3.44Å; R108-T112 WeakPolarHBondContact O-CG2 3.43Å; R108-T112 PolarHBondContact O-N 3.43Å; R108-T112 PolarHBondContact O-OG1 3.26Å
109F90.9Very high92.1Very high0 Ų082.4 Ų82.40%038%0.384CS..Hα-helixtrans-65.4-47.3176.6-179.2-89.1000110.4P97 T101 W106 W107 V111 T112 W113 F189 Y190 Y193P97-F109 HydrophobicContact CB-CE1 4.11Å; P97-F109 HydrophobicContact CB-CZ 3.88Å; T101-F109 HydrophobicContact CG2-CB 4.25Å; T101-F109 HydrophobicContact CG2-CD1 3.53Å; T101-F109 HydrophobicContact CG2-CE1 3.97Å; T101-F109 HydrophobicContact CG2-CG 3.88Å; T101-F109 WeakPolarHBondContact OG1-CD1 3.38Å; W106-F109 HydrophobicContact CD2-CB 4.16Å; W106-F109 HydrophobicContact CE3-CB 4.49Å; W106-F109 HydrophobicContact CG-CB 4.2Å; W106-F109 PolarHBondContact O-N 3.48Å; W106-F109 VanDerWaalsContact O-N 3.15Å; W107-F109 VanDerWaalsContact C-N 3.33Å; W107-F109 PolarHBondContact O-N 3.3Å; F109-V111 VanDerWaalsContact C-N 3.32Å; F109-V111 PolarHBondContact O-N 3.05Å; F109-T112 PolarHBondContact O-N 3.35Å; F109-T112 PolarHBondContact O-OG1 2.84Å; F109-W113 HydrophobicContact CD1-CB 4.15Å; F109-W113 HydrophobicContact CE1-CB 3.92Å; F109-W113 AromaticContact CE1-CD1 3.59Å; F109-W113 AromaticContact CE1-CG 3.94Å; F109-W113 HydrophobicContact CE1-CG 3.94Å; F109-W113 HydrophobicContact CZ-CB 4.39Å; F109-W113 AromaticContact CZ-CD1 3.74Å; F109-W113 HydrophobicContact CZ-CG 4.39Å; F109-W113 WeakPolarHBondContact O-CB 3.48Å; F109-W113 PolarHBondContact O-N 2.98Å; F109-F189 AromaticContact CD2-CE1 3.84Å; F109-F189 HydrophobicContact CD2-CE1 3.84Å; F109-F189 AromaticContact CE2-CE1 3.55Å; F109-F189 HydrophobicContact CE2-CE1 3.55Å; F109-F189 HydrophobicContact CE2-CZ 4.09Å; F109-Y190 WeakPolarHBondContact CA-OH 3.39Å; F109-Y190 HydrophobicContact CB-CE1 4.38Å; F109-Y190 HydrophobicContact CD2-CD1 4.3Å; F109-Y190 AromaticContact CD2-CE1 3.56Å; F109-Y190 HydrophobicContact CD2-CE1 3.56Å; F109-Y190 HydrophobicContact CE2-CE1 4.32Å; F109-Y190 HydrophobicContact CG-CE1 4.39Å; F109-Y190 PolarHBondContact N-OH 2.91Å; F109-Y193 AromaticContact CE2-CD1 3.86Å; F109-Y193 HydrophobicContact CE2-CD1 3.86Å; F109-Y193 AromaticContact CE2-CE1 3.75Å; F109-Y193 HydrophobicContact CE2-CE1 3.75Å; F109-Y193 HydrophobicContact CZ-CD1 4.07Å; F109-Y193 AromaticContact CZ-CE1 3.47Å; F109-Y193 HydrophobicContact CZ-CE1 3.47Å; F109-Y193 VanDerWaalsContact CZ-CE1 3.47Å; F109-Y193 AromaticContact CZ-CZ 3.87Å
110L92.1Very high92.2Very high26 Ų2676.4 Ų76.414%0.13636%0.361CS..Hα-helixtrans-57.1-42.8-178.9-64.5175.8000112.9L98 T101 T102 W106 W107 F114L98-L110 HydrophobicContact CD1-CD2 3.71Å; T101-L110 WeakPolarHBondContact OG1-CD2 3.36Å; T102-L110 HydrophobicContact CG2-CD1 4.13Å; T102-L110 HydrophobicContact CG2-CD2 3.75Å; W106-L110 PolarHBondContact O-N 3.49Å; W107-L110 HydrophobicContact CD2-CD1 4.49Å; W107-L110 HydrophobicContact CE3-CD1 3.84Å; W107-L110 HydrophobicContact CZ3-CD1 4.05Å; W107-L110 PolarHBondContact O-N 3.42Å; L110-F114 VanDerWaalsContact O-CB 3.28Å; L110-F114 WeakPolarHBondContact O-CB 3.19Å; L110-F114 PolarHBondContact O-N 3.37Å
111V93.4Very high92.4Very high87 Ų8774.6 Ų74.653%0.52736%0.362SS..Hα-helixtrans-64.6-50.8177.8172.50000111.2W107 F109 W113 F114 I115W107-V111 WeakPolarHBondContact O-CG2 3.2Å; W107-V111 PolarHBondContact O-N 3.35Å; F109-V111 VanDerWaalsContact C-N 3.32Å; F109-V111 PolarHBondContact O-N 3.05Å; V111-W113 VanDerWaalsContact C-N 3.29Å; V111-W113 PolarHBondContact O-N 2.78Å; V111-F114 PolarHBondContact O-N 2.93Å; V111-I115 HydrophobicContact CG1-CD1 4Å; V111-I115 WeakPolarHBondContact O-CG1 3.45Å; V111-I115 PolarHBondContact O-N 3.08Å; V111-I115 VanDerWaalsContact O-N 3.08Å
112T93.7Very high92.7Very high58 Ų5879.9 Ų79.936%0.35638%0.382SS..Hα-helixtrans-62.9-39.5179.857.30000111.5R108 F109 I115 F116 Y194R108-T112 WeakPolarHBondContact O-CG2 3.43Å; R108-T112 PolarHBondContact O-N 3.43Å; R108-T112 PolarHBondContact O-OG1 3.26Å; F109-T112 PolarHBondContact O-N 3.35Å; F109-T112 PolarHBondContact O-OG1 2.84Å; T112-I115 PolarHBondContact O-N 3.09Å; T112-F116 VanDerWaalsContact O-CB 3.29Å; T112-F116 WeakPolarHBondContact O-CB 3.48Å; T112-F116 PolarHBondContact O-N 3.19Å; T112-Y194 WeakPolarHBondContact CB-OH 3.38Å; T112-Y194 PolarHBondContact OG1-OH 2.96Å
113W94.3Very high92.9Very high33 Ų3377 Ų7713%0.12537%0.365CS..Hα-helixtrans-65.7-40.8178.8179.6100.5000111.5W94 L98 F109 V111 F116 S117 Y193 Y194W94-W113 AromaticContact CD1-CE2 3.34Å; W94-W113 AromaticContact CD1-CZ2 3.04Å; W94-W113 AromaticContact CD1-NE1 3.35Å; W94-W113 VanDerWaalsContact CD1-NE1 3.35Å; W94-W113 HydrophobicContact CG-CZ2 4.07Å; W94-W113 AromaticContact NE1-CE2 3.4Å; W94-W113 AromaticContact NE1-CH2 3.7Å; W94-W113 AromaticContact NE1-CZ2 3.04Å; W94-W113 AromaticContact NE1-NE1 3.75Å; L98-W113 HydrophobicContact CB-CZ2 4.18Å; L98-W113 HydrophobicContact CD1-CD2 4.12Å; L98-W113 HydrophobicContact CD1-CE3 3.95Å; L98-W113 HydrophobicContact CD1-CH2 3.92Å; L98-W113 HydrophobicContact CD1-CZ2 3.99Å; L98-W113 HydrophobicContact CD1-CZ3 3.89Å; L98-W113 HydrophobicContact CD2-CH2 3.69Å; L98-W113 HydrophobicContact CD2-CZ2 3.88Å; L98-W113 HydrophobicContact CD2-CZ3 4.34Å; L98-W113 HydrophobicContact CG-CH2 4.32Å; L98-W113 HydrophobicContact CG-CZ2 4.24Å; F109-W113 HydrophobicContact CD1-CB 4.15Å; F109-W113 HydrophobicContact CE1-CB 3.92Å; F109-W113 AromaticContact CE1-CD1 3.59Å; F109-W113 AromaticContact CE1-CG 3.94Å; F109-W113 HydrophobicContact CE1-CG 3.94Å; F109-W113 HydrophobicContact CZ-CB 4.39Å; F109-W113 AromaticContact CZ-CD1 3.74Å; F109-W113 HydrophobicContact CZ-CG 4.39Å; F109-W113 WeakPolarHBondContact O-CB 3.48Å; F109-W113 PolarHBondContact O-N 2.98Å; V111-W113 VanDerWaalsContact C-N 3.29Å; V111-W113 PolarHBondContact O-N 2.78Å; W113-F116 PolarHBondContact O-N 2.86Å; W113-S117 WeakPolarHBondContact O-CB 3.41Å; W113-S117 PolarHBondContact O-N 3.38Å; W113-S117 PolarHBondContact O-OG 3.05Å; W113-Y193 PolarHBondContact NE1-OH 3.07Å; W113-Y194 VanDerWaalsContact CA-OH 3.25Å; W113-Y194 WeakPolarHBondContact CA-OH 3.47Å; W113-Y194 PolarHBondContact N-OH 2.91Å
114F94.1Very high93Very high130 Ų13071.5 Ų71.557%0.5734%0.343SS*.Hα-helixtrans-65-47.7177.6-179.9-100.3000111.1L110 V111 F116 S117 V118L110-F114 VanDerWaalsContact O-CB 3.28Å; L110-F114 WeakPolarHBondContact O-CB 3.19Å; L110-F114 PolarHBondContact O-N 3.37Å; V111-F114 PolarHBondContact O-N 2.93Å; F114-F116 PolarHBondContact O-N 3.41Å; F114-S117 PolarHBondContact O-N 2.94Å; F114-V118 HydrophobicContact CD1-CG2 4.3Å; F114-V118 HydrophobicContact CD2-CG2 4.47Å; F114-V118 HydrophobicContact CE1-CG2 3.9Å; F114-V118 HydrophobicContact CE2-CG2 4.09Å; F114-V118 HydrophobicContact CZ-CG2 3.79Å; F114-V118 WeakPolarHBondContact O-CG2 3.22Å; F114-V118 PolarHBondContact O-N 3.35Å
115I94.6Very high93.2Very high98 Ų9871.1 Ų71.150%0.50333%0.333SS..Hα-helixtrans-58.5-49.3176.1-65.8167.3000110.2V111 T112 S117 V118 V119V111-I115 HydrophobicContact CG1-CD1 4Å; V111-I115 WeakPolarHBondContact O-CG1 3.45Å; V111-I115 PolarHBondContact O-N 3.08Å; V111-I115 VanDerWaalsContact O-N 3.08Å; T112-I115 PolarHBondContact O-N 3.09Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 3.23Å; I115-V118 PolarHBondContact O-N 3.43Å; I115-V119 WeakPolarHBondContact O-CG2 3.39Å; I115-V119 PolarHBondContact O-N 2.92Å
116F94.3Very high93.3Very high13 Ų1367.2 Ų67.26%0.05731%0.313CS..Hα-helixtrans-56.3-45.6177.3173.9-97.1000112T112 W113 F114 T120 L147 Y194 L197T112-F116 VanDerWaalsContact O-CB 3.29Å; T112-F116 WeakPolarHBondContact O-CB 3.48Å; T112-F116 PolarHBondContact O-N 3.19Å; W113-F116 PolarHBondContact O-N 2.86Å; F114-F116 PolarHBondContact O-N 3.41Å; F116-T120 WeakPolarHBondContact CE2-OG1 3.31Å; F116-T120 WeakPolarHBondContact CZ-OG1 3.31Å; F116-T120 WeakPolarHBondContact O-CB 3.28Å; F116-T120 PolarHBondContact O-N 2.84Å; F116-T120 PolarHBondContact O-OG1 2.79Å; F116-L147 HydrophobicContact CD2-CD1 3.98Å; F116-L147 HydrophobicContact CE2-CD1 3.69Å; F116-L147 HydrophobicContact CE2-CD2 3.56Å; F116-L147 HydrophobicContact CE2-CG 4.26Å; F116-L147 HydrophobicContact CZ-CD2 4.23Å; F116-Y194 HydrophobicContact CB-CD1 4.21Å; F116-Y194 HydrophobicContact CB-CE1 3.68Å; F116-Y194 AromaticContact CD1-CD1 3.93Å; F116-Y194 HydrophobicContact CD1-CD1 3.93Å; F116-Y194 AromaticContact CD1-CE1 3.84Å; F116-Y194 HydrophobicContact CD1-CE1 3.84Å; F116-Y194 AromaticContact CD2-CD1 3.72Å; F116-Y194 HydrophobicContact CD2-CD1 3.72Å; F116-Y194 HydrophobicContact CD2-CE1 4.08Å; F116-Y194 HydrophobicContact CE1-CD1 4.25Å; F116-Y194 HydrophobicContact CE2-CD1 4.06Å; F116-Y194 AromaticContact CG-CD1 3.64Å; F116-Y194 HydrophobicContact CG-CD1 3.64Å; F116-Y194 AromaticContact CG-CE1 3.56Å; F116-Y194 HydrophobicContact CG-CE1 3.56Å; F116-Y194 HydrophobicContact CZ-CD1 4.32Å; F116-L197 HydrophobicContact CD1-CD1 4.46Å; F116-L197 HydrophobicContact CE1-CB 4Å; F116-L197 HydrophobicContact CE1-CD1 3.83Å; F116-L197 HydrophobicContact CZ-CB 3.88Å; F116-L197 HydrophobicContact CZ-CD1 4.49Å
117S93.9Very high93.3Very high10 Ų1063 Ų637%0.0730%0.297CS..Hα-helixtrans-64.7-44.5-178.9-65.10000111.9W94 W113 F114 I115 A121W94-S117 PolarHBondContact NE1-OG 2.94Å; W113-S117 WeakPolarHBondContact O-CB 3.41Å; W113-S117 PolarHBondContact O-N 3.38Å; W113-S117 PolarHBondContact O-OG 3.05Å; F114-S117 PolarHBondContact O-N 2.94Å; I115-S117 VanDerWaalsContact C-N 3.3Å; I115-S117 PolarHBondContact O-N 3.23Å; S117-A121 WeakPolarHBondContact O-CB 3.15Å; S117-A121 PolarHBondContact O-N 3.37Å
118V95.6Very high93.3Very high77 Ų7757.6 Ų57.647%0.46728%0.283SS..Hα-helixtrans-63.6-48178.3170.60000111.3F114 I115 A121 Y122F114-V118 HydrophobicContact CD1-CG2 4.3Å; F114-V118 HydrophobicContact CD2-CG2 4.47Å; F114-V118 HydrophobicContact CE1-CG2 3.9Å; F114-V118 HydrophobicContact CE2-CG2 4.09Å; F114-V118 HydrophobicContact CZ-CG2 3.79Å; F114-V118 WeakPolarHBondContact O-CG2 3.22Å; F114-V118 PolarHBondContact O-N 3.35Å; I115-V118 PolarHBondContact O-N 3.43Å; V118-A121 PolarHBondContact O-N 2.93Å; V118-Y122 PolarHBondContact O-N 2.9Å
119V95.4Very high93.2Very high46 Ų4654 Ų5428%0.27927%0.27SS..Hα-helixtrans-67.3-42.8-179.2-176.80000110.9I115 A121 Y122 V123 W143I115-V119 WeakPolarHBondContact O-CG2 3.39Å; I115-V119 PolarHBondContact O-N 2.92Å; V119-A121 PolarHBondContact O-N 3.33Å; V119-Y122 PolarHBondContact O-N 3.26Å; V119-V123 HydrophobicContact CG1-CG2 4.49Å; V119-V123 WeakPolarHBondContact O-CG2 3.37Å; V119-V123 PolarHBondContact O-N 3.29Å; V119-W143 HydrophobicContact CB-CH2 3.92Å; V119-W143 HydrophobicContact CB-CZ2 3.79Å; V119-W143 HydrophobicContact CG1-CD2 3.97Å; V119-W143 HydrophobicContact CG1-CE3 3.96Å; V119-W143 HydrophobicContact CG1-CH2 3.37Å; V119-W143 HydrophobicContact CG1-CZ2 3.34Å; V119-W143 HydrophobicContact CG1-CZ3 3.68Å; V119-W143 HydrophobicContact CG2-CH2 4.45Å
120T93.6Very high92.9Very high2 Ų262 Ų621%0.01230%0.304CS..Hα-helixtrans-65.6-39178.1-57.90000111.5F116 V123 T124 F144 F201F116-T120 WeakPolarHBondContact CE2-OG1 3.31Å; F116-T120 WeakPolarHBondContact CZ-OG1 3.31Å; F116-T120 WeakPolarHBondContact O-CB 3.28Å; F116-T120 PolarHBondContact O-N 2.84Å; F116-T120 PolarHBondContact O-OG1 2.79Å; T120-V123 PolarHBondContact O-N 2.82Å; T120-T124 VanDerWaalsContact O-CB 3.27Å; T120-T124 WeakPolarHBondContact O-CB 3.21Å; T120-T124 PolarHBondContact O-N 3.04Å; T120-T124 PolarHBondContact O-OG1 2.63Å; T120-F144 HydrophobicContact CG2-CE1 4.47Å; T120-F144 HydrophobicContact CG2-CZ 4.46Å; T120-F201 HydrophobicContact CG2-CB 4.02Å; T120-F201 HydrophobicContact CG2-CD1 3.69Å; T120-F201 HydrophobicContact CG2-CD2 3.74Å; T120-F201 HydrophobicContact CG2-CE1 4.02Å; T120-F201 HydrophobicContact CG2-CE2 4.07Å; T120-F201 HydrophobicContact CG2-CG 3.54Å; T120-F201 HydrophobicContact CG2-CZ 4.21Å
121A93.6Very high92.3Very high52 Ų5266.6 Ų66.643%0.4334%0.336SS..Hα-helixtrans-62.2-43.1173.900000111.6S117 V118 V119 T124 Y125S117-A121 WeakPolarHBondContact O-CB 3.15Å; S117-A121 PolarHBondContact O-N 3.37Å; V118-A121 PolarHBondContact O-N 2.93Å; V119-A121 PolarHBondContact O-N 3.33Å; A121-T124 PolarHBondContact O-N 3.02Å; A121-Y125 VanDerWaalsContact O-CB 3.26Å; A121-Y125 WeakPolarHBondContact O-CB 3.11Å; A121-Y125 PolarHBondContact O-N 3.43Å
122Y95.4Very high91.8Very high119 Ų11964 Ų6447%0.46732%0.319SS..Hα-helixtrans-61.3-46.6175.4171.4-104000112.5V118 V119 Y125 R126V118-Y122 PolarHBondContact O-N 2.9Å; V119-Y122 PolarHBondContact O-N 3.26Å; Y122-Y125 PolarHBondContact O-N 2.92Å; Y122-R126 HydrophobicContact CE1-CG 4.39Å; Y122-R126 HydrophobicContact CE2-CG 4.17Å; Y122-R126 WeakPolarHBondContact O-CG 3.22Å; Y122-R126 PolarHBondContact O-N 3.34Å; Y122-R126 PolarHBondContact OH-NH1 2.63Å
123V94.7Very high91.4Very high4 Ų465.6 Ų65.62%0.02432%0.323CS..Hα-helixtrans-64.5-42.2178.3174.30000111V119 T120 R126 A127 V140 W143 F144V119-V123 HydrophobicContact CG1-CG2 4.49Å; V119-V123 WeakPolarHBondContact O-CG2 3.37Å; V119-V123 PolarHBondContact O-N 3.29Å; T120-V123 PolarHBondContact O-N 2.82Å; V123-R126 PolarHBondContact O-N 2.97Å; V123-A127 PolarHBondContact O-N 2.98Å; V123-V140 HydrophobicContact CG1-CB 4.27Å; V123-V140 HydrophobicContact CG1-CG1 4.42Å; V123-V140 HydrophobicContact CG1-CG2 3.81Å; V123-W143 HydrophobicContact CG1-CB 4.45Å; V123-W143 HydrophobicContact CG1-CG 4.43Å; V123-W143 HydrophobicContact CG2-CB 4.17Å; V123-W143 HydrophobicContact CG2-CD2 4.38Å; V123-W143 HydrophobicContact CG2-CG 3.82Å; V123-F144 HydrophobicContact CG1-CE2 4.01Å; V123-F144 HydrophobicContact CG1-CZ 4.45Å
124T92.7Very high90.8Very high22 Ų2267 Ų6714%0.13534%0.337CS..Hα-helixtrans-65.6-40.3177.1-54.70000111.4T120 A121 R126 A127 T128T120-T124 VanDerWaalsContact O-CB 3.27Å; T120-T124 WeakPolarHBondContact O-CB 3.21Å; T120-T124 PolarHBondContact O-N 3.04Å; T120-T124 PolarHBondContact O-OG1 2.63Å; A121-T124 PolarHBondContact O-N 3.02Å; T124-R126 PolarHBondContact O-N 3.28Å; T124-A127 PolarHBondContact O-N 3.33Å; T124-T128 HydrophobicContact CG2-CG2 4.21Å; T124-T128 WeakPolarHBondContact O-CB 3.35Å; T124-T128 VanDerWaalsContact O-CG2 3.23Å; T124-T128 WeakPolarHBondContact O-CG2 3.42Å; T124-T128 PolarHBondContact O-N 3.44Å; T124-T128 PolarHBondContact O-OG1 3.37Å
125Y93.8Very high90.4Very high123 Ų12363.5 Ų63.548%0.48233%0.326SS..Hα-helixtrans-59.5-45.6173.6171.4-109.2000111.4A121 Y122 A127 T128 R129A121-Y125 VanDerWaalsContact O-CB 3.26Å; A121-Y125 WeakPolarHBondContact O-CB 3.11Å; A121-Y125 PolarHBondContact O-N 3.43Å; Y122-Y125 PolarHBondContact O-N 2.92Å; Y125-A127 VanDerWaalsContact C-N 3.34Å; Y125-A127 PolarHBondContact O-N 3.46Å; Y125-T128 WeakPolarHBondContact CA-OG1 3.49Å; Y125-T128 PolarHBondContact O-N 3.21Å; Y125-T128 PolarHBondContact O-OG1 3.28Å; Y125-T128 VanDerWaalsContact O-OG1 3.06Å; Y125-R129 HydrophobicContact CD2-CG 4.44Å; Y125-R129 HydrophobicContact CE1-CG 4.35Å; Y125-R129 HydrophobicContact CE2-CG 4.15Å; Y125-R129 WeakPolarHBondContact O-CG 3.47Å; Y125-R129 PolarHBondContact O-N 2.93Å; Y125-R129 PolarHBondContact OH-NH1 2.87Å
126R92.7Very high90.2Very high48 Ų4858.9 Ų58.918%0.18130%0.303CS..Hα-helixtrans-61-43.2175.2-67.6-70.4-69.6-100.66.7111.5Y122 V123 T124 T128 E133 T136Y122-R126 HydrophobicContact CE1-CG 4.39Å; Y122-R126 HydrophobicContact CE2-CG 4.17Å; Y122-R126 WeakPolarHBondContact O-CG 3.22Å; Y122-R126 PolarHBondContact O-N 3.34Å; Y122-R126 PolarHBondContact OH-NH1 2.63Å; V123-R126 PolarHBondContact O-N 2.97Å; T124-R126 PolarHBondContact O-N 3.28Å; R126-T128 VanDerWaalsContact C-N 3.3Å; R126-T128 PolarHBondContact O-N 3.07Å; R126-E133 IonicContact CZ-OE2 3.89Å; R126-E133 IonicContact NE-OE2 3.88Å; R126-E133 IonicContact NH2-OE1 3.86Å; R126-E133 IonicContact NH2-OE2 3.27Å; R126-E133 PolarHBondContact NH2-OE2 3.45Å; R126-T136 HydrophobicContact CB-CG2 4.02Å; R126-T136 WeakPolarHBondContact O-CG2 3.23Å
127A90.9Very high90Very high0 Ų058.4 Ų58.40%030%0.3CS..Hα-helixtrans-66.4-26.7179.100000114.2V123 T124 Y125 V140 C205 M209V123-A127 PolarHBondContact O-N 2.98Å; T124-A127 PolarHBondContact O-N 3.33Å; Y125-A127 VanDerWaalsContact C-N 3.34Å; Y125-A127 PolarHBondContact O-N 3.46Å; A127-V140 HydrophobicContact CB-CG2 3.91Å; A127-C205 HydrophobicContact CB-CB 3.96Å; A127-M209 HydrophobicContact CB-CG 4.11Å; A127-M209 HydrophobicContact CB-SD 4.39Å
128T89.9Confident89.8Confident61 Ų6160.1 Ų60.137%0.37431%0.305SS..Hα-helixtrans-94.6-11-176.2520000114T124 Y125 R126 V208T124-T128 HydrophobicContact CG2-CG2 4.21Å; T124-T128 WeakPolarHBondContact O-CB 3.35Å; T124-T128 VanDerWaalsContact O-CG2 3.23Å; T124-T128 WeakPolarHBondContact O-CG2 3.42Å; T124-T128 PolarHBondContact O-N 3.44Å; T124-T128 PolarHBondContact O-OG1 3.37Å; Y125-T128 WeakPolarHBondContact CA-OG1 3.49Å; Y125-T128 PolarHBondContact O-N 3.21Å; Y125-T128 PolarHBondContact O-OG1 3.28Å; Y125-T128 VanDerWaalsContact O-OG1 3.06Å; R126-T128 VanDerWaalsContact C-N 3.3Å; R126-T128 PolarHBondContact O-N 3.07Å; T128-V208 HydrophobicContact CG2-CB 4.43Å; T128-V208 HydrophobicContact CG2-CG1 3.95Å; T128-V208 HydrophobicContact CG2-CG2 4.29Å
129R87.1Confident89.7Confident124 Ų12459.6 Ų59.647%0.46830%0.3SS..  trans-65.5142.5178.4-71.4-120.3-72-166.61.7112.2Y125 P131Y125-R129 HydrophobicContact CD2-CG 4.44Å; Y125-R129 HydrophobicContact CE1-CG 4.35Å; Y125-R129 HydrophobicContact CE2-CG 4.15Å; Y125-R129 WeakPolarHBondContact O-CG 3.47Å; Y125-R129 PolarHBondContact O-N 2.93Å; Y125-R129 PolarHBondContact OH-NH1 2.87Å; R129-P131 CarbonylContact O-C 3.47Å
130K84.4Confident89.6Confident168 Ų16857.4 Ų57.473%0.7329%0.286SS*.SBendtrans-122.3127174.7-61.9-178.6-179179.90109T212K130-T212 HydrophobicContact CG-CG2 4.14Å
131P80.8Confident89.4Confident123 Ų12357.4 Ų57.480%0.79929%0.286SS*.SBendcis-68.9152.2-4.631-35.1000112.3R129R129-P131 CarbonylContact O-C 3.47Å
132L82.9Confident89.3Confident33 Ų3362 Ų6217%0.17330%0.297CS..PPolyproline II helixtrans-73.5127.8176.1-171.771.8000109.6T136 P137 M209 T212 V213L132-T136 HydrophobicContact CD1-CG2 3.79Å; L132-P137 HydrophobicContact CD2-CG 4.09Å; L132-M209 HydrophobicContact CD1-CG 4.14Å; L132-M209 HydrophobicContact CD2-CB 4.11Å; L132-M209 HydrophobicContact CD2-CG 4.02Å; L132-T212 HydrophobicContact CB-CG2 3.79Å; L132-V213 HydrophobicContact CD2-CG2 3.67Å
133E83.8Confident89.2Confident92 Ų9259.2 Ų59.243%0.4329%0.285SS..PPolyproline II helixtrans-76.4138.7176.9-173.4-170164.500111R126 T135 T136 P137R126-E133 IonicContact CZ-OE2 3.89Å; R126-E133 IonicContact NE-OE2 3.88Å; R126-E133 IonicContact NH2-OE1 3.86Å; R126-E133 IonicContact NH2-OE2 3.27Å; R126-E133 PolarHBondContact NH2-OE2 3.45Å; E133-T135 VanDerWaalsContact CD-OG1 3.26Å; E133-T135 PolarHBondContact O-N 2.84Å; E133-T135 VanDerWaalsContact O-N 3.09Å; E133-T135 PolarHBondContact OE1-OG1 3Å; E133-T136 VanDerWaalsContact O-CB 3.26Å; E133-T136 WeakPolarHBondContact O-CB 3.16Å; E133-T136 PolarHBondContact O-N 3.01Å; E133-T136 PolarHBondContact O-OG1 3.01Å; E133-P137 WeakPolarHBondContact O-CD 3.19Å
134C82.8Confident89.1Confident62 Ų6259.4 Ų59.442%0.41929%0.286SS..THydrogen-bonded Turntrans-53.9-31.3-176.7-67.30000114.8C234 Q236C134-C234 CarbonylContact C-O 3.28Å; C134-C234 VanDerWaalsContact C-O 3.28Å; C134-C234 WeakPolarHBondContact CA-O 3.21Å; C134-C234 WeakPolarHBondContact CB-O 3.39Å; C134-C234 WeakPolarHBondContact O-CB 3.37Å; C134-Q236 HydrophobicContact CB-CG 4.36Å
135T85.8Confident88.8Confident57 Ų5761.3 Ų61.335%0.3530%0.295SS..THydrogen-bonded Turntrans-80-18.1179.658.70000113.3E133 R138 L139E133-T135 VanDerWaalsContact CD-OG1 3.26Å; E133-T135 PolarHBondContact O-N 2.84Å; E133-T135 VanDerWaalsContact O-N 3.09Å; E133-T135 PolarHBondContact OE1-OG1 3Å; T135-R138 PolarHBondContact O-N 2.7Å; T135-L139 PolarHBondContact O-N 2.73Å
136T90.1Very high88.7Confident1 Ų159.6 Ų59.61%0.00629%0.293CS..Hα-helixtrans-63.5-46.5-171.2-63.10000113.4R126 L132 E133 R138 L139 V140 M209R126-T136 HydrophobicContact CB-CG2 4.02Å; R126-T136 WeakPolarHBondContact O-CG2 3.23Å; L132-T136 HydrophobicContact CD1-CG2 3.79Å; E133-T136 VanDerWaalsContact O-CB 3.26Å; E133-T136 WeakPolarHBondContact O-CB 3.16Å; E133-T136 PolarHBondContact O-N 3.01Å; E133-T136 PolarHBondContact O-OG1 3.01Å; T136-R138 PolarHBondContact O-N 3.48Å; T136-L139 WeakPolarHBondContact O-CB 3.25Å; T136-L139 PolarHBondContact O-N 3.22Å; T136-L139 VanDerWaalsContact O-N 3.09Å; T136-V140 HydrophobicContact CG2-CG2 3.96Å; T136-V140 VanDerWaalsContact O-CG2 3.3Å; T136-V140 WeakPolarHBondContact O-CG2 3.22Å; T136-V140 PolarHBondContact O-N 3.46Å; T136-M209 HydrophobicContact CG2-SD 4.47Å
137P89.9Confident88.6Confident2 Ų258 Ų581%0.01329%0.288CS..Hα-helixtrans-56.1-39.2178.5-27.736.9000113L132 E133 Y141 M209 V233L132-P137 HydrophobicContact CD2-CG 4.09Å; E133-P137 WeakPolarHBondContact O-CD 3.19Å; P137-Y141 HydrophobicContact CB-CE2 4.3Å; P137-Y141 WeakPolarHBondContact O-CB 3.42Å; P137-Y141 WeakPolarHBondContact O-CD2 3.26Å; P137-Y141 PolarHBondContact O-N 3.31Å; P137-M209 HydrophobicContact CB-SD 4.09Å; P137-M209 HydrophobicContact CG-SD 4.06Å; P137-V233 HydrophobicContact CB-CG1 4.13Å; P137-V233 WeakPolarHBondContact CG-O 3.42Å
138R90.3Very high88.5Confident46 Ų4663.1 Ų63.117%0.17431%0.309CS..Hα-helixtrans-66.6-43.9177.1-67.7-178.3-179.1-91.34111.9T135 T136 K142 C234 E249 H261 F263T135-R138 PolarHBondContact O-N 2.7Å; T136-R138 PolarHBondContact O-N 3.48Å; R138-K142 WeakPolarHBondContact O-CB 3.32Å; R138-K142 PolarHBondContact O-N 3.45Å; R138-C234 HydrophobicContact CG-CB 4.36Å; R138-E249 IonicContact CZ-OE1 3.77Å; R138-E249 IonicContact CZ-OE2 2.7Å; R138-E249 IonicContact NH1-OE1 3.41Å; R138-E249 PolarHBondContact NH1-OE1 3.33Å; R138-E249 IonicContact NH1-OE2 2.56Å; R138-E249 PolarHBondContact NH1-OE2 3.37Å; R138-E249 IonicContact NH2-OE1 2.67Å; R138-E249 PolarHBondContact NH2-OE1 3.49Å; R138-E249 IonicContact NH2-OE2 3.41Å; R138-E249 PolarHBondContact NH2-OE2 2.79Å; R138-H261 PolarHBondContact NH2-CE1 3.01Å; R138-H261 VanDerWaalsContact NH2-CE1 3.34Å; R138-H261 VanDerWaalsContact NH2-CG 3.31Å; R138-H261 PolarHBondContact NH2-ND1 3.02Å; R138-F263 HydrophobicContact CB-CE1 4.37Å; R138-F263 HydrophobicContact CG-CD1 4.44Å; R138-F263 HydrophobicContact CG-CE1 4.5Å
139L92.5Very high88.5Confident66 Ų6666.3 Ų66.335%0.34632%0.317SS..Hα-helixtrans-58.9-48.9176.417868.1000111.1T135 T136 K142 W143T135-L139 PolarHBondContact O-N 2.73Å; T136-L139 WeakPolarHBondContact O-CB 3.25Å; T136-L139 PolarHBondContact O-N 3.22Å; T136-L139 VanDerWaalsContact O-N 3.09Å; L139-K142 PolarHBondContact O-N 2.85Å; L139-W143 WeakPolarHBondContact O-CB 3.45Å; L139-W143 PolarHBondContact O-N 3.38Å
140V93.1Very high88.7Confident0 Ų064.9 Ų64.90%032%0.318CS..Hα-helixtrans-59.8-52.3-179.7171.90000110.7V123 A127 T136 K142 W143 F144 C205 M209V123-V140 HydrophobicContact CG1-CB 4.27Å; V123-V140 HydrophobicContact CG1-CG1 4.42Å; V123-V140 HydrophobicContact CG1-CG2 3.81Å; A127-V140 HydrophobicContact CB-CG2 3.91Å; T136-V140 HydrophobicContact CG2-CG2 3.96Å; T136-V140 VanDerWaalsContact O-CG2 3.3Å; T136-V140 WeakPolarHBondContact O-CG2 3.22Å; T136-V140 PolarHBondContact O-N 3.46Å; V140-K142 VanDerWaalsContact C-N 3.34Å; V140-K142 PolarHBondContact O-N 3.46Å; V140-W143 PolarHBondContact O-N 3.08Å; V140-F144 HydrophobicContact CG1-CD2 3.72Å; V140-F144 HydrophobicContact CG1-CE2 3.78Å; V140-F144 VanDerWaalsContact O-CD2 3.22Å; V140-F144 WeakPolarHBondContact O-CD2 3.46Å; V140-F144 PolarHBondContact O-N 3.31Å; V140-C205 HydrophobicContact CG1-CB 3.82Å; V140-M209 HydrophobicContact CB-CE 4.02Å; V140-M209 HydrophobicContact CB-SD 4.13Å; V140-M209 HydrophobicContact CG1-CE 3.67Å; V140-M209 HydrophobicContact CG1-SD 4.29Å; V140-M209 HydrophobicContact CG2-CE 4.4Å; V140-M209 HydrophobicContact CG2-SD 3.93Å
141Y90.5Very high89Confident3 Ų357.1 Ų57.11%0.01229%0.285CS..Hα-helixtrans-64.4-38.1179.8-62-29.8000112.5P137 L145 M209 V233 V271P137-Y141 HydrophobicContact CB-CE2 4.3Å; P137-Y141 WeakPolarHBondContact O-CB 3.42Å; P137-Y141 WeakPolarHBondContact O-CD2 3.26Å; P137-Y141 PolarHBondContact O-N 3.31Å; Y141-L145 WeakPolarHBondContact O-CB 3.38Å; Y141-L145 PolarHBondContact O-N 2.91Å; Y141-M209 HydrophobicContact CD1-CE 4.44Å; Y141-M209 HydrophobicContact CE1-CE 3.71Å; Y141-V233 HydrophobicContact CE2-CG1 4.01Å; Y141-V271 HydrophobicContact CD1-CB 4.04Å; Y141-V271 HydrophobicContact CD1-CG1 3.97Å; Y141-V271 HydrophobicContact CE1-CB 4.5Å
142K90.9Very high89.4Confident149 Ų14956.6 Ų56.665%0.64827%0.268SS*.Hα-helixtrans-65.1-43.2177.2-171.4175.4-178.11780111.8R138 L139 V140 L146 F263R138-K142 WeakPolarHBondContact O-CB 3.32Å; R138-K142 PolarHBondContact O-N 3.45Å; L139-K142 PolarHBondContact O-N 2.85Å; V140-K142 VanDerWaalsContact C-N 3.34Å; V140-K142 PolarHBondContact O-N 3.46Å; K142-L146 WeakPolarHBondContact O-CB 3.32Å; K142-L146 PolarHBondContact O-N 2.93Å; K142-F263 HydrophobicContact CB-CZ 4.24Å
143W93.7Very high89.7Confident59 Ų5957.4 Ų57.422%0.22328%0.279CS..Hα-helixtrans-61.6-52.9176.8172.1-111.3000111.8V119 V123 L139 V140 L145 L146 L147V119-W143 HydrophobicContact CB-CH2 3.92Å; V119-W143 HydrophobicContact CB-CZ2 3.79Å; V119-W143 HydrophobicContact CG1-CD2 3.97Å; V119-W143 HydrophobicContact CG1-CE3 3.96Å; V119-W143 HydrophobicContact CG1-CH2 3.37Å; V119-W143 HydrophobicContact CG1-CZ2 3.34Å; V119-W143 HydrophobicContact CG1-CZ3 3.68Å; V119-W143 HydrophobicContact CG2-CH2 4.45Å; V123-W143 HydrophobicContact CG1-CB 4.45Å; V123-W143 HydrophobicContact CG1-CG 4.43Å; V123-W143 HydrophobicContact CG2-CB 4.17Å; V123-W143 HydrophobicContact CG2-CD2 4.38Å; V123-W143 HydrophobicContact CG2-CG 3.82Å; L139-W143 WeakPolarHBondContact O-CB 3.45Å; L139-W143 PolarHBondContact O-N 3.38Å; V140-W143 PolarHBondContact O-N 3.08Å; W143-L145 VanDerWaalsContact C-N 3.32Å; W143-L145 PolarHBondContact O-N 2.91Å; W143-L146 HydrophobicContact CE3-CD2 4.41Å; W143-L146 HydrophobicContact CZ3-CD2 4.37Å; W143-L146 WeakPolarHBondContact O-CB 3.42Å; W143-L146 PolarHBondContact O-N 3.16Å; W143-L147 WeakPolarHBondContact O-CB 3.28Å; W143-L147 PolarHBondContact O-N 3.24Å
144F91.6Very high90.2Very high8 Ų854.9 Ų54.94%0.03527%0.27CS..Hα-helixtrans-69.6-29.4-177.9-72.2-62.3000113T120 V123 V140 L147 Y148 G198 F201 A202 C205 V271T120-F144 HydrophobicContact CG2-CE1 4.47Å; T120-F144 HydrophobicContact CG2-CZ 4.46Å; V123-F144 HydrophobicContact CG1-CE2 4.01Å; V123-F144 HydrophobicContact CG1-CZ 4.45Å; V140-F144 HydrophobicContact CG1-CD2 3.72Å; V140-F144 HydrophobicContact CG1-CE2 3.78Å; V140-F144 VanDerWaalsContact O-CD2 3.22Å; V140-F144 WeakPolarHBondContact O-CD2 3.46Å; V140-F144 PolarHBondContact O-N 3.31Å; F144-L147 HydrophobicContact CD1-CD2 4.13Å; F144-Y148 VanDerWaalsContact O-CB 3.31Å; F144-Y148 WeakPolarHBondContact O-CB 3.25Å; F144-Y148 PolarHBondContact O-N 2.84Å; F144-G198 VanDerWaalsContact CD1-O 3.31Å; F144-G198 WeakPolarHBondContact CD1-O 3.29Å; F144-F201 HydrophobicContact CE1-CB 3.61Å; F144-F201 HydrophobicContact CZ-CB 3.64Å; F144-A202 HydrophobicContact CB-CB 3.8Å; F144-A202 HydrophobicContact CD1-CB 3.81Å; F144-A202 HydrophobicContact CD2-CB 3.74Å; F144-A202 HydrophobicContact CE1-CB 4.33Å; F144-A202 HydrophobicContact CE2-CB 4.26Å; F144-A202 HydrophobicContact CG-CB 3.5Å; F144-C205 HydrophobicContact CE2-CB 4.12Å; F144-V271 HydrophobicContact CB-CG1 3.94Å
145L87.8Confident90.6Very high62 Ų6252.5 Ų52.533%0.32526%0.256SS..Hα-helixtrans-67.8-41.9170.7-178.264.3000112Y141 W143 Y148 K149 F263Y141-L145 WeakPolarHBondContact O-CB 3.38Å; Y141-L145 PolarHBondContact O-N 2.91Å; W143-L145 VanDerWaalsContact C-N 3.32Å; W143-L145 PolarHBondContact O-N 2.91Å; L145-Y148 HydrophobicContact CD1-CD1 4.45Å; L145-Y148 PolarHBondContact O-N 3.48Å; L145-K149 WeakPolarHBondContact O-CG 3.02Å; L145-K149 PolarHBondContact O-N 3.25Å; L145-F263 HydrophobicContact CD2-CE2 4.35Å
146L90.9Very high90.9Very high87 Ų8753.5 Ų53.546%0.45526%0.258SS..Hα-helixtrans-61-48.8174.9174.665.4000110.6K142 W143 Y148 K149 I150K142-L146 WeakPolarHBondContact O-CB 3.32Å; K142-L146 PolarHBondContact O-N 2.93Å; W143-L146 HydrophobicContact CE3-CD2 4.41Å; W143-L146 HydrophobicContact CZ3-CD2 4.37Å; W143-L146 WeakPolarHBondContact O-CB 3.42Å; W143-L146 PolarHBondContact O-N 3.16Å; L146-Y148 VanDerWaalsContact C-N 3.35Å; L146-Y148 PolarHBondContact O-N 3.22Å; L146-K149 PolarHBondContact O-N 3.34Å; L146-K149 VanDerWaalsContact O-N 3.16Å; L146-I150 HydrophobicContact CD1-CD1 3.99Å; L146-I150 HydrophobicContact CD1-CG1 4.32Å; L146-I150 HydrophobicContact CG-CD1 3.94Å; L146-I150 WeakPolarHBondContact O-CG1 3.4Å; L146-I150 PolarHBondContact O-N 3.41Å
147L91.7Very high91.1Very high15 Ų1557.1 Ų57.18%0.07928%0.281CS..Hα-helixtrans-58.2-47177.5-177.871.6000111.3F116 W143 F144 K149 I150 S151F116-L147 HydrophobicContact CD2-CD1 3.98Å; F116-L147 HydrophobicContact CE2-CD1 3.69Å; F116-L147 HydrophobicContact CE2-CD2 3.56Å; F116-L147 HydrophobicContact CE2-CG 4.26Å; F116-L147 HydrophobicContact CZ-CD2 4.23Å; W143-L147 WeakPolarHBondContact O-CB 3.28Å; W143-L147 PolarHBondContact O-N 3.24Å; F144-L147 HydrophobicContact CD1-CD2 4.13Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 2.86Å; L147-I150 PolarHBondContact O-N 3.44Å; L147-S151 WeakPolarHBondContact O-CB 3.49Å; L147-S151 PolarHBondContact O-N 3.46Å; L147-S151 PolarHBondContact O-OG 2.98Å
148Y88.3Confident91.3Very high108 Ų10857 Ų5742%0.42428%0.28SS..Hα-helixtrans-55.4-46.8174.3168.6-99.8000112F144 L145 L146 I150 S151 Y152 Y301F144-Y148 VanDerWaalsContact O-CB 3.31Å; F144-Y148 WeakPolarHBondContact O-CB 3.25Å; F144-Y148 PolarHBondContact O-N 2.84Å; L145-Y148 HydrophobicContact CD1-CD1 4.45Å; L145-Y148 PolarHBondContact O-N 3.48Å; L146-Y148 VanDerWaalsContact C-N 3.35Å; L146-Y148 PolarHBondContact O-N 3.22Å; Y148-I150 PolarHBondContact O-N 3.12Å; Y148-S151 PolarHBondContact O-N 3.19Å; Y148-Y152 WeakPolarHBondContact O-CB 3.25Å; Y148-Y152 PolarHBondContact O-N 3.29Å; Y148-Y301 HydrophobicContact CE2-CE1 4.2Å
149K88.8Confident91.4Very high127 Ų12761.2 Ų61.255%0.55230%0.297SS*.Hα-helixtrans-62.5-43.3178.9-74.7-179.5176.8-171.60112.4L145 L146 L147 A153L145-K149 WeakPolarHBondContact O-CG 3.02Å; L145-K149 PolarHBondContact O-N 3.25Å; L146-K149 PolarHBondContact O-N 3.34Å; L146-K149 VanDerWaalsContact O-N 3.16Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 2.86Å; K149-A153 VanDerWaalsContact O-CB 3.28Å; K149-A153 WeakPolarHBondContact O-CB 3.25Å; K149-A153 PolarHBondContact O-N 3.07Å
150I92.3Very high91.4Very high94 Ų9460.1 Ų60.148%0.48229%0.294SS..Hα-helixtrans-63.5-53.9177.2-67.3170.1000109.7L146 L147 Y148 Y152 A153 T154L146-I150 HydrophobicContact CD1-CD1 3.99Å; L146-I150 HydrophobicContact CD1-CG1 4.32Å; L146-I150 HydrophobicContact CG-CD1 3.94Å; L146-I150 WeakPolarHBondContact O-CG1 3.4Å; L146-I150 PolarHBondContact O-N 3.41Å; L147-I150 PolarHBondContact O-N 3.44Å; Y148-I150 PolarHBondContact O-N 3.12Å; I150-Y152 VanDerWaalsContact C-N 3.29Å; I150-Y152 PolarHBondContact O-N 3.44Å; I150-A153 PolarHBondContact O-N 2.87Å; I150-T154 WeakPolarHBondContact O-CB 3.28Å; I150-T154 PolarHBondContact O-N 2.92Å; I150-T154 PolarHBondContact O-OG1 3.08Å
151S91.4Very high91.4Very high5 Ų561.7 Ų61.74%0.03530%0.304CS..Hα-helixtrans-56.5-42.3178.8-72.70000112.8L147 Y148 G155 G191 G195L147-S151 WeakPolarHBondContact O-CB 3.49Å; L147-S151 PolarHBondContact O-N 3.46Å; L147-S151 PolarHBondContact O-OG 2.98Å; Y148-S151 PolarHBondContact O-N 3.19Å; S151-G155 PolarHBondContact O-N 3.38Å; S151-G191 VanDerWaalsContact CB-O 3.27Å; S151-G191 WeakPolarHBondContact CB-O 3.12Å; S151-G191 WeakPolarHBondContact O-CA 3.37Å; S151-G195 PolarHBondContact OG-N 3.11Å
152Y87.6Confident91.6Very high112 Ų11262.2 Ų62.244%0.43931%0.308SS..Hα-helixtrans-66.3-47.1177.5-176-105.7000112Y148 I150 G155 I156Y148-Y152 WeakPolarHBondContact O-CB 3.25Å; Y148-Y152 PolarHBondContact O-N 3.29Å; I150-Y152 VanDerWaalsContact C-N 3.29Å; I150-Y152 PolarHBondContact O-N 3.44Å; Y152-G155 PolarHBondContact O-N 3.3Å; Y152-I156 HydrophobicContact CD1-CD1 3.72Å; Y152-I156 HydrophobicContact CE1-CD1 3.23Å; Y152-I156 HydrophobicContact CE1-CG1 4.36Å; Y152-I156 HydrophobicContact CE2-CD1 4.2Å; Y152-I156 HydrophobicContact CG-CD1 4.39Å; Y152-I156 WeakPolarHBondContact O-CG1 3.37Å; Y152-I156 PolarHBondContact O-N 3.42Å
153A90.9Very high91.7Very high51 Ų5157.4 Ų57.442%0.42129%0.288SS..Hα-helixtrans-62.5-46.7177.100000111.7K149 I150 G155 I156 V157K149-A153 VanDerWaalsContact O-CB 3.28Å; K149-A153 WeakPolarHBondContact O-CB 3.25Å; K149-A153 PolarHBondContact O-N 3.07Å; I150-A153 PolarHBondContact O-N 2.87Å; A153-G155 VanDerWaalsContact C-N 3.31Å; A153-G155 PolarHBondContact O-N 3.45Å; A153-I156 PolarHBondContact O-N 2.91Å; A153-V157 WeakPolarHBondContact O-CG2 3.37Å; A153-V157 PolarHBondContact O-N 3.19Å
154T93.4Very high91.6Very high38 Ų3859.9 Ų59.923%0.23330%0.3CS..Hα-helixtrans-60-41.4175.8-58.70000111.6I150 V157 G158 L187I150-T154 WeakPolarHBondContact O-CB 3.28Å; I150-T154 PolarHBondContact O-N 2.92Å; I150-T154 PolarHBondContact O-OG1 3.08Å; T154-V157 PolarHBondContact O-N 2.83Å; T154-G158 PolarHBondContact O-N 3.4Å; T154-L187 HydrophobicContact CG2-CB 4.29Å; T154-L187 HydrophobicContact CG2-CD2 3.96Å; T154-L187 WeakPolarHBondContact CG2-O 3.36Å
155G92.1Very high91.6Very high12 Ų1260.1 Ų60.112%0.12430%0.303CS..Hα-helixtrans-63-43.4175.600000113.1S151 Y152 A153 G158 Y159 L188S151-G155 PolarHBondContact O-N 3.38Å; Y152-G155 PolarHBondContact O-N 3.3Å; A153-G155 VanDerWaalsContact C-N 3.31Å; A153-G155 PolarHBondContact O-N 3.45Å; G155-G158 PolarHBondContact O-N 2.95Å; G155-Y159 WeakPolarHBondContact O-CB 3.41Å; G155-Y159 PolarHBondContact O-N 3.45Å; G155-L188 VanDerWaalsContact O-CD2 3.32Å; G155-L188 WeakPolarHBondContact O-CD2 3.49Å
156I90.9Very high91.7Very high78 Ų7862.6 Ų62.640%0.432%0.316SS..Hα-helixtrans-62.5-48.1175.1-71169000110.7Y152 A153 G158 Y159 S160Y152-I156 HydrophobicContact CD1-CD1 3.72Å; Y152-I156 HydrophobicContact CE1-CD1 3.23Å; Y152-I156 HydrophobicContact CE1-CG1 4.36Å; Y152-I156 HydrophobicContact CE2-CD1 4.2Å; Y152-I156 HydrophobicContact CG-CD1 4.39Å; Y152-I156 WeakPolarHBondContact O-CG1 3.37Å; Y152-I156 PolarHBondContact O-N 3.42Å; A153-I156 PolarHBondContact O-N 2.91Å; I156-G158 VanDerWaalsContact C-N 3.33Å; I156-G158 PolarHBondContact O-N 2.99Å; I156-Y159 PolarHBondContact O-N 3.23Å; I156-S160 PolarHBondContact O-N 3.46Å; I156-S160 PolarHBondContact O-OG 2.9Å
157V94.4Very high91.7Very high78 Ų7866 Ų6647%0.47333%0.327SS..Hα-helixtrans-59.9-45.9179.5173.50000110.5A153 T154 Y159 S160 V161 L187A153-V157 WeakPolarHBondContact O-CG2 3.37Å; A153-V157 PolarHBondContact O-N 3.19Å; T154-V157 PolarHBondContact O-N 2.83Å; V157-Y159 PolarHBondContact O-N 2.98Å; V157-S160 PolarHBondContact O-N 2.88Å; V157-V161 WeakPolarHBondContact O-CG2 3.45Å; V157-V161 PolarHBondContact O-N 3.5Å; V157-L187 HydrophobicContact CG1-CD1 3.92Å
158G94.8Very high91.4Very high0 Ų066.5 Ų66.50%034%0.336CS..Hα-helixtrans-60-45.1176.200000112.6T154 G155 I156 S160 V161 V162T154-G158 PolarHBondContact O-N 3.4Å; G155-G158 PolarHBondContact O-N 2.95Å; I156-G158 VanDerWaalsContact C-N 3.33Å; I156-G158 PolarHBondContact O-N 2.99Å; G158-S160 PolarHBondContact O-N 3.41Å; G158-V161 PolarHBondContact O-N 3.46Å; G158-V162 WeakPolarHBondContact O-CG2 3.43Å; G158-V162 PolarHBondContact O-N 3.06Å
159Y92.4Very high91.2Very high134 Ų13464.1 Ų64.153%0.52533%0.33SS..Hα-helixtrans-59.6-46.9175.8177.8-103.6000111.8G155 I156 V157 V161 V162 M163G155-Y159 WeakPolarHBondContact O-CB 3.41Å; G155-Y159 PolarHBondContact O-N 3.45Å; I156-Y159 PolarHBondContact O-N 3.23Å; V157-Y159 PolarHBondContact O-N 2.98Å; Y159-V161 VanDerWaalsContact C-N 3.33Å; Y159-V161 PolarHBondContact O-N 2.87Å; Y159-V162 PolarHBondContact O-N 3.23Å; Y159-M163 HydrophobicContact CD1-CG 4.04Å; Y159-M163 HydrophobicContact CD2-CE 4.41Å; Y159-M163 HydrophobicContact CD2-CG 4.24Å; Y159-M163 HydrophobicContact CE1-CG 3.58Å; Y159-M163 HydrophobicContact CE1-SD 4.46Å; Y159-M163 HydrophobicContact CE2-CE 3.84Å; Y159-M163 HydrophobicContact CE2-CG 3.8Å; Y159-M163 HydrophobicContact CE2-SD 3.97Å; Y159-M163 HydrophobicContact CG-CG 4.35Å; Y159-M163 VanDerWaalsContact CZ-CG 3.45Å; Y159-M163 WeakPolarHBondContact O-CB 3.3Å; Y159-M163 WeakPolarHBondContact O-CG 3.37Å; Y159-M163 PolarHBondContact O-N 2.94Å
160S92.7Very high90.8Very high42 Ų4258.5 Ų58.529%0.29431%0.306SS..Hα-helixtrans-60.3-41.9177.8-64.90000112I156 V157 G158 M163 F164I156-S160 PolarHBondContact O-N 3.46Å; I156-S160 PolarHBondContact O-OG 2.9Å; V157-S160 PolarHBondContact O-N 2.88Å; G158-S160 PolarHBondContact O-N 3.41Å; S160-M163 PolarHBondContact O-N 3.2Å; S160-F164 WeakPolarHBondContact O-CB 3.4Å; S160-F164 WeakPolarHBondContact O-CD2 3.47Å; S160-F164 WeakPolarHBondContact O-CG 3.34Å; S160-F164 PolarHBondContact O-N 2.9Å
161V93.3Very high90.1Very high33 Ų3359.3 Ų59.320%0.231%0.31CS..Hα-helixtrans-61.9-46.4176.2171.40000111.2V157 G158 Y159 F164 T165 A180 F183V157-V161 WeakPolarHBondContact O-CG2 3.45Å; V157-V161 PolarHBondContact O-N 3.5Å; G158-V161 PolarHBondContact O-N 3.46Å; Y159-V161 VanDerWaalsContact C-N 3.33Å; Y159-V161 PolarHBondContact O-N 2.87Å; V161-F164 PolarHBondContact O-N 3.17Å; V161-T165 WeakPolarHBondContact O-CB 3.46Å; V161-T165 PolarHBondContact O-N 2.93Å; V161-T165 PolarHBondContact O-OG1 3.39Å; V161-A180 WeakPolarHBondContact CG1-O 3.27Å; V161-F183 HydrophobicContact CG1-CD1 4.27Å; V161-F183 HydrophobicContact CG2-CD1 4.49Å
162V93.9Very high89.8Confident15 Ų1565.2 Ų65.29%0.09134%0.34CS..Hα-helixtrans-62-46.6177.3173.70000110.6G158 Y159 F164 T165 L166 M181 V185 L188G158-V162 WeakPolarHBondContact O-CG2 3.43Å; G158-V162 PolarHBondContact O-N 3.06Å; Y159-V162 PolarHBondContact O-N 3.23Å; V162-F164 PolarHBondContact O-N 2.95Å; V162-T165 PolarHBondContact O-N 3.43Å; V162-L166 HydrophobicContact CG1-CD1 4.16Å; V162-L166 HydrophobicContact CG1-CG 4.41Å; V162-L166 WeakPolarHBondContact O-CG 3.34Å; V162-L166 PolarHBondContact O-N 2.88Å; V162-M181 HydrophobicContact CG1-CE 4.07Å; V162-M181 HydrophobicContact CG1-SD 4.14Å; V162-V185 HydrophobicContact CG2-CG2 4.12Å; V162-L188 HydrophobicContact CB-CD1 4.45Å; V162-L188 HydrophobicContact CG2-CD1 3.76Å
163M92.7Very high89.6Confident48 Ų4866.8 Ų66.824%0.23635%0.35CS..Hα-helixtrans-60.2-47.8178.2-70.9-59.4102.400111.9Y159 S160 T165 L166 F167Y159-M163 HydrophobicContact CD1-CG 4.04Å; Y159-M163 HydrophobicContact CD2-CE 4.41Å; Y159-M163 HydrophobicContact CD2-CG 4.24Å; Y159-M163 HydrophobicContact CE1-CG 3.58Å; Y159-M163 HydrophobicContact CE1-SD 4.46Å; Y159-M163 HydrophobicContact CE2-CE 3.84Å; Y159-M163 HydrophobicContact CE2-CG 3.8Å; Y159-M163 HydrophobicContact CE2-SD 3.97Å; Y159-M163 HydrophobicContact CG-CG 4.35Å; Y159-M163 VanDerWaalsContact CZ-CG 3.45Å; Y159-M163 WeakPolarHBondContact O-CB 3.3Å; Y159-M163 WeakPolarHBondContact O-CG 3.37Å; Y159-M163 PolarHBondContact O-N 2.94Å; S160-M163 PolarHBondContact O-N 3.2Å; M163-T165 PolarHBondContact O-N 3.37Å; M163-L166 HydrophobicContact CE-CD1 3.71Å; M163-L166 PolarHBondContact O-N 3.06Å; M163-F167 HydrophobicContact CB-CD2 4.48Å; M163-F167 HydrophobicContact CB-CE2 4.37Å; M163-F167 WeakPolarHBondContact O-CD2 3.31Å; M163-F167 PolarHBondContact O-N 2.97Å
164F91.8Very high89.2Confident111 Ų11175.8 Ų75.849%0.48737%0.373SS..Hα-helixtrans-62-33.2177.5-67.8-32.9000113S160 V161 V162 G168 I169S160-F164 WeakPolarHBondContact O-CB 3.4Å; S160-F164 WeakPolarHBondContact O-CD2 3.47Å; S160-F164 WeakPolarHBondContact O-CG 3.34Å; S160-F164 PolarHBondContact O-N 2.9Å; V161-F164 PolarHBondContact O-N 3.17Å; V162-F164 PolarHBondContact O-N 2.95Å; F164-G168 PolarHBondContact O-N 3.26Å; F164-I169 HydrophobicContact CB-CB 4.26Å; F164-I169 HydrophobicContact CD1-CD1 3.69Å; F164-I169 HydrophobicContact CE1-CD1 4.34Å; F164-I169 HydrophobicContact CG-CD1 4.48Å; F164-I169 WeakPolarHBondContact O-CB 3.38Å; F164-I169 PolarHBondContact O-N 2.89Å
165T90.9Very high89Confident13 Ų1378 Ų788%0.0838%0.382CS..Hα-helixtrans-70.1-41.8175.9-54.20000111.6V161 V162 M163 F167 G168 N170 P177 A180 M181V161-T165 WeakPolarHBondContact O-CB 3.46Å; V161-T165 PolarHBondContact O-N 2.93Å; V161-T165 PolarHBondContact O-OG1 3.39Å; V162-T165 PolarHBondContact O-N 3.43Å; M163-T165 PolarHBondContact O-N 3.37Å; T165-F167 VanDerWaalsContact C-N 3.35Å; T165-F167 PolarHBondContact O-N 3.13Å; T165-G168 PolarHBondContact O-N 2.84Å; T165-G168 VanDerWaalsContact O-N 3.11Å; T165-N170 HydrophobicContact CG2-CB 4.45Å; T165-P177 HydrophobicContact CG2-CB 4.25Å; T165-A180 HydrophobicContact CG2-CB 3.97Å; T165-A180 WeakPolarHBondContact OG1-CB 3.36Å; T165-M181 HydrophobicContact CG2-CG 3.58Å; T165-M181 HydrophobicContact CG2-SD 3.68Å
166L89.8Confident88.9Confident114 Ų11483 Ų8360%0.59740%0.401SS*.Hα-helixtrans-65.8-34.4176.2-68.3178000113.1V162 M163 G168 M181V162-L166 HydrophobicContact CG1-CD1 4.16Å; V162-L166 HydrophobicContact CG1-CG 4.41Å; V162-L166 WeakPolarHBondContact O-CG 3.34Å; V162-L166 PolarHBondContact O-N 2.88Å; M163-L166 HydrophobicContact CE-CD1 3.71Å; M163-L166 PolarHBondContact O-N 3.06Å; L166-G168 PolarHBondContact O-N 3.49Å; L166-M181 HydrophobicContact CD2-CE 4.46Å; L166-M181 HydrophobicContact CD2-SD 4.48Å
167F91Very high88.8Confident158 Ų15882.3 Ų82.369%0.69340%0.401SS*.THydrogen-bonded Turntrans-79.11.6174.1-69-62.7000113.7M163 T165 I169M163-F167 HydrophobicContact CB-CD2 4.48Å; M163-F167 HydrophobicContact CB-CE2 4.37Å; M163-F167 WeakPolarHBondContact O-CD2 3.31Å; M163-F167 PolarHBondContact O-N 2.97Å; T165-F167 VanDerWaalsContact C-N 3.35Å; T165-F167 PolarHBondContact O-N 3.13Å; F167-I169 HydrophobicContact CB-CD1 4.11Å; F167-I169 HydrophobicContact CB-CG1 4.34Å; F167-I169 PolarHBondContact O-N 3.21Å
168G85.8Confident88.6Confident26 Ų2683.9 Ų83.927%0.26840%0.404SS..THydrogen-bonded Turntrans72.810.7178.700000114.7F164 T165 L166 N170 L171F164-G168 PolarHBondContact O-N 3.26Å; T165-G168 PolarHBondContact O-N 2.84Å; T165-G168 VanDerWaalsContact O-N 3.11Å; L166-G168 PolarHBondContact O-N 3.49Å; G168-N170 WeakPolarHBondContact CA-OD1 3.32Å; G168-N170 PolarHBondContact O-N 3.11Å; G168-L171 WeakPolarHBondContact O-CB 3.32Å; G168-L171 PolarHBondContact O-N 3.23Å
169I85.5Confident88.4Confident58 Ų5888.1 Ų88.130%0.29743%0.426SS..G310 helixtrans-67.7-28.2178.7-67.5162.4000110.7F164 F167 L171 I172 F173F164-I169 HydrophobicContact CB-CB 4.26Å; F164-I169 HydrophobicContact CD1-CD1 3.69Å; F164-I169 HydrophobicContact CE1-CD1 4.34Å; F164-I169 HydrophobicContact CG-CD1 4.48Å; F164-I169 WeakPolarHBondContact O-CB 3.38Å; F164-I169 PolarHBondContact O-N 2.89Å; F167-I169 HydrophobicContact CB-CD1 4.11Å; F167-I169 HydrophobicContact CB-CG1 4.34Å; F167-I169 PolarHBondContact O-N 3.21Å; I169-L171 PolarHBondContact O-N 3.17Å; I169-I172 HydrophobicContact CG2-CD1 4.38Å; I169-I172 VanDerWaalsContact O-CB 3.26Å; I169-I172 WeakPolarHBondContact O-CB 3.37Å; I169-I172 PolarHBondContact O-N 2.89Å; I169-F173 HydrophobicContact CG2-CD2 4.45Å; I169-F173 HydrophobicContact CG2-CE2 3.95Å; I169-F173 WeakPolarHBondContact O-CD2 3.29Å
170N79.4Confident88.3Confident9 Ų982.2 Ų82.25%0.04841%0.405CS..G310 helixtrans-57.1-29.7173.168.7-43.1000113.3T165 G168 I172 F173 R174 I175 P177 A180T165-N170 HydrophobicContact CG2-CB 4.45Å; G168-N170 WeakPolarHBondContact CA-OD1 3.32Å; G168-N170 PolarHBondContact O-N 3.11Å; N170-I172 VanDerWaalsContact C-N 3.28Å; N170-I172 PolarHBondContact O-N 2.89Å; N170-F173 PolarHBondContact O-N 3.35Å; N170-R174 PolarHBondContact O-N 2.69Å; N170-I175 PolarHBondContact ND2-O 3.14Å; N170-I175 PolarHBondContact O-N 3.14Å; N170-I175 VanDerWaalsContact O-N 3.12Å; N170-P177 WeakPolarHBondContact ND2-CA 3.49Å; N170-P177 WeakPolarHBondContact ND2-CG 3.48Å; N170-A180 HydrophobicContact CB-CB 4.32Å
171L77.2Confident88.3Confident110 Ų11082.8 Ų82.858%0.57640%0.404SS*.G310 helixtrans-67.1-29.4176.9-60.1174.8000111.9G168 I169 F173 R174 P177G168-L171 WeakPolarHBondContact O-CB 3.32Å; G168-L171 PolarHBondContact O-N 3.23Å; I169-L171 PolarHBondContact O-N 3.17Å; L171-F173 VanDerWaalsContact C-N 3.26Å; L171-F173 PolarHBondContact O-N 3.43Å; L171-R174 PolarHBondContact O-N 3.31Å; L171-P177 HydrophobicContact CD2-CG 4.13Å
172I85.4Confident88.3Confident130 Ų13086.3 Ų86.367%0.66742%0.421SS*.THydrogen-bonded Turntrans-62.9-38174.7-58.7176.2000110.1I169 N170 R174I169-I172 HydrophobicContact CG2-CD1 4.38Å; I169-I172 VanDerWaalsContact O-CB 3.26Å; I169-I172 WeakPolarHBondContact O-CB 3.37Å; I169-I172 PolarHBondContact O-N 2.89Å; N170-I172 VanDerWaalsContact C-N 3.28Å; N170-I172 PolarHBondContact O-N 2.89Å; I172-R174 VanDerWaalsContact C-N 3.25Å; I172-R174 PolarHBondContact O-N 2.99Å
173F83.1Confident88.2Confident145 Ų14591.4 Ų91.464%0.63644%0.443SS*.THydrogen-bonded Turntrans-84.54.9176.7-61.5-75.7000113.5I169 N170 L171 I175I169-F173 HydrophobicContact CG2-CD2 4.45Å; I169-F173 HydrophobicContact CG2-CE2 3.95Å; I169-F173 WeakPolarHBondContact O-CD2 3.29Å; N170-F173 PolarHBondContact O-N 3.35Å; L171-F173 VanDerWaalsContact C-N 3.26Å; L171-F173 PolarHBondContact O-N 3.43Å; F173-I175 HydrophobicContact CB-CD1 3.98Å; F173-I175 HydrophobicContact CB-CG1 3.99Å; F173-I175 PolarHBondContact O-N 3.07Å
174R83.5Confident88.2Confident239 Ų23989.1 Ų89.190%0.90243%0.431SS*.THydrogen-bonded Turntrans54.328.8-175.1-60.5-179.2171.5174-2.6113.6N170 L171 I172N170-R174 PolarHBondContact O-N 2.69Å; L171-R174 PolarHBondContact O-N 3.31Å; I172-R174 VanDerWaalsContact C-N 3.25Å; I172-R174 PolarHBondContact O-N 2.99Å
175I88.1Confident88.3Confident84 Ų8487.5 Ų87.543%0.43143%0.43SS..  trans-91.6132.2174.7-57.1174.9000107.7N170 F173 A180N170-I175 PolarHBondContact ND2-O 3.14Å; N170-I175 PolarHBondContact O-N 3.14Å; N170-I175 VanDerWaalsContact O-N 3.12Å; F173-I175 HydrophobicContact CB-CD1 3.98Å; F173-I175 HydrophobicContact CB-CG1 3.99Å; F173-I175 PolarHBondContact O-N 3.07Å; I175-A180 HydrophobicContact CG2-CB 4.02Å
176K89.6Confident88.4Confident118 Ų11888.6 Ų88.651%0.51344%0.438SS..  trans-63.7139.9177.5-61.3-171.4-179.7175.70110.9E178 D179 A180K176-E178 VanDerWaalsContact C-N 3.27Å; K176-E178 HydrophobicContact CB-CG 3.79Å; K176-E178 HydrophobicContact CD-CG 4.08Å; K176-E178 WeakPolarHBondContact CD-OE1 3.49Å; K176-E178 IonicContact NZ-OE1 2.89Å; K176-E178 PolarHBondContact NZ-OE1 3.32Å; K176-E178 PolarHBondContact O-N 3.36Å; K176-D179 PolarHBondContact O-N 3.45Å; K176-A180 PolarHBondContact O-N 2.96Å
177P89.1Confident88.6Confident64 Ų6484.8 Ų84.842%0.41642%0.418SS..Hα-helixtrans-57.5-37177.7-23.431.6000114.1T165 N170 L171 A180 M181T165-P177 HydrophobicContact CG2-CB 4.25Å; N170-P177 WeakPolarHBondContact ND2-CA 3.49Å; N170-P177 WeakPolarHBondContact ND2-CG 3.48Å; L171-P177 HydrophobicContact CD2-CG 4.13Å; P177-A180 PolarHBondContact O-N 3Å; P177-M181 VanDerWaalsContact O-CB 3.32Å; P177-M181 WeakPolarHBondContact O-CB 3.21Å; P177-M181 VanDerWaalsContact O-CG 3.24Å; P177-M181 WeakPolarHBondContact O-CG 3.08Å; P177-M181 PolarHBondContact O-N 2.94Å
178E90Very high88.7Confident111 Ų11179.1 Ų79.152%0.51940%0.395SS..Hα-helixtrans-55.1-56.9175.752.2-173.1-17400111.9K176 A180 M181 D182K176-E178 VanDerWaalsContact C-N 3.27Å; K176-E178 HydrophobicContact CB-CG 3.79Å; K176-E178 HydrophobicContact CD-CG 4.08Å; K176-E178 WeakPolarHBondContact CD-OE1 3.49Å; K176-E178 IonicContact NZ-OE1 2.89Å; K176-E178 PolarHBondContact NZ-OE1 3.32Å; K176-E178 PolarHBondContact O-N 3.36Å; E178-A180 VanDerWaalsContact C-N 3.33Å; E178-A180 PolarHBondContact O-N 3.49Å; E178-M181 PolarHBondContact O-N 3.32Å; E178-D182 WeakPolarHBondContact O-CB 3.45Å; E178-D182 PolarHBondContact O-N 3.15Å
179D90.9Very high89Confident88 Ų8880.4 Ų80.447%0.47139%0.393SS..Hα-helixtrans-63.7-38.8-177.5-61.3-38.1000112.3K176 F183K176-D179 PolarHBondContact O-N 3.45Å; D179-F183 WeakPolarHBondContact O-CB 3.43Å; D179-F183 PolarHBondContact O-N 3.31Å
180A91.4Very high89.4Confident10 Ų1079.5 Ų79.58%0.08339%0.386CS..Hα-helixtrans-69.8-41.1179.500000112.1V161 T165 N170 I175 K176 P177 E178 G184V161-A180 WeakPolarHBondContact CG1-O 3.27Å; T165-A180 HydrophobicContact CG2-CB 3.97Å; T165-A180 WeakPolarHBondContact OG1-CB 3.36Å; N170-A180 HydrophobicContact CB-CB 4.32Å; I175-A180 HydrophobicContact CG2-CB 4.02Å; K176-A180 PolarHBondContact O-N 2.96Å; P177-A180 PolarHBondContact O-N 3Å; E178-A180 VanDerWaalsContact C-N 3.33Å; E178-A180 PolarHBondContact O-N 3.49Å; A180-G184 PolarHBondContact O-N 3.46Å
181M92.7Very high90Very high55 Ų5579.1 Ų79.127%0.27139%0.385SS..Hα-helixtrans-64-47.2174.2-75.3-60.1-7300111V162 T165 L166 P177 E178 F183 G184 V185V162-M181 HydrophobicContact CG1-CE 4.07Å; V162-M181 HydrophobicContact CG1-SD 4.14Å; T165-M181 HydrophobicContact CG2-CG 3.58Å; T165-M181 HydrophobicContact CG2-SD 3.68Å; L166-M181 HydrophobicContact CD2-CE 4.46Å; L166-M181 HydrophobicContact CD2-SD 4.48Å; P177-M181 VanDerWaalsContact O-CB 3.32Å; P177-M181 WeakPolarHBondContact O-CB 3.21Å; P177-M181 VanDerWaalsContact O-CG 3.24Å; P177-M181 WeakPolarHBondContact O-CG 3.08Å; P177-M181 PolarHBondContact O-N 2.94Å; E178-M181 PolarHBondContact O-N 3.32Å; M181-F183 VanDerWaalsContact C-N 3.31Å; M181-F183 PolarHBondContact O-N 3.26Å; M181-G184 PolarHBondContact O-N 3.13Å; M181-V185 WeakPolarHBondContact O-CB 3.33Å; M181-V185 VanDerWaalsContact O-CG2 3.29Å; M181-V185 WeakPolarHBondContact O-CG2 3.47Å; M181-V185 PolarHBondContact O-N 3.24Å
182D91.7Very high90.7Very high106 Ų10675.7 Ų75.757%0.56737%0.367SS*.Hα-helixtrans-60-42.9179.5-79.5-6.9000111.6E178 S186E178-D182 WeakPolarHBondContact O-CB 3.45Å; E178-D182 PolarHBondContact O-N 3.15Å; D182-S186 WeakPolarHBondContact O-CB 3.37Å; D182-S186 PolarHBondContact O-N 3.22Å; D182-S186 PolarHBondContact O-OG 2.9Å
183F92.4Very high91Very high123 Ų12369.5 Ų69.554%0.53934%0.335SS..Hα-helixtrans-64.9-47.4175.2-177.8-108.6000112.2V161 D179 M181 S186 L187V161-F183 HydrophobicContact CG1-CD1 4.27Å; V161-F183 HydrophobicContact CG2-CD1 4.49Å; D179-F183 WeakPolarHBondContact O-CB 3.43Å; D179-F183 PolarHBondContact O-N 3.31Å; M181-F183 VanDerWaalsContact C-N 3.31Å; M181-F183 PolarHBondContact O-N 3.26Å; F183-S186 PolarHBondContact O-N 2.91Å; F183-L187 HydrophobicContact CD1-CD1 4.05Å; F183-L187 HydrophobicContact CE1-CD1 3.45Å; F183-L187 VanDerWaalsContact CE1-CD1 3.45Å; F183-L187 HydrophobicContact CE1-CG 4.29Å; F183-L187 HydrophobicContact CE2-CD1 4.28Å; F183-L187 HydrophobicContact CE2-CG 4.35Å; F183-L187 HydrophobicContact CZ-CD1 3.58Å; F183-L187 HydrophobicContact CZ-CD2 4.45Å; F183-L187 HydrophobicContact CZ-CG 4.13Å; F183-L187 WeakPolarHBondContact O-CG 3.45Å; F183-L187 PolarHBondContact O-N 2.65Å
184G93.9Very high91.5Very high0 Ų063.8 Ų63.80%031%0.31CS..Hα-helixtrans-63.4-46.2-179.400000113A180 M181 L187 L188A180-G184 PolarHBondContact O-N 3.46Å; M181-G184 PolarHBondContact O-N 3.13Å; G184-L187 PolarHBondContact O-N 2.92Å; G184-L188 WeakPolarHBondContact O-CG 3.23Å; G184-L188 PolarHBondContact O-N 3.18Å
185V93.3Very high91.8Very high77 Ų7752.7 Ų52.747%0.46727%0.27SS..Hα-helixtrans-65.7-39.8176.4173.80000110.8V162 M181 L187 L188 F189V162-V185 HydrophobicContact CG2-CG2 4.12Å; M181-V185 WeakPolarHBondContact O-CB 3.33Å; M181-V185 VanDerWaalsContact O-CG2 3.29Å; M181-V185 WeakPolarHBondContact O-CG2 3.47Å; M181-V185 PolarHBondContact O-N 3.24Å; V185-L187 PolarHBondContact O-N 3.29Å; V185-L188 WeakPolarHBondContact O-CB 3.49Å; V185-L188 PolarHBondContact O-N 3.28Å; V185-F189 WeakPolarHBondContact O-CB 3.42Å; V185-F189 PolarHBondContact O-N 3.3Å
186S92.7Very high91.9Very high35 Ų3548.7 Ų48.725%0.24525%0.249CC..Hα-helixtrans-60.9-45.2174.8-67.10000112D182 F183 F189 Y190D182-S186 WeakPolarHBondContact O-CB 3.37Å; D182-S186 PolarHBondContact O-N 3.22Å; D182-S186 PolarHBondContact O-OG 2.9Å; F183-S186 PolarHBondContact O-N 2.91Å; S186-F189 PolarHBondContact O-N 3.29Å; S186-Y190 WeakPolarHBondContact O-CD2 3.4Å; S186-Y190 PolarHBondContact O-N 3.47Å
187L94.4Very high92Very high34 Ų3443.1 Ų43.118%0.17823%0.225CC..Hα-helixtrans-63.2-43.1176-74-179.8000111.9T154 V157 F183 G184 V185 F189 Y190 G191T154-L187 HydrophobicContact CG2-CB 4.29Å; T154-L187 HydrophobicContact CG2-CD2 3.96Å; T154-L187 WeakPolarHBondContact CG2-O 3.36Å; V157-L187 HydrophobicContact CG1-CD1 3.92Å; F183-L187 HydrophobicContact CD1-CD1 4.05Å; F183-L187 HydrophobicContact CE1-CD1 3.45Å; F183-L187 VanDerWaalsContact CE1-CD1 3.45Å; F183-L187 HydrophobicContact CE1-CG 4.29Å; F183-L187 HydrophobicContact CE2-CD1 4.28Å; F183-L187 HydrophobicContact CE2-CG 4.35Å; F183-L187 HydrophobicContact CZ-CD1 3.58Å; F183-L187 HydrophobicContact CZ-CD2 4.45Å; F183-L187 HydrophobicContact CZ-CG 4.13Å; F183-L187 WeakPolarHBondContact O-CG 3.45Å; F183-L187 PolarHBondContact O-N 2.65Å; G184-L187 PolarHBondContact O-N 2.92Å; V185-L187 PolarHBondContact O-N 3.29Å; L187-F189 VanDerWaalsContact C-N 3.32Å; L187-F189 PolarHBondContact O-N 2.81Å; L187-Y190 PolarHBondContact O-N 3.4Å; L187-G191 PolarHBondContact O-N 2.98Å
188L93.1Very high92.1Very high39 Ų3940.3 Ų40.320%0.20421%0.208CC..Hα-helixtrans-57.5-47173.9-81.8171.2000111.4G155 V162 G184 V185 G191 L192G155-L188 VanDerWaalsContact O-CD2 3.32Å; G155-L188 WeakPolarHBondContact O-CD2 3.49Å; V162-L188 HydrophobicContact CB-CD1 4.45Å; V162-L188 HydrophobicContact CG2-CD1 3.76Å; G184-L188 WeakPolarHBondContact O-CG 3.23Å; G184-L188 PolarHBondContact O-N 3.18Å; V185-L188 WeakPolarHBondContact O-CB 3.49Å; V185-L188 PolarHBondContact O-N 3.28Å; L188-G191 PolarHBondContact O-N 2.88Å; L188-L192 VanDerWaalsContact O-CB 3.3Å; L188-L192 WeakPolarHBondContact O-CB 3.35Å; L188-L192 VanDerWaalsContact O-CG 3.24Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 3.2Å
189F92.3Very high92Very high53 Ų5338.1 Ų38.123%0.23220%0.195CC..Hα-helixtrans-58.5-49.8177.2175.3-105.2000111.3F109 V185 S186 L187 G191 L192 Y193 V312F109-F189 AromaticContact CD2-CE1 3.84Å; F109-F189 HydrophobicContact CD2-CE1 3.84Å; F109-F189 AromaticContact CE2-CE1 3.55Å; F109-F189 HydrophobicContact CE2-CE1 3.55Å; F109-F189 HydrophobicContact CE2-CZ 4.09Å; V185-F189 WeakPolarHBondContact O-CB 3.42Å; V185-F189 PolarHBondContact O-N 3.3Å; S186-F189 PolarHBondContact O-N 3.29Å; L187-F189 VanDerWaalsContact C-N 3.32Å; L187-F189 PolarHBondContact O-N 2.81Å; F189-G191 PolarHBondContact O-N 2.95Å; F189-L192 PolarHBondContact O-N 3.24Å; F189-Y193 HydrophobicContact CZ-CD2 4.47Å; F189-Y193 HydrophobicContact CZ-CG 4.32Å; F189-Y193 WeakPolarHBondContact O-CA 3.27Å; F189-Y193 WeakPolarHBondContact O-CB 3.45Å; F189-Y193 PolarHBondContact O-N 3.25Å; F189-V312 HydrophobicContact CE2-CG2 4.4Å
190Y92.8Very high91.9Very high39 Ų3935.1 Ų35.115%0.15318%0.179CC..Hα-helixtrans-60.2-46.4177.4-76.5-59.9000112.9F109 S186 L187 Y194F109-Y190 WeakPolarHBondContact CA-OH 3.39Å; F109-Y190 HydrophobicContact CB-CE1 4.38Å; F109-Y190 HydrophobicContact CD2-CD1 4.3Å; F109-Y190 AromaticContact CD2-CE1 3.56Å; F109-Y190 HydrophobicContact CD2-CE1 3.56Å; F109-Y190 HydrophobicContact CE2-CE1 4.32Å; F109-Y190 HydrophobicContact CG-CE1 4.39Å; F109-Y190 PolarHBondContact N-OH 2.91Å; S186-Y190 WeakPolarHBondContact O-CD2 3.4Å; S186-Y190 PolarHBondContact O-N 3.47Å; L187-Y190 PolarHBondContact O-N 3.4Å; Y190-Y194 HydrophobicContact CD1-CD2 4.28Å; Y190-Y194 AromaticContact CD1-CE2 3.65Å; Y190-Y194 HydrophobicContact CD1-CE2 3.65Å; Y190-Y194 HydrophobicContact CE1-CE2 4.33Å; Y190-Y194 WeakPolarHBondContact O-CB 3.48Å; Y190-Y194 VanDerWaalsContact O-CD2 3.29Å; Y190-Y194 WeakPolarHBondContact O-CD2 3.46Å; Y190-Y194 PolarHBondContact O-N 3.28Å; Y190-Y194 VanDerWaalsContact O-N 3.11Å
191G92.9Very high91.9Very high2 Ų235.2 Ų35.22%0.02118%0.177CC..Hα-helixtrans-61.8-47-179.900000112.1S151 L187 L188 F189 G195S151-G191 VanDerWaalsContact CB-O 3.27Å; S151-G191 WeakPolarHBondContact CB-O 3.12Å; S151-G191 WeakPolarHBondContact O-CA 3.37Å; L187-G191 PolarHBondContact O-N 2.98Å; L188-G191 PolarHBondContact O-N 2.88Å; F189-G191 PolarHBondContact O-N 2.95Å; G191-G195 PolarHBondContact O-N 2.8Å
192L91.4Very high91.8Very high38 Ų3832.8 Ų32.820%0.19917%0.166CC..Hα-helixtrans-72.2-44.2-179.7-65.7174.9000112L188 F189 G195 V196 L304 L308L188-L192 VanDerWaalsContact O-CB 3.3Å; L188-L192 WeakPolarHBondContact O-CB 3.35Å; L188-L192 VanDerWaalsContact O-CG 3.24Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 3.2Å; F189-L192 PolarHBondContact O-N 3.24Å; L192-G195 PolarHBondContact O-N 3.21Å; L192-V196 WeakPolarHBondContact O-CG2 3.45Å; L192-V196 PolarHBondContact O-N 3.47Å; L192-L304 HydrophobicContact CD2-CD2 3.99Å; L192-L308 HydrophobicContact CB-CD2 3.64Å; L192-L308 WeakPolarHBondContact O-CD2 3.5Å
193Y92.4Very high91.6Very high0 Ų030.2 Ų30.20%015%0.15CC..Hα-helixtrans-61.1-54.9-178.6176.2-110.4000112.2M93 P97 F109 W113 F189 G195 V196 L197 V312M93-Y193 HydrophobicContact CE-CD2 3.85Å; M93-Y193 HydrophobicContact CE-CE2 3.92Å; M93-Y193 WeakPolarHBondContact O-CE2 3.28Å; M93-Y193 PolarHBondContact O-OH 3.25Å; P97-Y193 HydrophobicContact CB-CE2 4.34Å; P97-Y193 HydrophobicContact CG-CE2 3.73Å; F109-Y193 AromaticContact CE2-CD1 3.86Å; F109-Y193 HydrophobicContact CE2-CD1 3.86Å; F109-Y193 AromaticContact CE2-CE1 3.75Å; F109-Y193 HydrophobicContact CE2-CE1 3.75Å; F109-Y193 HydrophobicContact CZ-CD1 4.07Å; F109-Y193 AromaticContact CZ-CE1 3.47Å; F109-Y193 HydrophobicContact CZ-CE1 3.47Å; F109-Y193 VanDerWaalsContact CZ-CE1 3.47Å; F109-Y193 AromaticContact CZ-CZ 3.87Å; W113-Y193 PolarHBondContact NE1-OH 3.07Å; F189-Y193 HydrophobicContact CZ-CD2 4.47Å; F189-Y193 HydrophobicContact CZ-CG 4.32Å; F189-Y193 WeakPolarHBondContact O-CA 3.27Å; F189-Y193 WeakPolarHBondContact O-CB 3.45Å; F189-Y193 PolarHBondContact O-N 3.25Å; Y193-G195 PolarHBondContact O-N 2.9Å; Y193-V196 PolarHBondContact O-N 3.47Å; Y193-L197 HydrophobicContact CD1-CD1 4.25Å; Y193-L197 HydrophobicContact CE1-CD1 3.59Å; Y193-L197 HydrophobicContact CE2-CD1 3.89Å; Y193-L197 HydrophobicContact CE2-CG 4.32Å; Y193-L197 PolarHBondContact O-N 3.27Å; Y193-L197 VanDerWaalsContact O-N 3.08Å; Y193-V312 HydrophobicContact CE2-CG1 4.5Å
194Y93Very high91.4Very high25 Ų2527.3 Ų27.310%0.09814%0.139CC..Hα-helixtrans-68.1-27176.9-69.1-56.6000112.2T112 W113 F116 Y190 G198T112-Y194 WeakPolarHBondContact CB-OH 3.38Å; T112-Y194 PolarHBondContact OG1-OH 2.96Å; W113-Y194 VanDerWaalsContact CA-OH 3.25Å; W113-Y194 WeakPolarHBondContact CA-OH 3.47Å; W113-Y194 PolarHBondContact N-OH 2.91Å; F116-Y194 HydrophobicContact CB-CD1 4.21Å; F116-Y194 HydrophobicContact CB-CE1 3.68Å; F116-Y194 AromaticContact CD1-CD1 3.93Å; F116-Y194 HydrophobicContact CD1-CD1 3.93Å; F116-Y194 AromaticContact CD1-CE1 3.84Å; F116-Y194 HydrophobicContact CD1-CE1 3.84Å; F116-Y194 AromaticContact CD2-CD1 3.72Å; F116-Y194 HydrophobicContact CD2-CD1 3.72Å; F116-Y194 HydrophobicContact CD2-CE1 4.08Å; F116-Y194 HydrophobicContact CE1-CD1 4.25Å; F116-Y194 HydrophobicContact CE2-CD1 4.06Å; F116-Y194 AromaticContact CG-CD1 3.64Å; F116-Y194 HydrophobicContact CG-CD1 3.64Å; F116-Y194 AromaticContact CG-CE1 3.56Å; F116-Y194 HydrophobicContact CG-CE1 3.56Å; F116-Y194 HydrophobicContact CZ-CD1 4.32Å; Y190-Y194 HydrophobicContact CD1-CD2 4.28Å; Y190-Y194 AromaticContact CD1-CE2 3.65Å; Y190-Y194 HydrophobicContact CD1-CE2 3.65Å; Y190-Y194 HydrophobicContact CE1-CE2 4.33Å; Y190-Y194 WeakPolarHBondContact O-CB 3.48Å; Y190-Y194 VanDerWaalsContact O-CD2 3.29Å; Y190-Y194 WeakPolarHBondContact O-CD2 3.46Å; Y190-Y194 PolarHBondContact O-N 3.28Å; Y190-Y194 VanDerWaalsContact O-N 3.11Å; Y194-G198 WeakPolarHBondContact O-CA 3.28Å; Y194-G198 PolarHBondContact O-N 2.93Å
195G90.8Very high91.3Very high6 Ų627.4 Ų27.46%0.06214%0.14CC..Hα-helixtrans-64.6-44.6172.800000112.9S151 G191 L192 Y193 R199S151-G195 PolarHBondContact OG-N 3.11Å; G191-G195 PolarHBondContact O-N 2.8Å; L192-G195 PolarHBondContact O-N 3.21Å; Y193-G195 PolarHBondContact O-N 2.9Å; G195-R199 WeakPolarHBondContact O-CB 3.19Å; G195-R199 PolarHBondContact O-N 2.86Å; G195-R199 VanDerWaalsContact O-N 3.11Å
196V89.8Confident91.1Very high0 Ų023.7 Ų23.70%012%0.118CC..Hα-helixtrans-62.9-54.1174.2175.20000110.5M93 L192 Y193 G198 R199 D200 L305 L308 R309M93-V196 HydrophobicContact CE-CB 4.11Å; M93-V196 HydrophobicContact CE-CG1 3.81Å; L192-V196 WeakPolarHBondContact O-CG2 3.45Å; L192-V196 PolarHBondContact O-N 3.47Å; Y193-V196 PolarHBondContact O-N 3.47Å; V196-G198 VanDerWaalsContact C-N 3.33Å; V196-G198 PolarHBondContact O-N 3.16Å; V196-R199 PolarHBondContact O-N 3.4Å; V196-D200 PolarHBondContact O-N 3.29Å; V196-L305 HydrophobicContact CB-CD2 4.37Å; V196-L305 HydrophobicContact CG2-CB 3.86Å; V196-L305 HydrophobicContact CG2-CD2 3.29Å; V196-L305 HydrophobicContact CG2-CG 4.03Å; V196-L308 HydrophobicContact CB-CD2 4.42Å; V196-L308 HydrophobicContact CG2-CB 4.17Å; V196-L308 HydrophobicContact CG2-CD2 3.45Å; V196-L308 VanDerWaalsContact CG2-CD2 3.45Å; V196-L308 HydrophobicContact CG2-CG 4.33Å; V196-R309 HydrophobicContact CG1-CG 3.62Å
197L91.6Very high90.8Very high0 Ų025.2 Ų25.20%012%0.123CC..Hα-helixtrans-58.9-46.7-178.4-75-179.5000111.4L90 M93 F116 Y193 R199 D200 F201L90-L197 HydrophobicContact CD1-CD2 3.83Å; M93-L197 HydrophobicContact CB-CD2 3.87Å; F116-L197 HydrophobicContact CD1-CD1 4.46Å; F116-L197 HydrophobicContact CE1-CB 4Å; F116-L197 HydrophobicContact CE1-CD1 3.83Å; F116-L197 HydrophobicContact CZ-CB 3.88Å; F116-L197 HydrophobicContact CZ-CD1 4.49Å; Y193-L197 HydrophobicContact CD1-CD1 4.25Å; Y193-L197 HydrophobicContact CE1-CD1 3.59Å; Y193-L197 HydrophobicContact CE2-CD1 3.89Å; Y193-L197 HydrophobicContact CE2-CG 4.32Å; Y193-L197 PolarHBondContact O-N 3.27Å; Y193-L197 VanDerWaalsContact O-N 3.08Å; L197-R199 VanDerWaalsContact C-N 3.32Å; L197-R199 PolarHBondContact O-N 2.95Å; L197-D200 PolarHBondContact O-N 3.5Å; L197-F201 VanDerWaalsContact O-CD2 3.31Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 3.01Å
198G90.8Very high90.5Very high5 Ų525.3 Ų25.35%0.05213%0.125CC..Hα-helixtrans-55.4-45.9177.200000113F144 Y194 V196 A202F144-G198 VanDerWaalsContact CD1-O 3.31Å; F144-G198 WeakPolarHBondContact CD1-O 3.29Å; Y194-G198 WeakPolarHBondContact O-CA 3.28Å; Y194-G198 PolarHBondContact O-N 2.93Å; V196-G198 VanDerWaalsContact C-N 3.33Å; V196-G198 PolarHBondContact O-N 3.16Å; G198-A202 WeakPolarHBondContact O-CB 3.36Å; G198-A202 PolarHBondContact O-N 2.87Å
199R87.9Confident90.3Very high65 Ų6523.6 Ų23.625%0.24512%0.116CC..Hα-helixtrans-63.3-43.9177.6176.8-178.6170.9127.3-1112.3G195 V196 L197 A202 E203 K273G195-R199 WeakPolarHBondContact O-CB 3.19Å; G195-R199 PolarHBondContact O-N 2.86Å; G195-R199 VanDerWaalsContact O-N 3.11Å; V196-R199 PolarHBondContact O-N 3.4Å; L197-R199 VanDerWaalsContact C-N 3.32Å; L197-R199 PolarHBondContact O-N 2.95Å; R199-A202 PolarHBondContact O-N 3.38Å; R199-E203 PolarHBondContact O-N 2.92Å; R199-E203 VanDerWaalsContact O-N 3.08Å; R199-K273 VanDerWaalsContact CZ-CE 3.47Å
200D88.6Confident89.9Confident25 Ų2522.3 Ų22.313%0.13412%0.115CC..Hα-helixtrans-70.6-41.5-176.9-69-10.1000111.3L90 V196 L197 E203 M204 R309L90-D200 HydrophobicContact CD1-CB 3.97Å; V196-D200 PolarHBondContact O-N 3.29Å; L197-D200 PolarHBondContact O-N 3.5Å; D200-E203 PolarHBondContact O-N 3.43Å; D200-M204 PolarHBondContact O-N 2.89Å; D200-R309 IonicContact OD1-CZ 3.04Å; D200-R309 IonicContact OD1-NE 2.65Å; D200-R309 IonicContact OD1-NH2 3.92Å; D200-R309 PolarHBondContact OD1-NH2 2.84Å; D200-R309 IonicContact OD2-CZ 3.7Å; D200-R309 IonicContact OD2-NE 3.43Å; D200-R309 PolarHBondContact OD2-NE 3.4Å; D200-R309 IonicContact OD2-NH2 2.63Å
201F91.2Very high89.4Confident12 Ų1224.5 Ų24.55%0.05314%0.136CC..Hα-helixtrans-66.2-36.9172.9-85.7-74.9000112.7L90 W94 T120 F144 L197 M204 C205L90-F201 HydrophobicContact CD1-CD2 4.19Å; L90-F201 HydrophobicContact CD1-CE2 3.93Å; L90-F201 HydrophobicContact CD1-CZ 4.43Å; L90-F201 HydrophobicContact CD2-CE1 4.43Å; L90-F201 HydrophobicContact CD2-CZ 4.34Å; W94-F201 HydrophobicContact CE3-CZ 4.22Å; W94-F201 HydrophobicContact CH2-CZ 4.15Å; W94-F201 AromaticContact CZ3-CZ 3.91Å; W94-F201 HydrophobicContact CZ3-CZ 3.91Å; T120-F201 HydrophobicContact CG2-CB 4.02Å; T120-F201 HydrophobicContact CG2-CD1 3.69Å; T120-F201 HydrophobicContact CG2-CD2 3.74Å; T120-F201 HydrophobicContact CG2-CE1 4.02Å; T120-F201 HydrophobicContact CG2-CE2 4.07Å; T120-F201 HydrophobicContact CG2-CG 3.54Å; T120-F201 HydrophobicContact CG2-CZ 4.21Å; F144-F201 HydrophobicContact CE1-CB 3.61Å; F144-F201 HydrophobicContact CZ-CB 3.64Å; L197-F201 VanDerWaalsContact O-CD2 3.31Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 3.01Å; F201-M204 PolarHBondContact O-N 3.39Å; F201-C205 WeakPolarHBondContact O-CB 3.02Å; F201-C205 PolarHBondContact O-N 3.44Å; F201-C205 PolarHBondContact O-SG 2.94Å
202A90.3Very high88.7Confident4 Ų426.3 Ų26.33%0.03315%0.146CC..Hα-helixtrans-63.8-42.7177.400000112.1F144 G198 R199 C205 A206 V271F144-A202 HydrophobicContact CB-CB 3.8Å; F144-A202 HydrophobicContact CD1-CB 3.81Å; F144-A202 HydrophobicContact CD2-CB 3.74Å; F144-A202 HydrophobicContact CE1-CB 4.33Å; F144-A202 HydrophobicContact CE2-CB 4.26Å; F144-A202 HydrophobicContact CG-CB 3.5Å; G198-A202 WeakPolarHBondContact O-CB 3.36Å; G198-A202 PolarHBondContact O-N 2.87Å; R199-A202 PolarHBondContact O-N 3.38Å; A202-C205 PolarHBondContact O-N 3.31Å; A202-A206 VanDerWaalsContact O-CB 3.28Å; A202-A206 WeakPolarHBondContact O-CB 3.41Å; A202-A206 PolarHBondContact O-N 2.96Å; A202-V271 HydrophobicContact CB-CG1 3.6Å
203E87.4Confident87.8Confident52 Ų5225.7 Ų25.724%0.24314%0.144CC..Hα-helixtrans-64.3-44.2175.2-172.1167.5168.800111.2R199 D200 A206 D207 K273R199-E203 PolarHBondContact O-N 2.92Å; R199-E203 VanDerWaalsContact O-N 3.08Å; D200-E203 PolarHBondContact O-N 3.43Å; E203-A206 PolarHBondContact O-N 3.4Å; E203-D207 PolarHBondContact O-N 3.44Å; E203-K273 IonicContact OE2-NZ 3.56Å; E203-K273 PolarHBondContact OE2-NZ 3.24Å
204M88.5Confident86.4Confident63 Ų6327.8 Ų27.831%0.3117%0.166SC..Hα-helixtrans-60.8-47.3175-175.8-172.7-63.100112.4L90 D200 F201 A206 D207 V208L90-M204 HydrophobicContact CD2-CE 3.27Å; D200-M204 PolarHBondContact O-N 2.89Å; F201-M204 PolarHBondContact O-N 3.39Å; M204-A206 VanDerWaalsContact C-N 3.32Å; M204-A206 PolarHBondContact O-N 2.93Å; M204-D207 WeakPolarHBondContact O-CB 3.32Å; M204-D207 PolarHBondContact O-N 3.07Å; M204-V208 WeakPolarHBondContact O-CG2 3.4Å; M204-V208 PolarHBondContact O-N 3.4Å
205C91.4Very high84.6Confident1 Ų128 Ų281%0.00717%0.167CC..Hα-helixtrans-63.3-41.3178.2-69.20000111.1A127 V140 F144 F201 A202 D207 V208 M209A127-C205 HydrophobicContact CB-CB 3.96Å; V140-C205 HydrophobicContact CG1-CB 3.82Å; F144-C205 HydrophobicContact CE2-CB 4.12Å; F201-C205 WeakPolarHBondContact O-CB 3.02Å; F201-C205 PolarHBondContact O-N 3.44Å; F201-C205 PolarHBondContact O-SG 2.94Å; A202-C205 PolarHBondContact O-N 3.31Å; C205-D207 VanDerWaalsContact C-N 3.34Å; C205-D207 PolarHBondContact O-N 3.48Å; C205-V208 PolarHBondContact O-N 2.87Å; C205-M209 WeakPolarHBondContact O-CB 3.5Å; C205-M209 VanDerWaalsContact O-CG 3.27Å; C205-M209 WeakPolarHBondContact O-CG 3.49Å; C205-M209 PolarHBondContact O-N 3.38Å
206A89.1Confident82.6Confident0 Ų031.8 Ų31.80%018%0.18CC..Hα-helixtrans-63.1-39.2176.200000112.2A202 E203 M204 A210A202-A206 VanDerWaalsContact O-CB 3.28Å; A202-A206 WeakPolarHBondContact O-CB 3.41Å; A202-A206 PolarHBondContact O-N 2.96Å; E203-A206 PolarHBondContact O-N 3.4Å; M204-A206 VanDerWaalsContact C-N 3.32Å; M204-A206 PolarHBondContact O-N 2.93Å; A206-A210 WeakPolarHBondContact O-CB 2.9Å; A206-A210 PolarHBondContact O-N 3.08Å
207D87.7Confident80.2Confident66 Ų6634.5 Ų34.535%0.35320%0.199SC..Hα-helixtrans-60.9-47174.4-81.3-2.9000112.3E203 M204 C205 A210 S211 K274E203-D207 PolarHBondContact O-N 3.44Å; M204-D207 WeakPolarHBondContact O-CB 3.32Å; M204-D207 PolarHBondContact O-N 3.07Å; C205-D207 VanDerWaalsContact C-N 3.34Å; C205-D207 PolarHBondContact O-N 3.48Å; D207-A210 PolarHBondContact O-N 3.47Å; D207-S211 WeakPolarHBondContact O-CB 3.38Å; D207-S211 PolarHBondContact O-N 2.75Å; D207-S211 PolarHBondContact O-OG 2.98Å; D207-K274 WeakPolarHBondContact OD1-CE 3.32Å; D207-K274 IonicContact OD1-NZ 3.62Å; D207-K274 PolarHBondContact OD1-NZ 2.92Å
208V87.5Confident77.7Confident37 Ų3740.1 Ų40.122%0.22425%0.245CC..Hα-helixtrans-67.1-45.1-179.8178.80000110.8T128 M204 C205 A210 S211 T212T128-V208 HydrophobicContact CG2-CB 4.43Å; T128-V208 HydrophobicContact CG2-CG1 3.95Å; T128-V208 HydrophobicContact CG2-CG2 4.29Å; M204-V208 WeakPolarHBondContact O-CG2 3.4Å; M204-V208 PolarHBondContact O-N 3.4Å; C205-V208 PolarHBondContact O-N 2.87Å; V208-A210 PolarHBondContact O-N 3.29Å; V208-S211 PolarHBondContact O-N 2.93Å; V208-S211 PolarHBondContact O-OG 2.93Å; V208-T212 WeakPolarHBondContact O-CB 3.27Å; V208-T212 PolarHBondContact O-N 2.88Å; V208-T212 PolarHBondContact O-OG1 2.86Å
209M88.3Confident75.4Confident3 Ų344.3 Ų44.32%0.01527%0.274CS..Hα-helixtrans-60.3-46.6175.5-70.9-171.3-56.100111.2A127 L132 T136 P137 V140 Y141 C205 S211 T212 V213A127-M209 HydrophobicContact CB-CG 4.11Å; A127-M209 HydrophobicContact CB-SD 4.39Å; L132-M209 HydrophobicContact CD1-CG 4.14Å; L132-M209 HydrophobicContact CD2-CB 4.11Å; L132-M209 HydrophobicContact CD2-CG 4.02Å; T136-M209 HydrophobicContact CG2-SD 4.47Å; P137-M209 HydrophobicContact CB-SD 4.09Å; P137-M209 HydrophobicContact CG-SD 4.06Å; V140-M209 HydrophobicContact CB-CE 4.02Å; V140-M209 HydrophobicContact CB-SD 4.13Å; V140-M209 HydrophobicContact CG1-CE 3.67Å; V140-M209 HydrophobicContact CG1-SD 4.29Å; V140-M209 HydrophobicContact CG2-CE 4.4Å; V140-M209 HydrophobicContact CG2-SD 3.93Å; Y141-M209 HydrophobicContact CD1-CE 4.44Å; Y141-M209 HydrophobicContact CE1-CE 3.71Å; C205-M209 WeakPolarHBondContact O-CB 3.5Å; C205-M209 VanDerWaalsContact O-CG 3.27Å; C205-M209 WeakPolarHBondContact O-CG 3.49Å; C205-M209 PolarHBondContact O-N 3.38Å; M209-S211 VanDerWaalsContact C-N 3.31Å; M209-S211 PolarHBondContact O-N 3.4Å; M209-T212 PolarHBondContact O-N 3.35Å; M209-T212 VanDerWaalsContact O-N 3.09Å; M209-V213 WeakPolarHBondContact O-CB 3.28Å; M209-V213 VanDerWaalsContact O-CG2 3.23Å; M209-V213 WeakPolarHBondContact O-CG2 3.27Å; M209-V213 PolarHBondContact O-N 2.96Å
210A83.9Confident73.3Confident25 Ų2543.9 Ų43.921%0.20729%0.289CS..Hα-helixtrans-56.3-44176.300000112.4A206 D207 V208 T212 G214 W268A206-A210 WeakPolarHBondContact O-CB 2.9Å; A206-A210 PolarHBondContact O-N 3.08Å; D207-A210 PolarHBondContact O-N 3.47Å; V208-A210 PolarHBondContact O-N 3.29Å; A210-T212 VanDerWaalsContact C-N 3.31Å; A210-T212 PolarHBondContact O-N 3.05Å; A210-G214 PolarHBondContact O-N 3.43Å; A210-G214 VanDerWaalsContact O-N 3.14Å; A210-W268 HydrophobicContact CB-CH2 3.3Å; A210-W268 HydrophobicContact CB-CZ2 4.36Å; A210-W268 HydrophobicContact CB-CZ3 3.6Å
211S83.1Confident70.9Confident86 Ų8649.3 Ų49.360%0.60132%0.316SS*.Hα-helixtrans-68.5-28.7178.374.50000113.4D207 V208 M209D207-S211 WeakPolarHBondContact O-CB 3.38Å; D207-S211 PolarHBondContact O-N 2.75Å; D207-S211 PolarHBondContact O-OG 2.98Å; V208-S211 PolarHBondContact O-N 2.93Å; V208-S211 PolarHBondContact O-OG 2.93Å; M209-S211 VanDerWaalsContact C-N 3.31Å; M209-S211 PolarHBondContact O-N 3.4Å
212T78.4Confident68.7Low39 Ų3951.8 Ų51.824%0.23933%0.333CS..Hα-helixtrans-87.1-35.6-177.9-54.80000112.1K130 L132 V208 M209 A210 G214K130-T212 HydrophobicContact CG-CG2 4.14Å; L132-T212 HydrophobicContact CB-CG2 3.79Å; V208-T212 WeakPolarHBondContact O-CB 3.27Å; V208-T212 PolarHBondContact O-N 2.88Å; V208-T212 PolarHBondContact O-OG1 2.86Å; M209-T212 PolarHBondContact O-N 3.35Å; M209-T212 VanDerWaalsContact O-N 3.09Å; A210-T212 VanDerWaalsContact C-N 3.31Å; A210-T212 PolarHBondContact O-N 3.05Å; T212-G214 VanDerWaalsContact C-N 3.26Å
213V72.5Confident66.8Low26 Ų2656.8 Ų56.816%0.15836%0.363CS..Hα-helixtrans-67.4-31.5172.9171.40000110.7L132 M209 Y215 A232L132-V213 HydrophobicContact CD2-CG2 3.67Å; M209-V213 WeakPolarHBondContact O-CB 3.28Å; M209-V213 VanDerWaalsContact O-CG2 3.23Å; M209-V213 WeakPolarHBondContact O-CG2 3.27Å; M209-V213 PolarHBondContact O-N 2.96Å; V213-Y215 HydrophobicContact CG1-CD2 3.84Å; V213-Y215 HydrophobicContact CG1-CE2 3.28Å; V213-Y215 VanDerWaalsContact O-CD2 3.26Å; V213-Y215 WeakPolarHBondContact O-CD2 3.44Å; V213-Y215 PolarHBondContact O-N 3.26Å; V213-A232 VanDerWaalsContact CG1-O 3.22Å; V213-A232 WeakPolarHBondContact CG1-O 3.41Å
214G62.1Low65.2Low44 Ų4460.5 Ų60.545%0.45438%0.379SS..  trans-2893.5-177.100000114.9A210 T212 Y216A210-G214 PolarHBondContact O-N 3.43Å; A210-G214 VanDerWaalsContact O-N 3.14Å; T212-G214 VanDerWaalsContact C-N 3.26Å; G214-Y216 PolarHBondContact O-N 3.01Å
215Y56.8Low63.7Low30 Ų3066.1 Ų66.112%0.11840%0.404CS..  trans-71.712.2176.2-63.1-82.3000112.9V213 P222 T223 K224 L226 A232V213-Y215 HydrophobicContact CG1-CD2 3.84Å; V213-Y215 HydrophobicContact CG1-CE2 3.28Å; V213-Y215 VanDerWaalsContact O-CD2 3.26Å; V213-Y215 WeakPolarHBondContact O-CD2 3.44Å; V213-Y215 PolarHBondContact O-N 3.26Å; Y215-P222 WeakPolarHBondContact O-CA 3.45Å; Y215-T223 PolarHBondContact O-N 3.46Å; Y215-K224 HydrophobicContact CD1-CB 3.71Å; Y215-K224 HydrophobicContact CD1-CD 3.72Å; Y215-K224 HydrophobicContact CD1-CG 4.34Å; Y215-K224 HydrophobicContact CE1-CB 4.45Å; Y215-K224 HydrophobicContact CE1-CD 3.97Å; Y215-L226 HydrophobicContact CE1-CD1 4.2Å; Y215-A232 HydrophobicContact CE2-CB 3.88Å; Y215-A232 WeakPolarHBondContact CE2-O 3.36Å; Y215-A232 PolarHBondContact OH-O 2.84Å
216Y47.2Very low62.4Low85 Ų8567.5 Ų67.533%0.33341%0.411SS..BIsolated β-bridgetrans-136.7141.4-178.7-71.7-89.4000112.3G214 P222 Y279G214-Y216 PolarHBondContact O-N 3.01Å; Y216-P222 HydrophobicContact CD1-CB 3.9Å; Y216-P222 HydrophobicContact CD1-CG 4.38Å; Y216-P222 HydrophobicContact CE1-CB 3.38Å; Y216-P222 HydrophobicContact CE1-CG 3.55Å; Y216-P222 HydrophobicContact CE2-CB 4.34Å; Y216-Y279 WeakPolarHBondContact CE2-O 3.4Å
217S40.1Very low61.2Low56 Ų5670 Ų7039%0.39243%0.428SS..  trans-89.6164.5162.1800000110.7S219 G220S217-S219 PolarHBondContact O-N 3.15Å; S217-S219 PolarHBondContact OG-OG 3.4Å; S217-G220 PolarHBondContact O-N 3.18Å
218A39.7Very low60.4Low119 Ų11973.9 Ų73.998%0.98345%0.449SS*.THydrogen-bonded Turntrans-59.6-9.2-179.100000114.9
219S42.3Very low59.9Low92 Ų9275.2 Ų75.264%0.64346%0.46SS*.THydrogen-bonded Turntrans-91.53.7179.660.40000115S217 M221S217-S219 PolarHBondContact O-N 3.15Å; S217-S219 PolarHBondContact OG-OG 3.4Å; S219-M221 VanDerWaalsContact C-N 3.33Å; S219-M221 PolarHBondContact O-N 3.2Å
220G43.2Very low59.7Low56 Ų5677.6 Ų77.658%0.57747%0.472SS*.SBendtrans82-3.6169.400000116.5S217S217-G220 PolarHBondContact O-N 3.18Å
221M38.6Very low59.8Low140 Ų14076.4 Ų76.469%0.6946%0.463SS*.  trans-90.9126.2169.3-80-168.4-77.700111.3S219 T223S219-M221 VanDerWaalsContact C-N 3.33Å; S219-M221 PolarHBondContact O-N 3.2Å; M221-T223 PolarHBondContact O-N 3.47Å
222P45.2Very low59.8Low64 Ų6472.5 Ų72.542%0.41644%0.436SS..BIsolated β-bridgetrans-68.8124.2173.316.2-13.8000109.8Y215 Y216 K224Y215-P222 WeakPolarHBondContact O-CA 3.45Å; Y216-P222 HydrophobicContact CD1-CB 3.9Å; Y216-P222 HydrophobicContact CD1-CG 4.38Å; Y216-P222 HydrophobicContact CE1-CB 3.38Å; Y216-P222 HydrophobicContact CE1-CG 3.55Å; Y216-P222 HydrophobicContact CE2-CB 4.34Å; P222-K224 VanDerWaalsContact C-N 3.29Å
223T50.1Low60.1Low108 Ų10871 Ų7166%0.66343%0.426SS*.SBendtrans-84-4.4178.241.80000113.3Y215 M221Y215-T223 PolarHBondContact O-N 3.46Å; M221-T223 PolarHBondContact O-N 3.47Å
224K53.8Low60.7Low131 Ų13169.9 Ų69.957%0.5742%0.419SS*.  trans-143.6117.1-176.3-76.9-178.1179.2-179.90109.6Y215 P222Y215-K224 HydrophobicContact CD1-CB 3.71Å; Y215-K224 HydrophobicContact CD1-CD 3.72Å; Y215-K224 HydrophobicContact CD1-CG 4.34Å; Y215-K224 HydrophobicContact CE1-CB 4.45Å; Y215-K224 HydrophobicContact CE1-CD 3.97Å; P222-K224 VanDerWaalsContact C-N 3.29Å
225H56.3Low61.6Low181 Ų18169 Ų6984%0.83841%0.41SS*.  trans-82.4112.9168.9-155.6-78.4000107.7
226L63.8Low62.9Low29 Ų2970.4 Ų70.415%0.15242%0.418CS..  trans-90.3131.8175.2-160.773.7000107.9Y215 I230 A232 Y279Y215-L226 HydrophobicContact CE1-CD1 4.2Å; L226-I230 HydrophobicContact CD1-CB 4.07Å; L226-I230 HydrophobicContact CD1-CD1 4.46Å; L226-I230 HydrophobicContact CD1-CG2 3.87Å; L226-I230 HydrophobicContact CD2-CB 4.32Å; L226-I230 HydrophobicContact CD2-CG2 4.27Å; L226-I230 VanDerWaalsContact CD2-O 3.27Å; L226-I230 WeakPolarHBondContact CD2-O 3.41Å; L226-I230 HydrophobicContact CG-CB 4.02Å; L226-I230 HydrophobicContact CG-CG2 4.23Å; L226-A232 VanDerWaalsContact CD2-CA 3.46Å; L226-A232 HydrophobicContact CD2-CB 3.52Å; L226-Y279 HydrophobicContact CB-CE2 4.36Å
227S65.2Low64.6Low53 Ų5370.1 Ų70.137%0.37143%0.426SS..  trans-67.5146.817356.10000110.1S229 I230S227-S229 PolarHBondContact O-N 3.31Å; S227-S229 PolarHBondContact OG-OG 2.85Å; S227-I230 PolarHBondContact O-N 2.96Å; S227-I230 WeakPolarHBondContact OG-CD1 3.3Å; S227-I230 WeakPolarHBondContact OG-CG1 3.49Å
228D69.6Low66.8Low148 Ų14868.6 Ų68.679%0.79141%0.414SS*.THydrogen-bonded Turntrans-57.5-17.4178.7-68.4-18.8000113.3
229S77.2Confident68.6Low65 Ų6570 Ų7046%0.45540%0.404SS..THydrogen-bonded Turntrans-83.4-0.3176.659.20000114.9S227 P237 I238S227-S229 PolarHBondContact O-N 3.31Å; S227-S229 PolarHBondContact OG-OG 2.85Å; S229-P237 CarbonylContact O-C 3.54Å; S229-P237 VanDerWaalsContact O-CA 3.24Å; S229-P237 WeakPolarHBondContact O-CA 3.46Å; S229-I238 PolarHBondContact O-N 3.46Å
230I84.1Confident70.3Confident53 Ų5367.1 Ų67.127%0.27238%0.383SS..BIsolated β-bridgetrans-119.5129.5-179.8-60.1171.7000110.1L226 S227 A232L226-I230 HydrophobicContact CD1-CB 4.07Å; L226-I230 HydrophobicContact CD1-CD1 4.46Å; L226-I230 HydrophobicContact CD1-CG2 3.87Å; L226-I230 HydrophobicContact CD2-CB 4.32Å; L226-I230 HydrophobicContact CD2-CG2 4.27Å; L226-I230 VanDerWaalsContact CD2-O 3.27Å; L226-I230 WeakPolarHBondContact CD2-O 3.41Å; L226-I230 HydrophobicContact CG-CB 4.02Å; L226-I230 HydrophobicContact CG-CG2 4.23Å; S227-I230 PolarHBondContact O-N 2.96Å; S227-I230 WeakPolarHBondContact OG-CD1 3.3Å; S227-I230 WeakPolarHBondContact OG-CG1 3.49Å; I230-A232 PolarHBondContact O-N 3Å
231C86.2Confident71.8Confident0 Ų069.1 Ų69.10%038%0.38CS..  trans-70.8119.8176.3179.40000110.7V233 C234 G235 Q236 I238 H261C231-V233 PolarHBondContact O-N 3.37Å; C231-V233 VanDerWaalsContact O-N 3.11Å; C231-C234 PolarHBondContact O-N 3.31Å; C231-G235 VanDerWaalsContact O-CA 3.25Å; C231-G235 WeakPolarHBondContact O-CA 3.24Å; C231-G235 PolarHBondContact O-N 3.31Å; C231-Q236 PolarHBondContact N-O 2.88Å; C231-I238 HydrophobicContact CB-CD1 4.21Å; C231-I238 HydrophobicContact CB-CG1 4.05Å; C231-H261 VanDerWaalsContact CB-ND1 3.29Å; C231-H261 WeakPolarHBondContact CB-ND1 3.13Å
232A82.5Confident73.5Confident4 Ų465.1 Ų65.13%0.03336%0.363CS..THydrogen-bonded Turntrans-65.5-19.5-176.800000114.2V213 Y215 L226 I230 F260V213-A232 VanDerWaalsContact CG1-O 3.22Å; V213-A232 WeakPolarHBondContact CG1-O 3.41Å; Y215-A232 HydrophobicContact CE2-CB 3.88Å; Y215-A232 WeakPolarHBondContact CE2-O 3.36Å; Y215-A232 PolarHBondContact OH-O 2.84Å; L226-A232 VanDerWaalsContact CD2-CA 3.46Å; L226-A232 HydrophobicContact CD2-CB 3.52Å; I230-A232 PolarHBondContact O-N 3Å; A232-F260 HydrophobicContact CB-CE1 3.83Å
233V85.3Confident74.6Confident7 Ų767.1 Ų67.14%0.04238%0.379CS..THydrogen-bonded Turntrans-79.6-52.3-179.9178.50000111.5P137 Y141 C231 F260 C264 P278P137-V233 HydrophobicContact CB-CG1 4.13Å; P137-V233 WeakPolarHBondContact CG-O 3.42Å; Y141-V233 HydrophobicContact CE2-CG1 4.01Å; C231-V233 PolarHBondContact O-N 3.37Å; C231-V233 VanDerWaalsContact O-N 3.11Å; V233-F260 HydrophobicContact CG2-CD1 4.01Å; V233-F260 HydrophobicContact CG2-CE1 4.28Å; V233-C264 HydrophobicContact CB-CB 3.9Å; V233-C264 HydrophobicContact CG1-CB 3.92Å; V233-C264 HydrophobicContact CG2-CB 4.4Å; V233-P278 HydrophobicContact CG2-CB 4.12Å; V233-P278 HydrophobicContact CG2-CG 3.66Å
234C86.4Confident75.8Confident2 Ų268.3 Ų68.31%0.01438%0.377CS..THydrogen-bonded Turntrans-101.7-7.3-177.465.10000114.2C134 R138 C231 Q236 H261C134-C234 CarbonylContact C-O 3.28Å; C134-C234 VanDerWaalsContact C-O 3.28Å; C134-C234 WeakPolarHBondContact CA-O 3.21Å; C134-C234 WeakPolarHBondContact CB-O 3.39Å; C134-C234 WeakPolarHBondContact O-CB 3.37Å; R138-C234 HydrophobicContact CG-CB 4.36Å; C231-C234 PolarHBondContact O-N 3.31Å; C234-Q236 PolarHBondContact O-N 3.31Å; C234-H261 PolarHBondContact SG-ND1 3.22Å
235G80.1Confident76.6Confident26 Ų2670.8 Ų70.827%0.26839%0.39SS..  trans64.617.9-179.300000114.8C231C231-G235 VanDerWaalsContact O-CA 3.25Å; C231-G235 WeakPolarHBondContact O-CA 3.24Å; C231-G235 PolarHBondContact O-N 3.31Å
236Q84Confident77.3Confident60 Ų6063 Ų6328%0.2836%0.359SS..  trans-100.5151.8177.5-67.4-179.7-4500111.4C134 C231 C234C134-Q236 HydrophobicContact CB-CG 4.36Å; C231-Q236 PolarHBondContact N-O 2.88Å; C234-Q236 PolarHBondContact O-N 3.31Å
237P83.4Confident77.4Confident78 Ų7870.1 Ų70.151%0.50640%0.395SS..BIsolated β-bridgetrans-65.1140.9177.427.9-34.5000111.3S229 L239 H261S229-P237 CarbonylContact O-C 3.54Å; S229-P237 VanDerWaalsContact O-CA 3.24Å; S229-P237 WeakPolarHBondContact O-CA 3.46Å; P237-L239 HydrophobicContact CB-CD2 4.42Å; P237-H261 PolarHBondContact O-NE2 2.91Å
238I84.9Confident77.7Confident25 Ų2574.9 Ų74.913%0.12842%0.415CS..  trans-89.3112174.4-56.1177.3000106.6S229 C231 V240 T251 V259S229-I238 PolarHBondContact O-N 3.46Å; C231-I238 HydrophobicContact CB-CD1 4.21Å; C231-I238 HydrophobicContact CB-CG1 4.05Å; I238-V240 WeakPolarHBondContact CG2-O 3.49Å; I238-T251 HydrophobicContact CG2-CG2 3.68Å; I238-T251 WeakPolarHBondContact CG2-OG1 3.39Å; I238-V259 HydrophobicContact CD1-CB 4.28Å; I238-V259 HydrophobicContact CD1-CG1 3.98Å; I238-V259 WeakPolarHBondContact CD1-O 3.09Å
239L78.9Confident78.1Confident149 Ų14969.9 Ų69.978%0.7839%0.387SS*.  trans-96.3-14.9-172.9-61.6174.9000113.6P237P237-L239 HydrophobicContact CB-CD2 4.42Å
240V78.6Confident78.4Confident31 Ų3169.6 Ų69.619%0.18838%0.38CS..SBendtrans-119.7129.6-174.1-175.80000108.5I238 E244 T251I238-V240 WeakPolarHBondContact CG2-O 3.49Å; V240-E244 HydrophobicContact CG1-CB 4.05Å; V240-E244 WeakPolarHBondContact CG1-O 3.36Å; V240-T251 VanDerWaalsContact O-CB 3.31Å; V240-T251 WeakPolarHBondContact O-CB 3.41Å; V240-T251 PolarHBondContact O-OG1 3.5Å
241D74.5Confident78.6Confident97 Ų9767.7 Ų67.752%0.51937%0.371SS..  trans-74.2158.1175-153.1-26.9000110.8S243 E244D241-S243 PolarHBondContact O-N 3.42Å; D241-S243 VanDerWaalsContact O-N 3.11Å; D241-E244 PolarHBondContact O-N 2.95Å; D241-E244 VanDerWaalsContact O-N 3.09Å
242V74.3Confident78.5Confident57 Ų5769.8 Ų69.835%0.34538%0.379SS..THydrogen-bonded Turntrans-60.1-23.4-177.3-174.60000112.4T251 R253 V259V242-T251 HydrophobicContact CG2-CG2 4.01Å; V242-R253 HydrophobicContact CG1-CB 4.09Å; V242-R253 HydrophobicContact CG2-CB 3.98Å; V242-V259 HydrophobicContact CG2-CG1 4.09Å
243S66.9Low78.8Confident105 Ų10574.6 Ų74.673%0.73440%0.396SS*.THydrogen-bonded Turntrans-87.3-9.1179.953.10000114.5D241D241-S243 PolarHBondContact O-N 3.42Å; D241-S243 VanDerWaalsContact O-N 3.11Å
244E74.9Confident78.9Confident134 Ų13474.6 Ų74.663%0.62640%0.396SS*.SBendtrans-113138.3-177-65.7-175173.800110.8V240 D241 G246V240-E244 HydrophobicContact CG1-CB 4.05Å; V240-E244 WeakPolarHBondContact CG1-O 3.36Å; D241-E244 PolarHBondContact O-N 2.95Å; D241-E244 VanDerWaalsContact O-N 3.09Å; E244-G246 PolarHBondContact O-N 3.46Å
245E71Confident78.8Confident183 Ų18377.5 Ų77.586%0.85542%0.416SS*.  trans-72.5119.6169.2-75.1-171.6172.200109.1
246G71.6Confident79.1Confident17 Ų1777.1 Ų77.118%0.17541%0.409CS..  trans-76.3132.8-178.300000111.5E244 I248 N250E244-G246 PolarHBondContact O-N 3.46Å; G246-I248 PolarHBondContact O-N 2.96Å; G246-N250 PolarHBondContact N-OD1 3.41Å
247I65.8Low79.2Confident178 Ų17879.5 Ų79.591%0.91342%0.424SS*.SBendtrans-61.5-34.6174.4-58.8172.9000111.1
248I71.1Confident79.3Confident153 Ų15378 Ų7879%0.78541%0.41SS*.SBendtrans-101-50.2-177.5-56.9174.3000111G246G246-I248 PolarHBondContact O-N 2.96Å
249E77.7Confident79.4Confident44 Ų4478 Ų7821%0.20641%0.412CS..  trans-159.3148.6177.664.2-174.7160.200110.9R138 H261R138-E249 IonicContact CZ-OE1 3.77Å; R138-E249 IonicContact CZ-OE2 2.7Å; R138-E249 IonicContact NH1-OE1 3.41Å; R138-E249 PolarHBondContact NH1-OE1 3.33Å; R138-E249 IonicContact NH1-OE2 2.56Å; R138-E249 PolarHBondContact NH1-OE2 3.37Å; R138-E249 IonicContact NH2-OE1 2.67Å; R138-E249 PolarHBondContact NH2-OE1 3.49Å; R138-E249 IonicContact NH2-OE2 3.41Å; R138-E249 PolarHBondContact NH2-OE2 2.79Å; E249-H261 VanDerWaalsContact CD-CD2 3.42Å; E249-H261 IonicContact OE1-CD2 2.84Å; E249-H261 PolarHBondContact OE1-CD2 3.25Å; E249-H261 IonicContact OE1-CE1 3.66Å; E249-H261 IonicContact OE1-CG 3.51Å; E249-H261 IonicContact OE1-ND1 2.79Å; E249-H261 IonicContact OE1-NE2 3.67Å; E249-H261 PolarHBondContact OE1-NE2 2.87Å; E249-H261 IonicContact OE2-CG 2.68Å
250N84.5Confident79.9Confident58 Ų5871 Ų7131%0.3138%0.375SS..  trans-81.9161.7175.8-61.9-37.6000111.8G246 E262G246-N250 PolarHBondContact N-OD1 3.41Å; N250-E262 HydrophobicContact CB-CB 4.26Å; N250-E262 WeakPolarHBondContact CB-OE2 3.44Å; N250-E262 PolarHBondContact ND2-OE2 2.89Å; N250-E262 VanDerWaalsContact O-CB 3.29Å; N250-E262 WeakPolarHBondContact O-CB 3.31Å; N250-E262 PolarHBondContact O-N 2.96Å
251T87.3Confident80.4Confident13 Ų1369.8 Ų69.88%0.0837%0.367CS..EExtended strand (participates in β ladder)trans-110.6137.4177.1-61.70000109.9I238 V240 V242 V259I238-T251 HydrophobicContact CG2-CG2 3.68Å; I238-T251 WeakPolarHBondContact CG2-OG1 3.39Å; V240-T251 VanDerWaalsContact O-CB 3.31Å; V240-T251 WeakPolarHBondContact O-CB 3.41Å; V240-T251 PolarHBondContact O-OG1 3.5Å; V242-T251 HydrophobicContact CG2-CG2 4.01Å; T251-V259 HydrophobicContact CG2-CG1 3.04Å
252Y86Confident81Confident44 Ų4467.2 Ų67.217%0.17335%0.352CS..EExtended strand (participates in β ladder)trans-119.9131179.5-166.1-90.5000111.2L254 F260 R288 M289Y252-L254 HydrophobicContact CD1-CD2 4Å; Y252-L254 HydrophobicContact CE1-CD2 3.95Å; Y252-F260 PolarHBondContact N-O 2.81Å; Y252-F260 PolarHBondContact O-N 3.49Å; Y252-R288 PolarHBondContact OH-O 3.44Å; Y252-M289 HydrophobicContact CD1-CE 4.33Å; Y252-M289 HydrophobicContact CD1-CG 4.38Å; Y252-M289 HydrophobicContact CE1-CE 4.33Å; Y252-M289 HydrophobicContact CE1-CG 3.5Å; Y252-M289 HydrophobicContact CE1-SD 4.11Å; Y252-M289 HydrophobicContact CE2-CG 4.37Å; Y252-M289 VanDerWaalsContact CZ-CG 3.5Å; Y252-M289 VanDerWaalsContact OH-CG 3.32Å; Y252-M289 WeakPolarHBondContact OH-CG 3.33Å
253R87.5Confident81.7Confident105 Ų10567.8 Ų67.840%0.39635%0.35SS..EExtended strand (participates in β ladder)trans-101124.2175.1-174.6-179.3-67.6-96.97.2110.6V242 N257 V259V242-R253 HydrophobicContact CG1-CB 4.09Å; V242-R253 HydrophobicContact CG2-CB 3.98Å; R253-N257 PolarHBondContact NH1-O 3.46Å; R253-N257 VanDerWaalsContact NH1-O 3.08Å; R253-V259 HydrophobicContact CB-CG2 4.42Å; R253-V259 HydrophobicContact CG-CG2 4.22Å
254L86.8Confident82.7Confident7 Ų762.8 Ų62.84%0.03732%0.315CS..  trans-76.5168.1175.4-63.5-176.8000112Y252 C256 N257 H258 F260 I265 C277 V284 M289Y252-L254 HydrophobicContact CD1-CD2 4Å; Y252-L254 HydrophobicContact CE1-CD2 3.95Å; L254-C256 VanDerWaalsContact CB-SG 3.57Å; L254-C256 PolarHBondContact O-N 2.89Å; L254-N257 WeakPolarHBondContact O-CA 3.43Å; L254-N257 PolarHBondContact O-N 2.96Å; L254-H258 PolarHBondContact N-O 2.96Å; L254-F260 HydrophobicContact CD1-CD2 3.98Å; L254-F260 HydrophobicContact CD1-CE2 3.46Å; L254-F260 VanDerWaalsContact CD1-CE2 3.46Å; L254-F260 HydrophobicContact CD1-CZ 4.38Å; L254-F260 HydrophobicContact CG-CD2 4.09Å; L254-F260 HydrophobicContact CG-CE2 3.98Å; L254-I265 HydrophobicContact CD1-CD1 4.07Å; L254-I265 HydrophobicContact CD2-CD1 4.35Å; L254-I265 HydrophobicContact CD2-CG1 4.04Å; L254-C277 HydrophobicContact CD1-CB 3.96Å; L254-V284 HydrophobicContact CD1-CG2 3.98Å; L254-V284 HydrophobicContact CD2-CG1 3.71Å; L254-V284 HydrophobicContact CD2-CG2 4.19Å; L254-M289 HydrophobicContact CD2-SD 4.14Å
255S85.8Confident83.4Confident63 Ų6356.4 Ų56.444%0.44129%0.285SS..THydrogen-bonded Turntrans-57-35.6172.954.40000113.1N257 E282S255-N257 PolarHBondContact O-N 3.48Å; S255-N257 VanDerWaalsContact O-N 3.11Å; S255-E282 PolarHBondContact OG-OE1 3.26Å
256C85.3Confident84.1Confident18 Ų1851.7 Ų51.712%0.12226%0.26CS..THydrogen-bonded Turntrans-73.511.9174.965.40000114.3L254 H258 C280 E282L254-C256 VanDerWaalsContact CB-SG 3.57Å; L254-C256 PolarHBondContact O-N 2.89Å; C256-H258 PolarHBondContact O-N 2.7Å; C256-H258 PolarHBondContact O-ND1 3.37Å; C256-H258 PolarHBondContact SG-ND1 3.31Å; C256-C280 WeakPolarHBondContact CB-SG 3.5Å; C256-E282 HydrophobicContact CB-CB 4.13Å; C256-E282 HydrophobicContact CB-CG 4.48Å; C256-E282 WeakPolarHBondContact CB-OE2 3.29Å
257N86.1Confident84.8Confident111 Ų11151.1 Ų51.159%0.59425%0.254SS*.SBendtrans63-3.6-177.8-67-40.4000117.4R253 L254 S255R253-N257 PolarHBondContact NH1-O 3.46Å; R253-N257 VanDerWaalsContact NH1-O 3.08Å; L254-N257 WeakPolarHBondContact O-CA 3.43Å; L254-N257 PolarHBondContact O-N 2.96Å; S255-N257 PolarHBondContact O-N 3.48Å; S255-N257 VanDerWaalsContact O-N 3.11Å
258H86.3Confident85.9Confident45 Ų4543.5 Ų43.521%0.20821%0.214CC..  trans-68.9139.4173.1-63.1102.8000112.1L254 C256 F260 Y279L254-H258 PolarHBondContact N-O 2.96Å; C256-H258 PolarHBondContact O-N 2.7Å; C256-H258 PolarHBondContact O-ND1 3.37Å; C256-H258 PolarHBondContact SG-ND1 3.31Å; H258-F260 HydrophobicContact CB-CD2 4.49Å; H258-F260 HydrophobicContact CB-CE2 3.49Å; H258-F260 VanDerWaalsContact CB-CE2 3.49Å; H258-F260 HydrophobicContact CB-CZ 3.82Å; H258-Y279 AromaticContact CD2-CD1 3.55Å; H258-Y279 AromaticContact CD2-CG 3.93Å; H258-Y279 AromaticContact CE1-CD1 3.41Å; H258-Y279 VanDerWaalsContact CE1-CD1 3.41Å; H258-Y279 WeakPolarHBondContact CE1-CD1 3.44Å; H258-Y279 AromaticContact CE1-CE1 3.99Å; H258-Y279 AromaticContact NE2-CD1 2.98Å; H258-Y279 WeakPolarHBondContact NE2-CD1 3.39Å; H258-Y279 AromaticContact NE2-CE1 3.27Å; H258-Y279 VanDerWaalsContact NE2-CE1 3.27Å; H258-Y279 WeakPolarHBondContact NE2-CE1 3.3Å; H258-Y279 AromaticContact NE2-CG 3.83Å
259V87.7Confident86.5Confident27 Ų2736.7 Ų36.716%0.16418%0.179CC..EExtended strand (participates in β ladder)trans-110.9135.6-172.2-173.60000110.1I238 V242 T251 R253I238-V259 HydrophobicContact CD1-CB 4.28Å; I238-V259 HydrophobicContact CD1-CG1 3.98Å; I238-V259 WeakPolarHBondContact CD1-O 3.09Å; V242-V259 HydrophobicContact CG2-CG1 4.09Å; T251-V259 HydrophobicContact CG2-CG1 3.04Å; R253-V259 HydrophobicContact CB-CG2 4.42Å; R253-V259 HydrophobicContact CG-CG2 4.22Å
260F88.8Confident86.7Confident2 Ų237.8 Ų37.81%0.00919%0.186CC..EExtended strand (participates in β ladder)trans-142.2158.9-178.2-57-90.6000111.1A232 V233 Y252 L254 H258 E262 I265 P278A232-F260 HydrophobicContact CB-CE1 3.83Å; V233-F260 HydrophobicContact CG2-CD1 4.01Å; V233-F260 HydrophobicContact CG2-CE1 4.28Å; Y252-F260 PolarHBondContact N-O 2.81Å; Y252-F260 PolarHBondContact O-N 3.49Å; L254-F260 HydrophobicContact CD1-CD2 3.98Å; L254-F260 HydrophobicContact CD1-CE2 3.46Å; L254-F260 VanDerWaalsContact CD1-CE2 3.46Å; L254-F260 HydrophobicContact CD1-CZ 4.38Å; L254-F260 HydrophobicContact CG-CD2 4.09Å; L254-F260 HydrophobicContact CG-CE2 3.98Å; H258-F260 HydrophobicContact CB-CD2 4.49Å; H258-F260 HydrophobicContact CB-CE2 3.49Å; H258-F260 VanDerWaalsContact CB-CE2 3.49Å; H258-F260 HydrophobicContact CB-CZ 3.82Å; F260-E262 PolarHBondContact O-N 3.36Å; F260-I265 HydrophobicContact CB-CB 3.98Å; F260-I265 HydrophobicContact CB-CG2 4.42Å; F260-I265 HydrophobicContact CD2-CD1 4.22Å; F260-I265 HydrophobicContact CG-CB 4.41Å; F260-I265 HydrophobicContact CG-CD1 4.41Å; F260-P278 HydrophobicContact CE1-CB 4.21Å; F260-P278 HydrophobicContact CE1-CG 3.93Å; F260-P278 HydrophobicContact CZ-CB 4.5Å; F260-P278 HydrophobicContact CZ-CG 4.15Å
261H89.6Confident86.5Confident5 Ų536.2 Ų36.22%0.02318%0.178CC..EExtended strand (participates in β ladder)trans-60.1133.4162.6-59.1118000109.9R138 C231 C234 P237 E249 F263 C264 I265R138-H261 PolarHBondContact NH2-CE1 3.01Å; R138-H261 VanDerWaalsContact NH2-CE1 3.34Å; R138-H261 VanDerWaalsContact NH2-CG 3.31Å; R138-H261 PolarHBondContact NH2-ND1 3.02Å; C231-H261 VanDerWaalsContact CB-ND1 3.29Å; C231-H261 WeakPolarHBondContact CB-ND1 3.13Å; C234-H261 PolarHBondContact SG-ND1 3.22Å; P237-H261 PolarHBondContact O-NE2 2.91Å; E249-H261 VanDerWaalsContact CD-CD2 3.42Å; E249-H261 IonicContact OE1-CD2 2.84Å; E249-H261 PolarHBondContact OE1-CD2 3.25Å; E249-H261 IonicContact OE1-CE1 3.66Å; E249-H261 IonicContact OE1-CG 3.51Å; E249-H261 IonicContact OE1-ND1 2.79Å; E249-H261 IonicContact OE1-NE2 3.67Å; E249-H261 PolarHBondContact OE1-NE2 2.87Å; E249-H261 IonicContact OE2-CG 2.68Å; H261-F263 VanDerWaalsContact C-N 3.25Å; H261-F263 PolarHBondContact O-N 3.42Å; H261-C264 HydrophobicContact CB-CB 4.06Å; H261-C264 PolarHBondContact O-N 2.79Å; H261-I265 PolarHBondContact O-N 3.48Å
262E87.1Confident86.1Confident43 Ų4335.6 Ų35.620%0.20117%0.174CC..Hα-helixtrans-54.3-44.1-178.9179.1172.6-152.700111.3N250 F260 C264 I265 R266N250-E262 HydrophobicContact CB-CB 4.26Å; N250-E262 WeakPolarHBondContact CB-OE2 3.44Å; N250-E262 PolarHBondContact ND2-OE2 2.89Å; N250-E262 VanDerWaalsContact O-CB 3.29Å; N250-E262 WeakPolarHBondContact O-CB 3.31Å; N250-E262 PolarHBondContact O-N 2.96Å; F260-E262 PolarHBondContact O-N 3.36Å; E262-C264 PolarHBondContact O-N 3.11Å; E262-I265 WeakPolarHBondContact O-CG2 3.39Å; E262-R266 HydrophobicContact CG-CG 4.29Å; E262-R266 VanDerWaalsContact O-CB 3.25Å; E262-R266 WeakPolarHBondContact O-CB 3.24Å; E262-R266 WeakPolarHBondContact O-CG 3.44Å; E262-R266 PolarHBondContact O-N 2.92Å; E262-R266 IonicContact OE1-CZ 3.1Å; E262-R266 IonicContact OE1-NE 3.84Å; E262-R266 PolarHBondContact OE1-NE 3.03Å; E262-R266 IonicContact OE1-NH2 2.63Å; E262-R266 PolarHBondContact OE1-NH2 2.97Å
263F87.9Confident85.9Confident69 Ų6936.8 Ų36.830%0.30318%0.181SC..Hα-helixtrans-61.3-42.1177.5-177.5-99.8000112.7R138 K142 L145 H261 G267R138-F263 HydrophobicContact CB-CE1 4.37Å; R138-F263 HydrophobicContact CG-CD1 4.44Å; R138-F263 HydrophobicContact CG-CE1 4.5Å; K142-F263 HydrophobicContact CB-CZ 4.24Å; L145-F263 HydrophobicContact CD2-CE2 4.35Å; H261-F263 VanDerWaalsContact C-N 3.25Å; H261-F263 PolarHBondContact O-N 3.42Å; F263-G267 PolarHBondContact O-N 3.34Å
264C89.2Confident85.7Confident0 Ų034.4 Ų34.40%017%0.173CC..Hα-helixtrans-68.2-44.1-178.1-69.90000112.2V233 H261 E262 G267 W268V233-C264 HydrophobicContact CB-CB 3.9Å; V233-C264 HydrophobicContact CG1-CB 3.92Å; V233-C264 HydrophobicContact CG2-CB 4.4Å; H261-C264 HydrophobicContact CB-CB 4.06Å; H261-C264 PolarHBondContact O-N 2.79Å; E262-C264 PolarHBondContact O-N 3.11Å; C264-G267 PolarHBondContact O-N 3.43Å; C264-W268 WeakPolarHBondContact O-CB 3.37Å; C264-W268 PolarHBondContact O-N 3.36Å
265I87.9Confident85.6Confident0 Ų039.6 Ų39.60%020%0.197CC..Hα-helixtrans-72.8-35.9179.7-167.462.6000111.7L254 F260 H261 E262 W268 C269 P278 M289L254-I265 HydrophobicContact CD1-CD1 4.07Å; L254-I265 HydrophobicContact CD2-CD1 4.35Å; L254-I265 HydrophobicContact CD2-CG1 4.04Å; F260-I265 HydrophobicContact CB-CB 3.98Å; F260-I265 HydrophobicContact CB-CG2 4.42Å; F260-I265 HydrophobicContact CD2-CD1 4.22Å; F260-I265 HydrophobicContact CG-CB 4.41Å; F260-I265 HydrophobicContact CG-CD1 4.41Å; H261-I265 PolarHBondContact O-N 3.48Å; E262-I265 WeakPolarHBondContact O-CG2 3.39Å; I265-W268 PolarHBondContact O-N 3.48Å; I265-C269 WeakPolarHBondContact O-CB 3.45Å; I265-C269 PolarHBondContact O-N 2.94Å; I265-C269 PolarHBondContact O-SG 3.23Å; I265-C269 VanDerWaalsContact O-SG 3.42Å; I265-P278 HydrophobicContact CD1-CG 4.21Å; I265-M289 HydrophobicContact CB-CE 4.33Å; I265-M289 HydrophobicContact CG1-CE 3.83Å; I265-M289 HydrophobicContact CG1-SD 4.44Å; I265-M289 HydrophobicContact CG2-CE 3.72Å
266R86.4Confident85.7Confident83 Ų8339 Ų3931%0.31319%0.191SC..Hα-helixtrans-62.2-44.8170.8-75.6-178.8-179.9-145.42.3111.3E262 W268 C269 I270 M289 E295E262-R266 HydrophobicContact CG-CG 4.29Å; E262-R266 VanDerWaalsContact O-CB 3.25Å; E262-R266 WeakPolarHBondContact O-CB 3.24Å; E262-R266 WeakPolarHBondContact O-CG 3.44Å; E262-R266 PolarHBondContact O-N 2.92Å; E262-R266 IonicContact OE1-CZ 3.1Å; E262-R266 IonicContact OE1-NE 3.84Å; E262-R266 PolarHBondContact OE1-NE 3.03Å; E262-R266 IonicContact OE1-NH2 2.63Å; E262-R266 PolarHBondContact OE1-NH2 2.97Å; R266-W268 PolarHBondContact O-N 3.43Å; R266-C269 PolarHBondContact O-N 3.14Å; R266-I270 HydrophobicContact CB-CD1 4.24Å; R266-I270 VanDerWaalsContact O-CB 3.26Å; R266-I270 WeakPolarHBondContact O-CB 3.47Å; R266-I270 WeakPolarHBondContact O-CG1 3.15Å; R266-I270 PolarHBondContact O-N 2.87Å; R266-M289 HydrophobicContact CG-CE 4.47Å; R266-E295 IonicContact NH1-OE1 3.97Å
267G86.9Confident85.7Confident5 Ų538.2 Ų38.25%0.05219%0.186CC..Iπ-helixtrans-59-45.3174.800000112.4F263 C264 V271 G272F263-G267 PolarHBondContact O-N 3.34Å; C264-G267 PolarHBondContact O-N 3.43Å; G267-V271 WeakPolarHBondContact O-CA 3.48Å; G267-V271 WeakPolarHBondContact O-CB 3.34Å; G267-V271 PolarHBondContact O-N 3.3Å; G267-G272 PolarHBondContact O-N 3.27Å
268W87.4Confident85.7Confident19 Ų1933.9 Ų33.97%0.07216%0.164CC..Iπ-helixtrans-59-49.4175.9-179.2-95.6000112.9A210 C264 I265 R266 G272 K273 K274 T276 P278A210-W268 HydrophobicContact CB-CH2 3.3Å; A210-W268 HydrophobicContact CB-CZ2 4.36Å; A210-W268 HydrophobicContact CB-CZ3 3.6Å; C264-W268 WeakPolarHBondContact O-CB 3.37Å; C264-W268 PolarHBondContact O-N 3.36Å; I265-W268 PolarHBondContact O-N 3.48Å; R266-W268 PolarHBondContact O-N 3.43Å; W268-G272 CarbonylContact O-C 3.52Å; W268-G272 WeakPolarHBondContact O-CA 3.47Å; W268-G272 PolarHBondContact O-N 2.91Å; W268-K273 PolarHBondContact O-N 3.14Å; W268-K274 HydrophobicContact CD2-CB 3.94Å; W268-K274 HydrophobicContact CD2-CG 4.24Å; W268-K274 VanDerWaalsContact CE2-CB 3.43Å; W268-K274 HydrophobicContact CG-CB 4.05Å; W268-K274 HydrophobicContact CZ2-CB 3.99Å; W268-K274 HydrophobicContact CZ2-CG 4.1Å; W268-K274 PolarHBondContact O-N 3.03Å; W268-K274 VanDerWaalsContact O-N 3.09Å; W268-T276 PolarHBondContact NE1-O 3.46Å; W268-P278 HydrophobicContact CD2-CB 4.44Å; W268-P278 HydrophobicContact CD2-CG 3.83Å; W268-P278 HydrophobicContact CE3-CG 4.41Å; W268-P278 HydrophobicContact CG-CG 4Å; W268-P278 HydrophobicContact CH2-CB 4.24Å; W268-P278 HydrophobicContact CZ2-CB 4.01Å; W268-P278 HydrophobicContact CZ2-CG 4.11Å
269C85.3Confident85.4Confident9 Ų933.7 Ų33.76%0.06116%0.161CC..Iπ-helixtrans-75-41.3-176.5-68.60000113.5I265 R266 K273 K274 L286 F290I265-C269 WeakPolarHBondContact O-CB 3.45Å; I265-C269 PolarHBondContact O-N 2.94Å; I265-C269 PolarHBondContact O-SG 3.23Å; I265-C269 VanDerWaalsContact O-SG 3.42Å; R266-C269 PolarHBondContact O-N 3.14Å; C269-K273 VanDerWaalsContact O-CA 3.27Å; C269-K273 WeakPolarHBondContact O-CA 3.49Å; C269-K274 WeakPolarHBondContact CA-O 3.27Å; C269-K274 PolarHBondContact SG-O 3.22Å; C269-L286 HydrophobicContact CB-CD2 4.11Å; C269-F290 HydrophobicContact CB-CZ 4.31Å
270I80.3Confident85.1Confident67 Ų6734.8 Ų34.834%0.34417%0.17SC..Iπ-helixtrans-87.8-59.6-175.3-61.8164.5000110.6R266 F290R266-I270 HydrophobicContact CB-CD1 4.24Å; R266-I270 VanDerWaalsContact O-CB 3.26Å; R266-I270 WeakPolarHBondContact O-CB 3.47Å; R266-I270 WeakPolarHBondContact O-CG1 3.15Å; R266-I270 PolarHBondContact O-N 2.87Å; I270-F290 HydrophobicContact CD1-CD1 4.4Å; I270-F290 HydrophobicContact CD1-CE1 3.51Å; I270-F290 HydrophobicContact CD1-CZ 3.93Å; I270-F290 HydrophobicContact CG1-CE1 3.78Å; I270-F290 HydrophobicContact CG1-CZ 3.64Å
271V81.7Confident84.7Confident25 Ų2542.1 Ų42.115%0.15220%0.201CC..Iπ-helixtrans-73.2-44.5-171.6-179.20000110Y141 F144 A202 G267Y141-V271 HydrophobicContact CD1-CB 4.04Å; Y141-V271 HydrophobicContact CD1-CG1 3.97Å; Y141-V271 HydrophobicContact CE1-CB 4.5Å; F144-V271 HydrophobicContact CB-CG1 3.94Å; A202-V271 HydrophobicContact CB-CG1 3.6Å; G267-V271 WeakPolarHBondContact O-CA 3.48Å; G267-V271 WeakPolarHBondContact O-CB 3.34Å; G267-V271 PolarHBondContact O-N 3.3Å
272G79.1Confident84.5Confident0 Ų046.3 Ų46.30%022%0.221CC..SBendtrans-83.4-6.1176.700000115.5G267 W268 K274G267-G272 PolarHBondContact O-N 3.27Å; W268-G272 CarbonylContact O-C 3.52Å; W268-G272 WeakPolarHBondContact O-CA 3.47Å; W268-G272 PolarHBondContact O-N 2.91Å; G272-K274 WeakPolarHBondContact O-CG 3.32Å; G272-K274 PolarHBondContact O-N 3.04Å; G272-K274 VanDerWaalsContact O-N 3.07Å
273K80.8Confident84.4Confident70 Ų7052.4 Ų52.430%0.30425%0.247SC..  trans48.829.6-171.8-60.5-173.7-162.2134.30114.1R199 E203 W268 C269 Q275R199-K273 VanDerWaalsContact CZ-CE 3.47Å; E203-K273 IonicContact OE2-NZ 3.56Å; E203-K273 PolarHBondContact OE2-NZ 3.24Å; W268-K273 PolarHBondContact O-N 3.14Å; C269-K273 VanDerWaalsContact O-CA 3.27Å; C269-K273 WeakPolarHBondContact O-CA 3.49Å; K273-Q275 PolarHBondContact O-N 3.33Å
274K83.6Confident84.3Confident54 Ų5449.8 Ų49.824%0.23524%0.236CC..  trans-91.7102.5-179.4-60.9-51.4-179.7-170.70110D207 W268 C269 G272 T276D207-K274 WeakPolarHBondContact OD1-CE 3.32Å; D207-K274 IonicContact OD1-NZ 3.62Å; D207-K274 PolarHBondContact OD1-NZ 2.92Å; W268-K274 HydrophobicContact CD2-CB 3.94Å; W268-K274 HydrophobicContact CD2-CG 4.24Å; W268-K274 VanDerWaalsContact CE2-CB 3.43Å; W268-K274 HydrophobicContact CG-CB 4.05Å; W268-K274 HydrophobicContact CZ2-CB 3.99Å; W268-K274 HydrophobicContact CZ2-CG 4.1Å; W268-K274 PolarHBondContact O-N 3.03Å; W268-K274 VanDerWaalsContact O-N 3.09Å; C269-K274 WeakPolarHBondContact CA-O 3.27Å; C269-K274 PolarHBondContact SG-O 3.22Å; G272-K274 WeakPolarHBondContact O-CG 3.32Å; G272-K274 PolarHBondContact O-N 3.04Å; G272-K274 VanDerWaalsContact O-N 3.07Å; K274-T276 PolarHBondContact O-N 2.94Å
275Q84.9Confident83.8Confident117 Ų11753.8 Ų53.855%0.54726%0.258SS..  trans-87.429-179.3-51.4-172.54.700113.3K273 K283 V284 L286K273-Q275 PolarHBondContact O-N 3.33Å; Q275-K283 WeakPolarHBondContact O-CA 3.45Å; Q275-V284 PolarHBondContact O-N 3.38Å; Q275-V284 VanDerWaalsContact O-N 3.09Å; Q275-L286 HydrophobicContact CB-CD1 4.45Å; Q275-L286 HydrophobicContact CG-CD1 3.87Å
276T86.7Confident83.1Confident51 Ų5155.9 Ų55.931%0.31327%0.269SS..BIsolated β-bridgetrans-134.3146.8-176.853.10000109.6W268 K274 E282W268-T276 PolarHBondContact NE1-O 3.46Å; K274-T276 PolarHBondContact O-N 2.94Å; T276-E282 CarbonylContact C-O 3.51Å; T276-E282 WeakPolarHBondContact CA-O 3.4Å
277C86.9Confident82.3Confident1 Ų160.1 Ų60.11%0.00729%0.29CS..  trans-58.5128.8177.1177.20000109.8L254 Y279 C280 K281 E282L254-C277 HydrophobicContact CD1-CB 3.96Å; C277-Y279 PolarHBondContact O-N 3.3Å; C277-Y279 PolarHBondContact SG-N 3.44Å; C277-Y279 VanDerWaalsContact SG-N 3.41Å; C277-C280 VanDerWaalsContact CB-SG 3.52Å; C277-K281 VanDerWaalsContact O-CA 3.24Å; C277-K281 WeakPolarHBondContact O-CA 3.35Å; C277-K281 PolarHBondContact O-N 3.1Å; C277-E282 PolarHBondContact N-O 2.9Å
278P84.6Confident81.6Confident20 Ų2068.1 Ų68.113%0.1332%0.318CS..THydrogen-bonded Turntrans-56-25176.8-22.429.1000113.7V233 F260 I265 W268V233-P278 HydrophobicContact CG2-CB 4.12Å; V233-P278 HydrophobicContact CG2-CG 3.66Å; F260-P278 HydrophobicContact CE1-CB 4.21Å; F260-P278 HydrophobicContact CE1-CG 3.93Å; F260-P278 HydrophobicContact CZ-CB 4.5Å; F260-P278 HydrophobicContact CZ-CG 4.15Å; I265-P278 HydrophobicContact CD1-CG 4.21Å; W268-P278 HydrophobicContact CD2-CB 4.44Å; W268-P278 HydrophobicContact CD2-CG 3.83Å; W268-P278 HydrophobicContact CE3-CG 4.41Å; W268-P278 HydrophobicContact CG-CG 4Å; W268-P278 HydrophobicContact CH2-CB 4.24Å; W268-P278 HydrophobicContact CZ2-CB 4.01Å; W268-P278 HydrophobicContact CZ2-CG 4.11Å
279Y80.2Confident80.7Confident40 Ų4067.7 Ų67.716%0.15732%0.317CS..THydrogen-bonded Turntrans-93.9-66.2-177.6-170.2-92.6000112.7Y216 L226 H258 C277Y216-Y279 WeakPolarHBondContact CE2-O 3.4Å; L226-Y279 HydrophobicContact CB-CE2 4.36Å; H258-Y279 AromaticContact CD2-CD1 3.55Å; H258-Y279 AromaticContact CD2-CG 3.93Å; H258-Y279 AromaticContact CE1-CD1 3.41Å; H258-Y279 VanDerWaalsContact CE1-CD1 3.41Å; H258-Y279 WeakPolarHBondContact CE1-CD1 3.44Å; H258-Y279 AromaticContact CE1-CE1 3.99Å; H258-Y279 AromaticContact NE2-CD1 2.98Å; H258-Y279 WeakPolarHBondContact NE2-CD1 3.39Å; H258-Y279 AromaticContact NE2-CE1 3.27Å; H258-Y279 VanDerWaalsContact NE2-CE1 3.27Å; H258-Y279 WeakPolarHBondContact NE2-CE1 3.3Å; H258-Y279 AromaticContact NE2-CG 3.83Å; C277-Y279 PolarHBondContact O-N 3.3Å; C277-Y279 PolarHBondContact SG-N 3.44Å; C277-Y279 VanDerWaalsContact SG-N 3.41Å
280C81.4Confident79.8Confident51 Ų5168.3 Ų68.335%0.34532%0.319SS..THydrogen-bonded Turntrans-94.9-2.1-173.463.90000114.8C256 C277 E282C256-C280 WeakPolarHBondContact CB-SG 3.5Å; C277-C280 VanDerWaalsContact CB-SG 3.52Å; C280-E282 PolarHBondContact O-N 3.07Å; C280-E282 VanDerWaalsContact SG-CB 3.52Å
281K81.1Confident78.7Confident155 Ų15570.3 Ų70.367%0.67434%0.339SS*.  trans57.111-174.3-61.5-177.8178.2176.40115.8C277C277-K281 VanDerWaalsContact O-CA 3.24Å; C277-K281 WeakPolarHBondContact O-CA 3.35Å; C277-K281 PolarHBondContact O-N 3.1Å
282E86.1Confident77.4Confident93 Ų9372.6 Ų72.644%0.43535%0.35SS..PPolyproline II helixtrans-60.5141.8170-167.7-176.8133.400110S255 C256 T276 C277 C280 V284S255-E282 PolarHBondContact OG-OE1 3.26Å; C256-E282 HydrophobicContact CB-CB 4.13Å; C256-E282 HydrophobicContact CB-CG 4.48Å; C256-E282 WeakPolarHBondContact CB-OE2 3.29Å; T276-E282 CarbonylContact C-O 3.51Å; T276-E282 WeakPolarHBondContact CA-O 3.4Å; C277-E282 PolarHBondContact N-O 2.9Å; C280-E282 PolarHBondContact O-N 3.07Å; C280-E282 VanDerWaalsContact SG-CB 3.52Å; E282-V284 PolarHBondContact O-N 3.01Å
283K85.3Confident75.8Confident172 Ų17276.7 Ų76.775%0.74838%0.377SS*.BIsolated β-bridgetrans-64134.3178.4-72.6-174.8179.3178.90110.2Q275Q275-K283 WeakPolarHBondContact O-CA 3.45Å
284V84.7Confident74.2Confident13 Ų1383.2 Ų83.28%0.07940%0.4CS..PPolyproline II helixtrans-88.8134.1179.4178.40000109.9L254 Q275 E282 L286 M289L254-V284 HydrophobicContact CD1-CG2 3.98Å; L254-V284 HydrophobicContact CD2-CG1 3.71Å; L254-V284 HydrophobicContact CD2-CG2 4.19Å; Q275-V284 PolarHBondContact O-N 3.38Å; Q275-V284 VanDerWaalsContact O-N 3.09Å; E282-V284 PolarHBondContact O-N 3.01Å; V284-L286 PolarHBondContact O-N 3.48Å; V284-M289 HydrophobicContact CG1-CG 4.36Å; V284-M289 HydrophobicContact CG1-SD 3.39Å; V284-M289 WeakPolarHBondContact CG1-SD 3.32Å
285D79.3Confident72.7Confident85 Ų8584.4 Ų84.446%0.45541%0.406SS..  trans-75.993.3171.8-173.20.3000111.1K287 R288 M289D285-K287 PolarHBondContact O-N 3.5Å; D285-K287 WeakPolarHBondContact OD1-CB 3.36Å; D285-K287 PolarHBondContact OD1-N 2.98Å; D285-R288 HydrophobicContact CB-CB 4.46Å; D285-R288 PolarHBondContact O-N 3.43Å; D285-M289 PolarHBondContact O-N 3.19Å
286L72.9Confident71.3Confident44 Ų4484.3 Ų84.323%0.2340%0.404CS..Hα-helixtrans-62.9-26.8179-56.5174.4000112.6C269 Q275 V284 R288 M289 F290C269-L286 HydrophobicContact CB-CD2 4.11Å; Q275-L286 HydrophobicContact CB-CD1 4.45Å; Q275-L286 HydrophobicContact CG-CD1 3.87Å; V284-L286 PolarHBondContact O-N 3.48Å; L286-R288 VanDerWaalsContact C-N 3.33Å; L286-R288 PolarHBondContact O-N 2.94Å; L286-M289 PolarHBondContact O-N 3.27Å; L286-F290 HydrophobicContact CB-CD2 3.94Å; L286-F290 HydrophobicContact CB-CE2 3.86Å; L286-F290 HydrophobicContact CD2-CE2 3.76Å; L286-F290 HydrophobicContact CD2-CZ 4.5Å; L286-F290 HydrophobicContact CG-CE2 4.31Å; L286-F290 WeakPolarHBondContact O-CD2 3.2Å; L286-F290 PolarHBondContact O-N 2.75Å
287K69.8Low69.6Low172 Ų17286.2 Ų86.275%0.74842%0.417SS*.Hα-helixtrans-68.5-35.6-178.8-68.3-179.5-179.8176.80111.6D285D285-K287 PolarHBondContact O-N 3.5Å; D285-K287 WeakPolarHBondContact OD1-CB 3.36Å; D285-K287 PolarHBondContact OD1-N 2.98Å
288R71.5Confident68Low173 Ų17390.6 Ų90.665%0.65344%0.437SS*.Hα-helixtrans-75.6-26.6176.3-171.2179.3174-175-2.4112.7Y252 D285 L286Y252-R288 PolarHBondContact OH-O 3.44Å; D285-R288 HydrophobicContact CB-CB 4.46Å; D285-R288 PolarHBondContact O-N 3.43Å; L286-R288 VanDerWaalsContact C-N 3.33Å; L286-R288 PolarHBondContact O-N 2.94Å
289M69Low66.7Low10 Ų1094.7 Ų94.75%0.04946%0.462CS..Hα-helixtrans-79.1-34.9176.4-75.3-169.971.800113.4Y252 L254 I265 R266 V284 D285 L286Y252-M289 HydrophobicContact CD1-CE 4.33Å; Y252-M289 HydrophobicContact CD1-CG 4.38Å; Y252-M289 HydrophobicContact CE1-CE 4.33Å; Y252-M289 HydrophobicContact CE1-CG 3.5Å; Y252-M289 HydrophobicContact CE1-SD 4.11Å; Y252-M289 HydrophobicContact CE2-CG 4.37Å; Y252-M289 VanDerWaalsContact CZ-CG 3.5Å; Y252-M289 VanDerWaalsContact OH-CG 3.32Å; Y252-M289 WeakPolarHBondContact OH-CG 3.33Å; L254-M289 HydrophobicContact CD2-SD 4.14Å; I265-M289 HydrophobicContact CB-CE 4.33Å; I265-M289 HydrophobicContact CG1-CE 3.83Å; I265-M289 HydrophobicContact CG1-SD 4.44Å; I265-M289 HydrophobicContact CG2-CE 3.72Å; R266-M289 HydrophobicContact CG-CE 4.47Å; V284-M289 HydrophobicContact CG1-CG 4.36Å; V284-M289 HydrophobicContact CG1-SD 3.39Å; V284-M289 WeakPolarHBondContact CG1-SD 3.32Å; D285-M289 PolarHBondContact O-N 3.19Å; L286-M289 PolarHBondContact O-N 3.27Å
290F67Low65.8Low22 Ų2298.8 Ų98.810%0.09648%0.484CS..  trans-112.880.8-175.9-50.4-58.9000109.9C269 I270 L286 N292 E295C269-F290 HydrophobicContact CB-CZ 4.31Å; I270-F290 HydrophobicContact CD1-CD1 4.4Å; I270-F290 HydrophobicContact CD1-CE1 3.51Å; I270-F290 HydrophobicContact CD1-CZ 3.93Å; I270-F290 HydrophobicContact CG1-CE1 3.78Å; I270-F290 HydrophobicContact CG1-CZ 3.64Å; L286-F290 HydrophobicContact CB-CD2 3.94Å; L286-F290 HydrophobicContact CB-CE2 3.86Å; L286-F290 HydrophobicContact CD2-CE2 3.76Å; L286-F290 HydrophobicContact CD2-CZ 4.5Å; L286-F290 HydrophobicContact CG-CE2 4.31Å; L286-F290 WeakPolarHBondContact O-CD2 3.2Å; L286-F290 PolarHBondContact O-N 2.75Å; F290-N292 PolarHBondContact O-N 3.43Å; F290-E295 HydrophobicContact CB-CB 4.47Å
291S55.8Low65.2Low108 Ų10898.6 Ų98.676%0.75548%0.476SS*.  trans-62.7-23.7178.2-48.10000112.4P293S291-P293 WeakPolarHBondContact O-CD 3.38Å
292N55.9Low64.6Low74 Ų7491.8 Ų91.840%0.39645%0.449SS..SBendtrans-91.3116.7-178.9-164.1-10.2000111.3F290 W294 E295F290-N292 PolarHBondContact O-N 3.43Å; N292-W294 PolarHBondContact O-N 2.88Å; N292-W294 PolarHBondContact OD1-N 2.97Å; N292-E295 HydrophobicContact CB-CB 4.46Å; N292-E295 HydrophobicContact CB-CG 4.02Å; N292-E295 PolarHBondContact O-N 3.39Å
293P44.5Very low64.2Low86 Ų8692 Ų9256%0.55845%0.451SS*.G310 helixtrans-55.9-25.4178-25.634.9000114.2S291S291-P293 WeakPolarHBondContact O-CD 3.38Å
294W47Very low63.9Low207 Ų20788 Ų8878%0.78444%0.437SS*.G310 helixtrans-79.5-10.5178.9-55.2106000114.2N292 K296N292-W294 PolarHBondContact O-N 2.88Å; N292-W294 PolarHBondContact OD1-N 2.97Å; W294-K296 VanDerWaalsContact C-N 3.35Å
295E52Low63.5Low79 Ų7987.3 Ų87.337%0.36943%0.433SS..G310 helixtrans-87.1-5.4174.1-74.9-176.9164.300113R266 F290 N292 P297R266-E295 IonicContact NH1-OE1 3.97Å; F290-E295 HydrophobicContact CB-CB 4.47Å; N292-E295 HydrophobicContact CB-CB 4.46Å; N292-E295 HydrophobicContact CB-CG 4.02Å; N292-E295 PolarHBondContact O-N 3.39Å; E295-P297 WeakPolarHBondContact O-CD 3.43Å
296K55.1Low63.6Low115 Ų11586 Ų8650%0.543%0.426SS..SBendtrans-65.1126.4175.2-71.7-179.5-178.9171.40108.5W294 H298W294-K296 VanDerWaalsContact C-N 3.35Å; K296-H298 VanDerWaalsContact C-N 3.3Å; K296-H298 PolarHBondContact O-CD2 3.2Å; K296-H298 PolarHBondContact O-N 3.31Å
297P51.9Low64.2Low91 Ų9192.7 Ų92.759%0.59145%0.448SS*.  trans-60.499.2168.5-1122.7000107.1E295 V299E295-P297 WeakPolarHBondContact O-CD 3.43Å; P297-V299 PolarHBondContact O-N 2.88Å; P297-V299 VanDerWaalsContact O-N 3.13Å
298H54Low65Low93 Ų9385.5 Ų85.543%0.43142%0.418SS..  trans-56.1124.3-174.5-60.1-80.3000108.3K296 M300 Y301 G302K296-H298 VanDerWaalsContact C-N 3.3Å; K296-H298 PolarHBondContact O-CD2 3.2Å; K296-H298 PolarHBondContact O-N 3.31Å; H298-M300 PolarHBondContact O-N 2.96Å; H298-M300 VanDerWaalsContact O-N 3.08Å; H298-Y301 WeakPolarHBondContact O-CB 3.39Å; H298-Y301 PolarHBondContact O-N 3.06Å; H298-G302 PolarHBondContact O-N 3.47Å
299V56.8Low65.9Low106 Ų10678.1 Ų78.164%0.64239%0.39SS*.Hα-helixtrans-51.6-34.8178.1174.50000110.7P297 Y301 G302 Q303P297-V299 PolarHBondContact O-N 2.88Å; P297-V299 VanDerWaalsContact O-N 3.13Å; V299-Y301 PolarHBondContact O-N 3.01Å; V299-G302 WeakPolarHBondContact O-CA 3.41Å; V299-G302 PolarHBondContact O-N 3.18Å; V299-G302 VanDerWaalsContact O-N 3.15Å; V299-Q303 PolarHBondContact O-N 3.35Å
300M59.9Low66.8Low126 Ų12679.8 Ų79.862%0.62140%0.396SS*.Hα-helixtrans-57.3-43.6173.7-62.3-63.7101.400113.1H298 G302 Q303 L304H298-M300 PolarHBondContact O-N 2.96Å; H298-M300 VanDerWaalsContact O-N 3.08Å; M300-G302 VanDerWaalsContact C-N 3.34Å; M300-Q303 PolarHBondContact O-N 2.83Å; M300-L304 WeakPolarHBondContact O-CB 3.42Å; M300-L304 PolarHBondContact O-N 3.22Å
301Y68.9Low67.9Low47 Ų4783.3 Ų83.318%0.18442%0.415CS..Hα-helixtrans-66.4-39.4176.4-173.2-113.6000110.7Y148 H298 V299 Q303 L304 L305Y148-Y301 HydrophobicContact CE2-CE1 4.2Å; H298-Y301 WeakPolarHBondContact O-CB 3.39Å; H298-Y301 PolarHBondContact O-N 3.06Å; V299-Y301 PolarHBondContact O-N 3.01Å; Y301-Q303 PolarHBondContact O-N 3.35Å; Y301-L304 PolarHBondContact O-N 3.32Å; Y301-L305 HydrophobicContact CD1-CD1 3.92Å; Y301-L305 HydrophobicContact CD1-CG 4.45Å; Y301-L305 HydrophobicContact CE1-CD1 3.56Å; Y301-L305 HydrophobicContact CE1-CD2 4.43Å; Y301-L305 HydrophobicContact CE1-CG 4.22Å; Y301-L305 HydrophobicContact CE2-CD2 4.17Å; Y301-L305 HydrophobicContact CE2-CG 4.44Å; Y301-L305 VanDerWaalsContact O-CG 3.23Å; Y301-L305 WeakPolarHBondContact O-CG 3.18Å; Y301-L305 PolarHBondContact O-N 3.44Å; Y301-L305 VanDerWaalsContact O-N 3.07Å
302G70.3Confident69.5Low11 Ų1179 Ų7911%0.11339%0.385CS..Hα-helixtrans-58.3-45.9172.500000113.2H298 V299 M300 L305 D306H298-G302 PolarHBondContact O-N 3.47Å; V299-G302 WeakPolarHBondContact O-CA 3.41Å; V299-G302 PolarHBondContact O-N 3.18Å; V299-G302 VanDerWaalsContact O-N 3.15Å; M300-G302 VanDerWaalsContact C-N 3.34Å; G302-L305 PolarHBondContact O-N 2.82Å; G302-D306 PolarHBondContact O-N 2.8Å; G302-D306 VanDerWaalsContact O-N 3.14Å
303Q76Confident71.2Confident99 Ų9975.5 Ų75.546%0.46337%0.366SS..Hα-helixtrans-66.4-41.8177.7-72175.6-22.600112.3V299 M300 Y301 L305 D306 W307V299-Q303 PolarHBondContact O-N 3.35Å; M300-Q303 PolarHBondContact O-N 2.83Å; Y301-Q303 PolarHBondContact O-N 3.35Å; Q303-L305 VanDerWaalsContact C-N 3.3Å; Q303-L305 PolarHBondContact O-N 3.49Å; Q303-D306 WeakPolarHBondContact O-CB 3.22Å; Q303-D306 PolarHBondContact O-N 3.32Å; Q303-D306 VanDerWaalsContact O-N 3.14Å; Q303-W307 VanDerWaalsContact O-CD1 3.3Å; Q303-W307 PolarHBondContact O-N 3.47Å
304L79Confident73.5Confident86 Ų8672.4 Ų72.445%0.4534%0.343SS..Hα-helixtrans-58.1-43.4176.1178.863.1000111.6L192 M300 Y301 D306 W307 L308L192-L304 HydrophobicContact CD2-CD2 3.99Å; M300-L304 WeakPolarHBondContact O-CB 3.42Å; M300-L304 PolarHBondContact O-N 3.22Å; Y301-L304 PolarHBondContact O-N 3.32Å; L304-D306 VanDerWaalsContact C-N 3.34Å; L304-W307 WeakPolarHBondContact O-CB 3.33Å; L304-W307 PolarHBondContact O-N 3.3Å; L304-L308 PolarHBondContact O-N 2.96Å
305L77.8Confident75.6Confident0 Ų065.9 Ų65.90%032%0.321CS..Hα-helixtrans-66.6-35.1177-65179.4000112.2V196 Y301 G302 Q303 L308 R309V196-L305 HydrophobicContact CB-CD2 4.37Å; V196-L305 HydrophobicContact CG2-CB 3.86Å; V196-L305 HydrophobicContact CG2-CD2 3.29Å; V196-L305 HydrophobicContact CG2-CG 4.03Å; Y301-L305 HydrophobicContact CD1-CD1 3.92Å; Y301-L305 HydrophobicContact CD1-CG 4.45Å; Y301-L305 HydrophobicContact CE1-CD1 3.56Å; Y301-L305 HydrophobicContact CE1-CD2 4.43Å; Y301-L305 HydrophobicContact CE1-CG 4.22Å; Y301-L305 HydrophobicContact CE2-CD2 4.17Å; Y301-L305 HydrophobicContact CE2-CG 4.44Å; Y301-L305 VanDerWaalsContact O-CG 3.23Å; Y301-L305 WeakPolarHBondContact O-CG 3.18Å; Y301-L305 PolarHBondContact O-N 3.44Å; Y301-L305 VanDerWaalsContact O-N 3.07Å; G302-L305 PolarHBondContact O-N 2.82Å; Q303-L305 VanDerWaalsContact C-N 3.3Å; Q303-L305 PolarHBondContact O-N 3.49Å; L305-L308 PolarHBondContact O-N 3.49Å; L305-R309 WeakPolarHBondContact O-CG 3.37Å; L305-R309 PolarHBondContact O-N 2.95Å
306D80.7Confident77.5Confident58 Ų5863.8 Ų63.831%0.3131%0.314SS..Hα-helixtrans-63.5-42.9173-78.716.3000111.7K78 G302 Q303 L304 R309 Y310K78-D306 IonicContact NZ-OD2 2.7Å; K78-D306 PolarHBondContact NZ-OD2 3.11Å; G302-D306 PolarHBondContact O-N 2.8Å; G302-D306 VanDerWaalsContact O-N 3.14Å; Q303-D306 WeakPolarHBondContact O-CB 3.22Å; Q303-D306 PolarHBondContact O-N 3.32Å; Q303-D306 VanDerWaalsContact O-N 3.14Å; L304-D306 VanDerWaalsContact C-N 3.34Å; D306-R309 PolarHBondContact O-N 3.47Å; D306-R309 IonicContact OD1-CZ 3.01Å; D306-R309 IonicContact OD1-NH1 3.39Å; D306-R309 PolarHBondContact OD1-NH1 3.38Å; D306-R309 IonicContact OD1-NH2 3.35Å; D306-Y310 PolarHBondContact O-N 2.9Å
307W85.4Confident79.3Confident184 Ų18461.3 Ų61.370%0.69731%0.309SS*.Hα-helixtrans-61.5-42.1172.8-85.2101.7000112.5Q303 L304 R309 Y310 L311Q303-W307 VanDerWaalsContact O-CD1 3.3Å; Q303-W307 PolarHBondContact O-N 3.47Å; L304-W307 WeakPolarHBondContact O-CB 3.33Å; L304-W307 PolarHBondContact O-N 3.3Å; W307-R309 VanDerWaalsContact C-N 3.32Å; W307-R309 PolarHBondContact O-N 3.06Å; W307-Y310 WeakPolarHBondContact O-CB 3.24Å; W307-Y310 PolarHBondContact O-N 3.38Å; W307-Y310 VanDerWaalsContact O-N 3.17Å; W307-L311 PolarHBondContact O-N 3Å
308L86.9Confident81.2Confident21 Ų2157.3 Ų57.311%0.1128%0.282CS..Hα-helixtrans-62.9-39.4178.2-167.474.5000111.9L192 V196 L304 L305 Y310 L311 V312L192-L308 HydrophobicContact CB-CD2 3.64Å; L192-L308 WeakPolarHBondContact O-CD2 3.5Å; V196-L308 HydrophobicContact CB-CD2 4.42Å; V196-L308 HydrophobicContact CG2-CB 4.17Å; V196-L308 HydrophobicContact CG2-CD2 3.45Å; V196-L308 VanDerWaalsContact CG2-CD2 3.45Å; V196-L308 HydrophobicContact CG2-CG 4.33Å; L304-L308 PolarHBondContact O-N 2.96Å; L305-L308 PolarHBondContact O-N 3.49Å; L308-Y310 VanDerWaalsContact C-N 3.29Å; L308-Y310 PolarHBondContact O-N 3.35Å; L308-L311 PolarHBondContact O-N 3.09Å; L308-V312 HydrophobicContact CD1-CG2 3.96Å; L308-V312 HydrophobicContact CG-CG2 4.02Å; L308-V312 WeakPolarHBondContact O-CB 3.23Å; L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 3.08Å
309R89.3Confident83Confident18 Ų1856 Ų567%0.06828%0.278CS..Hα-helixtrans-60.6-41174.7-70.9-167.1-14989.4-9.2111.7T89 M93 V196 D200 L305 D306 W307 A313T89-R309 HydrophobicContact CG2-CB 3.85Å; T89-R309 HydrophobicContact CG2-CG 4.05Å; M93-R309 HydrophobicContact CG-CG 4.44Å; M93-R309 HydrophobicContact SD-CG 4.28Å; V196-R309 HydrophobicContact CG1-CG 3.62Å; D200-R309 IonicContact OD1-CZ 3.04Å; D200-R309 IonicContact OD1-NE 2.65Å; D200-R309 IonicContact OD1-NH2 3.92Å; D200-R309 PolarHBondContact OD1-NH2 2.84Å; D200-R309 IonicContact OD2-CZ 3.7Å; D200-R309 IonicContact OD2-NE 3.43Å; D200-R309 PolarHBondContact OD2-NE 3.4Å; D200-R309 IonicContact OD2-NH2 2.63Å; L305-R309 WeakPolarHBondContact O-CG 3.37Å; L305-R309 PolarHBondContact O-N 2.95Å; D306-R309 PolarHBondContact O-N 3.47Å; D306-R309 IonicContact OD1-CZ 3.01Å; D306-R309 IonicContact OD1-NH1 3.39Å; D306-R309 PolarHBondContact OD1-NH1 3.38Å; D306-R309 IonicContact OD1-NH2 3.35Å; W307-R309 VanDerWaalsContact C-N 3.32Å; W307-R309 PolarHBondContact O-N 3.06Å; R309-A313 WeakPolarHBondContact O-CA 3.42Å; R309-A313 WeakPolarHBondContact O-CB 3.49Å; R309-A313 PolarHBondContact O-N 3.14Å
310Y89.7Confident84.6Confident45 Ų4552.7 Ų52.718%0.17627%0.265CS..Iπ-helixtrans-62.5-50.3174.9178-96.6000111.5L67 L74 D306 W307 L308 V312 W314 Q315 I318L67-Y310 WeakPolarHBondContact CD2-OH 3.21Å; L74-Y310 HydrophobicContact CD1-CD2 4.21Å; L74-Y310 HydrophobicContact CD1-CE2 4.13Å; D306-Y310 PolarHBondContact O-N 2.9Å; W307-Y310 WeakPolarHBondContact O-CB 3.24Å; W307-Y310 PolarHBondContact O-N 3.38Å; W307-Y310 VanDerWaalsContact O-N 3.17Å; L308-Y310 VanDerWaalsContact C-N 3.29Å; L308-Y310 PolarHBondContact O-N 3.35Å; Y310-V312 PolarHBondContact O-N 3.2Å; Y310-W314 HydrophobicContact CD2-CB 4.02Å; Y310-W314 HydrophobicContact CE2-CB 4.41Å; Y310-W314 CarbonylContact O-C 3.58Å; Y310-W314 WeakPolarHBondContact O-CA 3.46Å; Y310-W314 PolarHBondContact O-N 3.06Å; Y310-Q315 PolarHBondContact O-N 3.19Å; Y310-I318 HydrophobicContact CE2-CD1 3.86Å
311L89.3Confident86.2Confident96 Ų9651.4 Ų51.450%0.50326%0.26SS..Iπ-helixtrans-61.4-46-177.9-168.284.3000112.7W307 L308 Q315W307-L311 PolarHBondContact O-N 3Å; L308-L311 PolarHBondContact O-N 3.09Å; L311-Q315 WeakPolarHBondContact O-CB 2.99Å
312V90.2Very high87.3Confident18 Ų1849.5 Ų49.511%0.10925%0.253CS..Iπ-helixtrans-87.4-37.2-171.91770000112.2M93 V96 P97 F189 Y193 L308 Y310M93-V312 HydrophobicContact CE-CG1 4.41Å; M93-V312 HydrophobicContact SD-CB 3.91Å; M93-V312 HydrophobicContact SD-CG1 3.95Å; V96-V312 WeakPolarHBondContact CG1-O 3.45Å; P97-V312 HydrophobicContact CG-CG1 3.7Å; F189-V312 HydrophobicContact CE2-CG2 4.4Å; Y193-V312 HydrophobicContact CE2-CG1 4.5Å; L308-V312 HydrophobicContact CD1-CG2 3.96Å; L308-V312 HydrophobicContact CG-CG2 4.02Å; L308-V312 WeakPolarHBondContact O-CB 3.23Å; L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 3.08Å; Y310-V312 PolarHBondContact O-N 3.2Å
313A91Very high88.2Confident0 Ų054.2 Ų54.20%027%0.272CS..Iπ-helixtrans-96.5-47.5-173.600000112.7T89 Q92 M93 R309 V317T89-A313 HydrophobicContact CG2-CB 4.43Å; Q92-A313 HydrophobicContact CB-CB 3.82Å; M93-A313 HydrophobicContact CG-CB 3.87Å; M93-A313 HydrophobicContact SD-CB 3.87Å; R309-A313 WeakPolarHBondContact O-CA 3.42Å; R309-A313 WeakPolarHBondContact O-CB 3.49Å; R309-A313 PolarHBondContact O-N 3.14Å; A313-V317 WeakPolarHBondContact O-CG2 3.46Å
314W92.3Very high89Confident21 Ų2151 Ų518%0.0827%0.266CS..Iπ-helixtrans-93.6-37.9-169.4-72.1105.8000113.6L74 W77 Y85 V88 T89 Y310 V317 I318L74-W314 HydrophobicContact CD1-CB 4.09Å; L74-W314 HydrophobicContact CD1-CD2 3.93Å; L74-W314 HydrophobicContact CD1-CE3 4.23Å; L74-W314 HydrophobicContact CD1-CG 3.86Å; L74-W314 HydrophobicContact CD2-CD2 3.56Å; L74-W314 HydrophobicContact CD2-CE3 3.64Å; L74-W314 HydrophobicContact CD2-CG 4.28Å; L74-W314 HydrophobicContact CD2-CH2 3.77Å; L74-W314 HydrophobicContact CD2-CZ2 3.66Å; L74-W314 HydrophobicContact CD2-CZ3 3.74Å; L74-W314 HydrophobicContact CG-CD2 4.42Å; W77-W314 HydrophobicContact CE3-CH2 4.31Å; W77-W314 HydrophobicContact CH2-CH2 4.24Å; W77-W314 AromaticContact CZ3-CH2 3.51Å; W77-W314 HydrophobicContact CZ3-CH2 3.51Å; W77-W314 HydrophobicContact CZ3-CZ2 4Å; W77-W314 HydrophobicContact CZ3-CZ3 4.48Å; Y85-W314 HydrophobicContact CE2-CZ2 4.45Å; V88-W314 HydrophobicContact CG1-CH2 3.9Å; V88-W314 HydrophobicContact CG1-CZ2 4.07Å; T89-W314 PolarHBondContact OG1-NE1 2.89Å; Y310-W314 HydrophobicContact CD2-CB 4.02Å; Y310-W314 HydrophobicContact CE2-CB 4.41Å; Y310-W314 CarbonylContact O-C 3.58Å; Y310-W314 WeakPolarHBondContact O-CA 3.46Å; Y310-W314 PolarHBondContact O-N 3.06Å; W314-V317 WeakPolarHBondContact O-CB 3.48Å; W314-V317 PolarHBondContact O-N 3.12Å; W314-V317 VanDerWaalsContact O-N 3.13Å; W314-I318 HydrophobicContact CB-CD1 4.39Å; W314-I318 VanDerWaalsContact O-CG1 3.29Å; W314-I318 WeakPolarHBondContact O-CG1 3.03Å; W314-I318 PolarHBondContact O-N 3.43Å
315Q91.8Very high89.5Confident69 Ų6949.5 Ų49.532%0.32226%0.258SS..Hα-helixtrans-58.5-44.6-178.6-172.8-172.80.700112.7Y310 L311 V317 I318 I319Y310-Q315 PolarHBondContact O-N 3.19Å; L311-Q315 WeakPolarHBondContact O-CB 2.99Å; Q315-V317 VanDerWaalsContact C-N 3.29Å; Q315-V317 PolarHBondContact O-N 3.19Å; Q315-I318 PolarHBondContact O-N 3.33Å; Q315-I319 HydrophobicContact CG-CD1 3.84Å; Q315-I319 HydrophobicContact CG-CG1 4.38Å; Q315-I319 VanDerWaalsContact O-CG1 3.32Å; Q315-I319 WeakPolarHBondContact O-CG1 3.45Å; Q315-I319 PolarHBondContact O-N 3.43Å
316P92.1Very high90.1Very high36 Ų3650.1 Ų50.123%0.23426%0.262CS..Hα-helixtrans-64.9-33.6177.2-23.336.7000113V96 F100 G320V96-P316 HydrophobicContact CG1-CB 3.99Å; V96-P316 HydrophobicContact CG1-CG 3.88Å; F100-P316 HydrophobicContact CE2-CB 3.65Å; F100-P316 HydrophobicContact CE2-CG 4.13Å; F100-P316 HydrophobicContact CZ-CB 3.99Å; P316-G320 PolarHBondContact O-N 3.31Å
317V91.9Very high90.5Very high63 Ų6355 Ų5538%0.38228%0.277SS..Hα-helixtrans-67.4-43.2175.71770000110.7A313 W314 Q315 G320 L321A313-V317 WeakPolarHBondContact O-CG2 3.46Å; W314-V317 WeakPolarHBondContact O-CB 3.48Å; W314-V317 PolarHBondContact O-N 3.12Å; W314-V317 VanDerWaalsContact O-N 3.13Å; Q315-V317 VanDerWaalsContact C-N 3.29Å; Q315-V317 PolarHBondContact O-N 3.19Å; V317-G320 PolarHBondContact O-N 3.48Å; V317-L321 WeakPolarHBondContact O-CB 3.39Å; V317-L321 PolarHBondContact O-N 2.83Å
318I92.2Very high90.7Very high7 Ų752.9 Ų52.94%0.03628%0.278CS..Hα-helixtrans-66.6-43.1178-62.6162.4000110.6T66 L67 A70 L74 Y310 W314 Q315 L321 V322T66-I318 HydrophobicContact CG2-CG2 4.25Å; L67-I318 HydrophobicContact CD2-CD1 4.47Å; L67-I318 HydrophobicContact CD2-CG2 3.73Å; L67-I318 HydrophobicContact CG-CG2 4.32Å; A70-I318 HydrophobicContact CB-CD1 3.76Å; A70-I318 HydrophobicContact CB-CG1 3.91Å; A70-I318 HydrophobicContact CB-CG2 4.4Å; L74-I318 HydrophobicContact CD1-CD1 4.47Å; Y310-I318 HydrophobicContact CE2-CD1 3.86Å; W314-I318 HydrophobicContact CB-CD1 4.39Å; W314-I318 VanDerWaalsContact O-CG1 3.29Å; W314-I318 WeakPolarHBondContact O-CG1 3.03Å; W314-I318 PolarHBondContact O-N 3.43Å; Q315-I318 PolarHBondContact O-N 3.33Å; I318-L321 WeakPolarHBondContact O-CB 3.44Å; I318-L321 PolarHBondContact O-N 3.44Å; I318-V322 WeakPolarHBondContact O-CG2 3.24Å; I318-V322 PolarHBondContact O-N 3.21Å
319I91.5Very high90.7Very high66 Ų6656.8 Ų56.834%0.33830%0.298SS..Hα-helixtrans-62.8-43.9176.3-68.6170.6000110.6Q315 L321 V322 Q323Q315-I319 HydrophobicContact CG-CD1 3.84Å; Q315-I319 HydrophobicContact CG-CG1 4.38Å; Q315-I319 VanDerWaalsContact O-CG1 3.32Å; Q315-I319 WeakPolarHBondContact O-CG1 3.45Å; Q315-I319 PolarHBondContact O-N 3.43Å; I319-L321 VanDerWaalsContact C-N 3.28Å; I319-L321 PolarHBondContact O-N 2.84Å; I319-V322 PolarHBondContact O-N 3.19Å; I319-V322 VanDerWaalsContact O-N 3.17Å; I319-Q323 HydrophobicContact CG2-CG 4.47Å; I319-Q323 WeakPolarHBondContact O-CG 3.26Å; I319-Q323 PolarHBondContact O-N 3.39Å
320G91.3Very high90.4Very high36 Ų3659 Ų5937%0.37133%0.326SS..Hα-helixtrans-61.5-36.3175.600000112.9P316 V317 G324P316-G320 PolarHBondContact O-N 3.31Å; V317-G320 PolarHBondContact O-N 3.48Å; G320-G324 PolarHBondContact O-N 3.47Å
321L92.8Very high89.7Confident98 Ų9858 Ų5851%0.51332%0.323SS..Hα-helixtrans-64.5-45.8172.6178.266000111.5T66 V317 I318 I319 Q323 G324 I325T66-L321 HydrophobicContact CG2-CD2 4.05Å; V317-L321 WeakPolarHBondContact O-CB 3.39Å; V317-L321 PolarHBondContact O-N 2.83Å; I318-L321 WeakPolarHBondContact O-CB 3.44Å; I318-L321 PolarHBondContact O-N 3.44Å; I319-L321 VanDerWaalsContact C-N 3.28Å; I319-L321 PolarHBondContact O-N 2.84Å; L321-Q323 VanDerWaalsContact C-N 3.35Å; L321-Q323 PolarHBondContact O-N 3.03Å; L321-G324 PolarHBondContact O-N 2.66Å; L321-I325 HydrophobicContact CD1-CD1 4.44Å; L321-I325 HydrophobicContact CG-CD1 4.09Å; L321-I325 WeakPolarHBondContact O-CG1 3.33Å; L321-I325 PolarHBondContact O-N 3.2Å
322V92.3Very high88.3Confident7 Ų761.2 Ų61.24%0.04234%0.336CS..Hα-helixtrans-61.7-43.3177.71710000111.1I62 L63 T66 I318 I319 G324 I325 N326I62-V322 HydrophobicContact CG2-CG1 4.37Å; L63-V322 HydrophobicContact CB-CG1 4.2Å; L63-V322 HydrophobicContact CD1-CB 4.42Å; L63-V322 HydrophobicContact CD1-CG1 4.22Å; L63-V322 HydrophobicContact CD1-CG2 3.95Å; T66-V322 HydrophobicContact CG2-CG2 3.64Å; I318-V322 WeakPolarHBondContact O-CG2 3.24Å; I318-V322 PolarHBondContact O-N 3.21Å; I319-V322 PolarHBondContact O-N 3.19Å; I319-V322 VanDerWaalsContact O-N 3.17Å; V322-G324 VanDerWaalsContact C-N 3.33Å; V322-G324 PolarHBondContact O-N 3.25Å; V322-I325 PolarHBondContact O-N 2.9Å; V322-N326 PolarHBondContact O-N 3.06Å
323Q89.4Confident88.2Confident110 Ų11063.4 Ų63.451%0.51435%0.347SS..Hα-helixtrans-59.2-44.4173.4-73.5176.1-24.100111.4I319 L321 I325 N326 Y327I319-Q323 HydrophobicContact CG2-CG 4.47Å; I319-Q323 WeakPolarHBondContact O-CG 3.26Å; I319-Q323 PolarHBondContact O-N 3.39Å; L321-Q323 VanDerWaalsContact C-N 3.35Å; L321-Q323 PolarHBondContact O-N 3.03Å; Q323-I325 VanDerWaalsContact C-N 3.34Å; Q323-I325 PolarHBondContact O-N 3.31Å; Q323-N326 PolarHBondContact O-N 2.82Å; Q323-Y327 WeakPolarHBondContact O-CB 3.35Å; Q323-Y327 PolarHBondContact O-N 2.86Å
324G91.6Very high88.1Confident33 Ų3366.7 Ų66.734%0.3437%0.366SS..Hα-helixtrans-60.3-40.4174.600000113.4G320 L321 V322 I328G320-G324 PolarHBondContact O-N 3.47Å; L321-G324 PolarHBondContact O-N 2.66Å; V322-G324 VanDerWaalsContact C-N 3.33Å; V322-G324 PolarHBondContact O-N 3.25Å; G324-I328 WeakPolarHBondContact O-CD1 3.3Å; G324-I328 VanDerWaalsContact O-CG1 3.22Å; G324-I328 WeakPolarHBondContact O-CG1 3.16Å; G324-I328 PolarHBondContact O-N 2.92Å; G324-I328 VanDerWaalsContact O-N 3.07Å
325I90.8Very high87.9Confident54 Ų5469.3 Ų69.328%0.27738%0.382SS..Hα-helixtrans-64.5-48175.6-67.6165.4000110.4I62 L321 V322 Q323 Y327 I328 L329I62-I325 HydrophobicContact CG2-CB 4.5Å; I62-I325 HydrophobicContact CG2-CG2 3.88Å; L321-I325 HydrophobicContact CD1-CD1 4.44Å; L321-I325 HydrophobicContact CG-CD1 4.09Å; L321-I325 WeakPolarHBondContact O-CG1 3.33Å; L321-I325 PolarHBondContact O-N 3.2Å; V322-I325 PolarHBondContact O-N 2.9Å; Q323-I325 VanDerWaalsContact C-N 3.34Å; Q323-I325 PolarHBondContact O-N 3.31Å; I325-Y327 VanDerWaalsContact C-N 3.33Å; I325-Y327 PolarHBondContact O-N 3.32Å; I325-I328 PolarHBondContact O-N 3.13Å; I325-L329 HydrophobicContact CG2-CD1 3.77Å; I325-L329 HydrophobicContact CG2-CG 4.39Å; I325-L329 VanDerWaalsContact O-CG 3.32Å; I325-L329 WeakPolarHBondContact O-CG 3.21Å; I325-L329 PolarHBondContact O-N 3.47Å
326N89Confident87.6Confident13 Ų1369.3 Ų69.37%0.0739%0.385CS..Hα-helixtrans-61.6-41.9179.5-70.9-17.6000111.6I62 V322 Q323 I328 L329 G330 L331I62-N326 WeakPolarHBondContact CD1-OD1 3.19Å; V322-N326 PolarHBondContact O-N 3.06Å; Q323-N326 PolarHBondContact O-N 2.82Å; N326-I328 PolarHBondContact O-N 3.4Å; N326-L329 CarbonylContact O-C 3.55Å; N326-L329 PolarHBondContact O-N 2.69Å; N326-G330 PolarHBondContact O-N 3.03Å; N326-L331 HydrophobicContact CB-CB 4.35Å; N326-L331 PolarHBondContact O-N 3.43Å
327Y89.4Confident87.3Confident161 Ų16171.4 Ų71.463%0.63140%0.395SS*.Hα-helixtrans-59.6-45.4174.8179.5-101000112.1Q323 I325 L329 G330 E332Q323-Y327 WeakPolarHBondContact O-CB 3.35Å; Q323-Y327 PolarHBondContact O-N 2.86Å; I325-Y327 VanDerWaalsContact C-N 3.33Å; I325-Y327 PolarHBondContact O-N 3.32Å; Y327-L329 VanDerWaalsContact C-N 3.29Å; Y327-L329 PolarHBondContact O-N 3.05Å; Y327-G330 PolarHBondContact O-N 3.42Å; Y327-G330 VanDerWaalsContact O-N 3.12Å; Y327-E332 WeakPolarHBondContact CD2-OE2 2.93Å
328I90.6Very high87Confident139 Ų13971.9 Ų71.971%0.71340%0.395SS*.Hα-helixtrans-64.3-35.7177.8-69.5165.3000111.5G324 I325 N326 G330G324-I328 WeakPolarHBondContact O-CD1 3.3Å; G324-I328 VanDerWaalsContact O-CG1 3.22Å; G324-I328 WeakPolarHBondContact O-CG1 3.16Å; G324-I328 PolarHBondContact O-N 2.92Å; G324-I328 VanDerWaalsContact O-N 3.07Å; I325-I328 PolarHBondContact O-N 3.13Å; N326-I328 PolarHBondContact O-N 3.4Å; I328-G330 PolarHBondContact O-N 3.13Å
329L86.5Confident86.7Confident103 Ų10376.6 Ų76.654%0.53942%0.421SS..THydrogen-bonded Turntrans-79.7-4.6177.6-65.5174.7000113.2I62 I325 N326 Y327 L331I62-L329 HydrophobicContact CD1-CD1 3.7Å; I325-L329 HydrophobicContact CG2-CD1 3.77Å; I325-L329 HydrophobicContact CG2-CG 4.39Å; I325-L329 VanDerWaalsContact O-CG 3.32Å; I325-L329 WeakPolarHBondContact O-CG 3.21Å; I325-L329 PolarHBondContact O-N 3.47Å; N326-L329 CarbonylContact O-C 3.55Å; N326-L329 PolarHBondContact O-N 2.69Å; Y327-L329 VanDerWaalsContact C-N 3.29Å; Y327-L329 PolarHBondContact O-N 3.05Å; L329-L331 VanDerWaalsContact C-N 3.25Å; L329-L331 HydrophobicContact CB-CD1 3.71Å; L329-L331 HydrophobicContact CB-CG 3.89Å; L329-L331 HydrophobicContact CD1-CD1 3.92Å; L329-L331 HydrophobicContact CG-CD1 4.49Å; L329-L331 PolarHBondContact O-N 2.96Å
330G81.8Confident86.3Confident63 Ų6377.4 Ų77.465%0.64943%0.427SS*.THydrogen-bonded Turntrans67.625.8-177.700000113.4N326 Y327 I328 E332N326-G330 PolarHBondContact O-N 3.03Å; Y327-G330 PolarHBondContact O-N 3.42Å; Y327-G330 VanDerWaalsContact O-N 3.12Å; I328-G330 PolarHBondContact O-N 3.13Å; G330-E332 VanDerWaalsContact C-N 3.33Å
331L75.4Confident85.9Confident24 Ų2480.8 Ų80.813%0.12643%0.432CS..  trans-91.413.4-178.3-67168.7000112.7M55 E58 M59 I62 N326 L329M55-L331 HydrophobicContact CG-CD2 4.17Å; E58-L331 VanDerWaalsContact OE2-CD2 3.27Å; E58-L331 WeakPolarHBondContact OE2-CD2 3.28Å; M59-L331 WeakPolarHBondContact CE-O 3.36Å; M59-L331 HydrophobicContact CG-CB 4.48Å; I62-L331 HydrophobicContact CD1-CD1 3.59Å; N326-L331 HydrophobicContact CB-CB 4.35Å; N326-L331 PolarHBondContact O-N 3.43Å; L329-L331 VanDerWaalsContact C-N 3.25Å; L329-L331 HydrophobicContact CB-CD1 3.71Å; L329-L331 HydrophobicContact CB-CG 3.89Å; L329-L331 HydrophobicContact CD1-CD1 3.92Å; L329-L331 HydrophobicContact CG-CD1 4.49Å; L329-L331 PolarHBondContact O-N 2.96Å
332E61.1Low85.3Confident165 Ų16579.3 Ų79.377%0.77143%0.425SS*.  trans-90.30177.6-83.7-169.116700114Y327 G330Y327-E332 WeakPolarHBondContact CD2-OE2 2.93Å; G330-E332 VanDerWaalsContact C-N 3.33Å

Retrieved 332 of 332 residues in 1825.2 ms (Link to these results)