A0A3Q0KKF1_SCHMA Loading...

(Dihydro)ceramide Synthase (LAG1)

AlphaFold DB , UniProt , Accession A0A3Q0KKF1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 463 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
1M52.6Low55.3Low216 Ų216137.8 Ų137.8100%1.06466%0.655SS**  0-35.60-149.6169.5162.400113.8
2F48.4Very low55.2Low174 Ų174134.5 Ų134.576%0.76364%0.643SS**Hα-helixtrans-71.7-28.5-178.8-117.2-94.2000115.8
3Q51.2Low55Low177 Ų177135.6 Ų135.683%0.82764%0.644SS**Hα-helixtrans-76.4-26.7-179.2-160151.5-10.800113.2S7Q3-S7 PolarHBondContact O-N 3.03Å
4S55.6Low54.8Low71 Ų71129.4 Ų129.450%0.49762%0.62SS.*Hα-helixtrans-69.2-37.1174.4168.20000112.1K6 S7 I8S4-K6 PolarHBondContact O-N 2.62Å; S4-S7 PolarHBondContact O-N 3.13Å; S4-I8 WeakPolarHBondContact O-CG1 3.33Å; S4-I8 PolarHBondContact O-N 3.42Å
5R54.4Low54.5Low172 Ų172129.5 Ų129.565%0.64962%0.616SS**Hα-helixtrans-65-38178.1-87.5-174.4164-168.5-4.1113.3I8 F9R5-I8 PolarHBondContact O-N 2.98Å; R5-F9 WeakPolarHBondContact O-CD2 3.24Å; R5-F9 PolarHBondContact O-N 3.42Å
6K55.8Low53.9Low163 Ų163126.9 Ų126.971%0.70962%0.615SS**Hα-helixtrans-67.6-36.8176.5-72.7-172.6176.9-1760112.3S4 F9 F10S4-K6 PolarHBondContact O-N 2.62Å; K6-F9 PolarHBondContact O-N 2.99Å; K6-F10 WeakPolarHBondContact O-CB 3.42Å; K6-F10 PolarHBondContact O-N 3.44Å
7S57.1Low53.3Low67 Ų67124.2 Ų124.247%0.46961%0.608SS.*Hα-helixtrans-68.9-36.4175.2-156.10000111.9Q3 S4 F10 L11Q3-S7 PolarHBondContact O-N 3.03Å; S4-S7 PolarHBondContact O-N 3.13Å; S7-F10 PolarHBondContact O-N 3.46Å; S7-L11 WeakPolarHBondContact O-CB 3.25Å; S7-L11 WeakPolarHBondContact O-CG 3.42Å; S7-L11 PolarHBondContact O-N 3.03Å
8I61.5Low52.7Low84 Ų84123.3 Ų123.343%0.43161%0.611SS.*Hα-helixtrans-69-40.4174.9-69.8162.6000111.7S4 R5 L11 L12S4-I8 WeakPolarHBondContact O-CG1 3.33Å; S4-I8 PolarHBondContact O-N 3.42Å; R5-I8 PolarHBondContact O-N 2.98Å; I8-L11 PolarHBondContact O-N 2.92Å; I8-L12 HydrophobicContact CG2-CD1 3.7Å; I8-L12 HydrophobicContact CG2-CG 4.41Å; I8-L12 VanDerWaalsContact O-CB 3.23Å; I8-L12 WeakPolarHBondContact O-CB 3.4Å; I8-L12 VanDerWaalsContact O-CG 3.31Å; I8-L12 WeakPolarHBondContact O-CG 3.48Å; I8-L12 PolarHBondContact O-N 3.3Å
9F56.9Low52.2Low152 Ų152123.5 Ų123.567%0.66761%0.613SS**Hα-helixtrans-67.8-37.1173.5-92.5-82.5000112.1R5 K6 F13R5-F9 WeakPolarHBondContact O-CD2 3.24Å; R5-F9 PolarHBondContact O-N 3.42Å; K6-F9 PolarHBondContact O-N 2.99Å; F9-F13 WeakPolarHBondContact O-CB 3.15Å; F9-F13 PolarHBondContact O-N 2.98Å
10F57.3Low51.7Low146 Ų146125.1 Ų125.164%0.6461%0.613SS**Hα-helixtrans-70.2-38.1175.7-159.8-95.6000111.6K6 S7 F13 T14K6-F10 WeakPolarHBondContact O-CB 3.42Å; K6-F10 PolarHBondContact O-N 3.44Å; S7-F10 PolarHBondContact O-N 3.46Å; F10-F13 PolarHBondContact O-N 3.12Å; F10-T14 HydrophobicContact CD1-CG2 4.14Å; F10-T14 HydrophobicContact CE1-CG2 3.93Å; F10-T14 HydrophobicContact CZ-CG2 4.5Å; F10-T14 WeakPolarHBondContact O-CB 3.42Å; F10-T14 WeakPolarHBondContact O-CG2 3.45Å; F10-T14 PolarHBondContact O-N 3.4Å; F10-T14 PolarHBondContact O-OG1 3.33Å
11L57.5Low51.7Low94 Ų94124.9 Ų124.949%0.49262%0.623SS.*Hα-helixtrans-69.1-38.6173-80.7163.1000112.1S7 I8 T14 F15S7-L11 WeakPolarHBondContact O-CB 3.25Å; S7-L11 WeakPolarHBondContact O-CG 3.42Å; S7-L11 PolarHBondContact O-N 3.03Å; I8-L11 PolarHBondContact O-N 2.92Å; L11-T14 VanDerWaalsContact CA-OG1 3.3Å; L11-T14 WeakPolarHBondContact CA-OG1 3.48Å; L11-T14 PolarHBondContact O-OG1 2.96Å; L11-F15 WeakPolarHBondContact O-CA 3.48Å; L11-F15 WeakPolarHBondContact O-CB 3.45Å; L11-F15 PolarHBondContact O-N 3.05Å
12L54.6Low52.2Low98 Ų98121.1 Ų121.151%0.51360%0.602SS.*Hα-helixtrans-69.9-35.7173.2-80.1163.2000111.9I8 C16I8-L12 HydrophobicContact CG2-CD1 3.7Å; I8-L12 HydrophobicContact CG2-CG 4.41Å; I8-L12 VanDerWaalsContact O-CB 3.23Å; I8-L12 WeakPolarHBondContact O-CB 3.4Å; I8-L12 VanDerWaalsContact O-CG 3.31Å; I8-L12 WeakPolarHBondContact O-CG 3.48Å; I8-L12 PolarHBondContact O-N 3.3Å; L12-C16 WeakPolarHBondContact O-CB 3.24Å; L12-C16 PolarHBondContact O-N 3.12Å
13F52.3Low53.9Low149 Ų149115 Ų11565%0.65458%0.581SS**Hα-helixtrans-71-41.1175-160.9-97.8000110.7F9 F10 T17F9-F13 WeakPolarHBondContact O-CB 3.15Å; F9-F13 PolarHBondContact O-N 2.98Å; F10-F13 PolarHBondContact O-N 3.12Å; F13-T17 WeakPolarHBondContact O-CG2 3.34Å; F13-T17 PolarHBondContact O-N 3.09Å; F13-T17 PolarHBondContact O-OG1 3.36Å
14T52.6Low55.8Low49 Ų49110 Ų11030%0.30156%0.563SS.*Hα-helixtrans-71.7-35.7174.845.80000112.9F10 L11 T17 T18F10-T14 HydrophobicContact CD1-CG2 4.14Å; F10-T14 HydrophobicContact CE1-CG2 3.93Å; F10-T14 HydrophobicContact CZ-CG2 4.5Å; F10-T14 WeakPolarHBondContact O-CB 3.42Å; F10-T14 WeakPolarHBondContact O-CG2 3.45Å; F10-T14 PolarHBondContact O-N 3.4Å; F10-T14 PolarHBondContact O-OG1 3.33Å; L11-T14 VanDerWaalsContact CA-OG1 3.3Å; L11-T14 WeakPolarHBondContact CA-OG1 3.48Å; L11-T14 PolarHBondContact O-OG1 2.96Å; T14-T17 VanDerWaalsContact CA-OG1 3.29Å; T14-T17 WeakPolarHBondContact CA-OG1 3.22Å; T14-T17 PolarHBondContact O-N 3.49Å; T14-T17 PolarHBondContact O-OG1 3.44Å; T14-T18 WeakPolarHBondContact O-CB 3.45Å; T14-T18 PolarHBondContact O-N 3.29Å; T14-T18 PolarHBondContact O-OG1 3.32Å
15F49Very low57.4Low130 Ų130107.4 Ų107.457%0.5754%0.544SS*.Hα-helixtrans-69.8-39.1171.4-108.1-101.2000112.5L11 T17 T18 I19L11-F15 WeakPolarHBondContact O-CA 3.48Å; L11-F15 WeakPolarHBondContact O-CB 3.45Å; L11-F15 PolarHBondContact O-N 3.05Å; F15-T17 VanDerWaalsContact C-N 3.28Å; F15-T17 PolarHBondContact O-N 3.02Å; F15-T18 WeakPolarHBondContact CA-OG1 3.48Å; F15-T18 PolarHBondContact O-N 2.77Å; F15-T18 PolarHBondContact O-OG1 3.2Å; F15-I19 HydrophobicContact CD1-CD1 3.98Å; F15-I19 HydrophobicContact CE1-CD1 4.42Å; F15-I19 PolarHBondContact O-N 3.41Å; F15-I19 VanDerWaalsContact O-N 3.09Å
16C46.2Very low59.1Low89 Ų89104.2 Ų104.260%0.60154%0.535SS*.Hα-helixtrans-67.1-29.7173.1-87.30000112L12L12-C16 WeakPolarHBondContact O-CB 3.24Å; L12-C16 PolarHBondContact O-N 3.12Å
17T43.7Very low60.7Low81 Ų8196.5 Ų96.550%0.49750%0.501SS..Hα-helixtrans-80.4-18.3171.853.50000114F13 T14 F15F13-T17 WeakPolarHBondContact O-CG2 3.34Å; F13-T17 PolarHBondContact O-N 3.09Å; F13-T17 PolarHBondContact O-OG1 3.36Å; T14-T17 VanDerWaalsContact CA-OG1 3.29Å; T14-T17 WeakPolarHBondContact CA-OG1 3.22Å; T14-T17 PolarHBondContact O-N 3.49Å; T14-T17 PolarHBondContact O-OG1 3.44Å; F15-T17 VanDerWaalsContact C-N 3.28Å; F15-T17 PolarHBondContact O-N 3.02Å
18T42.7Very low62Low107 Ų10795.9 Ų95.966%0.65650%0.495SS*.Hα-helixtrans-100.5-0.7179.639.80000114.7T14 F15T14-T18 WeakPolarHBondContact O-CB 3.45Å; T14-T18 PolarHBondContact O-N 3.29Å; T14-T18 PolarHBondContact O-OG1 3.32Å; F15-T18 WeakPolarHBondContact CA-OG1 3.48Å; F15-T18 PolarHBondContact O-N 2.77Å; F15-T18 PolarHBondContact O-OG1 3.2Å
19I42.3Very low62.9Low128 Ų12895 Ų9566%0.65649%0.489SS*.  trans-113.428.7165-49.3172.6000110.5F15 C21F15-I19 HydrophobicContact CD1-CD1 3.98Å; F15-I19 HydrophobicContact CE1-CD1 4.42Å; F15-I19 PolarHBondContact O-N 3.41Å; F15-I19 VanDerWaalsContact O-N 3.09Å; I19-C21 VanDerWaalsContact C-N 3.26Å; I19-C21 PolarHBondContact O-N 3.24Å
20Y42.8Very low64.3Low155 Ų15590 Ų9061%0.60847%0.472SS*.  trans-78.787.3151.5-101.6-92.7000106.9Q22Y20-Q22 PolarHBondContact O-N 3.44Å
21C50.5Low65.7Low120 Ų12085.4 Ų85.481%0.81147%0.465SS*.  trans-61.492.3160.9-169.70000105.9I19 S23I19-C21 VanDerWaalsContact C-N 3.26Å; I19-C21 PolarHBondContact O-N 3.24Å; C21-S23 PolarHBondContact O-N 3.41Å
22Q64.1Low67.3Low137 Ų13787 Ų8764%0.6447%0.468SS*.  trans-59.1103.4177.4-82.9-177.8-25.900106.5Y20 T24Y20-Q22 PolarHBondContact O-N 3.44Å; Q22-T24 PolarHBondContact O-N 3.43Å
23S83.5Confident69.1Low45 Ų4588 Ų8832%0.31547%0.469SS..  trans-59.4131.6176.853.80000108.3C21 I36 R41C21-S23 PolarHBondContact O-N 3.41Å; S23-I36 WeakPolarHBondContact O-CB 3.5Å; S23-I36 WeakPolarHBondContact O-CG1 3.45Å; S23-I36 PolarHBondContact O-N 3.4Å; S23-R41 PolarHBondContact OG-NE 2.86Å; S23-R41 PolarHBondContact OG-NH2 2.88Å
24T90.6Very high71Confident74 Ų7483 Ų8345%0.45445%0.447SS..EExtended strand (participates in β ladder)trans-114.7152179.165.20000110.2Q22 H33 Y34Q22-T24 PolarHBondContact O-N 3.43Å; T24-H33 PolarHBondContact OG1-ND1 3.35Å; T24-H33 VanDerWaalsContact OG1-ND1 3.07Å; T24-Y34 CarbonylContact C-O 3.57Å; T24-Y34 WeakPolarHBondContact CA-O 3.32Å; T24-Y34 WeakPolarHBondContact CB-O 3.46Å
25I89.7Confident72.9Confident16 Ų1684.5 Ų84.58%0.08246%0.457CS..EExtended strand (participates in β ladder)trans-111.9132171.9-170.3177.6000109.1H33 Y34 I36 K197 I203I25-H33 WeakPolarHBondContact O-CA 3.44Å; I25-Y34 PolarHBondContact N-O 3.05Å; I25-Y34 PolarHBondContact O-N 3.08Å; I25-I36 HydrophobicContact CB-CD1 4.25Å; I25-I36 HydrophobicContact CB-CG1 4.04Å; I25-I36 HydrophobicContact CG2-CG1 4.17Å; I25-K197 HydrophobicContact CD1-CB 4.36Å; I25-I203 HydrophobicContact CB-CD1 4.31Å; I25-I203 HydrophobicContact CD1-CD1 3.56Å; I25-I203 HydrophobicContact CD1-CG1 4.2Å; I25-I203 HydrophobicContact CG1-CD1 3.72Å; I25-I203 HydrophobicContact CG1-CG1 4.44Å; I25-I203 HydrophobicContact CG2-CD1 3.77Å; I25-I203 HydrophobicContact CG2-CG1 3.52Å
26F90.5Very high75Confident105 Ų10579 Ų7946%0.46143%0.434SS..EExtended strand (participates in β ladder)trans-83.1129.5177.2177.2-107.8000110.3P28 H33F26-P28 HydrophobicContact CD1-CB 4.48Å; F26-P28 HydrophobicContact CE1-CB 4.01Å; F26-P28 WeakPolarHBondContact O-CD 3.49Å; F26-H33 AromaticContact CD2-CD2 3.75Å; F26-H33 AromaticContact CD2-NE2 3.47Å; F26-H33 WeakPolarHBondContact CD2-NE2 3.46Å
27D88.8Confident77.2Confident0 Ų076.8 Ų76.80%042%0.419CS..EExtended strand (participates in β ladder)trans-98.5110.8171.8179.436.5000111.1E29 T30 G31 K32 Y34 I203 R258D27-E29 PolarHBondContact O-N 3.32Å; D27-E29 PolarHBondContact OD1-N 3.03Å; D27-T30 PolarHBondContact O-N 3.22Å; D27-T30 VanDerWaalsContact OD2-CB 3.29Å; D27-T30 WeakPolarHBondContact OD2-CB 3.45Å; D27-T30 WeakPolarHBondContact OD2-CG2 3.31Å; D27-T30 PolarHBondContact OD2-N 3.41Å; D27-T30 PolarHBondContact OD2-OG1 2.95Å; D27-G31 WeakPolarHBondContact O-CA 3.21Å; D27-G31 PolarHBondContact O-N 3.3Å; D27-K32 PolarHBondContact N-O 3.46Å; D27-Y34 HydrophobicContact CB-CD2 3.94Å; D27-Y34 HydrophobicContact CB-CE2 3.55Å; D27-I203 HydrophobicContact CB-CD1 4.09Å; D27-I203 HydrophobicContact CB-CG2 3.8Å; D27-R258 IonicContact OD1-CZ 3.29Å; D27-R258 IonicContact OD1-NH2 3.18Å; D27-R258 PolarHBondContact OD1-NH2 3.18Å
28P84Confident79.4Confident54 Ų5477.5 Ų77.535%0.35142%0.42SS..THydrogen-bonded Turntrans-70.7-16-179.127-32.2000113.7F26 N193F26-P28 HydrophobicContact CD1-CB 4.48Å; F26-P28 HydrophobicContact CE1-CB 4.01Å; F26-P28 WeakPolarHBondContact O-CD 3.49Å; P28-N193 HydrophobicContact CB-CB 4.31Å; P28-N193 HydrophobicContact CG-CB 3.61Å
29E81.7Confident81.7Confident65 Ų6577.2 Ų77.230%0.30441%0.41SS..THydrogen-bonded Turntrans-77.6-43.4176.9-67.9-174.4-178.900112D27 H260 R261D27-E29 PolarHBondContact O-N 3.32Å; D27-E29 PolarHBondContact OD1-N 3.03Å; E29-H260 IonicContact OE1-CE1 2.76Å; E29-H260 IonicContact OE1-NE2 3.51Å; E29-H260 PolarHBondContact OE1-NE2 3.48Å; E29-H260 IonicContact OE2-CE1 3.02Å; E29-H260 IonicContact OE2-NE2 2.8Å; E29-H260 PolarHBondContact OE2-NE2 3.44Å; E29-R261 VanDerWaalsContact OE1-CD 3.25Å; E29-R261 WeakPolarHBondContact OE1-CD 3.43Å
30T84.9Confident84.1Confident49 Ų4971.2 Ų71.230%0.30138%0.379SS..THydrogen-bonded Turntrans-98.6-12.4-179.362.40000114.3D27 K32 Y34 P206D27-T30 PolarHBondContact O-N 3.22Å; D27-T30 VanDerWaalsContact OD2-CB 3.29Å; D27-T30 WeakPolarHBondContact OD2-CB 3.45Å; D27-T30 WeakPolarHBondContact OD2-CG2 3.31Å; D27-T30 PolarHBondContact OD2-N 3.41Å; D27-T30 PolarHBondContact OD2-OG1 2.95Å; T30-K32 PolarHBondContact O-N 3.35Å; T30-Y34 PolarHBondContact OG1-OH 2.98Å; T30-P206 HydrophobicContact CG2-CB 4.41Å; T30-P206 HydrophobicContact CG2-CG 4.05Å
31G87.6Confident86.3Confident48 Ų4866.4 Ų66.450%0.49536%0.36SS..THydrogen-bonded Turntrans70.216.2-17500000114.1D27D27-G31 WeakPolarHBondContact O-CA 3.21Å; D27-G31 PolarHBondContact O-N 3.3Å
32K91.6Very high88.2Confident128 Ų12866.2 Ų66.256%0.55735%0.349SS*.EExtended strand (participates in β ladder)trans-108.4155-174.8-66.2179.9-179.2-179.70111.7D27 T30 Y34D27-K32 PolarHBondContact N-O 3.46Å; T30-K32 PolarHBondContact O-N 3.35Å; K32-Y34 HydrophobicContact CB-CE2 4Å
33H92.4Very high89.4Confident118 Ų11863.6 Ų63.655%0.54634%0.337SS..EExtended strand (participates in β ladder)trans-96.7136.4168.9-77.3-103.7000110.2T24 I25 F26T24-H33 PolarHBondContact OG1-ND1 3.35Å; T24-H33 VanDerWaalsContact OG1-ND1 3.07Å; I25-H33 WeakPolarHBondContact O-CA 3.44Å; F26-H33 AromaticContact CD2-CD2 3.75Å; F26-H33 AromaticContact CD2-NE2 3.47Å; F26-H33 WeakPolarHBondContact CD2-NE2 3.46Å
34Y92.3Very high89.7Confident46 Ų4661.5 Ų61.518%0.1832%0.322CS..EExtended strand (participates in β ladder)trans-117.9142.9176.3-62.7-80.7000110.4T24 I25 D27 T30 K32 I203 P204T24-Y34 CarbonylContact C-O 3.57Å; T24-Y34 WeakPolarHBondContact CA-O 3.32Å; T24-Y34 WeakPolarHBondContact CB-O 3.46Å; I25-Y34 PolarHBondContact N-O 3.05Å; I25-Y34 PolarHBondContact O-N 3.08Å; D27-Y34 HydrophobicContact CB-CD2 3.94Å; D27-Y34 HydrophobicContact CB-CE2 3.55Å; T30-Y34 PolarHBondContact OG1-OH 2.98Å; K32-Y34 HydrophobicContact CB-CE2 4Å; Y34-I203 HydrophobicContact CD2-CB 4.41Å; Y34-I203 HydrophobicContact CD2-CG1 4.08Å; Y34-I203 HydrophobicContact CD2-CG2 4.01Å; Y34-I203 HydrophobicContact CE2-CG2 4Å; Y34-P204 VanDerWaalsContact CD1-CD 3.49Å; Y34-P204 HydrophobicContact CD1-CG 3.86Å; Y34-P204 VanDerWaalsContact CE1-CD 3.45Å; Y34-P204 HydrophobicContact CE1-CG 3.34Å; Y34-P204 HydrophobicContact CE2-CG 4.34Å
35P92.8Very high89.6Confident79 Ų7962.8 Ų62.851%0.51333%0.325SS..EExtended strand (participates in β ladder)trans-67.7136.1176.228.9-33.9000110.4
36I92.5Very high89.4Confident16 Ų1666.4 Ų66.48%0.08235%0.35CS..PPolyproline II helixtrans-79.9126.4173.3-60.2177000108.5S23 I25 R41 I198 D202S23-I36 WeakPolarHBondContact O-CB 3.5Å; S23-I36 WeakPolarHBondContact O-CG1 3.45Å; S23-I36 PolarHBondContact O-N 3.4Å; I25-I36 HydrophobicContact CB-CD1 4.25Å; I25-I36 HydrophobicContact CB-CG1 4.04Å; I25-I36 HydrophobicContact CG2-CG1 4.17Å; I36-R41 HydrophobicContact CG2-CG 3.64Å; I36-R41 PolarHBondContact O-NH2 3.08Å; I36-R41 VanDerWaalsContact O-NH2 3.17Å; I36-I198 HydrophobicContact CD1-CG2 4.37Å; I36-I198 WeakPolarHBondContact CD1-O 3.43Å; I36-I198 HydrophobicContact CG2-CG2 3.8Å; I36-D202 WeakPolarHBondContact CA-OD2 3.33Å
37S91.8Very high89.1Confident42 Ų4262.1 Ų62.129%0.29433%0.331SS..PPolyproline II helixtrans-71.4149.1178.870.40000111.7F39 S40 R41 D202S37-F39 PolarHBondContact O-N 3.05Å; S37-S40 PolarHBondContact O-N 3.36Å; S37-S40 VanDerWaalsContact O-N 3.14Å; S37-S40 WeakPolarHBondContact OG-CB 3.26Å; S37-S40 PolarHBondContact OG-N 3.16Å; S37-S40 PolarHBondContact OG-OG 3.1Å; S37-S40 VanDerWaalsContact OG-OG 3.1Å; S37-R41 WeakPolarHBondContact O-CG 3.35Å; S37-R41 PolarHBondContact O-N 3.35Å; S37-D202 WeakPolarHBondContact CB-OD1 3.49Å; S37-D202 PolarHBondContact N-OD2 2.99Å; S37-D202 PolarHBondContact OG-OD1 3.38Å; S37-D202 PolarHBondContact OG-OD2 3.29Å
38D90.8Very high88.9Confident96 Ų9665.1 Ų65.151%0.51335%0.347SS..Hα-helixtrans-60.4-32.4177.4-69.6-37.2000112.1R41 I42D38-R41 PolarHBondContact O-N 2.95Å; D38-R41 IonicContact OD1-CZ 3.86Å; D38-R41 IonicContact OD1-NH1 2.71Å; D38-R41 PolarHBondContact OD1-NH1 3.39Å; D38-I42 WeakPolarHBondContact O-CG1 3.49Å; D38-I42 PolarHBondContact O-N 3.41Å
39F90.7Very high88.7Confident101 Ų10165.2 Ų65.244%0.44334%0.344SS..Hα-helixtrans-61-50173.9-174.4-115.4000111.7S37 R41 I42 E43S37-F39 PolarHBondContact O-N 3.05Å; F39-R41 VanDerWaalsContact C-N 3.31Å; F39-R41 PolarHBondContact O-N 3.36Å; F39-I42 PolarHBondContact O-N 3.34Å; F39-E43 HydrophobicContact CD2-CG 3.87Å; F39-E43 HydrophobicContact CE1-CG 4.37Å; F39-E43 HydrophobicContact CE2-CG 3.55Å; F39-E43 HydrophobicContact CG-CG 4.39Å; F39-E43 HydrophobicContact CZ-CG 3.83Å; F39-E43 WeakPolarHBondContact O-CB 3.42Å; F39-E43 WeakPolarHBondContact O-CG 3.36Å; F39-E43 PolarHBondContact O-N 3.09Å
40S91.4Very high88.6Confident1 Ų167.2 Ų67.21%0.00736%0.363CS..Hα-helixtrans-64.7-33.9177.3-66.80000112.4S37 I42 D44 R106 D202S37-S40 PolarHBondContact O-N 3.36Å; S37-S40 VanDerWaalsContact O-N 3.14Å; S37-S40 WeakPolarHBondContact OG-CB 3.26Å; S37-S40 PolarHBondContact OG-N 3.16Å; S37-S40 PolarHBondContact OG-OG 3.1Å; S37-S40 VanDerWaalsContact OG-OG 3.1Å; S40-I42 PolarHBondContact O-N 3.28Å; S40-D44 WeakPolarHBondContact CB-OD2 3.44Å; S40-D44 WeakPolarHBondContact O-CB 3.31Å; S40-D44 VanDerWaalsContact O-CG 3.22Å; S40-D44 PolarHBondContact O-N 2.84Å; S40-R106 PolarHBondContact OG-NH2 3.32Å; S40-R106 VanDerWaalsContact OG-NH2 3.14Å; S40-D202 WeakPolarHBondContact CB-OD2 3.29Å; S40-D202 VanDerWaalsContact OG-CG 3.28Å; S40-D202 PolarHBondContact OG-OD1 3.02Å; S40-D202 PolarHBondContact OG-OD2 3.5Å
41R90Very high88.4Confident55 Ų5572 Ų7221%0.20839%0.386CS..Hα-helixtrans-61.3-31.3174.4-68.5179.2-167.9154.6-0.7113.2S23 I36 S37 D38 F39 I45 I198S23-R41 PolarHBondContact OG-NE 2.86Å; S23-R41 PolarHBondContact OG-NH2 2.88Å; I36-R41 HydrophobicContact CG2-CG 3.64Å; I36-R41 PolarHBondContact O-NH2 3.08Å; I36-R41 VanDerWaalsContact O-NH2 3.17Å; S37-R41 WeakPolarHBondContact O-CG 3.35Å; S37-R41 PolarHBondContact O-N 3.35Å; D38-R41 PolarHBondContact O-N 2.95Å; D38-R41 IonicContact OD1-CZ 3.86Å; D38-R41 IonicContact OD1-NH1 2.71Å; D38-R41 PolarHBondContact OD1-NH1 3.39Å; F39-R41 VanDerWaalsContact C-N 3.31Å; F39-R41 PolarHBondContact O-N 3.36Å; R41-I45 WeakPolarHBondContact O-CD1 3.39Å; R41-I45 VanDerWaalsContact O-CG1 3.31Å; R41-I45 WeakPolarHBondContact O-CG1 3.39Å; R41-I198 HydrophobicContact CG-CG2 4.46Å
42I89.9Confident88.3Confident116 Ų11670.6 Ų70.660%0.59537%0.369SS*.Hα-helixtrans-90-50.2-179-63.8167.5000110D38 F39 S40D38-I42 WeakPolarHBondContact O-CG1 3.49Å; D38-I42 PolarHBondContact O-N 3.41Å; F39-I42 PolarHBondContact O-N 3.34Å; S40-I42 PolarHBondContact O-N 3.28Å
43E90.7Very high88Confident82 Ų8268.6 Ų68.638%0.38336%0.364SS..Hα-helixtrans-82.6-21.5-168.3-64.8-67142.600113.9F39 P46 F47F39-E43 HydrophobicContact CD2-CG 3.87Å; F39-E43 HydrophobicContact CE1-CG 4.37Å; F39-E43 HydrophobicContact CE2-CG 3.55Å; F39-E43 HydrophobicContact CG-CG 4.39Å; F39-E43 HydrophobicContact CZ-CG 3.83Å; F39-E43 WeakPolarHBondContact O-CB 3.42Å; F39-E43 WeakPolarHBondContact O-CG 3.36Å; F39-E43 PolarHBondContact O-N 3.09Å; E43-P46 WeakPolarHBondContact O-CD 3.23Å; E43-F47 WeakPolarHBondContact O-CD2 3.28Å; E43-F47 WeakPolarHBondContact O-CE2 3.38Å
44D89.7Confident87.8Confident0 Ų067.2 Ų67.20%037%0.366CS..SBendtrans-81.3-27.9-178.9-66.1-15.1000112.9S40 P46 F47 L48 R106 F196 G199S40-D44 WeakPolarHBondContact CB-OD2 3.44Å; S40-D44 WeakPolarHBondContact O-CB 3.31Å; S40-D44 VanDerWaalsContact O-CG 3.22Å; S40-D44 PolarHBondContact O-N 2.84Å; D44-P46 VanDerWaalsContact C-CD 3.47Å; D44-F47 PolarHBondContact O-N 3.17Å; D44-L48 PolarHBondContact O-N 2.92Å; D44-R106 IonicContact OD1-CZ 3.95Å; D44-R106 IonicContact OD1-NE 2.74Å; D44-R106 PolarHBondContact OD1-NE 3.31Å; D44-R106 IonicContact OD1-NH2 3.06Å; D44-R106 PolarHBondContact OD1-NH2 2.71Å; D44-R106 IonicContact OD2-NH2 3.24Å; D44-F196 HydrophobicContact CB-CE1 4.41Å; D44-F196 HydrophobicContact CB-CZ 4.38Å; D44-G199 PolarHBondContact OD2-N 2.98Å
45I88.2Confident87.6Confident101 Ų10174.3 Ų74.352%0.51840%0.398SS..G310 helixtrans-53.1-47.1-173.2-65.9174.1000112.8R41 F47 L48 I198R41-I45 WeakPolarHBondContact O-CD1 3.39Å; R41-I45 VanDerWaalsContact O-CG1 3.31Å; R41-I45 WeakPolarHBondContact O-CG1 3.39Å; I45-F47 PolarHBondContact O-N 3.42Å; I45-L48 PolarHBondContact O-N 3.38Å; I45-I198 HydrophobicContact CG1-CD1 4.36Å
46P85.5Confident87.3Confident93 Ų9376.4 Ų76.460%0.60440%0.399SS*.G310 helixtrans-62.6-18.1-179.2-22.434.8000114E43 D44E43-P46 WeakPolarHBondContact O-CD 3.23Å; D44-P46 VanDerWaalsContact C-CD 3.47Å
47F84.3Confident87.1Confident15 Ų1576.4 Ų76.47%0.06640%0.398CS..G310 helixtrans-100-12-174.8-55.5-60.7000113.5E43 D44 I45 L49 S102 F103 R106 F196 R342E43-F47 WeakPolarHBondContact O-CD2 3.28Å; E43-F47 WeakPolarHBondContact O-CE2 3.38Å; D44-F47 PolarHBondContact O-N 3.17Å; I45-F47 PolarHBondContact O-N 3.42Å; F47-L49 PolarHBondContact O-N 3.28Å; F47-S102 WeakPolarHBondContact CZ-O 3.47Å; F47-F103 HydrophobicContact CB-CD2 4.08Å; F47-F103 HydrophobicContact CB-CE2 4.38Å; F47-F103 HydrophobicContact CD1-CB 3.97Å; F47-F103 AromaticContact CD1-CD2 3.69Å; F47-F103 HydrophobicContact CD1-CD2 3.69Å; F47-F103 HydrophobicContact CD1-CG 4.33Å; F47-F103 HydrophobicContact CE1-CB 3.87Å; F47-F103 HydrophobicContact CE1-CD2 4.27Å; F47-F103 AromaticContact CG-CD2 3.83Å; F47-F103 HydrophobicContact CG-CD2 3.83Å; F47-R106 HydrophobicContact CD2-CB 4.19Å; F47-R106 HydrophobicContact CD2-CG 3.94Å; F47-R106 HydrophobicContact CE2-CB 3.56Å; F47-R106 HydrophobicContact CE2-CG 3.69Å; F47-R106 HydrophobicContact CZ-CB 3.91Å; F47-F196 HydrophobicContact CB-CE1 3.91Å; F47-F196 HydrophobicContact CB-CZ 4.25Å; F47-R342 PolarHBondContact O-NH1 2.9Å
48L83.6Confident87.1Confident63 Ų6377 Ų7733%0.3340%0.4SS..PPolyproline II helixtrans-65.9121.5175.7-63.1170.9000109.8D44 I45 F196 I198D44-L48 PolarHBondContact O-N 2.92Å; I45-L48 PolarHBondContact O-N 3.38Å; L48-F196 HydrophobicContact CD2-CD1 3.99Å; L48-F196 HydrophobicContact CD2-CE1 4.13Å; L48-I198 HydrophobicContact CD1-CD1 3.84Å; L48-I198 HydrophobicContact CD1-CG1 3.55Å; L48-I198 HydrophobicContact CD2-CG1 4.19Å; L48-I198 HydrophobicContact CG-CG1 4.36Å
49L79.7Confident87.1Confident55 Ų5576.4 Ų76.429%0.28840%0.402SS..PPolyproline II helixtrans-79.3146.8165.1-66.5-175.9000109.5F47 F97 E340F47-L49 PolarHBondContact O-N 3.28Å; L49-F97 HydrophobicContact CD1-CD1 4.26Å; L49-F97 HydrophobicContact CD1-CE1 3.79Å; L49-E340 HydrophobicContact CD1-CB 4.07Å; L49-E340 VanDerWaalsContact CD1-OE2 3.26Å; L49-E340 WeakPolarHBondContact CD1-OE2 3.04Å; L49-E340 HydrophobicContact CG-CB 4.13Å; L49-E340 VanDerWaalsContact CG-OE2 3.25Å; L49-E340 WeakPolarHBondContact CG-OE2 3.29Å
50P79.8Confident87.1Confident108 Ų10879.4 Ų79.470%0.70142%0.417SS*.PPolyproline II helixtrans-58.4160.1166.128.1-34.5000109.6
51D82.1Confident87.2Confident148 Ų14883.5 Ų83.579%0.79144%0.435SS*.SBendtrans-52.1149.2172-76.4-42.8000110.9D53D51-D53 PolarHBondContact O-N 3.23Å
52P83.9Confident87.2Confident20 Ų2081.7 Ų81.713%0.1343%0.43CS..PPolyproline II helixtrans-50.3128.8-179.3-25.632.4000111.3P54 Y57 L62 R339P52-P54 WeakPolarHBondContact O-CD 3.42Å; P52-Y57 HydrophobicContact CB-CD2 4.3Å; P52-L62 HydrophobicContact CB-CD1 4.07Å; P52-L62 HydrophobicContact CG-CD1 4.05Å; P52-R339 HydrophobicContact CG-CG 3.82Å
53D86Confident87.3Confident85 Ų8581 Ų8146%0.45543%0.427SS..  trans-52.2114.6178.7174.33.6000109.8D51 K55 K56 Y57D51-D53 PolarHBondContact O-N 3.23Å; D53-K55 PolarHBondContact O-N 3.11Å; D53-K55 VanDerWaalsContact O-N 3.12Å; D53-K55 WeakPolarHBondContact OD1-CB 3.42Å; D53-K55 PolarHBondContact OD1-N 3.11Å; D53-K56 HydrophobicContact CB-CB 4.26Å; D53-K56 PolarHBondContact O-N 3.1Å; D53-Y57 PolarHBondContact O-N 3.34Å
54P88Confident87.4Confident90 Ų9079.8 Ų79.858%0.58443%0.428SS*.THydrogen-bonded Turntrans-64-21.4-173.925.1-34.4000112.6P52P52-P54 WeakPolarHBondContact O-CD 3.42Å
55K88.9Confident87.6Confident194 Ų19480.5 Ų80.584%0.84343%0.432SS*.THydrogen-bonded Turntrans-71.4-35.2173.9-66.2-176.9178.7179.50112.1D53D53-K55 PolarHBondContact O-N 3.11Å; D53-K55 VanDerWaalsContact O-N 3.12Å; D53-K55 WeakPolarHBondContact OD1-CB 3.42Å; D53-K55 PolarHBondContact OD1-N 3.11Å
56K86.3Confident87.8Confident123 Ų12377.1 Ų77.154%0.53541%0.414SS..THydrogen-bonded Turntrans-93-34.7-177.2-170.1171.4-179.7171.50112.5D53D53-K56 HydrophobicContact CB-CB 4.26Å; D53-K56 PolarHBondContact O-N 3.1Å
57Y88Confident88.1Confident17 Ų1780.1 Ų80.17%0.06742%0.418CS..SBendtrans-13276.5-178.7-55.8-71.4000110P52 D53 F61 L62 K96 V337P52-Y57 HydrophobicContact CB-CD2 4.3Å; D53-Y57 PolarHBondContact O-N 3.34Å; Y57-F61 HydrophobicContact CD1-CD1 4.34Å; Y57-F61 HydrophobicContact CD1-CE1 4.09Å; Y57-L62 HydrophobicContact CD1-CD2 4.5Å; Y57-K96 PolarHBondContact OH-NZ 3.37Å; Y57-V337 HydrophobicContact CD1-CG2 4.12Å; Y57-V337 HydrophobicContact CE1-CG2 3.45Å; Y57-V337 VanDerWaalsContact CE1-CG2 3.45Å
58P91.7Very high88.5Confident53 Ų5383 Ų8334%0.34443%0.431SS..  trans-54.2142.7175.5-2533.6000111.2E60 F61 L62P58-E60 PolarHBondContact O-N 3.06Å; P58-E60 VanDerWaalsContact O-N 3.15Å; P58-F61 HydrophobicContact CB-CB 4.32Å; P58-F61 WeakPolarHBondContact O-CA 3.34Å; P58-F61 WeakPolarHBondContact O-CB 3.39Å; P58-F61 PolarHBondContact O-N 3.19Å; P58-L62 PolarHBondContact O-N 2.99Å
59P90Very high88.8Confident85 Ų8580 Ų8055%0.55242%0.416SS*.Hα-helixtrans-54.4-35.6178.6-28.135.1000113.5L62 N63P59-L62 PolarHBondContact O-N 2.84Å; P59-N63 WeakPolarHBondContact O-CB 3.05Å; P59-N63 PolarHBondContact O-N 3.32Å; P59-N63 PolarHBondContact O-ND2 3.44Å
60E92.2Very high89.4Confident164 Ų16481.7 Ų81.777%0.76643%0.425SS*.Hα-helixtrans-62.9-41.2175.2-64.9179.6-17600112.5P58 N63 S64P58-E60 PolarHBondContact O-N 3.06Å; P58-E60 VanDerWaalsContact O-N 3.15Å; E60-N63 PolarHBondContact O-N 2.75Å; E60-S64 WeakPolarHBondContact O-CB 3.41Å; E60-S64 PolarHBondContact O-N 3.25Å
61F92.7Very high90Very high87 Ų8779.2 Ų79.238%0.38241%0.406SS..Hα-helixtrans-64.5-47.1175.7172.3-103.5000111Y57 P58 N63 S64 L65Y57-F61 HydrophobicContact CD1-CD1 4.34Å; Y57-F61 HydrophobicContact CD1-CE1 4.09Å; P58-F61 HydrophobicContact CB-CB 4.32Å; P58-F61 WeakPolarHBondContact O-CA 3.34Å; P58-F61 WeakPolarHBondContact O-CB 3.39Å; P58-F61 PolarHBondContact O-N 3.19Å; F61-N63 VanDerWaalsContact C-N 3.35Å; F61-N63 PolarHBondContact O-N 2.76Å; F61-S64 WeakPolarHBondContact O-CB 3.28Å; F61-S64 PolarHBondContact O-N 2.87Å; F61-S64 VanDerWaalsContact O-N 3.17Å; F61-L65 HydrophobicContact CD1-CD1 4.16Å; F61-L65 HydrophobicContact CE1-CD1 3.51Å; F61-L65 HydrophobicContact CE1-CG 4.15Å; F61-L65 HydrophobicContact CE2-CD1 4.48Å; F61-L65 HydrophobicContact CE2-CD2 4.39Å; F61-L65 HydrophobicContact CE2-CG 4.34Å; F61-L65 HydrophobicContact CZ-CD1 3.7Å; F61-L65 HydrophobicContact CZ-CD2 4.18Å; F61-L65 HydrophobicContact CZ-CG 4.02Å; F61-L65 PolarHBondContact O-N 3.25Å
62L91.2Very high90.4Very high17 Ų1777.4 Ų77.49%0.08940%0.402CS..Hα-helixtrans-61.7-42.4176.9-66.3177.9000111.9P52 Y57 P58 P59 S64 L65 L66 V337P52-L62 HydrophobicContact CB-CD1 4.07Å; P52-L62 HydrophobicContact CG-CD1 4.05Å; Y57-L62 HydrophobicContact CD1-CD2 4.5Å; P58-L62 PolarHBondContact O-N 2.99Å; P59-L62 PolarHBondContact O-N 2.84Å; L62-S64 VanDerWaalsContact C-N 3.31Å; L62-S64 PolarHBondContact O-N 2.94Å; L62-L65 WeakPolarHBondContact O-CB 3.43Å; L62-L65 PolarHBondContact O-N 2.94Å; L62-L66 WeakPolarHBondContact O-CG 3.19Å; L62-L66 PolarHBondContact O-N 3.09Å; L62-V337 HydrophobicContact CD2-CG1 3.72Å
63N91.6Very high90.7Very high100 Ų10080 Ų8054%0.53541%0.414SS..Hα-helixtrans-65.5-34.8175.6-74.2-25.3000112.2P59 E60 F61 L66 K67P59-N63 WeakPolarHBondContact O-CB 3.05Å; P59-N63 PolarHBondContact O-N 3.32Å; P59-N63 PolarHBondContact O-ND2 3.44Å; E60-N63 PolarHBondContact O-N 2.75Å; F61-N63 VanDerWaalsContact C-N 3.35Å; F61-N63 PolarHBondContact O-N 2.76Å; N63-L66 PolarHBondContact O-N 2.77Å; N63-K67 PolarHBondContact O-N 3.38Å
64S92.9Very high91.1Very high57 Ų5776.4 Ų76.440%0.39940%0.395SS..Hα-helixtrans-63.5-45.3172.5-168.40000111.3E60 F61 L62 L66 K67E60-S64 WeakPolarHBondContact O-CB 3.41Å; E60-S64 PolarHBondContact O-N 3.25Å; F61-S64 WeakPolarHBondContact O-CB 3.28Å; F61-S64 PolarHBondContact O-N 2.87Å; F61-S64 VanDerWaalsContact O-N 3.17Å; L62-S64 VanDerWaalsContact C-N 3.31Å; L62-S64 PolarHBondContact O-N 2.94Å; S64-L66 VanDerWaalsContact C-N 3.3Å; S64-L66 PolarHBondContact O-N 3.45Å; S64-K67 WeakPolarHBondContact O-CB 3.28Å; S64-K67 PolarHBondContact O-N 3.42Å; S64-K67 VanDerWaalsContact O-N 3.1Å
65L92.9Very high91.5Very high16 Ų1675.2 Ų75.28%0.08439%0.388CS..Hα-helixtrans-58.4-40175.1-71-178.8000112.5F61 L62 K67 H68 Y333 I334 V337F61-L65 HydrophobicContact CD1-CD1 4.16Å; F61-L65 HydrophobicContact CE1-CD1 3.51Å; F61-L65 HydrophobicContact CE1-CG 4.15Å; F61-L65 HydrophobicContact CE2-CD1 4.48Å; F61-L65 HydrophobicContact CE2-CD2 4.39Å; F61-L65 HydrophobicContact CE2-CG 4.34Å; F61-L65 HydrophobicContact CZ-CD1 3.7Å; F61-L65 HydrophobicContact CZ-CD2 4.18Å; F61-L65 HydrophobicContact CZ-CG 4.02Å; F61-L65 PolarHBondContact O-N 3.25Å; L62-L65 WeakPolarHBondContact O-CB 3.43Å; L62-L65 PolarHBondContact O-N 2.94Å; L65-K67 PolarHBondContact O-N 3.31Å; L65-H68 WeakPolarHBondContact O-CB 3.48Å; L65-H68 PolarHBondContact O-N 3.07Å; L65-H68 VanDerWaalsContact O-N 3.09Å; L65-Y333 HydrophobicContact CD1-CE1 4.44Å; L65-I334 HydrophobicContact CB-CB 4.21Å; L65-I334 HydrophobicContact CD2-CG2 4.44Å; L65-V337 HydrophobicContact CD1-CG1 3.63Å
66L92.2Very high91.8Very high29 Ų2969.9 Ų69.915%0.15236%0.364CS..Hα-helixtrans-65.3-22.2179.1-70.7176.2000113.5L62 N63 S64 H68 C69 R192L62-L66 WeakPolarHBondContact O-CG 3.19Å; L62-L66 PolarHBondContact O-N 3.09Å; N63-L66 PolarHBondContact O-N 2.77Å; S64-L66 VanDerWaalsContact C-N 3.3Å; S64-L66 PolarHBondContact O-N 3.45Å; L66-H68 PolarHBondContact O-N 2.92Å; L66-C69 WeakPolarHBondContact O-CB 3.37Å; L66-C69 PolarHBondContact O-N 3.46Å; L66-C69 PolarHBondContact O-SG 2.92Å; L66-R192 HydrophobicContact CD2-CG 4.48Å
67K92.1Very high92.3Very high157 Ų15770.9 Ų70.968%0.68337%0.373SS*.Hα-helixtrans-64.4-31.2173.8-65.2177.8-179.4177.80111.9N63 S64 L65 C69 N70N63-K67 PolarHBondContact O-N 3.38Å; S64-K67 WeakPolarHBondContact O-CB 3.28Å; S64-K67 PolarHBondContact O-N 3.42Å; S64-K67 VanDerWaalsContact O-N 3.1Å; L65-K67 PolarHBondContact O-N 3.31Å; K67-C69 PolarHBondContact O-N 2.95Å; K67-N70 PolarHBondContact O-N 3.18Å
68H92.6Very high92.7Very high75 Ų7573.3 Ų73.335%0.34739%0.385SS..G310 helixtrans-68.9-8.6177-68.4-78000113.7L65 L66 N70 D71 L188 I334L65-H68 WeakPolarHBondContact O-CB 3.48Å; L65-H68 PolarHBondContact O-N 3.07Å; L65-H68 VanDerWaalsContact O-N 3.09Å; L66-H68 PolarHBondContact O-N 2.92Å; H68-N70 PolarHBondContact O-N 2.82Å; H68-N70 VanDerWaalsContact O-N 3.14Å; H68-D71 WeakPolarHBondContact CB-OD2 3.28Å; H68-D71 IonicContact CE1-OD2 3.17Å; H68-D71 IonicContact CG-OD2 2.71Å; H68-D71 IonicContact ND1-OD1 3.42Å; H68-D71 IonicContact ND1-OD2 2.71Å; H68-D71 PolarHBondContact ND1-OD2 2.93Å; H68-D71 VanDerWaalsContact O-CB 3.29Å; H68-D71 WeakPolarHBondContact O-CB 3.44Å; H68-D71 VanDerWaalsContact O-CG 3.32Å; H68-D71 PolarHBondContact O-N 2.81Å; H68-L188 WeakPolarHBondContact O-CD1 3.42Å; H68-I334 HydrophobicContact CB-CD1 4.39Å
69C91.1Very high92.9Very high0 Ų070.9 Ų70.90%037%0.369CS..G310 helixtrans-64.3-18.1175.9-610000113.1L66 K67 L188 C189 I334L66-C69 WeakPolarHBondContact O-CB 3.37Å; L66-C69 PolarHBondContact O-N 3.46Å; L66-C69 PolarHBondContact O-SG 2.92Å; K67-C69 PolarHBondContact O-N 2.95Å; C69-L188 HydrophobicContact CB-CB 4.42Å; C69-C189 HydrophobicContact CB-CB 4.48Å; C69-C189 WeakPolarHBondContact CB-SG 3.48Å; C69-C189 PolarHBondContact O-SG 3.24Å; C69-I334 HydrophobicContact CB-CD1 4.35Å; C69-I334 WeakPolarHBondContact SG-CD1 3.21Å
70N90.9Very high93.2Very high90 Ų9071.9 Ų71.948%0.48137%0.365SS..G310 helixtrans-99.46.4177.4-62.1-28.5000112.9K67 H68 Y186K67-N70 PolarHBondContact O-N 3.18Å; H68-N70 PolarHBondContact O-N 2.82Å; H68-N70 VanDerWaalsContact O-N 3.14Å; N70-Y186 HydrophobicContact CB-CD1 4.37Å; N70-Y186 HydrophobicContact CB-CE1 4.42Å
71D92.1Very high93.4Very high56 Ų5667.1 Ų67.130%0.29935%0.35SS..PPolyproline II helixtrans-61.5148.7179.3-75.7-3.2000111H68 L188H68-D71 WeakPolarHBondContact CB-OD2 3.28Å; H68-D71 IonicContact CE1-OD2 3.17Å; H68-D71 IonicContact CG-OD2 2.71Å; H68-D71 IonicContact ND1-OD1 3.42Å; H68-D71 IonicContact ND1-OD2 2.71Å; H68-D71 PolarHBondContact ND1-OD2 2.93Å; H68-D71 VanDerWaalsContact O-CB 3.29Å; H68-D71 WeakPolarHBondContact O-CB 3.44Å; H68-D71 VanDerWaalsContact O-CG 3.32Å; H68-D71 PolarHBondContact O-N 2.81Å; D71-L188 HydrophobicContact CB-CD1 4.23Å
72P91.3Very high93.6Very high111 Ų11165.7 Ų65.772%0.72134%0.344SS*.PPolyproline II helixtrans-63.7168.4174.929.3-35.7000111.5
73M91.2Very high93.8Very high75 Ų7565 Ų6537%0.36934%0.341SS..PPolyproline II helixtrans-57.9133.7177.5-169.1171.671.300110.8Y318 L319 L322 K323M73-Y318 HydrophobicContact CE-CE1 3.6Å; M73-Y318 HydrophobicContact CE-CE2 4.42Å; M73-Y318 WeakPolarHBondContact CE-OH 3.48Å; M73-L319 HydrophobicContact SD-CD2 4.08Å; M73-L322 HydrophobicContact CE-CD1 3.91Å; M73-L322 HydrophobicContact CG-CB 3.62Å; M73-L322 HydrophobicContact CG-CD1 4.23Å; M73-L322 HydrophobicContact SD-CB 3.76Å; M73-L322 HydrophobicContact SD-CD1 4.08Å; M73-K323 HydrophobicContact SD-CG 4.32Å
74P94.5Very high93.9Very high9 Ų968.4 Ų68.46%0.05835%0.346CS..PPolyproline II helixtrans-76170.9-174.136.1-42.8000112.1E78 L322 Y326P74-E78 WeakPolarHBondContact CA-OE2 3.38Å; P74-E78 HydrophobicContact CB-CB 4.01Å; P74-E78 HydrophobicContact CB-CG 3.93Å; P74-E78 WeakPolarHBondContact CB-OE2 3.42Å; P74-L322 WeakPolarHBondContact CD-O 3.25Å; P74-L322 HydrophobicContact CG-CB 4.41Å; P74-L322 HydrophobicContact CG-CD2 4.14Å; P74-Y326 HydrophobicContact CB-CD1 4.18Å; P74-Y326 HydrophobicContact CB-CD2 4.27Å; P74-Y326 HydrophobicContact CB-CE1 3.82Å; P74-Y326 HydrophobicContact CB-CE2 3.93Å; P74-Y326 HydrophobicContact CB-CG 4.39Å; P74-Y326 HydrophobicContact CG-CD1 3.46Å; P74-Y326 VanDerWaalsContact CG-CD1 3.46Å; P74-Y326 HydrophobicContact CG-CD2 3.79Å; P74-Y326 HydrophobicContact CG-CE1 3.63Å; P74-Y326 HydrophobicContact CG-CE2 3.96Å; P74-Y326 HydrophobicContact CG-CG 3.54Å
75S95.8Very high94Very high64 Ų6468.2 Ų68.245%0.44834%0.34SS..PPolyproline II helixtrans-79.6165159.670.50000111.4I77 E78 L79S75-I77 VanDerWaalsContact C-N 3.29Å; S75-I77 PolarHBondContact O-N 3.07Å; S75-E78 PolarHBondContact O-N 3.2Å; S75-E78 PolarHBondContact OG-N 2.97Å; S75-L79 PolarHBondContact O-N 2.84Å
76Y95.7Very high94Very high83 Ų8367.4 Ų67.433%0.32534%0.336SS..Hα-helixtrans-61-37.4172.2-77.8-81.2000113E78 L79 F80 L317 Y318 P321 L322Y76-E78 VanDerWaalsContact C-N 3.27Å; Y76-E78 PolarHBondContact O-N 3.29Å; Y76-L79 HydrophobicContact CD1-CD2 4.23Å; Y76-L79 WeakPolarHBondContact O-CB 3.48Å; Y76-L79 PolarHBondContact O-N 3.06Å; Y76-F80 HydrophobicContact CD1-CE2 4.22Å; Y76-F80 WeakPolarHBondContact O-CD2 3.15Å; Y76-F80 PolarHBondContact O-N 3.05Å; Y76-L317 PolarHBondContact OH-O 2.91Å; Y76-Y318 HydrophobicContact CE2-CD2 4.05Å; Y76-Y318 HydrophobicContact CE2-CE2 4.47Å; Y76-Y318 WeakPolarHBondContact OH-CA 3.47Å; Y76-P321 HydrophobicContact CE1-CB 4.29Å; Y76-P321 HydrophobicContact CE1-CG 3.93Å; Y76-L322 HydrophobicContact CD1-CD2 4.18Å; Y76-L322 HydrophobicContact CD2-CD2 4.49Å; Y76-L322 HydrophobicContact CE1-CD2 4.33Å; Y76-L322 HydrophobicContact CG-CD2 4.27Å
77I96.5Very high94.1Very high143 Ų14367.5 Ų67.573%0.73334%0.335SS*.Hα-helixtrans-60.1-44.5178.1-62.8171.5000109.5S75 S81S75-I77 VanDerWaalsContact C-N 3.29Å; S75-I77 PolarHBondContact O-N 3.07Å; I77-S81 VanDerWaalsContact O-CB 3.25Å; I77-S81 WeakPolarHBondContact O-CB 3.5Å; I77-S81 PolarHBondContact O-N 3.38Å
78E95.6Very high94Very high69 Ų6966.7 Ų66.732%0.32233%0.332SS..Hα-helixtrans-66.2-45.1175.8-178.4174.6-164.700111.8P74 S75 Y76 F80 S81 K82 Y326P74-E78 WeakPolarHBondContact CA-OE2 3.38Å; P74-E78 HydrophobicContact CB-CB 4.01Å; P74-E78 HydrophobicContact CB-CG 3.93Å; P74-E78 WeakPolarHBondContact CB-OE2 3.42Å; S75-E78 PolarHBondContact O-N 3.2Å; S75-E78 PolarHBondContact OG-N 2.97Å; Y76-E78 VanDerWaalsContact C-N 3.27Å; Y76-E78 PolarHBondContact O-N 3.29Å; E78-F80 PolarHBondContact O-N 2.94Å; E78-S81 PolarHBondContact O-N 3.42Å; E78-K82 HydrophobicContact CG-CG 3.84Å; E78-K82 VanDerWaalsContact O-CB 3.3Å; E78-K82 WeakPolarHBondContact O-CB 3.43Å; E78-K82 VanDerWaalsContact O-CG 3.24Å; E78-K82 WeakPolarHBondContact O-CG 3.27Å; E78-K82 PolarHBondContact O-N 3.43Å; E78-Y326 HydrophobicContact CG-CE2 4.27Å; E78-Y326 PolarHBondContact OE1-OH 3.37Å; E78-Y326 VanDerWaalsContact OE1-OH 3.1Å
79L96.3Very high93.8Very high1 Ų166.6 Ų66.61%0.00533%0.331CS..Hα-helixtrans-51.3-53.7174.1165.465.5000111.4S75 Y76 A83 P321 L322 L325 Y326S75-L79 PolarHBondContact O-N 2.84Å; Y76-L79 HydrophobicContact CD1-CD2 4.23Å; Y76-L79 WeakPolarHBondContact O-CB 3.48Å; Y76-L79 PolarHBondContact O-N 3.06Å; L79-A83 WeakPolarHBondContact O-CB 3.44Å; L79-A83 PolarHBondContact O-N 2.89Å; L79-P321 HydrophobicContact CD2-CB 3.69Å; L79-L322 HydrophobicContact CB-CD2 4.32Å; L79-L322 HydrophobicContact CD2-CD2 4.18Å; L79-L325 HydrophobicContact CD1-CB 4.25Å; L79-Y326 HydrophobicContact CB-CD2 4.26Å; L79-Y326 HydrophobicContact CD1-CD2 3.88Å; L79-Y326 HydrophobicContact CD1-CG 4.36Å
80F96.2Very high93.6Very high106 Ų10666.9 Ų66.947%0.46533%0.333SS..Hα-helixtrans-65.7-42.7-177.9-71.4-63000112.1Y76 E78 W84 W352Y76-F80 HydrophobicContact CD1-CE2 4.22Å; Y76-F80 WeakPolarHBondContact O-CD2 3.15Å; Y76-F80 PolarHBondContact O-N 3.05Å; E78-F80 PolarHBondContact O-N 2.94Å; F80-W84 VanDerWaalsContact O-CB 3.27Å; F80-W84 WeakPolarHBondContact O-CB 3.42Å; F80-W84 PolarHBondContact O-N 3.35Å; F80-W352 AromaticContact CD1-CH2 3.88Å; F80-W352 HydrophobicContact CD1-CH2 3.88Å; F80-W352 HydrophobicContact CD1-CZ3 4.47Å; F80-W352 AromaticContact CE1-CH2 3.59Å; F80-W352 HydrophobicContact CE1-CH2 3.59Å; F80-W352 AromaticContact CE1-CZ3 3.79Å; F80-W352 HydrophobicContact CE1-CZ3 3.79Å
81S96.9Very high93.3Very high65 Ų6563.1 Ų63.146%0.45532%0.315SS..Hα-helixtrans-62-50178.2179.10000112I77 E78 W84 I85I77-S81 VanDerWaalsContact O-CB 3.25Å; I77-S81 WeakPolarHBondContact O-CB 3.5Å; I77-S81 PolarHBondContact O-N 3.38Å; E78-S81 PolarHBondContact O-N 3.42Å; S81-W84 PolarHBondContact O-N 2.95Å; S81-I85 WeakPolarHBondContact O-CG1 3.1Å; S81-I85 PolarHBondContact O-N 3.04Å; S81-I85 VanDerWaalsContact O-N 3.1Å
82K95.7Very high92.9Very high57 Ų5766.2 Ų66.225%0.24833%0.331CS..Hα-helixtrans-70.3-38.1-179.8-63.6-57.2-167.9174.70112.5E78 W84 I85 A86 Y326 W330E78-K82 HydrophobicContact CG-CG 3.84Å; E78-K82 VanDerWaalsContact O-CB 3.3Å; E78-K82 WeakPolarHBondContact O-CB 3.43Å; E78-K82 VanDerWaalsContact O-CG 3.24Å; E78-K82 WeakPolarHBondContact O-CG 3.27Å; E78-K82 PolarHBondContact O-N 3.43Å; K82-W84 VanDerWaalsContact C-N 3.33Å; K82-I85 HydrophobicContact CD-CD1 4.35Å; K82-I85 PolarHBondContact O-N 3.11Å; K82-A86 PolarHBondContact O-N 3.34Å; K82-Y326 HydrophobicContact CB-CE2 3.82Å; K82-Y326 HydrophobicContact CG-CE2 3.94Å; K82-W330 HydrophobicContact CB-CB 3.94Å; K82-W330 HydrophobicContact CB-CD2 3.76Å; K82-W330 HydrophobicContact CB-CE3 3.71Å; K82-W330 HydrophobicContact CB-CG 3.87Å; K82-W330 HydrophobicContact CB-CZ3 4.49Å; K82-W330 HydrophobicContact CD-CD2 3.81Å; K82-W330 HydrophobicContact CD-CE3 3.78Å; K82-W330 HydrophobicContact CD-CH2 3.87Å; K82-W330 HydrophobicContact CD-CZ2 3.88Å; K82-W330 HydrophobicContact CD-CZ3 3.81Å; K82-W330 HydrophobicContact CG-CD2 3.94Å; K82-W330 HydrophobicContact CG-CE3 4.14Å; K82-W330 HydrophobicContact CG-CG 4.18Å
83A95.3Very high92.4Very high3 Ų363.1 Ų63.13%0.02531%0.308CS..Hα-helixtrans-61.6-44.2173.400000110.8L79 I85 A86 F87 W352L79-A83 WeakPolarHBondContact O-CB 3.44Å; L79-A83 PolarHBondContact O-N 2.89Å; A83-I85 PolarHBondContact O-N 2.93Å; A83-A86 PolarHBondContact O-N 3.04Å; A83-F87 HydrophobicContact CB-CD2 4.46Å; A83-F87 HydrophobicContact CB-CE2 4.49Å; A83-F87 WeakPolarHBondContact O-CD2 3.38Å; A83-F87 PolarHBondContact O-N 3.49Å; A83-W352 HydrophobicContact CB-CZ2 4.07Å
84W95.3Very high91.4Very high171 Ų17161.8 Ų61.865%0.64831%0.314SS*.Hα-helixtrans-58.8-43.4176.1-179.4-110.1000112.8F80 S81 K82 F87 K88F80-W84 VanDerWaalsContact O-CB 3.27Å; F80-W84 WeakPolarHBondContact O-CB 3.42Å; F80-W84 PolarHBondContact O-N 3.35Å; S81-W84 PolarHBondContact O-N 2.95Å; K82-W84 VanDerWaalsContact C-N 3.33Å; W84-F87 PolarHBondContact O-N 2.89Å; W84-K88 WeakPolarHBondContact O-CB 3.24Å; W84-K88 PolarHBondContact O-N 3.27Å
85I93.8Very high90.4Very high52 Ų5266.7 Ų66.727%0.26735%0.348SS..Hα-helixtrans-59.3-49.9174-66.7165.1000110.5S81 K82 A83 F87 K88 E89 W330 Y333S81-I85 WeakPolarHBondContact O-CG1 3.1Å; S81-I85 PolarHBondContact O-N 3.04Å; S81-I85 VanDerWaalsContact O-N 3.1Å; K82-I85 HydrophobicContact CD-CD1 4.35Å; K82-I85 PolarHBondContact O-N 3.11Å; A83-I85 PolarHBondContact O-N 2.93Å; I85-F87 PolarHBondContact O-N 3.31Å; I85-K88 PolarHBondContact O-N 3.06Å; I85-E89 PolarHBondContact O-N 3.45Å; I85-W330 HydrophobicContact CG2-CZ3 4.25Å; I85-Y333 HydrophobicContact CG2-CE2 4.43Å
86A93.5Very high89.1Confident0 Ų065.9 Ų65.90%034%0.336CS..Hα-helixtrans-60.8-43-179.900000112K82 A83 M90 S329 Y333 F344K82-A86 PolarHBondContact O-N 3.34Å; A83-A86 PolarHBondContact O-N 3.04Å; A86-M90 WeakPolarHBondContact O-CA 3.34Å; A86-M90 VanDerWaalsContact O-CB 3.27Å; A86-M90 WeakPolarHBondContact O-CB 3.36Å; A86-M90 PolarHBondContact O-N 3.41Å; A86-S329 WeakPolarHBondContact CB-O 3.48Å; A86-Y333 HydrophobicContact CB-CD2 4.48Å; A86-F344 HydrophobicContact CB-CE2 4.27Å; A86-F344 HydrophobicContact CB-CZ 3.69Å
87F92.9Very high88Confident31 Ų3162.2 Ų62.214%0.13632%0.322CS..Iπ-helixtrans-62-45.5174.2-83-69000112.5A83 W84 I85 G91 L92 F344 L345 N348 W352A83-F87 HydrophobicContact CB-CD2 4.46Å; A83-F87 HydrophobicContact CB-CE2 4.49Å; A83-F87 WeakPolarHBondContact O-CD2 3.38Å; A83-F87 PolarHBondContact O-N 3.49Å; W84-F87 PolarHBondContact O-N 2.89Å; I85-F87 PolarHBondContact O-N 3.31Å; F87-G91 CarbonylContact O-C 3.37Å; F87-G91 VanDerWaalsContact O-CA 3.25Å; F87-G91 WeakPolarHBondContact O-CA 3.34Å; F87-G91 PolarHBondContact O-N 3.17Å; F87-L92 PolarHBondContact O-N 3.44Å; F87-F344 HydrophobicContact CD1-CE1 4.03Å; F87-F344 HydrophobicContact CE1-CE1 4.35Å; F87-F344 HydrophobicContact CG-CE1 4.45Å; F87-L345 HydrophobicContact CD1-CD1 3.85Å; F87-L345 HydrophobicContact CE1-CD1 3.96Å; F87-N348 HydrophobicContact CE1-CB 3.97Å; F87-N348 HydrophobicContact CZ-CB 3.71Å; F87-W352 AromaticContact CE2-CD1 3.9Å; F87-W352 AromaticContact CE2-NE1 3.44Å; F87-W352 AromaticContact CZ-CD1 3.59Å; F87-W352 AromaticContact CZ-NE1 3.61Å
88K90.8Very high86.6Confident140 Ų14058.1 Ų58.161%0.60931%0.305SS*.Iπ-helixtrans-63.4-44179.6-173.6-178.8178.4-175.70112W84 I85W84-K88 WeakPolarHBondContact O-CB 3.24Å; W84-K88 PolarHBondContact O-N 3.27Å; I85-K88 PolarHBondContact O-N 3.06Å
89E87.9Confident85.3Confident73 Ų7359.4 Ų59.434%0.34131%0.314SS..Iπ-helixtrans-86.5-35.1-173-69.2-160.6-157.200114.5I85 N93 Y333I85-E89 PolarHBondContact O-N 3.45Å; E89-N93 WeakPolarHBondContact O-CB 3.05Å; E89-Y333 HydrophobicContact CB-CE2 4Å; E89-Y333 HydrophobicContact CG-CE2 4.41Å; E89-Y333 WeakPolarHBondContact OE2-CE2 3.21Å; E89-Y333 PolarHBondContact OE2-OH 2.84Å
90M87.5Confident84.2Confident6 Ų661.1 Ų61.13%0.0333%0.326CS..Iπ-helixtrans-106-36.1-176.6-51.3-176.493.200113.2A86 F97 Y333 L336 N341 F344A86-M90 WeakPolarHBondContact O-CA 3.34Å; A86-M90 VanDerWaalsContact O-CB 3.27Å; A86-M90 WeakPolarHBondContact O-CB 3.36Å; A86-M90 PolarHBondContact O-N 3.41Å; M90-F97 HydrophobicContact CB-CE2 4.43Å; M90-F97 VanDerWaalsContact O-CD2 3.23Å; M90-F97 WeakPolarHBondContact O-CD2 3.48Å; M90-Y333 HydrophobicContact CG-CD2 3.94Å; M90-Y333 WeakPolarHBondContact SD-CA 3.41Å; M90-Y333 HydrophobicContact SD-CD2 3.89Å; M90-Y333 HydrophobicContact SD-CG 4.32Å; M90-L336 HydrophobicContact CE-CB 4.04Å; M90-N341 HydrophobicContact CE-CB 3.85Å; M90-N341 WeakPolarHBondContact CE-ND2 3.42Å; M90-F344 HydrophobicContact CB-CD1 3.93Å; M90-F344 HydrophobicContact CB-CE1 4.13Å; M90-F344 HydrophobicContact CB-CG 4.28Å; M90-F344 HydrophobicContact SD-CD2 4.3Å; M90-F344 HydrophobicContact SD-CE2 4.26Å
91G83.8Confident83.6Confident10 Ų1063.9 Ų63.910%0.10334%0.338CS..Iπ-helixtrans-88.1-46.7-173.500000114.1F87F87-G91 CarbonylContact O-C 3.37Å; F87-G91 VanDerWaalsContact O-CA 3.25Å; F87-G91 WeakPolarHBondContact O-CA 3.34Å; F87-G91 PolarHBondContact O-N 3.17Å
92L83.9Confident83Confident122 Ų12264.2 Ų64.264%0.63934%0.34SS*.SBendtrans-93.3-3.1-174.4-62.5177.7000113.3F87 G94F87-L92 PolarHBondContact O-N 3.44Å; L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.37Å; L92-G94 VanDerWaalsContact O-N 3.09Å
93N80.9Confident82.5Confident46 Ų4662 Ų6225%0.24633%0.331CS..  trans-86.971.3176.6-165.9-8.5000111.5E89 S95 K96 F97E89-N93 WeakPolarHBondContact O-CB 3.05Å; N93-S95 PolarHBondContact O-N 3.2Å; N93-S95 VanDerWaalsContact O-N 3.09Å; N93-S95 PolarHBondContact OD1-OG 2.81Å; N93-K96 PolarHBondContact O-N 2.87Å; N93-F97 PolarHBondContact O-N 3.21Å
94G71.4Confident82Confident47 Ų4765.1 Ų65.149%0.48535%0.349SS..THydrogen-bonded Turntrans-59.7-20.2-178.300000114.6L92 P98L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.37Å; L92-G94 VanDerWaalsContact O-N 3.09Å; G94-P98 WeakPolarHBondContact O-CA 3.24Å
95S72.2Confident81.8Confident111 Ų11165.4 Ų65.478%0.77635%0.35SS*.THydrogen-bonded Turntrans-70.3-33.9175.273.20000113N93N93-S95 PolarHBondContact O-N 3.2Å; N93-S95 VanDerWaalsContact O-N 3.09Å; N93-S95 PolarHBondContact OD1-OG 2.81Å
96K69.7Low81.6Confident47 Ų4763.2 Ų63.220%0.20434%0.339CS..THydrogen-bonded Turntrans-93.8-35.3-177.7-168.5177.3-179.2-1690111.9Y57 N93 P98Y57-K96 PolarHBondContact OH-NZ 3.37Å; N93-K96 PolarHBondContact O-N 2.87Å; K96-P98 VanDerWaalsContact C-CD 3.44Å; K96-P98 WeakPolarHBondContact O-CD 3.41Å
97F71.2Confident81.4Confident6 Ų664.3 Ų64.33%0.02634%0.344CS..SBendtrans-124.871.1-179.8-56.8-66.2000109.8L49 M90 N93 N99 R339 R342L49-F97 HydrophobicContact CD1-CD1 4.26Å; L49-F97 HydrophobicContact CD1-CE1 3.79Å; M90-F97 HydrophobicContact CB-CE2 4.43Å; M90-F97 VanDerWaalsContact O-CD2 3.23Å; M90-F97 WeakPolarHBondContact O-CD2 3.48Å; N93-F97 PolarHBondContact O-N 3.21Å; F97-N99 PolarHBondContact O-N 3.14Å; F97-N99 VanDerWaalsContact O-N 3.08Å; F97-R339 WeakPolarHBondContact CE1-O 3.43Å; F97-R339 WeakPolarHBondContact CZ-O 3.29Å; F97-R342 HydrophobicContact CB-CG 4.47Å
98P67.6Low81.3Confident58 Ų5867.6 Ų67.638%0.37736%0.362SS..  trans-64.3117.2175.626.1-32.5000108.4G94 K96 S100 R342G94-P98 WeakPolarHBondContact O-CA 3.24Å; K96-P98 VanDerWaalsContact C-CD 3.44Å; K96-P98 WeakPolarHBondContact O-CD 3.41Å; P98-S100 PolarHBondContact O-N 3.13Å; P98-R342 WeakPolarHBondContact O-CD 3.5Å
99N67.5Low81.3Confident96 Ų9663.5 Ų63.551%0.51335%0.351SS..  trans-69.876.4168-70.6-30.7000108.1F97 R342F97-N99 PolarHBondContact O-N 3.14Å; F97-N99 VanDerWaalsContact O-N 3.08Å; N99-R342 PolarHBondContact OD1-O 3.37Å
100S74.9Confident81.4Confident37 Ų3760.8 Ų60.826%0.25934%0.34SS..  trans-76.8136.8178.165.20000109.6P98 S102 F103 V104P98-S100 PolarHBondContact O-N 3.13Å; S100-S102 PolarHBondContact O-N 2.85Å; S100-S102 VanDerWaalsContact O-N 3.12Å; S100-F103 PolarHBondContact O-N 3.31Å; S100-F103 PolarHBondContact OG-N 3.11Å; S100-V104 PolarHBondContact O-N 3.38Å
101F82.4Confident81.6Confident164 Ų16463.4 Ų63.472%0.71935%0.354SS*.Hα-helixtrans-52.6-31.5169.3178.4-103000111.4F103 V104 R105F101-F103 PolarHBondContact O-N 2.71Å; F101-V104 PolarHBondContact O-N 2.8Å; F101-R105 WeakPolarHBondContact O-CB 3.27Å; F101-R105 PolarHBondContact O-N 2.98Å
102S85Confident82Confident71 Ų7167.3 Ų67.350%0.49737%0.365SS..Hα-helixtrans-58.9-44.3174.2-52.10000113.1F47 S100 R105 R106F47-S102 WeakPolarHBondContact CZ-O 3.47Å; S100-S102 PolarHBondContact O-N 2.85Å; S100-S102 VanDerWaalsContact O-N 3.12Å; S102-R105 PolarHBondContact O-N 3.41Å; S102-R106 PolarHBondContact O-N 3.26Å
103F84.2Confident82.5Confident10 Ų1066.6 Ų66.64%0.04437%0.368CS..Hα-helixtrans-69.6-39.4178.1-176-106.8000111.8F47 S100 F101 R105 R106 I107 F196 R342F47-F103 HydrophobicContact CB-CD2 4.08Å; F47-F103 HydrophobicContact CB-CE2 4.38Å; F47-F103 HydrophobicContact CD1-CB 3.97Å; F47-F103 AromaticContact CD1-CD2 3.69Å; F47-F103 HydrophobicContact CD1-CD2 3.69Å; F47-F103 HydrophobicContact CD1-CG 4.33Å; F47-F103 HydrophobicContact CE1-CB 3.87Å; F47-F103 HydrophobicContact CE1-CD2 4.27Å; F47-F103 AromaticContact CG-CD2 3.83Å; F47-F103 HydrophobicContact CG-CD2 3.83Å; S100-F103 PolarHBondContact O-N 3.31Å; S100-F103 PolarHBondContact OG-N 3.11Å; F101-F103 PolarHBondContact O-N 2.71Å; F103-R105 VanDerWaalsContact C-N 3.34Å; F103-R105 PolarHBondContact O-N 3.22Å; F103-R106 WeakPolarHBondContact O-CB 3.31Å; F103-R106 PolarHBondContact O-N 2.94Å; F103-R106 VanDerWaalsContact O-N 3.16Å; F103-I107 HydrophobicContact CD1-CD1 3.76Å; F103-I107 HydrophobicContact CD1-CG1 4.45Å; F103-I107 HydrophobicContact CE1-CD1 3.41Å; F103-I107 VanDerWaalsContact CE1-CD1 3.41Å; F103-I107 HydrophobicContact CE1-CG1 4.12Å; F103-I107 HydrophobicContact CZ-CD1 4.06Å; F103-I107 HydrophobicContact CZ-CG1 4.33Å; F103-I107 WeakPolarHBondContact O-CG1 3.42Å; F103-I107 PolarHBondContact O-N 3.42Å; F103-F196 HydrophobicContact CE2-CE2 4.37Å; F103-R342 HydrophobicContact CD1-CB 3.57Å; F103-R342 HydrophobicContact CD1-CG 4.35Å; F103-R342 HydrophobicContact CE1-CB 3.42Å; F103-R342 VanDerWaalsContact CE1-CB 3.42Å; F103-R342 HydrophobicContact CE1-CG 4.46Å; F103-R342 HydrophobicContact CG-CB 4.31Å; F103-R342 HydrophobicContact CZ-CB 4.08Å
104V86.3Confident83.1Confident69 Ų6969.7 Ų69.742%0.41838%0.384SS..Hα-helixtrans-61.5-44.6173.8177.90000110.7S100 F101 R106 I107 I108S100-V104 PolarHBondContact O-N 3.38Å; F101-V104 PolarHBondContact O-N 2.8Å; V104-R106 VanDerWaalsContact C-N 3.29Å; V104-R106 PolarHBondContact O-N 3.34Å; V104-I107 PolarHBondContact O-N 2.82Å; V104-I108 HydrophobicContact CG1-CD1 3.93Å; V104-I108 WeakPolarHBondContact O-CG1 3.43Å; V104-I108 PolarHBondContact O-N 3.33Å
105R89.7Confident84.2Confident178 Ų17867.6 Ų67.667%0.67236%0.362SS*.Hα-helixtrans-59.7-39.6174-177.7-178.9175.7-173.6-1.9111.5F101 S102 F103 I108 S109F101-R105 WeakPolarHBondContact O-CB 3.27Å; F101-R105 PolarHBondContact O-N 2.98Å; S102-R105 PolarHBondContact O-N 3.41Å; F103-R105 VanDerWaalsContact C-N 3.34Å; F103-R105 PolarHBondContact O-N 3.22Å; R105-I108 PolarHBondContact O-N 2.9Å; R105-S109 WeakPolarHBondContact O-CB 3.46Å; R105-S109 PolarHBondContact O-N 3.29Å
106R89.9Confident85.3Confident6 Ų664.8 Ų64.82%0.02334%0.34CS..Hα-helixtrans-61.1-47.4174.7-179.565.7-172.8119.5-4.2111.2S40 D44 F47 S102 F103 V104 I108 S109 S110 F201S40-R106 PolarHBondContact OG-NH2 3.32Å; S40-R106 VanDerWaalsContact OG-NH2 3.14Å; D44-R106 IonicContact OD1-CZ 3.95Å; D44-R106 IonicContact OD1-NE 2.74Å; D44-R106 PolarHBondContact OD1-NE 3.31Å; D44-R106 IonicContact OD1-NH2 3.06Å; D44-R106 PolarHBondContact OD1-NH2 2.71Å; D44-R106 IonicContact OD2-NH2 3.24Å; F47-R106 HydrophobicContact CD2-CB 4.19Å; F47-R106 HydrophobicContact CD2-CG 3.94Å; F47-R106 HydrophobicContact CE2-CB 3.56Å; F47-R106 HydrophobicContact CE2-CG 3.69Å; F47-R106 HydrophobicContact CZ-CB 3.91Å; S102-R106 PolarHBondContact O-N 3.26Å; F103-R106 WeakPolarHBondContact O-CB 3.31Å; F103-R106 PolarHBondContact O-N 2.94Å; F103-R106 VanDerWaalsContact O-N 3.16Å; V104-R106 VanDerWaalsContact C-N 3.29Å; V104-R106 PolarHBondContact O-N 3.34Å; R106-I108 PolarHBondContact O-N 3.39Å; R106-S109 PolarHBondContact NH1-OG 3.23Å; R106-S109 VanDerWaalsContact NH1-OG 3.12Å; R106-S109 PolarHBondContact O-N 3.31Å; R106-S109 PolarHBondContact O-OG 2.74Å; R106-S110 PolarHBondContact NH1-OG 3.12Å; R106-S110 PolarHBondContact O-N 2.94Å; R106-S110 PolarHBondContact O-OG 2.9Å; R106-S110 VanDerWaalsContact O-OG 3.12Å; R106-F201 HydrophobicContact CG-CE2 3.93Å
107I89.1Confident86.7Confident22 Ų2268.2 Ų68.211%0.11336%0.355CS..Hα-helixtrans-57.8-47.8175.6-67.1164.5000111F103 V104 S109 S110 F201 L256 L257F103-I107 HydrophobicContact CD1-CD1 3.76Å; F103-I107 HydrophobicContact CD1-CG1 4.45Å; F103-I107 HydrophobicContact CE1-CD1 3.41Å; F103-I107 VanDerWaalsContact CE1-CD1 3.41Å; F103-I107 HydrophobicContact CE1-CG1 4.12Å; F103-I107 HydrophobicContact CZ-CD1 4.06Å; F103-I107 HydrophobicContact CZ-CG1 4.33Å; F103-I107 WeakPolarHBondContact O-CG1 3.42Å; F103-I107 PolarHBondContact O-N 3.42Å; V104-I107 PolarHBondContact O-N 2.82Å; I107-S109 VanDerWaalsContact C-N 3.3Å; I107-S109 PolarHBondContact O-N 2.99Å; I107-S110 WeakPolarHBondContact O-CB 3.27Å; I107-S110 PolarHBondContact O-N 3.3Å; I107-F201 HydrophobicContact CG1-CZ 4.28Å; I107-L256 HydrophobicContact CG2-CB 4.06Å; I107-L256 HydrophobicContact CG2-CD1 3.71Å; I107-L256 HydrophobicContact CG2-CG 4.5Å; I107-L257 HydrophobicContact CD1-CD2 3.82Å; I107-L257 HydrophobicContact CG1-CD2 4.11Å
108I90.4Very high87.9Confident101 Ų10170 Ų7052%0.51836%0.363SS..Hα-helixtrans-61.8-39.4178.9-66.5168.3000110.9V104 R105 R106 S110 I111V104-I108 HydrophobicContact CG1-CD1 3.93Å; V104-I108 WeakPolarHBondContact O-CG1 3.43Å; V104-I108 PolarHBondContact O-N 3.33Å; R105-I108 PolarHBondContact O-N 2.9Å; R106-I108 PolarHBondContact O-N 3.39Å; I108-S110 PolarHBondContact O-N 3.19Å; I108-I111 HydrophobicContact CG2-CD1 4.13Å; I108-I111 WeakPolarHBondContact O-CB 3.42Å; I108-I111 WeakPolarHBondContact O-CD1 3.45Å; I108-I111 VanDerWaalsContact O-CG1 3.23Å; I108-I111 WeakPolarHBondContact O-CG1 3.43Å; I108-I111 PolarHBondContact O-N 3.47Å
109S90.9Very high89.4Confident54 Ų5467.5 Ų67.538%0.37835%0.347SS..Hα-helixtrans-65.5-19.6176.676.10000113.7R105 R106 I107 I111R105-S109 WeakPolarHBondContact O-CB 3.46Å; R105-S109 PolarHBondContact O-N 3.29Å; R106-S109 PolarHBondContact NH1-OG 3.23Å; R106-S109 VanDerWaalsContact NH1-OG 3.12Å; R106-S109 PolarHBondContact O-N 3.31Å; R106-S109 PolarHBondContact O-OG 2.74Å; I107-S109 VanDerWaalsContact C-N 3.3Å; I107-S109 PolarHBondContact O-N 2.99Å; S109-I111 VanDerWaalsContact C-N 3.34Å
110S90.9Very high90.8Very high16 Ų1667.6 Ų67.611%0.11235%0.347CS..THydrogen-bonded Turntrans-87.1-1.6178.3-59.70000113.3R106 I107 I108 R112 F201R106-S110 PolarHBondContact NH1-OG 3.12Å; R106-S110 PolarHBondContact O-N 2.94Å; R106-S110 PolarHBondContact O-OG 2.9Å; R106-S110 VanDerWaalsContact O-OG 3.12Å; I107-S110 WeakPolarHBondContact O-CB 3.27Å; I107-S110 PolarHBondContact O-N 3.3Å; I108-S110 PolarHBondContact O-N 3.19Å; S110-R112 PolarHBondContact O-N 3.07Å; S110-F201 VanDerWaalsContact OG-CD2 3.28Å; S110-F201 WeakPolarHBondContact OG-CD2 3.36Å; S110-F201 WeakPolarHBondContact OG-CG 3.48Å
111I92.5Very high91.9Very high60 Ų6069.5 Ų69.531%0.30835%0.354SS..  trans-59.3124.2174.3-67.5170.5000109.2I108 S109 P113 V116 L256I108-I111 HydrophobicContact CG2-CD1 4.13Å; I108-I111 WeakPolarHBondContact O-CB 3.42Å; I108-I111 WeakPolarHBondContact O-CD1 3.45Å; I108-I111 VanDerWaalsContact O-CG1 3.23Å; I108-I111 WeakPolarHBondContact O-CG1 3.43Å; I108-I111 PolarHBondContact O-N 3.47Å; S109-I111 VanDerWaalsContact C-N 3.34Å; I111-P113 WeakPolarHBondContact O-CD 3.34Å; I111-V116 HydrophobicContact CG2-CG2 3.46Å; I111-V116 VanDerWaalsContact CG2-CG2 3.46Å; I111-L256 HydrophobicContact CG1-CD1 3.79Å; I111-L256 HydrophobicContact CG1-CD2 4.01Å
112R91.8Very high92.7Very high92 Ų9262.9 Ų62.935%0.34733%0.327SS..  trans-83.6109.1-179.4-66.7-179.5179.1-117.8-0.3108.9S110 L114 Q115 V116 F201 D202 I203S110-R112 PolarHBondContact O-N 3.07Å; R112-L114 PolarHBondContact O-N 3.06Å; R112-L114 VanDerWaalsContact O-N 3.1Å; R112-Q115 HydrophobicContact CB-CB 4.13Å; R112-Q115 WeakPolarHBondContact O-CB 3.3Å; R112-Q115 PolarHBondContact O-N 2.91Å; R112-V116 PolarHBondContact O-N 3.22Å; R112-F201 PolarHBondContact NH2-O 2.94Å; R112-D202 PolarHBondContact NH2-O 2.78Å; R112-I203 PolarHBondContact NH2-O 3.41Å
113P93.3Very high93.3Very high108 Ų10859.7 Ų59.770%0.70131%0.305SS*.Hα-helixtrans-59.1-32.6-174-24.935.8000113I111 Q115 V116 F117I111-P113 WeakPolarHBondContact O-CD 3.34Å; P113-Q115 PolarHBondContact O-N 3.24Å; P113-V116 PolarHBondContact O-N 3.29Å; P113-F117 WeakPolarHBondContact O-CB 3.3Å; P113-F117 PolarHBondContact O-N 3.31Å
114L94.5Very high93.9Very high110 Ų11063.9 Ų63.958%0.57633%0.328SS*.Hα-helixtrans-63.1-38.8176.6-176.362.7000112.9R112 F117 H118R112-L114 PolarHBondContact O-N 3.06Å; R112-L114 VanDerWaalsContact O-N 3.1Å; L114-F117 PolarHBondContact O-N 3.47Å; L114-H118 VanDerWaalsContact O-CG 3.32Å; L114-H118 PolarHBondContact O-N 3.44Å; L114-H118 PolarHBondContact O-ND1 3.2Å
115Q94.9Very high94.5Very high3 Ų364.3 Ų64.31%0.01433%0.331CS..Hα-helixtrans-68.5-44.4177179.1-138.4-35.500110.8R112 P113 F117 H118 A119 Y210 E252 L255R112-Q115 HydrophobicContact CB-CB 4.13Å; R112-Q115 WeakPolarHBondContact O-CB 3.3Å; R112-Q115 PolarHBondContact O-N 2.91Å; P113-Q115 PolarHBondContact O-N 3.24Å; Q115-F117 VanDerWaalsContact C-N 3.3Å; Q115-F117 PolarHBondContact O-N 2.89Å; Q115-H118 PolarHBondContact O-N 3.35Å; Q115-A119 PolarHBondContact O-N 2.91Å; Q115-Y210 HydrophobicContact CB-CE2 4.01Å; Q115-Y210 HydrophobicContact CG-CE2 4.05Å; Q115-E252 PolarHBondContact NE2-OE2 2.87Å; Q115-L255 HydrophobicContact CG-CD2 4.06Å
116V95.5Very high94.8Very high52 Ų5256.2 Ų56.232%0.31530%0.3SS..Hα-helixtrans-60-43.8175.3178.80000110.4I111 R112 P113 A119 L120I111-V116 HydrophobicContact CG2-CG2 3.46Å; I111-V116 VanDerWaalsContact CG2-CG2 3.46Å; R112-V116 PolarHBondContact O-N 3.22Å; P113-V116 PolarHBondContact O-N 3.29Å; V116-A119 PolarHBondContact O-N 3.41Å; V116-L120 HydrophobicContact CG1-CD1 3.91Å; V116-L120 HydrophobicContact CG1-CG 4.33Å; V116-L120 WeakPolarHBondContact O-CB 3.33Å; V116-L120 VanDerWaalsContact O-CG 3.32Å; V116-L120 WeakPolarHBondContact O-CG 3.37Å; V116-L120 PolarHBondContact O-N 2.87Å
117F97.5Very high95.2Very high120 Ų12056.9 Ų56.953%0.52631%0.305SS..Hα-helixtrans-58.1-49174.5173.5-100.8000112.1P113 L114 Q115 A119 L120 L121P113-F117 WeakPolarHBondContact O-CB 3.3Å; P113-F117 PolarHBondContact O-N 3.31Å; L114-F117 PolarHBondContact O-N 3.47Å; Q115-F117 VanDerWaalsContact C-N 3.3Å; Q115-F117 PolarHBondContact O-N 2.89Å; F117-A119 VanDerWaalsContact C-N 3.34Å; F117-A119 PolarHBondContact O-N 3.29Å; F117-L120 PolarHBondContact O-N 3.43Å; F117-L121 HydrophobicContact CE1-CD2 4.19Å; F117-L121 HydrophobicContact CZ-CD2 4.32Å; F117-L121 VanDerWaalsContact O-CB 3.28Å; F117-L121 WeakPolarHBondContact O-CB 3.41Å; F117-L121 PolarHBondContact O-N 3.45Å
118H97.8Very high95.5Very high44 Ų4461.1 Ų61.120%0.20433%0.327CS..Hα-helixtrans-63-37.7177.4-67.5156.2000112.9L114 Q115 T122 Y210 T214L114-H118 VanDerWaalsContact O-CG 3.32Å; L114-H118 PolarHBondContact O-N 3.44Å; L114-H118 PolarHBondContact O-ND1 3.2Å; Q115-H118 PolarHBondContact O-N 3.35Å; H118-T122 WeakPolarHBondContact O-CB 3.29Å; H118-T122 PolarHBondContact O-N 3.38Å; H118-T122 PolarHBondContact O-OG1 3.47Å; H118-Y210 PolarHBondContact CE1-OH 3.13Å; H118-Y210 AromaticContact ND1-CE1 3.94Å; H118-Y210 AromaticContact ND1-CZ 3.74Å; H118-Y210 PolarHBondContact ND1-OH 2.86Å; H118-T214 HydrophobicContact CB-CG2 3.52Å
119A97.6Very high95.8Very high4 Ų460 Ų603%0.03332%0.322CS..Hα-helixtrans-65.7-45.9176.300000111.7Q115 V116 F117 T122 G123 L217 G218 L221Q115-A119 PolarHBondContact O-N 2.91Å; V116-A119 PolarHBondContact O-N 3.41Å; F117-A119 VanDerWaalsContact C-N 3.34Å; F117-A119 PolarHBondContact O-N 3.29Å; A119-T122 PolarHBondContact O-N 2.96Å; A119-G123 PolarHBondContact O-N 3.12Å; A119-L217 HydrophobicContact CB-CB 3.83Å; A119-L217 HydrophobicContact CB-CD1 4.49Å; A119-G218 WeakPolarHBondContact O-CA 3.36Å; A119-L221 HydrophobicContact CB-CD1 4.43Å
120L97.9Very high96Very high99 Ų9957.8 Ų57.852%0.51831%0.306SS..Hα-helixtrans-62.5-44.9175.7-71.4171.1000111.8V116 F117 T122 G123 L124 L221V116-L120 HydrophobicContact CG1-CD1 3.91Å; V116-L120 HydrophobicContact CG1-CG 4.33Å; V116-L120 WeakPolarHBondContact O-CB 3.33Å; V116-L120 VanDerWaalsContact O-CG 3.32Å; V116-L120 WeakPolarHBondContact O-CG 3.37Å; V116-L120 PolarHBondContact O-N 2.87Å; F117-L120 PolarHBondContact O-N 3.43Å; L120-T122 VanDerWaalsContact C-N 3.32Å; L120-T122 PolarHBondContact O-N 3.13Å; L120-G123 PolarHBondContact O-N 3.15Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 PolarHBondContact O-N 3.48Å; L120-L221 HydrophobicContact CD2-CD1 4.03Å
121L98.2Very high96.2Very high76 Ų7658.5 Ų58.540%0.39831%0.312SS..Hα-helixtrans-60.1-44.2176179.961.8000111F117 L124 V125F117-L121 HydrophobicContact CE1-CD2 4.19Å; F117-L121 HydrophobicContact CZ-CD2 4.32Å; F117-L121 VanDerWaalsContact O-CB 3.28Å; F117-L121 WeakPolarHBondContact O-CB 3.41Å; F117-L121 PolarHBondContact O-N 3.45Å; L121-L124 PolarHBondContact O-N 3.38Å; L121-V125 HydrophobicContact CD1-CG2 4.26Å; L121-V125 WeakPolarHBondContact O-CB 3.42Å; L121-V125 VanDerWaalsContact O-CG2 3.28Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.32Å
122T98.1Very high96.2Very high25 Ų2562.1 Ų62.115%0.15332%0.323CS..Hα-helixtrans-60.2-47175.7-59.60000110.9H118 A119 L120 L124 V125 L126 L215H118-T122 WeakPolarHBondContact O-CB 3.29Å; H118-T122 PolarHBondContact O-N 3.38Å; H118-T122 PolarHBondContact O-OG1 3.47Å; A119-T122 PolarHBondContact O-N 2.96Å; L120-T122 VanDerWaalsContact C-N 3.32Å; L120-T122 PolarHBondContact O-N 3.13Å; T122-L124 PolarHBondContact O-N 3.43Å; T122-V125 PolarHBondContact O-N 2.68Å; T122-L126 HydrophobicContact CG2-CD1 3.9Å; T122-L126 HydrophobicContact CG2-CG 4.3Å; T122-L126 WeakPolarHBondContact O-CB 3.4Å; T122-L126 VanDerWaalsContact O-CG 3.25Å; T122-L126 WeakPolarHBondContact O-CG 3.01Å; T122-L126 PolarHBondContact O-N 3.11Å; T122-L215 HydrophobicContact CG2-CD2 3.97Å
123G97.8Very high96.3Very high4 Ų460.1 Ų60.14%0.04132%0.319CS..Hα-helixtrans-61.4-40.2177.600000113.3A119 L120 T127 G218A119-G123 PolarHBondContact O-N 3.12Å; L120-G123 PolarHBondContact O-N 3.15Å; G123-T127 WeakPolarHBondContact O-CB 3.37Å; G123-T127 PolarHBondContact O-N 2.92Å; G123-T127 PolarHBondContact O-OG1 3.48Å; G123-G218 VanDerWaalsContact CA-O 3.22Å; G123-G218 WeakPolarHBondContact CA-O 3.1Å
124L97.8Very high96.3Very high99 Ų9956.8 Ų56.852%0.51830%0.296SS..Hα-helixtrans-64-49.3174.8179.563.7000111.5L120 L121 T122 L126 T127 L128L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 PolarHBondContact O-N 3.48Å; L121-L124 PolarHBondContact O-N 3.38Å; T122-L124 PolarHBondContact O-N 3.43Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.42Å; L124-T127 WeakPolarHBondContact O-CB 3.37Å; L124-T127 PolarHBondContact O-N 2.88Å; L124-T127 VanDerWaalsContact O-N 3.14Å; L124-L128 HydrophobicContact CD1-CD1 4.41Å; L124-L128 HydrophobicContact CD1-CG 4.41Å; L124-L128 HydrophobicContact CG-CD1 4.27Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 2.87Å
125V98Very high96.1Very high78 Ų7859.9 Ų59.947%0.47330%0.301SS..Hα-helixtrans-59.7-44.5178.6169.50000110.9L121 T122 T127 L128 L129L121-V125 HydrophobicContact CD1-CG2 4.26Å; L121-V125 WeakPolarHBondContact O-CB 3.42Å; L121-V125 VanDerWaalsContact O-CG2 3.28Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.32Å; T122-V125 PolarHBondContact O-N 2.68Å; V125-T127 VanDerWaalsContact C-N 3.31Å; V125-T127 PolarHBondContact O-N 2.83Å; V125-L128 PolarHBondContact O-N 2.82Å; V125-L129 VanDerWaalsContact O-CB 3.23Å; V125-L129 WeakPolarHBondContact O-CB 3.18Å; V125-L129 PolarHBondContact O-N 3.4Å
126L97.5Very high96Very high7 Ų765.9 Ų65.94%0.03733%0.326CS..Hα-helixtrans-61.3-39.4175.9-73.8174.7000112T122 L124 L129 R130 W160 W164 F219 H222T122-L126 HydrophobicContact CG2-CD1 3.9Å; T122-L126 HydrophobicContact CG2-CG 4.3Å; T122-L126 WeakPolarHBondContact O-CB 3.4Å; T122-L126 VanDerWaalsContact O-CG 3.25Å; T122-L126 WeakPolarHBondContact O-CG 3.01Å; T122-L126 PolarHBondContact O-N 3.11Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.42Å; L126-L129 PolarHBondContact O-N 3.02Å; L126-R130 WeakPolarHBondContact O-CB 3.48Å; L126-R130 PolarHBondContact O-N 3.39Å; L126-W160 HydrophobicContact CB-CZ2 4.05Å; L126-W160 HydrophobicContact CD2-CH2 3.91Å; L126-W160 HydrophobicContact CD2-CZ2 3.86Å; L126-W160 WeakPolarHBondContact O-CH2 3.42Å; L126-W160 VanDerWaalsContact O-CZ2 3.27Å; L126-W160 WeakPolarHBondContact O-CZ2 3.38Å; L126-W164 HydrophobicContact CD1-CH2 4.31Å; L126-W164 HydrophobicContact CD1-CZ2 3.96Å; L126-W164 HydrophobicContact CD2-CD2 4.42Å; L126-W164 HydrophobicContact CD2-CE3 4.01Å; L126-W164 HydrophobicContact CD2-CH2 3.77Å; L126-W164 HydrophobicContact CD2-CZ2 4.19Å; L126-W164 HydrophobicContact CD2-CZ3 3.68Å; L126-F219 HydrophobicContact CD1-CB 4.02Å; L126-F219 HydrophobicContact CD1-CD2 4.26Å; L126-H222 HydrophobicContact CB-CB 4.09Å
127T96.8Very high95.8Very high20 Ų2066.8 Ų66.812%0.12333%0.329CS..Hα-helixtrans-64.4-48.3176.9-57.50000112.1G123 L124 V125 L129 R130 A131 H222 W225G123-T127 WeakPolarHBondContact O-CB 3.37Å; G123-T127 PolarHBondContact O-N 2.92Å; G123-T127 PolarHBondContact O-OG1 3.48Å; L124-T127 WeakPolarHBondContact O-CB 3.37Å; L124-T127 PolarHBondContact O-N 2.88Å; L124-T127 VanDerWaalsContact O-N 3.14Å; V125-T127 VanDerWaalsContact C-N 3.31Å; V125-T127 PolarHBondContact O-N 2.83Å; T127-L129 VanDerWaalsContact C-N 3.33Å; T127-L129 PolarHBondContact O-N 3.39Å; T127-R130 PolarHBondContact O-N 2.92Å; T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 2.77Å; T127-H222 WeakPolarHBondContact CA-ND1 3.37Å; T127-H222 PolarHBondContact N-ND1 3.25Å; T127-H222 PolarHBondContact OG1-ND1 3.19Å; T127-W225 HydrophobicContact CG2-CD2 4.24Å; T127-W225 HydrophobicContact CG2-CE3 3.53Å; T127-W225 HydrophobicContact CG2-CH2 3.74Å; T127-W225 HydrophobicContact CG2-CZ2 4.41Å; T127-W225 HydrophobicContact CG2-CZ3 3.23Å
128L96.5Very high95.4Very high111 Ų11164.4 Ų64.458%0.58132%0.317SS*.Hα-helixtrans-63.3-41.2176.9-65.9176.1000111.5L124 V125 A131 Y132L124-L128 HydrophobicContact CD1-CD1 4.41Å; L124-L128 HydrophobicContact CD1-CG 4.41Å; L124-L128 HydrophobicContact CG-CD1 4.27Å; L124-L128 WeakPolarHBondContact O-CG 3.49Å; L124-L128 PolarHBondContact O-N 2.87Å; V125-L128 PolarHBondContact O-N 2.82Å; L128-A131 PolarHBondContact O-N 2.74Å; L128-Y132 WeakPolarHBondContact O-CB 3.26Å; L128-Y132 PolarHBondContact O-N 3.48Å
129L96.4Very high94.9Very high78 Ų7866.5 Ų66.541%0.40833%0.333SS..Hα-helixtrans-65.1-44.5177.5-176.561.6000111.4V125 L126 T127 A131 Y132 I133 W160V125-L129 VanDerWaalsContact O-CB 3.23Å; V125-L129 WeakPolarHBondContact O-CB 3.18Å; V125-L129 PolarHBondContact O-N 3.4Å; L126-L129 PolarHBondContact O-N 3.02Å; T127-L129 VanDerWaalsContact C-N 3.33Å; T127-L129 PolarHBondContact O-N 3.39Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 3.39Å; L129-Y132 PolarHBondContact O-N 3.1Å; L129-I133 HydrophobicContact CD1-CD1 3.99Å; L129-I133 HydrophobicContact CD1-CG1 4.2Å; L129-I133 HydrophobicContact CG-CD1 3.89Å; L129-I133 HydrophobicContact CG-CG1 4.45Å; L129-I133 WeakPolarHBondContact O-CB 3.39Å; L129-I133 VanDerWaalsContact O-CG1 3.3Å; L129-I133 WeakPolarHBondContact O-CG1 3.42Å; L129-I133 PolarHBondContact O-N 3.49Å; L129-W160 HydrophobicContact CB-CH2 3.94Å; L129-W160 HydrophobicContact CB-CZ3 4.32Å; L129-W160 HydrophobicContact CD2-CH2 3.88Å; L129-W160 HydrophobicContact CD2-CZ3 3.94Å; L129-W160 HydrophobicContact CG-CH2 3.88Å; L129-W160 HydrophobicContact CG-CZ3 3.82Å
130R95.2Very high94.6Very high8 Ų873 Ų733%0.0336%0.361CS..Hα-helixtrans-60.4-43.9175-172.1175.8166.395.4-11.3111.1L126 T127 T134 E157 W160 H222 M230 D231L126-R130 WeakPolarHBondContact O-CB 3.48Å; L126-R130 PolarHBondContact O-N 3.39Å; T127-R130 PolarHBondContact O-N 2.92Å; R130-T134 VanDerWaalsContact O-CB 3.27Å; R130-T134 WeakPolarHBondContact O-CB 3.23Å; R130-T134 PolarHBondContact O-N 3.35Å; R130-T134 PolarHBondContact O-OG1 2.89Å; R130-E157 PolarHBondContact NH1-O 2.65Å; R130-W160 HydrophobicContact CB-CD2 4.01Å; R130-W160 HydrophobicContact CB-CE3 4.25Å; R130-W160 HydrophobicContact CB-CH2 4.03Å; R130-W160 HydrophobicContact CB-CZ2 3.75Å; R130-W160 HydrophobicContact CB-CZ3 4.29Å; R130-W160 HydrophobicContact CG-CD2 3.92Å; R130-W160 HydrophobicContact CG-CE3 4.44Å; R130-W160 HydrophobicContact CG-CG 4.1Å; R130-W160 HydrophobicContact CG-CZ2 4.47Å; R130-H222 VanDerWaalsContact CD-CE1 3.45Å; R130-H222 WeakPolarHBondContact CD-CE1 3.44Å; R130-H222 VanDerWaalsContact CD-NE2 3.3Å; R130-H222 WeakPolarHBondContact CD-NE2 3.41Å; R130-M230 HydrophobicContact CG-CE 3.88Å; R130-M230 HydrophobicContact CG-SD 4.3Å; R130-D231 IonicContact CZ-OD1 3.36Å; R130-D231 IonicContact NH2-OD1 3.55Å; R130-D231 PolarHBondContact NH2-OD1 2.8Å
131A93.8Very high94.2Very high31 Ų3169.6 Ų69.626%0.25634%0.343SS..Hα-helixtrans-62.4-45177.100000112.1T127 L128 L129 T134 R135T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 2.77Å; L128-A131 PolarHBondContact O-N 2.74Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 3.39Å; A131-T134 PolarHBondContact O-N 2.9Å; A131-R135 WeakPolarHBondContact O-CG 3.4Å; A131-R135 PolarHBondContact O-N 3.43Å
132Y94.4Very high93.7Very high136 Ų13668.3 Ų68.353%0.53334%0.336SS..Hα-helixtrans-62.4-49176.7172.4-104.7000112.4L128 L129 T134 R135 K136L128-Y132 WeakPolarHBondContact O-CB 3.26Å; L128-Y132 PolarHBondContact O-N 3.48Å; L129-Y132 PolarHBondContact O-N 3.1Å; Y132-T134 VanDerWaalsContact C-N 3.31Å; Y132-T134 PolarHBondContact O-N 3.43Å; Y132-R135 PolarHBondContact O-N 3.04Å; Y132-K136 HydrophobicContact CE1-CD 4.41Å; Y132-K136 PolarHBondContact O-N 2.59Å
133I93.8Very high93.1Very high49 Ų4971.6 Ų71.625%0.25136%0.36SS..Hα-helixtrans-60.5-43.5177.6-71.1174.7000110.4L129 R135 K136 L137 W160L129-I133 HydrophobicContact CD1-CD1 3.99Å; L129-I133 HydrophobicContact CD1-CG1 4.2Å; L129-I133 HydrophobicContact CG-CD1 3.89Å; L129-I133 HydrophobicContact CG-CG1 4.45Å; L129-I133 WeakPolarHBondContact O-CB 3.39Å; L129-I133 VanDerWaalsContact O-CG1 3.3Å; L129-I133 WeakPolarHBondContact O-CG1 3.42Å; L129-I133 PolarHBondContact O-N 3.49Å; I133-R135 PolarHBondContact O-N 2.8Å; I133-K136 PolarHBondContact O-N 3.49Å; I133-L137 HydrophobicContact CG2-CD1 3.52Å; I133-L137 HydrophobicContact CG2-CG 4.01Å; I133-L137 WeakPolarHBondContact O-CB 3.5Å; I133-L137 WeakPolarHBondContact O-CG 3.48Å; I133-L137 PolarHBondContact O-N 2.97Å; I133-W160 HydrophobicContact CD1-CE3 3.98Å; I133-W160 HydrophobicContact CD1-CZ3 3.69Å
134T92.6Very high92.7Very high38 Ų3873.2 Ų73.223%0.23338%0.376CS..Hα-helixtrans-58.4-51.5178.6-58.20000110.4R130 A131 Y132 K136 L137 Y138 I156R130-T134 VanDerWaalsContact O-CB 3.27Å; R130-T134 WeakPolarHBondContact O-CB 3.23Å; R130-T134 PolarHBondContact O-N 3.35Å; R130-T134 PolarHBondContact O-OG1 2.89Å; A131-T134 PolarHBondContact O-N 2.9Å; Y132-T134 VanDerWaalsContact C-N 3.31Å; Y132-T134 PolarHBondContact O-N 3.43Å; T134-K136 VanDerWaalsContact C-N 3.31Å; T134-K136 PolarHBondContact O-N 3.41Å; T134-L137 PolarHBondContact O-N 2.96Å; T134-Y138 WeakPolarHBondContact O-CB 3.49Å; T134-Y138 PolarHBondContact O-N 3.18Å; T134-I156 HydrophobicContact CG2-CD1 4.29Å; T134-I156 HydrophobicContact CG2-CG2 4.38Å
135R91Very high92.2Very high176 Ų17670.7 Ų70.766%0.66437%0.365SS*.Hα-helixtrans-57.6-42.3178.3-70.9175.9-1771781112.7A131 Y132 I133A131-R135 WeakPolarHBondContact O-CG 3.4Å; A131-R135 PolarHBondContact O-N 3.43Å; Y132-R135 PolarHBondContact O-N 3.04Å; I133-R135 PolarHBondContact O-N 2.8Å
136K91.5Very high91.7Very high128 Ų12867.9 Ų67.956%0.55735%0.352SS*.Hα-helixtrans-75.2-40-176.7-171.2173.6-176.4173.10113.3Y132 I133 T134Y132-K136 HydrophobicContact CE1-CD 4.41Å; Y132-K136 PolarHBondContact O-N 2.59Å; I133-K136 PolarHBondContact O-N 3.49Å; T134-K136 VanDerWaalsContact C-N 3.31Å; T134-K136 PolarHBondContact O-N 3.41Å
137L92.4Very high91.3Very high72 Ų7267.8 Ų67.838%0.37735%0.351SS..Hα-helixtrans-83.6-29.8-177.6-67.6-174.5000112.6I133 T134 T139 K140 L141 I156I133-L137 HydrophobicContact CG2-CD1 3.52Å; I133-L137 HydrophobicContact CG2-CG 4.01Å; I133-L137 WeakPolarHBondContact O-CB 3.5Å; I133-L137 WeakPolarHBondContact O-CG 3.48Å; I133-L137 PolarHBondContact O-N 2.97Å; T134-L137 PolarHBondContact O-N 2.96Å; L137-T139 PolarHBondContact O-N 3.07Å; L137-K140 PolarHBondContact O-N 3.36Å; L137-K140 VanDerWaalsContact O-N 3.17Å; L137-L141 HydrophobicContact CB-CD1 4.45Å; L137-L141 WeakPolarHBondContact O-CB 3.4Å; L137-L141 VanDerWaalsContact O-CG 3.28Å; L137-L141 WeakPolarHBondContact O-CG 3.45Å; L137-L141 PolarHBondContact O-N 3.27Å; L137-I156 HydrophobicContact CB-CD1 4.1Å; L137-I156 HydrophobicContact CB-CG1 4.24Å
138Y89.3Confident90.9Very high70 Ų7068.6 Ų68.628%0.27536%0.356SS..Hα-helixtrans-57.2-52.3-176.5-172-97.1000112.1T134 K140 L141 I142 P149 I156T134-Y138 WeakPolarHBondContact O-CB 3.49Å; T134-Y138 PolarHBondContact O-N 3.18Å; Y138-K140 VanDerWaalsContact C-N 3.32Å; Y138-K140 PolarHBondContact O-N 3.37Å; Y138-L141 PolarHBondContact O-N 3.11Å; Y138-I142 HydrophobicContact CD1-CD1 3.76Å; Y138-I142 HydrophobicContact CE1-CD1 3.35Å; Y138-I142 HydrophobicContact CE2-CD1 4.39Å; Y138-I142 HydrophobicContact CG-CD1 4.42Å; Y138-I142 WeakPolarHBondContact O-CG1 3.45Å; Y138-I142 PolarHBondContact O-N 3.49Å; Y138-P149 WeakPolarHBondContact CE2-O 3.41Å; Y138-P149 WeakPolarHBondContact OH-CB 3.36Å; Y138-P149 PolarHBondContact OH-O 3.4Å; Y138-P149 VanDerWaalsContact OH-O 3.09Å; Y138-I156 HydrophobicContact CD2-CD1 4.17Å
139T86.9Confident90.4Very high88 Ų8865.2 Ų65.254%0.5434%0.341SS..Hα-helixtrans-64.5-37.3177.8550000112.2L137 S143L137-T139 PolarHBondContact O-N 3.07Å; T139-S143 WeakPolarHBondContact O-CB 3.42Å; T139-S143 PolarHBondContact O-N 2.91Å; T139-S143 PolarHBondContact O-OG 3.01Å
140K90.7Very high89.8Confident141 Ų14164 Ų6461%0.61333%0.334SS*.Hα-helixtrans-69.9-34.6179.4-169.4175.2-176.9179.20112.9L137 Y138 G144 V145L137-K140 PolarHBondContact O-N 3.36Å; L137-K140 VanDerWaalsContact O-N 3.17Å; Y138-K140 VanDerWaalsContact C-N 3.32Å; Y138-K140 PolarHBondContact O-N 3.37Å; K140-G144 WeakPolarHBondContact O-CA 3.43Å; K140-G144 PolarHBondContact O-N 3.29Å; K140-V145 PolarHBondContact O-N 3.14Å
141L89.7Confident89.5Confident26 Ų2665 Ų6514%0.13634%0.339CS..Iπ-helixtrans-70.1-40.6176.4-73.8170.6000111.2L137 Y138 V145 G146 V147 L155 I156L137-L141 HydrophobicContact CB-CD1 4.45Å; L137-L141 WeakPolarHBondContact O-CB 3.4Å; L137-L141 VanDerWaalsContact O-CG 3.28Å; L137-L141 WeakPolarHBondContact O-CG 3.45Å; L137-L141 PolarHBondContact O-N 3.27Å; Y138-L141 PolarHBondContact O-N 3.11Å; L141-V145 HydrophobicContact CD2-CB 4.37Å; L141-V145 HydrophobicContact CD2-CG2 3.92Å; L141-V145 CarbonylContact O-C 3.57Å; L141-V145 WeakPolarHBondContact O-CA 3.5Å; L141-V145 WeakPolarHBondContact O-CB 3.23Å; L141-V145 PolarHBondContact O-N 3.45Å; L141-G146 PolarHBondContact O-N 2.92Å; L141-V147 PolarHBondContact O-N 3.02Å; L141-L155 HydrophobicContact CD1-CD2 3.91Å; L141-L155 HydrophobicContact CD1-CG 4.38Å; L141-L155 HydrophobicContact CD2-CD2 3.75Å; L141-L155 HydrophobicContact CG-CD2 4.41Å; L141-I156 HydrophobicContact CD1-CD1 3.89Å; L141-I156 HydrophobicContact CD1-CG1 3.54Å
142I86.9Confident89.3Confident50 Ų5063.6 Ų63.626%0.25633%0.327SS..Iπ-helixtrans-68.7-57.6177.1-63.2169000110.6Y138 G146 P149 S152Y138-I142 HydrophobicContact CD1-CD1 3.76Å; Y138-I142 HydrophobicContact CE1-CD1 3.35Å; Y138-I142 HydrophobicContact CE2-CD1 4.39Å; Y138-I142 HydrophobicContact CG-CD1 4.42Å; Y138-I142 WeakPolarHBondContact O-CG1 3.45Å; Y138-I142 PolarHBondContact O-N 3.49Å; I142-G146 VanDerWaalsContact O-CA 3.26Å; I142-G146 WeakPolarHBondContact O-CA 3.3Å; I142-G146 PolarHBondContact O-N 3.26Å; I142-P149 HydrophobicContact CD1-CB 4.02Å; I142-S152 WeakPolarHBondContact CG1-OG 3.25Å
143S87.1Confident89.1Confident93 Ų9358.5 Ų58.565%0.6532%0.317SS*.Iπ-helixtrans-75.3-39.5-174.365.50000113.3T139T139-S143 WeakPolarHBondContact O-CB 3.42Å; T139-S143 PolarHBondContact O-N 2.91Å; T139-S143 PolarHBondContact O-OG 3.01Å
144G88.1Confident88.9Confident38 Ų3857.2 Ų57.239%0.39231%0.309SS..Iπ-helixtrans-85.1-57.2-175.200000112.4K140 R290K140-G144 WeakPolarHBondContact O-CA 3.43Å; K140-G144 PolarHBondContact O-N 3.29Å; G144-R290 PolarHBondContact O-NH2 3.18Å
145V87.9Confident89Confident47 Ų4756.1 Ų56.129%0.28530%0.302SS..Iπ-helixtrans-82.5-28-174.7-173.80000111.5K140 L141 V147 L286 R289K140-V145 PolarHBondContact O-N 3.14Å; L141-V145 HydrophobicContact CD2-CB 4.37Å; L141-V145 HydrophobicContact CD2-CG2 3.92Å; L141-V145 CarbonylContact O-C 3.57Å; L141-V145 WeakPolarHBondContact O-CA 3.5Å; L141-V145 WeakPolarHBondContact O-CB 3.23Å; L141-V145 PolarHBondContact O-N 3.45Å; V145-V147 HydrophobicContact CB-CG2 4.19Å; V145-V147 HydrophobicContact CG1-CG2 3.78Å; V145-L286 HydrophobicContact CG1-CD2 4.19Å; V145-R289 HydrophobicContact CG1-CG 4.08Å
146G87.4Confident89.1Confident19 Ų1948.2 Ų48.220%0.19627%0.272CS..  trans78.934.6-178.900000113.3L141 I142 R290L141-G146 PolarHBondContact O-N 2.92Å; I142-G146 VanDerWaalsContact O-CA 3.26Å; I142-G146 WeakPolarHBondContact O-CA 3.3Å; I142-G146 PolarHBondContact O-N 3.26Å; G146-R290 PolarHBondContact O-N 2.85Å
147V88.7Confident89.1Confident4 Ų442.6 Ų42.62%0.02425%0.248CC..  trans-86.3146172.5-178.40000108.7L141 V145 I151 L155 L286 R289L141-V147 PolarHBondContact O-N 3.02Å; V145-V147 HydrophobicContact CB-CG2 4.19Å; V145-V147 HydrophobicContact CG1-CG2 3.78Å; V147-I151 HydrophobicContact CG1-CB 3.58Å; V147-I151 HydrophobicContact CG1-CG2 3.42Å; V147-I151 VanDerWaalsContact CG1-CG2 3.42Å; V147-L155 HydrophobicContact CG2-CD2 4.46Å; V147-L286 HydrophobicContact CG2-CD2 4.2Å; V147-R289 HydrophobicContact CG2-CG 4.16Å
148T88.3Confident89.2Confident37 Ų3739.2 Ų39.223%0.22723%0.23CC..  trans-63.8155.5177.366.30000111.3E150 I151 S152T148-E150 VanDerWaalsContact C-N 3.27Å; T148-E150 WeakPolarHBondContact CB-OE2 3.27Å; T148-E150 PolarHBondContact O-N 3.24Å; T148-E150 PolarHBondContact OG1-OE2 2.81Å; T148-I151 PolarHBondContact O-N 3.5Å; T148-I151 WeakPolarHBondContact OG1-CB 3.35Å; T148-I151 WeakPolarHBondContact OG1-CD1 3.22Å; T148-I151 VanDerWaalsContact OG1-CG1 3.31Å; T148-I151 WeakPolarHBondContact OG1-CG1 3.38Å; T148-I151 PolarHBondContact OG1-N 3.3Å; T148-S152 WeakPolarHBondContact O-CB 3.34Å; T148-S152 PolarHBondContact O-N 3.48Å; T148-S152 PolarHBondContact O-OG 3Å
149P86.7Confident89.5Confident41 Ų4137.2 Ų37.227%0.26623%0.232SC..Hα-helixtrans-59.6-33.8179.920.3-31.3000113.7Y138 I142Y138-P149 WeakPolarHBondContact CE2-O 3.41Å; Y138-P149 WeakPolarHBondContact OH-CB 3.36Å; Y138-P149 PolarHBondContact OH-O 3.4Å; Y138-P149 VanDerWaalsContact OH-O 3.09Å; I142-P149 HydrophobicContact CD1-CB 4.02Å
150E83.6Confident89.9Confident52 Ų5233.9 Ų33.924%0.24321%0.209CC..Hα-helixtrans-69.3-47.7178.8-57.675.9-160.700111.4T148 S152 G153 N396T148-E150 VanDerWaalsContact C-N 3.27Å; T148-E150 WeakPolarHBondContact CB-OE2 3.27Å; T148-E150 PolarHBondContact O-N 3.24Å; T148-E150 PolarHBondContact OG1-OE2 2.81Å; E150-S152 VanDerWaalsContact C-N 3.31Å; E150-S152 PolarHBondContact O-N 3.5Å; E150-G153 PolarHBondContact O-N 2.98Å; E150-N396 VanDerWaalsContact CD-ND2 3.32Å; E150-N396 PolarHBondContact OE1-ND2 2.93Å; E150-N396 PolarHBondContact OE2-ND2 2.85Å
151I87.9Confident90.1Very high30 Ų3028.5 Ų28.515%0.15419%0.186CC..Hα-helixtrans-69.1-32.9-180-63.4173.7000110.6V147 T148 G153 K154 L155 Y285V147-I151 HydrophobicContact CG1-CB 3.58Å; V147-I151 HydrophobicContact CG1-CG2 3.42Å; V147-I151 VanDerWaalsContact CG1-CG2 3.42Å; T148-I151 PolarHBondContact O-N 3.5Å; T148-I151 WeakPolarHBondContact OG1-CB 3.35Å; T148-I151 WeakPolarHBondContact OG1-CD1 3.22Å; T148-I151 VanDerWaalsContact OG1-CG1 3.31Å; T148-I151 WeakPolarHBondContact OG1-CG1 3.38Å; T148-I151 PolarHBondContact OG1-N 3.3Å; I151-G153 VanDerWaalsContact C-N 3.27Å; I151-G153 PolarHBondContact O-N 3.46Å; I151-K154 PolarHBondContact O-N 3.27Å; I151-L155 VanDerWaalsContact O-CB 3.27Å; I151-L155 WeakPolarHBondContact O-CB 3.38Å; I151-L155 PolarHBondContact O-N 3.5Å; I151-Y285 HydrophobicContact CG2-CD1 4.1Å; I151-Y285 HydrophobicContact CG2-CG 3.98Å
152S90.9Very high90.4Very high0 Ų027.7 Ų27.70%018%0.183CC..Hα-helixtrans-58.8-38.5178.8-65.10000112.2I142 T148 E150 I156I142-S152 WeakPolarHBondContact CG1-OG 3.25Å; T148-S152 WeakPolarHBondContact O-CB 3.34Å; T148-S152 PolarHBondContact O-N 3.48Å; T148-S152 PolarHBondContact O-OG 3Å; E150-S152 VanDerWaalsContact C-N 3.31Å; E150-S152 PolarHBondContact O-N 3.5Å; S152-I156 WeakPolarHBondContact O-CD1 3.27Å; S152-I156 VanDerWaalsContact O-CG1 3.28Å; S152-I156 WeakPolarHBondContact O-CG1 3.3Å; S152-I156 PolarHBondContact O-N 3.36Å; S152-I156 VanDerWaalsContact O-N 3.11Å
153G89.6Confident90.9Very high30 Ų3031.3 Ų31.331%0.30920%0.197SC..Hα-helixtrans-63.9-51.5174.200000112.4E150 I151 L155 I156 E157E150-G153 PolarHBondContact O-N 2.98Å; I151-G153 VanDerWaalsContact C-N 3.27Å; I151-G153 PolarHBondContact O-N 3.46Å; G153-L155 VanDerWaalsContact C-N 3.28Å; G153-L155 PolarHBondContact O-N 2.96Å; G153-I156 PolarHBondContact O-N 3.22Å; G153-E157 PolarHBondContact O-N 3.01Å
154K90.6Very high91.3Very high22 Ų2228.1 Ų28.110%0.09617%0.171CC..Hα-helixtrans-59.3-38.9177.8-60.9-177.7-176.9-179.40111.7I151 E157 S158 Y285 E385 D393I151-K154 PolarHBondContact O-N 3.27Å; K154-E157 PolarHBondContact O-N 3.11Å; K154-S158 WeakPolarHBondContact O-CB 3.36Å; K154-S158 PolarHBondContact O-N 3.26Å; K154-Y285 HydrophobicContact CB-CD2 4.26Å; K154-Y285 HydrophobicContact CB-CE1 4.09Å; K154-Y285 HydrophobicContact CB-CE2 3.72Å; K154-Y285 HydrophobicContact CD-CE1 4.1Å; K154-E385 WeakPolarHBondContact CE-OE1 3.41Å; K154-E385 VanDerWaalsContact NZ-CD 3.29Å; K154-E385 IonicContact NZ-OE1 2.92Å; K154-E385 PolarHBondContact NZ-OE1 3.38Å; K154-E385 IonicContact NZ-OE2 2.76Å; K154-E385 PolarHBondContact NZ-OE2 2.83Å; K154-D393 IonicContact NZ-OD2 2.93Å; K154-D393 PolarHBondContact NZ-OD2 3.28Å
155L93.1Very high91.7Very high14 Ų1427.4 Ų27.47%0.07316%0.157CC..Hα-helixtrans-65-44178.1-179.864.1000112.5L141 V147 I151 G153 G159 I282 Y285 L286L141-L155 HydrophobicContact CD1-CD2 3.91Å; L141-L155 HydrophobicContact CD1-CG 4.38Å; L141-L155 HydrophobicContact CD2-CD2 3.75Å; L141-L155 HydrophobicContact CG-CD2 4.41Å; V147-L155 HydrophobicContact CG2-CD2 4.46Å; I151-L155 VanDerWaalsContact O-CB 3.27Å; I151-L155 WeakPolarHBondContact O-CB 3.38Å; I151-L155 PolarHBondContact O-N 3.5Å; G153-L155 VanDerWaalsContact C-N 3.28Å; G153-L155 PolarHBondContact O-N 2.96Å; L155-G159 PolarHBondContact O-N 3.41Å; L155-I282 HydrophobicContact CD1-CB 4.11Å; L155-I282 HydrophobicContact CD1-CG1 4.1Å; L155-I282 HydrophobicContact CD1-CG2 3.79Å; L155-Y285 HydrophobicContact CB-CD2 4.23Å; L155-Y285 HydrophobicContact CD1-CD2 4.34Å; L155-L286 HydrophobicContact CD1-CD1 4.45Å; L155-L286 HydrophobicContact CD1-CD2 4.42Å; L155-L286 HydrophobicContact CD1-CG 4.1Å; L155-L286 HydrophobicContact CD2-CD2 3.75Å; L155-L286 HydrophobicContact CD2-CG 4.32Å
156I93.5Very high92.2Very high10 Ų1029.9 Ų29.95%0.05117%0.165CC..Hα-helixtrans-67.1-42.7175.7-66.9164.9000110.5T134 L137 Y138 L141 S152 G153 S158 G159 W160T134-I156 HydrophobicContact CG2-CD1 4.29Å; T134-I156 HydrophobicContact CG2-CG2 4.38Å; L137-I156 HydrophobicContact CB-CD1 4.1Å; L137-I156 HydrophobicContact CB-CG1 4.24Å; Y138-I156 HydrophobicContact CD2-CD1 4.17Å; L141-I156 HydrophobicContact CD1-CD1 3.89Å; L141-I156 HydrophobicContact CD1-CG1 3.54Å; S152-I156 WeakPolarHBondContact O-CD1 3.27Å; S152-I156 VanDerWaalsContact O-CG1 3.28Å; S152-I156 WeakPolarHBondContact O-CG1 3.3Å; S152-I156 PolarHBondContact O-N 3.36Å; S152-I156 VanDerWaalsContact O-N 3.11Å; G153-I156 PolarHBondContact O-N 3.22Å; I156-S158 VanDerWaalsContact C-N 3.33Å; I156-S158 PolarHBondContact O-N 2.93Å; I156-G159 PolarHBondContact O-N 3.49Å; I156-W160 WeakPolarHBondContact O-CB 3.4Å; I156-W160 PolarHBondContact O-N 2.99Å
157E92.1Very high92.7Very high10 Ų1033.3 Ų33.35%0.04717%0.174CC..Hα-helixtrans-53.2-53176.1168.5-176.817400110.5R130 G153 K154 W160 K161 R234R130-E157 PolarHBondContact NH1-O 2.65Å; G153-E157 PolarHBondContact O-N 3.01Å; K154-E157 PolarHBondContact O-N 3.11Å; E157-W160 PolarHBondContact O-N 3.15Å; E157-K161 HydrophobicContact CG-CD 4.11Å; E157-K161 WeakPolarHBondContact O-CG 3.45Å; E157-K161 PolarHBondContact O-N 3.32Å; E157-K161 VanDerWaalsContact O-N 3.1Å; E157-K161 IonicContact OE1-NZ 3.59Å; E157-K161 PolarHBondContact OE1-NZ 3.2Å; E157-R234 IonicContact OE1-NH1 3.74Å; E157-R234 IonicContact OE1-NH2 2.81Å; E157-R234 IonicContact OE2-NH2 3.18Å; E157-R234 PolarHBondContact OE2-NH2 3.21Å
158S94.5Very high93.1Very high1 Ų133.1 Ų33.11%0.00717%0.173CC..Hα-helixtrans-66.4-42-179.8-79.70000113.2K154 I156 W160 K161 G162 E278 K281K154-S158 WeakPolarHBondContact O-CB 3.36Å; K154-S158 PolarHBondContact O-N 3.26Å; I156-S158 VanDerWaalsContact C-N 3.33Å; I156-S158 PolarHBondContact O-N 2.93Å; S158-W160 VanDerWaalsContact C-N 3.35Å; S158-W160 PolarHBondContact O-N 2.96Å; S158-K161 PolarHBondContact O-N 3.3Å; S158-G162 PolarHBondContact O-N 2.96Å; S158-E278 WeakPolarHBondContact CA-OE2 3.33Å; S158-E278 WeakPolarHBondContact CB-OE2 3.43Å; S158-E278 PolarHBondContact OG-OE2 2.9Å; S158-K281 WeakPolarHBondContact OG-CD 3.3Å
159G95.5Very high93.5Very high29 Ų2933.4 Ų33.430%0.29917%0.17SC..Hα-helixtrans-58.1-45.1175.900000112.8L155 I156 F163L155-G159 PolarHBondContact O-N 3.41Å; I156-G159 PolarHBondContact O-N 3.49Å; G159-F163 VanDerWaalsContact O-CB 3.3Å; G159-F163 WeakPolarHBondContact O-CB 3.06Å; G159-F163 PolarHBondContact O-N 2.98Å
160W95Very high94.1Very high18 Ų1835 Ų357%0.06818%0.176CC..Hα-helixtrans-64.6-48.1177.3171.8-89.5000112.6L126 L129 R130 I133 I156 E157 S158 F163 W164 H222L126-W160 HydrophobicContact CB-CZ2 4.05Å; L126-W160 HydrophobicContact CD2-CH2 3.91Å; L126-W160 HydrophobicContact CD2-CZ2 3.86Å; L126-W160 WeakPolarHBondContact O-CH2 3.42Å; L126-W160 VanDerWaalsContact O-CZ2 3.27Å; L126-W160 WeakPolarHBondContact O-CZ2 3.38Å; L129-W160 HydrophobicContact CB-CH2 3.94Å; L129-W160 HydrophobicContact CB-CZ3 4.32Å; L129-W160 HydrophobicContact CD2-CH2 3.88Å; L129-W160 HydrophobicContact CD2-CZ3 3.94Å; L129-W160 HydrophobicContact CG-CH2 3.88Å; L129-W160 HydrophobicContact CG-CZ3 3.82Å; R130-W160 HydrophobicContact CB-CD2 4.01Å; R130-W160 HydrophobicContact CB-CE3 4.25Å; R130-W160 HydrophobicContact CB-CH2 4.03Å; R130-W160 HydrophobicContact CB-CZ2 3.75Å; R130-W160 HydrophobicContact CB-CZ3 4.29Å; R130-W160 HydrophobicContact CG-CD2 3.92Å; R130-W160 HydrophobicContact CG-CE3 4.44Å; R130-W160 HydrophobicContact CG-CG 4.1Å; R130-W160 HydrophobicContact CG-CZ2 4.47Å; I133-W160 HydrophobicContact CD1-CE3 3.98Å; I133-W160 HydrophobicContact CD1-CZ3 3.69Å; I156-W160 WeakPolarHBondContact O-CB 3.4Å; I156-W160 PolarHBondContact O-N 2.99Å; E157-W160 PolarHBondContact O-N 3.15Å; S158-W160 VanDerWaalsContact C-N 3.35Å; S158-W160 PolarHBondContact O-N 2.96Å; W160-F163 PolarHBondContact O-N 3.14Å; W160-W164 PolarHBondContact O-N 3.21Å; W160-W164 VanDerWaalsContact O-N 3.12Å; W160-H222 AromaticContact CE2-NE2 3.65Å; W160-H222 AromaticContact CZ2-NE2 3.78Å; W160-H222 AromaticContact NE1-CD2 3.68Å; W160-H222 AromaticContact NE1-NE2 3.09Å; W160-H222 PolarHBondContact NE1-NE2 3.4Å
161K95.1Very high94.7Very high28 Ų2834.3 Ų34.312%0.12217%0.172CC..Hα-helixtrans-60.9-50.8179-74.5177.1179.1174.90110.4E157 S158 F163 W164 F165 D231 E278E157-K161 HydrophobicContact CG-CD 4.11Å; E157-K161 WeakPolarHBondContact O-CG 3.45Å; E157-K161 PolarHBondContact O-N 3.32Å; E157-K161 VanDerWaalsContact O-N 3.1Å; E157-K161 IonicContact OE1-NZ 3.59Å; E157-K161 PolarHBondContact OE1-NZ 3.2Å; S158-K161 PolarHBondContact O-N 3.3Å; K161-F163 PolarHBondContact O-N 2.84Å; K161-W164 PolarHBondContact O-N 2.91Å; K161-F165 HydrophobicContact CB-CD2 4.24Å; K161-F165 HydrophobicContact CB-CE2 3.76Å; K161-F165 HydrophobicContact CB-CZ 4.43Å; K161-F165 WeakPolarHBondContact O-CD2 3.38Å; K161-F165 VanDerWaalsContact O-CG 3.24Å; K161-F165 WeakPolarHBondContact O-CG 3.24Å; K161-F165 PolarHBondContact O-N 3.32Å; K161-D231 WeakPolarHBondContact CE-OD2 3.44Å; K161-D231 IonicContact NZ-OD2 2.67Å; K161-D231 PolarHBondContact NZ-OD2 3.19Å; K161-E278 HydrophobicContact CB-CG 4Å
162G96.4Very high95.2Very high8 Ų832.9 Ų32.98%0.08217%0.165CC..Hα-helixtrans-60.1-41.8179.400000113.5S158 F166S158-G162 PolarHBondContact O-N 2.96Å; G162-F166 WeakPolarHBondContact O-CB 3.29Å; G162-F166 PolarHBondContact O-N 3.34Å
163F96.1Very high95.5Very high126 Ų12634.7 Ų34.755%0.55317%0.174SC*.Hα-helixtrans-59.1-48174.9171.5-99.5000111.7G159 W160 K161 F166 F167G159-F163 VanDerWaalsContact O-CB 3.3Å; G159-F163 WeakPolarHBondContact O-CB 3.06Å; G159-F163 PolarHBondContact O-N 2.98Å; W160-F163 PolarHBondContact O-N 3.14Å; K161-F163 PolarHBondContact O-N 2.84Å; F163-F166 PolarHBondContact O-N 3.28Å; F163-F167 PolarHBondContact O-N 3.43Å
164W96.4Very high95.8Very high26 Ų2638.8 Ų38.810%0.09818%0.183CC..Hα-helixtrans-69.5-43-177.3-164.2-98.3000112.4L126 W160 K161 F166 F167 M168 L215 F219L126-W164 HydrophobicContact CD1-CH2 4.31Å; L126-W164 HydrophobicContact CD1-CZ2 3.96Å; L126-W164 HydrophobicContact CD2-CD2 4.42Å; L126-W164 HydrophobicContact CD2-CE3 4.01Å; L126-W164 HydrophobicContact CD2-CH2 3.77Å; L126-W164 HydrophobicContact CD2-CZ2 4.19Å; L126-W164 HydrophobicContact CD2-CZ3 3.68Å; W160-W164 PolarHBondContact O-N 3.21Å; W160-W164 VanDerWaalsContact O-N 3.12Å; K161-W164 PolarHBondContact O-N 2.91Å; W164-F166 VanDerWaalsContact C-N 3.28Å; W164-F166 PolarHBondContact O-N 3.33Å; W164-F167 HydrophobicContact CH2-CD1 4.44Å; W164-F167 HydrophobicContact CH2-CE1 4.48Å; W164-F167 HydrophobicContact CZ3-CD1 4.3Å; W164-F167 PolarHBondContact O-N 3.14Å; W164-M168 HydrophobicContact CD2-CG 4.41Å; W164-M168 HydrophobicContact CG-CG 4.34Å; W164-M168 HydrophobicContact CZ2-CG 4.41Å; W164-M168 HydrophobicContact CZ2-SD 3.99Å; W164-M168 VanDerWaalsContact NE1-CG 3.27Å; W164-M168 WeakPolarHBondContact O-CB 3.31Å; W164-M168 WeakPolarHBondContact O-CG 3.46Å; W164-M168 PolarHBondContact O-N 2.95Å; W164-L215 HydrophobicContact CH2-CD2 4.33Å; W164-L215 HydrophobicContact CZ2-CB 4.33Å; W164-L215 HydrophobicContact CZ2-CD2 4.41Å; W164-F219 HydrophobicContact CB-CD2 4.16Å; W164-F219 HydrophobicContact CB-CE2 3.71Å; W164-F219 HydrophobicContact CB-CZ 4.19Å; W164-F219 AromaticContact CD1-CD1 3.57Å; W164-F219 AromaticContact CD1-CD2 3.02Å; W164-F219 AromaticContact CD1-CE1 3.86Å; W164-F219 AromaticContact CD1-CE2 3.33Å; W164-F219 AromaticContact CD1-CG 3.13Å; W164-F219 AromaticContact CD1-CZ 3.74Å; W164-F219 HydrophobicContact CD2-CD2 4.08Å; W164-F219 AromaticContact CE2-CD2 3.98Å; W164-F219 AromaticContact CG-CD2 3.47Å; W164-F219 HydrophobicContact CG-CD2 3.47Å; W164-F219 VanDerWaalsContact CG-CD2 3.47Å; W164-F219 AromaticContact CG-CE2 3.55Å; W164-F219 HydrophobicContact CG-CE2 3.55Å; W164-F219 HydrophobicContact CG-CG 4.04Å; W164-F219 HydrophobicContact CG-CZ 4.2Å; W164-F219 AromaticContact NE1-CD1 3.88Å; W164-F219 AromaticContact NE1-CD2 3.33Å; W164-F219 VanDerWaalsContact NE1-CD2 3.33Å; W164-F219 AromaticContact NE1-CG 3.16Å
165F97.1Very high96Very high24 Ų2437.8 Ų37.811%0.10518%0.179CC..Hα-helixtrans-57.6-42.1174.2-64.8-42.1000111.8K161 W169 F219 D274 V275 E278K161-F165 HydrophobicContact CB-CD2 4.24Å; K161-F165 HydrophobicContact CB-CE2 3.76Å; K161-F165 HydrophobicContact CB-CZ 4.43Å; K161-F165 WeakPolarHBondContact O-CD2 3.38Å; K161-F165 VanDerWaalsContact O-CG 3.24Å; K161-F165 WeakPolarHBondContact O-CG 3.24Å; K161-F165 PolarHBondContact O-N 3.32Å; F165-W169 WeakPolarHBondContact O-CB 3.27Å; F165-W169 PolarHBondContact O-N 3.43Å; F165-F219 HydrophobicContact CD1-CE1 4.23Å; F165-F219 HydrophobicContact CD1-CZ 4.48Å; F165-F219 AromaticContact CE1-CE1 3.6Å; F165-F219 HydrophobicContact CE1-CE1 3.6Å; F165-F219 AromaticContact CE1-CZ 3.96Å; F165-F219 HydrophobicContact CE1-CZ 3.96Å; F165-F219 HydrophobicContact CZ-CE1 4.26Å; F165-F219 HydrophobicContact CZ-CZ 4.31Å; F165-D274 HydrophobicContact CD1-CB 4.42Å; F165-D274 HydrophobicContact CD2-CB 3.45Å; F165-D274 VanDerWaalsContact CD2-CB 3.45Å; F165-D274 HydrophobicContact CE1-CB 4.49Å; F165-D274 HydrophobicContact CE2-CB 3.55Å; F165-D274 HydrophobicContact CG-CB 3.93Å; F165-D274 HydrophobicContact CZ-CB 4.1Å; F165-V275 HydrophobicContact CB-CG2 3.73Å; F165-E278 HydrophobicContact CD2-CG 4.15Å; F165-E278 HydrophobicContact CE2-CG 4.14Å
166F97.8Very high96.1Very high99 Ų9937.5 Ų37.543%0.43418%0.178SC..Hα-helixtrans-65.5-45.5178.6-179-114000111.9G162 F163 W164 W169 L170 V275G162-F166 WeakPolarHBondContact O-CB 3.29Å; G162-F166 PolarHBondContact O-N 3.34Å; F163-F166 PolarHBondContact O-N 3.28Å; W164-F166 VanDerWaalsContact C-N 3.28Å; W164-F166 PolarHBondContact O-N 3.33Å; F166-W169 PolarHBondContact O-N 3.38Å; F166-L170 HydrophobicContact CD1-CD1 4.09Å; F166-L170 HydrophobicContact CE1-CD1 3.58Å; F166-L170 HydrophobicContact CE1-CG 4.4Å; F166-L170 HydrophobicContact CE2-CD1 4.26Å; F166-L170 HydrophobicContact CE2-CD2 4.42Å; F166-L170 HydrophobicContact CE2-CG 4.25Å; F166-L170 HydrophobicContact CZ-CD1 3.68Å; F166-L170 HydrophobicContact CZ-CD2 4.36Å; F166-L170 HydrophobicContact CZ-CG 4.15Å; F166-L170 WeakPolarHBondContact O-CG 3.42Å; F166-L170 PolarHBondContact O-N 2.9Å; F166-V275 HydrophobicContact CB-CG1 4.22Å; F166-V275 HydrophobicContact CB-CG2 3.97Å; F166-V275 HydrophobicContact CD2-CG1 4.18Å
167F97.5Very high96.1Very high91 Ų9139.6 Ų39.640%0.39919%0.191SC..Hα-helixtrans-61.7-47.1177.3176.2-100.7000112.3F163 W164 L170 F171 L215F163-F167 PolarHBondContact O-N 3.43Å; W164-F167 HydrophobicContact CH2-CD1 4.44Å; W164-F167 HydrophobicContact CH2-CE1 4.48Å; W164-F167 HydrophobicContact CZ3-CD1 4.3Å; W164-F167 PolarHBondContact O-N 3.14Å; F167-L170 PolarHBondContact O-N 3.44Å; F167-F171 PolarHBondContact O-N 2.9Å; F167-L215 HydrophobicContact CE1-CD1 4.26Å
168M97.4Very high96.2Very high0 Ų045 Ų450%022%0.22CC..Hα-helixtrans-67.8-35.4179.1-68.8-52.5-66.100112.4W164 F171 S172 L212 L215 Q216W164-M168 HydrophobicContact CD2-CG 4.41Å; W164-M168 HydrophobicContact CG-CG 4.34Å; W164-M168 HydrophobicContact CZ2-CG 4.41Å; W164-M168 HydrophobicContact CZ2-SD 3.99Å; W164-M168 VanDerWaalsContact NE1-CG 3.27Å; W164-M168 WeakPolarHBondContact O-CB 3.31Å; W164-M168 WeakPolarHBondContact O-CG 3.46Å; W164-M168 PolarHBondContact O-N 2.95Å; M168-F171 PolarHBondContact O-N 2.84Å; M168-S172 WeakPolarHBondContact O-CB 3.29Å; M168-S172 PolarHBondContact O-N 2.86Å; M168-S172 PolarHBondContact O-OG 3.45Å; M168-L212 HydrophobicContact CE-CD1 4.09Å; M168-L212 HydrophobicContact CE-CG 4.43Å; M168-L215 HydrophobicContact CE-CB 3.71Å; M168-L215 HydrophobicContact SD-CB 3.86Å; M168-L215 HydrophobicContact SD-CD1 4.32Å; M168-Q216 HydrophobicContact CE-CB 4.03Å
169W97.4Very high96.1Very high43 Ų4347.5 Ų47.516%0.16324%0.237CC..Hα-helixtrans-64.8-42.7173.8-176.876000111.9F165 F166 F171 S172 L173 F268 D271 L272F165-W169 WeakPolarHBondContact O-CB 3.27Å; F165-W169 PolarHBondContact O-N 3.43Å; F166-W169 PolarHBondContact O-N 3.38Å; W169-F171 VanDerWaalsContact C-N 3.33Å; W169-F171 PolarHBondContact O-N 2.74Å; W169-S172 PolarHBondContact O-N 3.47Å; W169-L173 HydrophobicContact CH2-CD2 3.95Å; W169-L173 HydrophobicContact CZ3-CD2 4.06Å; W169-L173 WeakPolarHBondContact O-CB 3.46Å; W169-L173 PolarHBondContact O-N 3.44Å; W169-F268 AromaticContact CE2-CE2 3.92Å; W169-F268 AromaticContact CZ2-CE2 3.98Å; W169-F268 HydrophobicContact CZ2-CE2 3.98Å; W169-F268 AromaticContact NE1-CD2 3.66Å; W169-F268 AromaticContact NE1-CE2 3.58Å; W169-F268 PolarHBondContact NE1-O 3.23Å; W169-D271 HydrophobicContact CB-CB 3.91Å; W169-D271 HydrophobicContact CG-CB 4.48Å; W169-L272 HydrophobicContact CD2-CB 4.37Å; W169-L272 HydrophobicContact CD2-CD1 3.93Å; W169-L272 HydrophobicContact CE3-CD1 4.2Å; W169-L272 HydrophobicContact CG-CB 4.2Å; W169-L272 HydrophobicContact CG-CD1 4.41Å; W169-L272 HydrophobicContact CH2-CD1 4.34Å; W169-L272 HydrophobicContact CZ2-CD1 4.09Å; W169-L272 HydrophobicContact CZ2-CD2 3.79Å; W169-L272 HydrophobicContact CZ2-CG 4.4Å; W169-L272 HydrophobicContact CZ3-CD1 4.4Å
170L97.8Very high95.8Very high73 Ų7349.4 Ų49.438%0.38226%0.257SS..Hα-helixtrans-61.3-40.4174.4-73.4176.2000112.1F166 F167 L173 K174F166-L170 HydrophobicContact CD1-CD1 4.09Å; F166-L170 HydrophobicContact CE1-CD1 3.58Å; F166-L170 HydrophobicContact CE1-CG 4.4Å; F166-L170 HydrophobicContact CE2-CD1 4.26Å; F166-L170 HydrophobicContact CE2-CD2 4.42Å; F166-L170 HydrophobicContact CE2-CG 4.25Å; F166-L170 HydrophobicContact CZ-CD1 3.68Å; F166-L170 HydrophobicContact CZ-CD2 4.36Å; F166-L170 HydrophobicContact CZ-CG 4.15Å; F166-L170 WeakPolarHBondContact O-CG 3.42Å; F166-L170 PolarHBondContact O-N 2.9Å; F167-L170 PolarHBondContact O-N 3.44Å; L170-L173 PolarHBondContact O-N 2.78Å; L170-K174 PolarHBondContact O-N 3.43Å
171F97.7Very high95.6Very high38 Ų3851.5 Ų51.517%0.16726%0.264CS..Hα-helixtrans-66.1-44.5175.7-168-176.3000110.9F167 M168 W169 L173 K174 V175 W211 L212 L215F167-F171 PolarHBondContact O-N 2.9Å; M168-F171 PolarHBondContact O-N 2.84Å; W169-F171 VanDerWaalsContact C-N 3.33Å; W169-F171 PolarHBondContact O-N 2.74Å; F171-L173 VanDerWaalsContact C-N 3.35Å; F171-L173 PolarHBondContact O-N 3.4Å; F171-K174 HydrophobicContact CD2-CD 4.38Å; F171-K174 WeakPolarHBondContact O-CB 3.44Å; F171-K174 PolarHBondContact O-N 2.84Å; F171-V175 HydrophobicContact CD2-CG2 3.75Å; F171-V175 HydrophobicContact CE2-CG2 3.58Å; F171-V175 WeakPolarHBondContact O-CG2 3.45Å; F171-V175 PolarHBondContact O-N 3Å; F171-W211 HydrophobicContact CE1-CB 4.21Å; F171-W211 HydrophobicContact CZ-CB 4.13Å; F171-L212 HydrophobicContact CB-CD1 3.74Å; F171-L212 HydrophobicContact CD1-CB 4.3Å; F171-L212 HydrophobicContact CD1-CD1 3.53Å; F171-L212 HydrophobicContact CD1-CG 4.5Å; F171-L212 HydrophobicContact CD2-CD1 3.95Å; F171-L212 HydrophobicContact CE1-CB 3.92Å; F171-L212 HydrophobicContact CE1-CD1 4.04Å; F171-L212 HydrophobicContact CE2-CB 4.47Å; F171-L212 HydrophobicContact CE2-CD1 4.38Å; F171-L212 HydrophobicContact CG-CD1 3.46Å; F171-L212 VanDerWaalsContact CG-CD1 3.46Å; F171-L212 HydrophobicContact CZ-CB 4Å; F171-L212 HydrophobicContact CZ-CD1 4.42Å; F171-L215 HydrophobicContact CD1-CD1 4.11Å; F171-L215 HydrophobicContact CE1-CD1 3.98Å
172S97.2Very high95.4Very high0 Ų053.5 Ų53.50%028%0.279CS..Hα-helixtrans-60.7-41.5174.8-62.90000112.2M168 W169 K174 V175 V176M168-S172 WeakPolarHBondContact O-CB 3.29Å; M168-S172 PolarHBondContact O-N 2.86Å; M168-S172 PolarHBondContact O-OG 3.45Å; W169-S172 PolarHBondContact O-N 3.47Å; S172-K174 VanDerWaalsContact C-N 3.33Å; S172-K174 PolarHBondContact O-N 3.09Å; S172-V175 PolarHBondContact O-N 3.43Å; S172-V176 WeakPolarHBondContact O-CB 3.38Å; S172-V176 WeakPolarHBondContact O-CG2 3.47Å; S172-V176 PolarHBondContact O-N 3.45Å
173L96.7Very high95.1Very high39 Ų3953.6 Ų53.620%0.20428%0.278CS..Hα-helixtrans-58.3-44.9174.3176.368.9000111.2W169 L170 F171 V175 V177 L178 F268W169-L173 HydrophobicContact CH2-CD2 3.95Å; W169-L173 HydrophobicContact CZ3-CD2 4.06Å; W169-L173 WeakPolarHBondContact O-CB 3.46Å; W169-L173 PolarHBondContact O-N 3.44Å; L170-L173 PolarHBondContact O-N 2.78Å; F171-L173 VanDerWaalsContact C-N 3.35Å; F171-L173 PolarHBondContact O-N 3.4Å; L173-V175 PolarHBondContact O-N 2.92Å; L173-V177 HydrophobicContact CD1-CB 3.97Å; L173-V177 HydrophobicContact CD1-CG2 3.91Å; L173-V177 WeakPolarHBondContact O-CB 3.38Å; L173-V177 PolarHBondContact O-N 2.93Å; L173-L178 HydrophobicContact CG-CD1 4.48Å; L173-L178 PolarHBondContact O-N 3.39Å; L173-F268 HydrophobicContact CB-CD2 4.37Å; L173-F268 HydrophobicContact CB-CE2 4Å; L173-F268 HydrophobicContact CD1-CE2 3.64Å; L173-F268 HydrophobicContact CD1-CZ 4.05Å; L173-F268 HydrophobicContact CG-CE2 4.44Å
174K96.5Very high94.8Very high115 Ų11550.7 Ų50.750%0.526%0.264SS..Iπ-helixtrans-60.5-44.9175.7-177-128.9176.8-1800111.7L170 F171 S172 L178 S179L170-K174 PolarHBondContact O-N 3.43Å; F171-K174 HydrophobicContact CD2-CD 4.38Å; F171-K174 WeakPolarHBondContact O-CB 3.44Å; F171-K174 PolarHBondContact O-N 2.84Å; S172-K174 VanDerWaalsContact C-N 3.33Å; S172-K174 PolarHBondContact O-N 3.09Å; K174-L178 CarbonylContact O-C 3.54Å; K174-L178 PolarHBondContact O-N 3.12Å; K174-S179 WeakPolarHBondContact O-CB 3.29Å; K174-S179 PolarHBondContact O-N 3.46Å
175V95.5Very high94.6Very high1 Ų154.1 Ų54.11%0.00628%0.281CS..Iπ-helixtrans-71.7-39.3-176.8174.10000112.1F171 S172 L173 S179 R181 D208 Y209 V264F171-V175 HydrophobicContact CD2-CG2 3.75Å; F171-V175 HydrophobicContact CE2-CG2 3.58Å; F171-V175 WeakPolarHBondContact O-CG2 3.45Å; F171-V175 PolarHBondContact O-N 3Å; S172-V175 PolarHBondContact O-N 3.43Å; L173-V175 PolarHBondContact O-N 2.92Å; V175-S179 WeakPolarHBondContact O-CB 3.46Å; V175-S179 PolarHBondContact O-OG 2.77Å; V175-R181 PolarHBondContact O-NH1 3.43Å; V175-D208 HydrophobicContact CG2-CB 4.18Å; V175-Y209 HydrophobicContact CG1-CD1 3.86Å; V175-Y209 HydrophobicContact CG1-CE1 3.6Å; V175-V264 HydrophobicContact CB-CG1 4.32Å; V175-V264 HydrophobicContact CG1-CG1 3.89Å
176V94.4Very high94.4Very high8 Ų857.8 Ų57.85%0.04830%0.295CS..Iπ-helixtrans-87-43.9-174.5176.40000112.7S172 Y184 V264 L265 F268S172-V176 WeakPolarHBondContact O-CB 3.38Å; S172-V176 WeakPolarHBondContact O-CG2 3.47Å; S172-V176 PolarHBondContact O-N 3.45Å; V176-Y184 HydrophobicContact CG1-CD2 4.44Å; V176-V264 HydrophobicContact CG2-CB 4.28Å; V176-V264 HydrophobicContact CG2-CG1 3.34Å; V176-L265 HydrophobicContact CG1-CD1 4.26Å; V176-F268 HydrophobicContact CB-CG 4.45Å; V176-F268 HydrophobicContact CG1-CD1 4.28Å; V176-F268 HydrophobicContact CG2-CB 4.05Å; V176-F268 HydrophobicContact CG2-CG 4.4Å
177V93.8Very high94.2Very high55 Ų5553.8 Ų53.833%0.33328%0.279SS..Iπ-helixtrans-107.1-48.8-168.9-177.70000111.5L173 S179 F268L173-V177 HydrophobicContact CD1-CB 3.97Å; L173-V177 HydrophobicContact CD1-CG2 3.91Å; L173-V177 WeakPolarHBondContact O-CB 3.38Å; L173-V177 PolarHBondContact O-N 2.93Å; V177-S179 PolarHBondContact O-N 3.47Å; V177-F268 HydrophobicContact CG2-CE1 4.37Å; V177-F268 HydrophobicContact CG2-CE2 4.49Å; V177-F268 HydrophobicContact CG2-CZ 4.05Å
178L94.4Very high94Very high124 Ų12449.6 Ų49.665%0.64926%0.26SS*.Iπ-helixtrans-83.3-10.7-171.5-51.3177.1000114.1L173 K174 G180L173-L178 HydrophobicContact CG-CD1 4.48Å; L173-L178 PolarHBondContact O-N 3.39Å; K174-L178 CarbonylContact O-C 3.54Å; K174-L178 PolarHBondContact O-N 3.12Å; L178-G180 VanDerWaalsContact C-N 3.28Å; L178-G180 PolarHBondContact O-N 3.4Å
179S91.8Very high93.7Very high53 Ų5350.4 Ų50.437%0.37127%0.266SS..THydrogen-bonded Turntrans-80.7-4.4179.8660000114K174 V175 V177 R181K174-S179 WeakPolarHBondContact O-CB 3.29Å; K174-S179 PolarHBondContact O-N 3.46Å; V175-S179 WeakPolarHBondContact O-CB 3.46Å; V175-S179 PolarHBondContact O-OG 2.77Å; V177-S179 PolarHBondContact O-N 3.47Å; S179-R181 VanDerWaalsContact C-N 3.28Å; S179-R181 WeakPolarHBondContact OG-CG 3.43Å; S179-R181 PolarHBondContact OG-N 2.99Å; S179-R181 PolarHBondContact OG-NH1 3.47Å
180G89.3Confident93.4Very high68 Ų6848.7 Ų48.770%0.70126%0.26SS*.SBendtrans79.74.7-174.500000114.5L178L178-G180 VanDerWaalsContact C-N 3.28Å; L178-G180 PolarHBondContact O-N 3.4Å
181R90.4Very high93.1Very high62 Ų6245.5 Ų45.523%0.23424%0.243CC..  trans-70.2147.8171.5-66.5-179.7-173.4116-5.1110.8V175 S179 D208 Y209V175-R181 PolarHBondContact O-NH1 3.43Å; S179-R181 VanDerWaalsContact C-N 3.28Å; S179-R181 WeakPolarHBondContact OG-CG 3.43Å; S179-R181 PolarHBondContact OG-N 2.99Å; S179-R181 PolarHBondContact OG-NH1 3.47Å; R181-D208 IonicContact CZ-OD2 3.84Å; R181-D208 IonicContact NH1-OD2 2.76Å; R181-D208 PolarHBondContact NH1-OD2 3.43Å; R181-D208 VanDerWaalsContact NH2-CG 3.33Å; R181-D208 IonicContact NH2-OD1 2.7Å; R181-D208 PolarHBondContact NH2-OD1 2.83Å; R181-D208 IonicContact NH2-OD2 3.32Å; R181-D208 PolarHBondContact NH2-OD2 2.95Å; R181-Y209 WeakPolarHBondContact CD-OH 3.39Å; R181-Y209 VanDerWaalsContact CZ-CZ 3.49Å; R181-Y209 PolarHBondContact NE-OH 2.94Å; R181-Y209 VanDerWaalsContact NH2-CE2 3.34Å
182T90.8Very high92.6Very high71 Ų7149.2 Ų49.244%0.43626%0.256SS..  trans-106.213.2-177.358.90000113.2Y184 Q185 Y186T182-Y184 PolarHBondContact O-N 3.39Å; T182-Q185 VanDerWaalsContact CA-OE1 3.3Å; T182-Q185 PolarHBondContact O-N 2.91Å; T182-Q185 PolarHBondContact O-OE1 3.4Å; T182-Y186 PolarHBondContact O-N 2.98Å
183D90.4Very high92.1Very high9 Ų953.3 Ų53.35%0.04828%0.278CS..THydrogen-bonded Turntrans-62.8-30.1-174.6-61.4-5.7000112.4P187 V190 R261D183-P187 VanDerWaalsContact O-CA 3.27Å; D183-P187 WeakPolarHBondContact O-CA 3.32Å; D183-V190 HydrophobicContact CB-CG2 4.13Å; D183-R261 IonicContact OD1-CZ 3.85Å; D183-R261 IonicContact OD1-NE 3.19Å; D183-R261 PolarHBondContact OD1-NE 2.97Å; D183-R261 IonicContact OD1-NH2 2.71Å; D183-R261 PolarHBondContact OD1-NH2 3.06Å; D183-R261 WeakPolarHBondContact OD2-CG 3.39Å; D183-R261 IonicContact OD2-CZ 2.63Å; D183-R261 IonicContact OD2-NE 3.62Å; D183-R261 PolarHBondContact OD2-NE 2.94Å; D183-R261 IonicContact OD2-NH2 3.24Å
184Y91.1Very high91.6Very high65 Ų6552.4 Ų52.426%0.25527%0.273SS..THydrogen-bonded Turntrans-71.4-39.1174.7-177.1-97.7000112.2V176 T182 L265 F268 L269 K323V176-Y184 HydrophobicContact CG1-CD2 4.44Å; T182-Y184 PolarHBondContact O-N 3.39Å; Y184-L265 HydrophobicContact CD2-CD1 3.62Å; Y184-L265 HydrophobicContact CE2-CD1 4.43Å; Y184-L265 HydrophobicContact CG-CD1 4.48Å; Y184-F268 HydrophobicContact CD2-CD1 4.15Å; Y184-F268 AromaticContact CD2-CE1 3.87Å; Y184-F268 HydrophobicContact CD2-CE1 3.87Å; Y184-F268 HydrophobicContact CE2-CD1 4.24Å; Y184-F268 AromaticContact CE2-CE1 3.71Å; Y184-F268 HydrophobicContact CE2-CE1 3.71Å; Y184-L269 HydrophobicContact CE2-CD2 4.25Å; Y184-K323 HydrophobicContact CD2-CD 4.46Å; Y184-K323 HydrophobicContact CE2-CD 4.12Å; Y184-K323 PolarHBondContact O-NZ 3.49Å
185Q92.3Very high91.2Very high99 Ų9949.3 Ų49.346%0.46326%0.262SS..THydrogen-bonded Turntrans-76-44.7-179.7-65.982.3-9.200111.2T182 P187T182-Q185 VanDerWaalsContact CA-OE1 3.3Å; T182-Q185 PolarHBondContact O-N 2.91Å; T182-Q185 PolarHBondContact O-OE1 3.4Å; Q185-P187 VanDerWaalsContact C-CD 3.47Å; Q185-P187 VanDerWaalsContact O-CD 3.28Å; Q185-P187 WeakPolarHBondContact O-CD 3.41Å
186Y92.4Very high90.8Very high101 Ų10150.4 Ų50.440%0.39627%0.267SS..  trans-121.170-176.4-53.6-68.8000111.1N70 T182 L188 C189N70-Y186 HydrophobicContact CB-CD1 4.37Å; N70-Y186 HydrophobicContact CB-CE1 4.42Å; T182-Y186 PolarHBondContact O-N 2.98Å; Y186-L188 PolarHBondContact O-N 3.49Å; Y186-C189 WeakPolarHBondContact O-CB 3.31Å; Y186-C189 PolarHBondContact O-N 3.06Å
187P92.8Very high90.6Very high15 Ų1555.8 Ų55.810%0.09729%0.289CS..G310 helixtrans-65.2-25.6-174.128.4-36.8000113D183 Q185 C189 V190 L265 K323 A327D183-P187 VanDerWaalsContact O-CA 3.27Å; D183-P187 WeakPolarHBondContact O-CA 3.32Å; Q185-P187 VanDerWaalsContact C-CD 3.47Å; Q185-P187 VanDerWaalsContact O-CD 3.28Å; Q185-P187 WeakPolarHBondContact O-CD 3.41Å; P187-C189 PolarHBondContact O-N 2.86Å; P187-V190 VanDerWaalsContact O-CB 3.26Å; P187-V190 WeakPolarHBondContact O-CB 3.44Å; P187-V190 WeakPolarHBondContact O-CG2 3.32Å; P187-V190 PolarHBondContact O-N 2.82Å; P187-L265 HydrophobicContact CB-CD2 4.01Å; P187-K323 HydrophobicContact CB-CB 4.26Å; P187-K323 WeakPolarHBondContact CB-O 3.48Å; P187-K323 HydrophobicContact CG-CB 4.16Å; P187-K323 HydrophobicContact CG-CG 4.32Å; P187-A327 HydrophobicContact CB-CB 4.08Å; P187-A327 WeakPolarHBondContact O-CB 3.48Å
188L93.7Very high90.4Very high3 Ų355.9 Ų55.92%0.01629%0.287CS..G310 helixtrans-63.1-29.2174.8-68.5170.5000112.8H68 C69 D71 Y186 V190 Y326 W330 I334H68-L188 WeakPolarHBondContact O-CD1 3.42Å; C69-L188 HydrophobicContact CB-CB 4.42Å; D71-L188 HydrophobicContact CB-CD1 4.23Å; Y186-L188 PolarHBondContact O-N 3.49Å; L188-V190 PolarHBondContact O-N 2.9Å; L188-Y326 HydrophobicContact CD1-CD1 4.44Å; L188-Y326 HydrophobicContact CD1-CE1 3.95Å; L188-Y326 HydrophobicContact CD2-CD1 3.67Å; L188-Y326 HydrophobicContact CD2-CE1 3.74Å; L188-Y326 HydrophobicContact CG-CD1 4.22Å; L188-Y326 HydrophobicContact CG-CE1 4.21Å; L188-W330 HydrophobicContact CD2-CB 4.43Å; L188-I334 HydrophobicContact CB-CD1 4.2Å; L188-I334 HydrophobicContact CD2-CD1 4.38Å
189C91.6Very high90.3Very high16 Ų1650 Ų5011%0.10826%0.256CS..G310 helixtrans-69.7-8.9177.4-75.50000113.8C69 Y186 P187 F191 R192 R261C69-C189 HydrophobicContact CB-CB 4.48Å; C69-C189 WeakPolarHBondContact CB-SG 3.48Å; C69-C189 PolarHBondContact O-SG 3.24Å; Y186-C189 WeakPolarHBondContact O-CB 3.31Å; Y186-C189 PolarHBondContact O-N 3.06Å; P187-C189 PolarHBondContact O-N 2.86Å; C189-F191 PolarHBondContact O-N 2.78Å; C189-R192 WeakPolarHBondContact O-CB 3.28Å; C189-R192 PolarHBondContact O-N 2.99Å; C189-R261 PolarHBondContact O-NH1 3.41Å
190V91.3Very high90.2Very high8 Ų848.1 Ų48.15%0.04824%0.241CC..G310 helixtrans-60.9-31.1-173.6170.20000112.4D183 P187 L188 R261 A262D183-V190 HydrophobicContact CB-CG2 4.13Å; P187-V190 VanDerWaalsContact O-CB 3.26Å; P187-V190 WeakPolarHBondContact O-CB 3.44Å; P187-V190 WeakPolarHBondContact O-CG2 3.32Å; P187-V190 PolarHBondContact O-N 2.82Å; L188-V190 PolarHBondContact O-N 2.9Å; V190-R261 HydrophobicContact CG1-CB 3.52Å; V190-R261 HydrophobicContact CG2-CB 4.46Å; V190-R261 PolarHBondContact O-NH1 2.94Å; V190-A262 HydrophobicContact CG1-CB 3.81Å
191F91.2Very high90.3Very high5 Ų545.9 Ų45.92%0.02221%0.212CC..G310 helixtrans-93.9-5.3-178.8-65.7-87.5000114.6C189 N193 N194 I259 A262 A327 A332 C335 L336C189-F191 PolarHBondContact O-N 2.78Å; F191-N193 VanDerWaalsContact C-N 3.26Å; F191-N193 PolarHBondContact O-N 2.76Å; F191-N193 VanDerWaalsContact O-N 3.1Å; F191-N194 WeakPolarHBondContact O-CB 3.46Å; F191-N194 PolarHBondContact O-N 3.46Å; F191-I259 HydrophobicContact CE1-CB 4.39Å; F191-I259 HydrophobicContact CE1-CD1 4.11Å; F191-I259 HydrophobicContact CE1-CG1 3.95Å; F191-I259 HydrophobicContact CE1-CG2 3.61Å; F191-I259 HydrophobicContact CZ-CG2 3.64Å; F191-A262 HydrophobicContact CZ-CB 4.49Å; F191-A327 WeakPolarHBondContact CD2-O 3.43Å; F191-A327 HydrophobicContact CE2-CB 4.44Å; F191-A327 WeakPolarHBondContact CE2-O 3.28Å; F191-A332 HydrophobicContact CD1-CB 4.24Å; F191-A332 HydrophobicContact CD2-CB 4.38Å; F191-A332 HydrophobicContact CE1-CB 4.4Å; F191-A332 HydrophobicContact CG-CB 4.22Å; F191-C335 HydrophobicContact CB-CB 3.8Å; F191-L336 HydrophobicContact CD1-CD1 4.29Å
192R87.5Confident90.4Very high116 Ų11644.5 Ų44.544%0.43821%0.21SC..THydrogen-bonded Turntrans-54.9-37.3-168.4-175.9173-179168.60.9114.5L66 C189 C335L66-R192 HydrophobicContact CD2-CG 4.48Å; C189-R192 WeakPolarHBondContact O-CB 3.28Å; C189-R192 PolarHBondContact O-N 2.99Å; R192-C335 VanDerWaalsContact CA-SG 3.59Å
193N85.5Confident90.4Very high87 Ų8741.5 Ų41.547%0.46519%0.191SC..THydrogen-bonded Turntrans-104.86.3-176.9-68.5-22.8000113.1P28 F191 I195P28-N193 HydrophobicContact CB-CB 4.31Å; P28-N193 HydrophobicContact CG-CB 3.61Å; F191-N193 VanDerWaalsContact C-N 3.26Å; F191-N193 PolarHBondContact O-N 2.76Å; F191-N193 VanDerWaalsContact O-N 3.1Å; N193-I195 VanDerWaalsContact C-N 3.25Å; N193-I195 PolarHBondContact O-N 3.48Å
194N87.6Confident90.5Very high19 Ų1943 Ų4310%0.10220%0.201CC..  trans-88.158.1-175-1642.6000111.8F191 Y200 L257 R258 L336F191-N194 WeakPolarHBondContact O-CB 3.46Å; F191-N194 PolarHBondContact O-N 3.46Å; N194-Y200 WeakPolarHBondContact OD1-CE2 3.46Å; N194-Y200 VanDerWaalsContact OD1-CZ 3.27Å; N194-Y200 PolarHBondContact OD1-OH 3.36Å; N194-L257 PolarHBondContact ND2-O 3.2Å; N194-R258 PolarHBondContact ND2-O 2.9Å; N194-L336 WeakPolarHBondContact O-CD2 3.41Å
195I86.9Confident90.5Very high51 Ų5141.2 Ų41.226%0.26220%0.197SC..  trans-98.5123-178-57.9174.3000109.2N193 K197 L336N193-I195 VanDerWaalsContact C-N 3.25Å; N193-I195 PolarHBondContact O-N 3.48Å; I195-K197 HydrophobicContact CG2-CG 4.41Å; I195-K197 PolarHBondContact O-N 3.37Å; I195-L336 HydrophobicContact CG1-CD2 4.47Å
196F88.5Confident90.5Very high24 Ų2437 Ų3711%0.10518%0.178CC..  trans-64.7126.1176.7-166.4-96.1000111.2D44 F47 L48 F103 Y200 F201 E340D44-F196 HydrophobicContact CB-CE1 4.41Å; D44-F196 HydrophobicContact CB-CZ 4.38Å; F47-F196 HydrophobicContact CB-CE1 3.91Å; F47-F196 HydrophobicContact CB-CZ 4.25Å; L48-F196 HydrophobicContact CD2-CD1 3.99Å; L48-F196 HydrophobicContact CD2-CE1 4.13Å; F103-F196 HydrophobicContact CE2-CE2 4.37Å; F196-Y200 AromaticContact CD2-CD1 3.78Å; F196-Y200 HydrophobicContact CD2-CD1 3.78Å; F196-Y200 HydrophobicContact CD2-CD2 4.24Å; F196-Y200 HydrophobicContact CD2-CE1 4.26Å; F196-Y200 AromaticContact CD2-CG 3.76Å; F196-Y200 HydrophobicContact CD2-CG 3.76Å; F196-Y200 AromaticContact CE2-CD1 3.91Å; F196-Y200 HydrophobicContact CE2-CD1 3.91Å; F196-Y200 HydrophobicContact CE2-CG 4.11Å; F196-F201 HydrophobicContact CE2-CD2 4.35Å; F196-F201 AromaticContact CE2-CE2 3.57Å; F196-F201 HydrophobicContact CE2-CE2 3.57Å; F196-F201 AromaticContact CE2-CZ 3.84Å; F196-F201 HydrophobicContact CE2-CZ 3.84Å; F196-F201 AromaticContact CZ-CE2 3.99Å; F196-F201 HydrophobicContact CZ-CE2 3.99Å; F196-E340 HydrophobicContact CB-CB 3.89Å; F196-E340 HydrophobicContact CB-CG 3.76Å; F196-E340 HydrophobicContact CD1-CG 4.19Å; F196-E340 HydrophobicContact CG-CG 3.99Å
197K88.8Confident90.6Very high120 Ų12036.8 Ų36.852%0.52219%0.189SC..  trans-144166.2-179.8-66.2-176.7-179.3-178.80109.2I25 I195 G199 Y200I25-K197 HydrophobicContact CD1-CB 4.36Å; I195-K197 HydrophobicContact CG2-CG 4.41Å; I195-K197 PolarHBondContact O-N 3.37Å; K197-G199 PolarHBondContact O-N 3.49Å; K197-Y200 WeakPolarHBondContact O-CB 3.32Å; K197-Y200 PolarHBondContact O-N 3.1Å
198I91.2Very high90.7Very high58 Ų5837.6 Ų37.630%0.29719%0.193SC..THydrogen-bonded Turntrans-59.3127.7173.5-55.6176.3000109.2I36 R41 I45 L48I36-I198 HydrophobicContact CD1-CG2 4.37Å; I36-I198 WeakPolarHBondContact CD1-O 3.43Å; I36-I198 HydrophobicContact CG2-CG2 3.8Å; R41-I198 HydrophobicContact CG-CG2 4.46Å; I45-I198 HydrophobicContact CG1-CD1 4.36Å; L48-I198 HydrophobicContact CD1-CD1 3.84Å; L48-I198 HydrophobicContact CD1-CG1 3.55Å; L48-I198 HydrophobicContact CD2-CG1 4.19Å; L48-I198 HydrophobicContact CG-CG1 4.36Å
199G90.9Very high90.7Very high0 Ų037.7 Ų37.70%019%0.193CC..THydrogen-bonded Turntrans83.312.7-176.500000114.2D44 K197 F201 D202D44-G199 PolarHBondContact OD2-N 2.98Å; K197-G199 PolarHBondContact O-N 3.49Å; G199-F201 PolarHBondContact O-N 3.27Å; G199-D202 WeakPolarHBondContact CA-OD2 3.28Å; G199-D202 WeakPolarHBondContact O-CB 3.25Å; G199-D202 PolarHBondContact O-N 2.97Å
200Y90.9Very high90.9Very high14 Ų1438.8 Ų38.86%0.05520%0.195CC..THydrogen-bonded Turntrans-52.4-40.8178174.5-91.3000113N194 F196 K197 L257 R258N194-Y200 WeakPolarHBondContact OD1-CE2 3.46Å; N194-Y200 VanDerWaalsContact OD1-CZ 3.27Å; N194-Y200 PolarHBondContact OD1-OH 3.36Å; F196-Y200 AromaticContact CD2-CD1 3.78Å; F196-Y200 HydrophobicContact CD2-CD1 3.78Å; F196-Y200 HydrophobicContact CD2-CD2 4.24Å; F196-Y200 HydrophobicContact CD2-CE1 4.26Å; F196-Y200 AromaticContact CD2-CG 3.76Å; F196-Y200 HydrophobicContact CD2-CG 3.76Å; F196-Y200 AromaticContact CE2-CD1 3.91Å; F196-Y200 HydrophobicContact CE2-CD1 3.91Å; F196-Y200 HydrophobicContact CE2-CG 4.11Å; K197-Y200 WeakPolarHBondContact O-CB 3.32Å; K197-Y200 PolarHBondContact O-N 3.1Å; Y200-L257 PolarHBondContact OH-O 2.86Å; Y200-R258 HydrophobicContact CE1-CG 4.01Å; Y200-R258 HydrophobicContact CE2-CG 4.49Å
201F91.1Very high91.2Very high20 Ų2044.4 Ų44.49%0.08822%0.215CC..THydrogen-bonded Turntrans-80.9-14.4177.9-60.2-68.5000113.9R106 I107 S110 R112 F196 G199 L256R106-F201 HydrophobicContact CG-CE2 3.93Å; I107-F201 HydrophobicContact CG1-CZ 4.28Å; S110-F201 VanDerWaalsContact OG-CD2 3.28Å; S110-F201 WeakPolarHBondContact OG-CD2 3.36Å; S110-F201 WeakPolarHBondContact OG-CG 3.48Å; R112-F201 PolarHBondContact NH2-O 2.94Å; F196-F201 HydrophobicContact CE2-CD2 4.35Å; F196-F201 AromaticContact CE2-CE2 3.57Å; F196-F201 HydrophobicContact CE2-CE2 3.57Å; F196-F201 AromaticContact CE2-CZ 3.84Å; F196-F201 HydrophobicContact CE2-CZ 3.84Å; F196-F201 AromaticContact CZ-CE2 3.99Å; F196-F201 HydrophobicContact CZ-CE2 3.99Å; G199-F201 PolarHBondContact O-N 3.27Å; F201-L256 WeakPolarHBondContact CD1-O 3.4Å; F201-L256 WeakPolarHBondContact CE1-O 3.22Å
202D91.6Very high91.5Very high34 Ų3444.2 Ų44.218%0.18221%0.214CC..THydrogen-bonded Turntrans-74.9-29.1-179.1-62.7-32.7000111.4I36 S37 S40 R112 G199 P204I36-D202 WeakPolarHBondContact CA-OD2 3.33Å; S37-D202 WeakPolarHBondContact CB-OD1 3.49Å; S37-D202 PolarHBondContact N-OD2 2.99Å; S37-D202 PolarHBondContact OG-OD1 3.38Å; S37-D202 PolarHBondContact OG-OD2 3.29Å; S40-D202 WeakPolarHBondContact CB-OD2 3.29Å; S40-D202 VanDerWaalsContact OG-CG 3.28Å; S40-D202 PolarHBondContact OG-OD1 3.02Å; S40-D202 PolarHBondContact OG-OD2 3.5Å; R112-D202 PolarHBondContact NH2-O 2.78Å; G199-D202 WeakPolarHBondContact CA-OD2 3.28Å; G199-D202 WeakPolarHBondContact O-CB 3.25Å; G199-D202 PolarHBondContact O-N 2.97Å; D202-P204 WeakPolarHBondContact O-CD 3.45Å
203I91.8Very high92Very high7 Ų738.7 Ų38.74%0.03619%0.194CC..SBendtrans-62120.9179-62.9177.9000110I25 D27 Y34 R112 R258I25-I203 HydrophobicContact CB-CD1 4.31Å; I25-I203 HydrophobicContact CD1-CD1 3.56Å; I25-I203 HydrophobicContact CD1-CG1 4.2Å; I25-I203 HydrophobicContact CG1-CD1 3.72Å; I25-I203 HydrophobicContact CG1-CG1 4.44Å; I25-I203 HydrophobicContact CG2-CD1 3.77Å; I25-I203 HydrophobicContact CG2-CG1 3.52Å; D27-I203 HydrophobicContact CB-CD1 4.09Å; D27-I203 HydrophobicContact CB-CG2 3.8Å; Y34-I203 HydrophobicContact CD2-CB 4.41Å; Y34-I203 HydrophobicContact CD2-CG1 4.08Å; Y34-I203 HydrophobicContact CD2-CG2 4.01Å; Y34-I203 HydrophobicContact CE2-CG2 4Å; R112-I203 PolarHBondContact NH2-O 3.41Å; I203-R258 VanDerWaalsContact CG2-NH1 3.32Å
204P91.7Very high92.5Very high42 Ų4234.5 Ų34.527%0.27317%0.171SC..PPolyproline II helixtrans-71.2145.3179.230.1-34.3000111.1Y34 D202Y34-P204 VanDerWaalsContact CD1-CD 3.49Å; Y34-P204 HydrophobicContact CD1-CG 3.86Å; Y34-P204 VanDerWaalsContact CE1-CD 3.45Å; Y34-P204 HydrophobicContact CE1-CG 3.34Å; Y34-P204 HydrophobicContact CE2-CG 4.34Å; D202-P204 WeakPolarHBondContact O-CD 3.45Å
205T91.9Very high93Very high27 Ų2735.4 Ų35.417%0.16618%0.176CC..PPolyproline II helixtrans-62.3134.2170.3-49.50000110L255T205-L255 HydrophobicContact CG2-CD1 3.52Å; T205-L255 WeakPolarHBondContact OG1-CD1 3.28Å
206P92.4Very high93.5Very high10 Ų1033 Ų337%0.06516%0.164CC..PPolyproline II helixtrans-55.7145.5174.8-23.231.3000112.1T30 D208 Y209 Y210T30-P206 HydrophobicContact CG2-CB 4.41Å; T30-P206 HydrophobicContact CG2-CG 4.05Å; P206-D208 VanDerWaalsContact C-N 3.29Å; P206-D208 PolarHBondContact O-N 3.31Å; P206-D208 VanDerWaalsContact O-N 3.15Å; P206-Y209 HydrophobicContact CB-CD2 3.85Å; P206-Y209 HydrophobicContact CG-CD2 3.83Å; P206-Y209 HydrophobicContact CG-CE2 4.33Å; P206-Y209 PolarHBondContact O-N 3.22Å; P206-Y210 WeakPolarHBondContact O-CB 3.44Å; P206-Y210 PolarHBondContact O-N 2.86Å
207P93.6Very high94Very high96 Ų9632.2 Ų32.262%0.62316%0.161SC*.Hα-helixtrans-58.7-34.1-167.2-2835.2000115.5Y210 W211P207-Y210 PolarHBondContact O-N 3.42Å; P207-W211 PolarHBondContact O-N 2.86Å
208D94.6Very high94.4Very high32 Ų3226.5 Ų26.517%0.17114%0.136CC..Hα-helixtrans-71.8-42.5-179.463-30.6000112.1V175 R181 P206 L212V175-D208 HydrophobicContact CG2-CB 4.18Å; R181-D208 IonicContact CZ-OD2 3.84Å; R181-D208 IonicContact NH1-OD2 2.76Å; R181-D208 PolarHBondContact NH1-OD2 3.43Å; R181-D208 VanDerWaalsContact NH2-CG 3.33Å; R181-D208 IonicContact NH2-OD1 2.7Å; R181-D208 PolarHBondContact NH2-OD1 2.83Å; R181-D208 IonicContact NH2-OD2 3.32Å; R181-D208 PolarHBondContact NH2-OD2 2.95Å; P206-D208 VanDerWaalsContact C-N 3.29Å; P206-D208 PolarHBondContact O-N 3.31Å; P206-D208 VanDerWaalsContact O-N 3.15Å; D208-L212 VanDerWaalsContact O-CB 3.28Å; D208-L212 WeakPolarHBondContact O-CB 3.34Å; D208-L212 PolarHBondContact O-N 3.38Å; D208-L212 VanDerWaalsContact O-N 3.08Å
209Y95Very high94.7Very high5 Ų524 Ų242%0.0212%0.122CC..Hα-helixtrans-62.1-45.1169-67.8-60.7000111.4V175 R181 P206 W211 L212 Y213 H260 V264V175-Y209 HydrophobicContact CG1-CD1 3.86Å; V175-Y209 HydrophobicContact CG1-CE1 3.6Å; R181-Y209 WeakPolarHBondContact CD-OH 3.39Å; R181-Y209 VanDerWaalsContact CZ-CZ 3.49Å; R181-Y209 PolarHBondContact NE-OH 2.94Å; R181-Y209 VanDerWaalsContact NH2-CE2 3.34Å; P206-Y209 HydrophobicContact CB-CD2 3.85Å; P206-Y209 HydrophobicContact CG-CD2 3.83Å; P206-Y209 HydrophobicContact CG-CE2 4.33Å; P206-Y209 PolarHBondContact O-N 3.22Å; Y209-W211 PolarHBondContact O-N 3.46Å; Y209-L212 PolarHBondContact O-N 3.03Å; Y209-Y213 WeakPolarHBondContact O-CB 3.28Å; Y209-Y213 VanDerWaalsContact O-CD2 3.28Å; Y209-Y213 WeakPolarHBondContact O-CD2 3.46Å; Y209-Y213 PolarHBondContact O-N 3.48Å; Y209-H260 AromaticContact CD1-CD2 3.81Å; Y209-H260 AromaticContact CD2-CD2 3.49Å; Y209-H260 VanDerWaalsContact CD2-CD2 3.49Å; Y209-H260 WeakPolarHBondContact CD2-CD2 3.42Å; Y209-H260 AromaticContact CD2-NE2 3.83Å; Y209-H260 AromaticContact CE2-CD2 3.76Å; Y209-H260 AromaticContact CE2-NE2 3.94Å; Y209-H260 AromaticContact CG-CD2 3.53Å; Y209-V264 HydrophobicContact CD1-CG2 3.49Å; Y209-V264 VanDerWaalsContact CD1-CG2 3.49Å; Y209-V264 HydrophobicContact CE1-CB 4.29Å; Y209-V264 HydrophobicContact CE1-CG2 3.7Å
210Y95.7Very high95Very high40 Ų4025 Ų2516%0.15713%0.127CC..Hα-helixtrans-55.6-52.2-179.7179.2-93.6000112.2Q115 H118 P206 P207 T214Q115-Y210 HydrophobicContact CB-CE2 4.01Å; Q115-Y210 HydrophobicContact CG-CE2 4.05Å; H118-Y210 PolarHBondContact CE1-OH 3.13Å; H118-Y210 AromaticContact ND1-CE1 3.94Å; H118-Y210 AromaticContact ND1-CZ 3.74Å; H118-Y210 PolarHBondContact ND1-OH 2.86Å; P206-Y210 WeakPolarHBondContact O-CB 3.44Å; P206-Y210 PolarHBondContact O-N 2.86Å; P207-Y210 PolarHBondContact O-N 3.42Å; Y210-T214 VanDerWaalsContact O-CB 3.3Å; Y210-T214 WeakPolarHBondContact O-CB 3.36Å; Y210-T214 PolarHBondContact O-N 3.08Å; Y210-T214 PolarHBondContact O-OG1 3.26Å
211W96.9Very high95.3Very high126 Ų12627 Ų2748%0.47714%0.138SC..Hα-helixtrans-70.4-38.4-178.7-75.1117000112.5F171 P207 Y209 T214 L215F171-W211 HydrophobicContact CE1-CB 4.21Å; F171-W211 HydrophobicContact CZ-CB 4.13Å; P207-W211 PolarHBondContact O-N 2.86Å; Y209-W211 PolarHBondContact O-N 3.46Å; W211-T214 HydrophobicContact CE3-CG2 4.49Å; W211-T214 PolarHBondContact O-N 3.49Å; W211-L215 WeakPolarHBondContact O-CB 3.48Å; W211-L215 VanDerWaalsContact O-CG 3.25Å; W211-L215 WeakPolarHBondContact O-CG 3.37Å; W211-L215 PolarHBondContact O-N 2.98Å
212L97.5Very high95.6Very high0 Ų026.2 Ų26.20%013%0.134CC..Hα-helixtrans-59.1-50175.1-173.589.3000111M168 F171 D208 Y209 L215 Q216 V264 L267M168-L212 HydrophobicContact CE-CD1 4.09Å; M168-L212 HydrophobicContact CE-CG 4.43Å; F171-L212 HydrophobicContact CB-CD1 3.74Å; F171-L212 HydrophobicContact CD1-CB 4.3Å; F171-L212 HydrophobicContact CD1-CD1 3.53Å; F171-L212 HydrophobicContact CD1-CG 4.5Å; F171-L212 HydrophobicContact CD2-CD1 3.95Å; F171-L212 HydrophobicContact CE1-CB 3.92Å; F171-L212 HydrophobicContact CE1-CD1 4.04Å; F171-L212 HydrophobicContact CE2-CB 4.47Å; F171-L212 HydrophobicContact CE2-CD1 4.38Å; F171-L212 HydrophobicContact CG-CD1 3.46Å; F171-L212 VanDerWaalsContact CG-CD1 3.46Å; F171-L212 HydrophobicContact CZ-CB 4Å; F171-L212 HydrophobicContact CZ-CD1 4.42Å; D208-L212 VanDerWaalsContact O-CB 3.28Å; D208-L212 WeakPolarHBondContact O-CB 3.34Å; D208-L212 PolarHBondContact O-N 3.38Å; D208-L212 VanDerWaalsContact O-N 3.08Å; Y209-L212 PolarHBondContact O-N 3.03Å; L212-L215 PolarHBondContact O-N 3.08Å; L212-Q216 WeakPolarHBondContact O-CB 3.42Å; L212-Q216 PolarHBondContact O-N 3.3Å; L212-V264 HydrophobicContact CD2-CB 4.09Å; L212-V264 HydrophobicContact CD2-CG1 3.54Å; L212-V264 HydrophobicContact CD2-CG2 3.47Å; L212-V264 VanDerWaalsContact CD2-CG2 3.47Å; L212-L267 HydrophobicContact CD2-CD1 4.04Å
213Y97.3Very high95.8Very high0 Ų025 Ų250%013%0.128CC..Hα-helixtrans-63.7-42.6178.6-90.5-104.2000112.3Y209 L215 Q216 L217 L251 S254 L255 H260 G263 V264Y209-Y213 WeakPolarHBondContact O-CB 3.28Å; Y209-Y213 VanDerWaalsContact O-CD2 3.28Å; Y209-Y213 WeakPolarHBondContact O-CD2 3.46Å; Y209-Y213 PolarHBondContact O-N 3.48Å; Y213-L215 PolarHBondContact O-N 2.92Å; Y213-Q216 PolarHBondContact O-N 3.44Å; Y213-L217 VanDerWaalsContact O-CB 3.29Å; Y213-L217 WeakPolarHBondContact O-CB 3.42Å; Y213-L217 WeakPolarHBondContact O-CG 3.47Å; Y213-L217 PolarHBondContact O-N 3.36Å; Y213-L251 HydrophobicContact CD1-CB 4.29Å; Y213-L251 HydrophobicContact CD1-CD2 3.73Å; Y213-L251 WeakPolarHBondContact CD1-O 3.43Å; Y213-L251 HydrophobicContact CE1-CB 4.35Å; Y213-L251 HydrophobicContact CE1-CD2 3.58Å; Y213-L251 VanDerWaalsContact CE1-O 3.3Å; Y213-L251 WeakPolarHBondContact CE1-O 3.39Å; Y213-S254 VanDerWaalsContact CE1-OG 3.31Å; Y213-S254 WeakPolarHBondContact CE1-OG 3.18Å; Y213-S254 PolarHBondContact OH-OG 3.15Å; Y213-L255 HydrophobicContact CD1-CB 4.25Å; Y213-L255 HydrophobicContact CD1-CD1 4.47Å; Y213-L255 HydrophobicContact CE1-CB 4.47Å; Y213-L255 HydrophobicContact CG-CD1 4.37Å; Y213-H260 HydrophobicContact CE2-CB 3.79Å; Y213-H260 WeakPolarHBondContact OH-CA 3.3Å; Y213-H260 PolarHBondContact OH-O 3.31Å; Y213-G263 WeakPolarHBondContact OH-CA 3.44Å; Y213-V264 HydrophobicContact CD2-CG2 4.26Å; Y213-V264 HydrophobicContact CE2-CG2 3.49Å; Y213-V264 VanDerWaalsContact CE2-CG2 3.49Å; Y213-V264 PolarHBondContact OH-N 3.44Å
214T97.4Very high96Very high0 Ų026.2 Ų26.20%014%0.135CC..Hα-helixtrans-60.1-46.7178.9-62.30000111.2H118 Y210 W211 G218H118-T214 HydrophobicContact CB-CG2 3.52Å; Y210-T214 VanDerWaalsContact O-CB 3.3Å; Y210-T214 WeakPolarHBondContact O-CB 3.36Å; Y210-T214 PolarHBondContact O-N 3.08Å; Y210-T214 PolarHBondContact O-OG1 3.26Å; W211-T214 HydrophobicContact CE3-CG2 4.49Å; W211-T214 PolarHBondContact O-N 3.49Å; T214-G218 PolarHBondContact O-N 3.41Å
215L97.8Very high96.2Very high37 Ų3729.5 Ų29.519%0.19414%0.142CC..Hα-helixtrans-64.8-41.4177.7-70.1174.6000111.8T122 W164 F167 M168 F171 W211 L212 Y213 G218 F219T122-L215 HydrophobicContact CG2-CD2 3.97Å; W164-L215 HydrophobicContact CH2-CD2 4.33Å; W164-L215 HydrophobicContact CZ2-CB 4.33Å; W164-L215 HydrophobicContact CZ2-CD2 4.41Å; F167-L215 HydrophobicContact CE1-CD1 4.26Å; M168-L215 HydrophobicContact CE-CB 3.71Å; M168-L215 HydrophobicContact SD-CB 3.86Å; M168-L215 HydrophobicContact SD-CD1 4.32Å; F171-L215 HydrophobicContact CD1-CD1 4.11Å; F171-L215 HydrophobicContact CE1-CD1 3.98Å; W211-L215 WeakPolarHBondContact O-CB 3.48Å; W211-L215 VanDerWaalsContact O-CG 3.25Å; W211-L215 WeakPolarHBondContact O-CG 3.37Å; W211-L215 PolarHBondContact O-N 2.98Å; L212-L215 PolarHBondContact O-N 3.08Å; Y213-L215 PolarHBondContact O-N 2.92Å; L215-G218 PolarHBondContact O-N 3.4Å; L215-F219 WeakPolarHBondContact O-CB 3.44Å; L215-F219 PolarHBondContact O-N 2.95Å
216Q97.6Very high96.4Very high1 Ų128.3 Ų28.31%0.00514%0.135CC..Hα-helixtrans-67.3-47.9179.3-160.968.834.500111.7M168 L212 Y213 G218 F219 Y220 L251 L267M168-Q216 HydrophobicContact CE-CB 4.03Å; L212-Q216 WeakPolarHBondContact O-CB 3.42Å; L212-Q216 PolarHBondContact O-N 3.3Å; Y213-Q216 PolarHBondContact O-N 3.44Å; Q216-G218 VanDerWaalsContact C-N 3.33Å; Q216-G218 PolarHBondContact O-N 2.79Å; Q216-F219 PolarHBondContact O-N 2.86Å; Q216-Y220 HydrophobicContact CG-CD2 3.79Å; Q216-Y220 HydrophobicContact CG-CE2 3.67Å; Q216-Y220 VanDerWaalsContact O-CD2 3.28Å; Q216-Y220 WeakPolarHBondContact O-CD2 3.47Å; Q216-Y220 PolarHBondContact O-N 3.42Å; Q216-L251 HydrophobicContact CB-CD1 4.18Å; Q216-L251 HydrophobicContact CB-CD2 4.46Å; Q216-L251 HydrophobicContact CG-CD1 3.77Å; Q216-L251 HydrophobicContact CG-CD2 4.24Å; Q216-L267 HydrophobicContact CB-CD1 4.29Å; Q216-L267 HydrophobicContact CG-CD1 3.92Å; Q216-L267 HydrophobicContact CG-CD2 3.68Å; Q216-L267 HydrophobicContact CG-CG 4.45Å
217L97.9Very high96.4Very high8 Ų828 Ų284%0.04213%0.133CC..Hα-helixtrans-56.3-47.8174.7-79.1166000110.9A119 Y213 F219 Y220 L221 L248 L251A119-L217 HydrophobicContact CB-CB 3.83Å; A119-L217 HydrophobicContact CB-CD1 4.49Å; Y213-L217 VanDerWaalsContact O-CB 3.29Å; Y213-L217 WeakPolarHBondContact O-CB 3.42Å; Y213-L217 WeakPolarHBondContact O-CG 3.47Å; Y213-L217 PolarHBondContact O-N 3.36Å; L217-F219 VanDerWaalsContact C-N 3.32Å; L217-F219 PolarHBondContact O-N 3.24Å; L217-Y220 PolarHBondContact O-N 3.37Å; L217-L221 WeakPolarHBondContact O-CG 3.15Å; L217-L221 PolarHBondContact O-N 2.9Å; L217-L248 HydrophobicContact CD2-CD2 3.99Å; L217-L251 HydrophobicContact CD2-CB 3.53Å; L217-L251 HydrophobicContact CD2-CD1 4.1Å; L217-L251 HydrophobicContact CD2-CG 4.46Å; L217-L251 HydrophobicContact CG-CB 3.97Å; L217-L251 HydrophobicContact CG-CD1 4.25Å
218G97.9Very high96.4Very high0 Ų028.1 Ų28.10%012%0.124CC..Hα-helixtrans-58.9-41.8176.700000112.8A119 G123 T214 L215 Q216 L221 H222A119-G218 WeakPolarHBondContact O-CA 3.36Å; G123-G218 VanDerWaalsContact CA-O 3.22Å; G123-G218 WeakPolarHBondContact CA-O 3.1Å; T214-G218 PolarHBondContact O-N 3.41Å; L215-G218 PolarHBondContact O-N 3.4Å; Q216-G218 VanDerWaalsContact C-N 3.33Å; Q216-G218 PolarHBondContact O-N 2.79Å; G218-L221 PolarHBondContact O-N 3.32Å; G218-H222 WeakPolarHBondContact O-CB 3.44Å; G218-H222 PolarHBondContact O-N 2.9Å
219F97.2Very high96.3Very high4 Ų433.4 Ų33.42%0.01815%0.145CC..Hα-helixtrans-68.8-39176.1179.1-103.7000113.6L126 W164 F165 L215 Q216 L217 L221 H222 S223L126-F219 HydrophobicContact CD1-CB 4.02Å; L126-F219 HydrophobicContact CD1-CD2 4.26Å; W164-F219 HydrophobicContact CB-CD2 4.16Å; W164-F219 HydrophobicContact CB-CE2 3.71Å; W164-F219 HydrophobicContact CB-CZ 4.19Å; W164-F219 AromaticContact CD1-CD1 3.57Å; W164-F219 AromaticContact CD1-CD2 3.02Å; W164-F219 AromaticContact CD1-CE1 3.86Å; W164-F219 AromaticContact CD1-CE2 3.33Å; W164-F219 AromaticContact CD1-CG 3.13Å; W164-F219 AromaticContact CD1-CZ 3.74Å; W164-F219 HydrophobicContact CD2-CD2 4.08Å; W164-F219 AromaticContact CE2-CD2 3.98Å; W164-F219 AromaticContact CG-CD2 3.47Å; W164-F219 HydrophobicContact CG-CD2 3.47Å; W164-F219 VanDerWaalsContact CG-CD2 3.47Å; W164-F219 AromaticContact CG-CE2 3.55Å; W164-F219 HydrophobicContact CG-CE2 3.55Å; W164-F219 HydrophobicContact CG-CG 4.04Å; W164-F219 HydrophobicContact CG-CZ 4.2Å; W164-F219 AromaticContact NE1-CD1 3.88Å; W164-F219 AromaticContact NE1-CD2 3.33Å; W164-F219 VanDerWaalsContact NE1-CD2 3.33Å; W164-F219 AromaticContact NE1-CG 3.16Å; F165-F219 HydrophobicContact CD1-CE1 4.23Å; F165-F219 HydrophobicContact CD1-CZ 4.48Å; F165-F219 AromaticContact CE1-CE1 3.6Å; F165-F219 HydrophobicContact CE1-CE1 3.6Å; F165-F219 AromaticContact CE1-CZ 3.96Å; F165-F219 HydrophobicContact CE1-CZ 3.96Å; F165-F219 HydrophobicContact CZ-CE1 4.26Å; F165-F219 HydrophobicContact CZ-CZ 4.31Å; L215-F219 WeakPolarHBondContact O-CB 3.44Å; L215-F219 PolarHBondContact O-N 2.95Å; Q216-F219 PolarHBondContact O-N 2.86Å; L217-F219 VanDerWaalsContact C-N 3.32Å; L217-F219 PolarHBondContact O-N 3.24Å; F219-L221 VanDerWaalsContact C-N 3.34Å; F219-H222 PolarHBondContact O-N 2.92Å; F219-S223 WeakPolarHBondContact CE1-OG 3.41Å; F219-S223 WeakPolarHBondContact CZ-OG 3.41Å; F219-S223 VanDerWaalsContact O-CB 3.25Å; F219-S223 WeakPolarHBondContact O-CB 3.49Å; F219-S223 PolarHBondContact O-N 2.96Å; F219-S223 PolarHBondContact O-OG 3.46Å
220Y97Very high96Very high23 Ų2336.3 Ų36.39%0.0916%0.16CC..Hα-helixtrans-65.9-37.5175-88.1-82.4000111.6Q216 L217 S223 L224 H243 H244 A247 L248 L251Q216-Y220 HydrophobicContact CG-CD2 3.79Å; Q216-Y220 HydrophobicContact CG-CE2 3.67Å; Q216-Y220 VanDerWaalsContact O-CD2 3.28Å; Q216-Y220 WeakPolarHBondContact O-CD2 3.47Å; Q216-Y220 PolarHBondContact O-N 3.42Å; L217-Y220 PolarHBondContact O-N 3.37Å; Y220-S223 PolarHBondContact O-N 3.44Å; Y220-L224 VanDerWaalsContact O-CB 3.3Å; Y220-L224 WeakPolarHBondContact O-CB 3.35Å; Y220-L224 PolarHBondContact O-N 2.8Å; Y220-H243 AromaticContact CE1-NE2 3.84Å; Y220-H244 AromaticContact CD1-ND1 3.3Å; Y220-H244 VanDerWaalsContact CD1-ND1 3.3Å; Y220-H244 WeakPolarHBondContact CD1-ND1 3.48Å; Y220-H244 AromaticContact CE1-ND1 3.79Å; Y220-A247 HydrophobicContact CD1-CB 3.59Å; Y220-A247 HydrophobicContact CE1-CB 3.26Å; Y220-A247 HydrophobicContact CE2-CB 4.21Å; Y220-A247 HydrophobicContact CG-CB 4.26Å; Y220-L248 VanDerWaalsContact CB-CD2 3.49Å; Y220-L251 HydrophobicContact CD2-CD1 3.58Å; Y220-L251 HydrophobicContact CE2-CD1 3.91Å; Y220-L251 HydrophobicContact CG-CD1 4.42Å
221L97.7Very high95.6Very high56 Ų5635.1 Ų35.129%0.29316%0.156SC..Hα-helixtrans-63.4-48.6172.6-73167.2000111.4A119 L120 L217 G218 F219 S223 L224 W225 L248A119-L221 HydrophobicContact CB-CD1 4.43Å; L120-L221 HydrophobicContact CD2-CD1 4.03Å; L217-L221 WeakPolarHBondContact O-CG 3.15Å; L217-L221 PolarHBondContact O-N 2.9Å; G218-L221 PolarHBondContact O-N 3.32Å; F219-L221 VanDerWaalsContact C-N 3.34Å; L221-S223 VanDerWaalsContact C-N 3.33Å; L221-S223 PolarHBondContact O-N 3.5Å; L221-L224 PolarHBondContact O-N 2.89Å; L221-W225 PolarHBondContact O-N 3.28Å; L221-L248 HydrophobicContact CD2-CD1 3.98Å; L221-L248 HydrophobicContact CD2-CD2 4.1Å; L221-L248 HydrophobicContact CG-CD2 3.86Å
222H97.2Very high94.9Very high3 Ų332 Ų321%0.01415%0.154CC..Hα-helixtrans-58.5-44.2174.816662.4000112.1L126 T127 R130 W160 G218 F219 W225 S226L126-H222 HydrophobicContact CB-CB 4.09Å; T127-H222 WeakPolarHBondContact CA-ND1 3.37Å; T127-H222 PolarHBondContact N-ND1 3.25Å; T127-H222 PolarHBondContact OG1-ND1 3.19Å; R130-H222 VanDerWaalsContact CD-CE1 3.45Å; R130-H222 WeakPolarHBondContact CD-CE1 3.44Å; R130-H222 VanDerWaalsContact CD-NE2 3.3Å; R130-H222 WeakPolarHBondContact CD-NE2 3.41Å; W160-H222 AromaticContact CE2-NE2 3.65Å; W160-H222 AromaticContact CZ2-NE2 3.78Å; W160-H222 AromaticContact NE1-CD2 3.68Å; W160-H222 AromaticContact NE1-NE2 3.09Å; W160-H222 PolarHBondContact NE1-NE2 3.4Å; G218-H222 WeakPolarHBondContact O-CB 3.44Å; G218-H222 PolarHBondContact O-N 2.9Å; F219-H222 PolarHBondContact O-N 2.92Å; H222-W225 PolarHBondContact O-N 3.36Å; H222-S226 PolarHBondContact CE1-OG 2.87Å; H222-S226 PolarHBondContact NE2-OG 3.18Å; H222-S226 WeakPolarHBondContact O-CB 3.18Å; H222-S226 PolarHBondContact O-N 3.4Å; H222-S226 PolarHBondContact O-OG 3.29Å
223S95.8Very high94.5Very high8 Ų837.9 Ų37.96%0.05618%0.176CC..Hα-helixtrans-67.8-41.2-179-610000111.2F219 Y220 L221 W225 S226 V227 H244F219-S223 WeakPolarHBondContact CE1-OG 3.41Å; F219-S223 WeakPolarHBondContact CZ-OG 3.41Å; F219-S223 VanDerWaalsContact O-CB 3.25Å; F219-S223 WeakPolarHBondContact O-CB 3.49Å; F219-S223 PolarHBondContact O-N 2.96Å; F219-S223 PolarHBondContact O-OG 3.46Å; Y220-S223 PolarHBondContact O-N 3.44Å; L221-S223 VanDerWaalsContact C-N 3.33Å; L221-S223 PolarHBondContact O-N 3.5Å; S223-W225 PolarHBondContact O-N 3.19Å; S223-S226 PolarHBondContact O-N 3.46Å; S223-V227 WeakPolarHBondContact O-CG2 3.47Å; S223-V227 PolarHBondContact O-N 3.05Å; S223-H244 WeakPolarHBondContact CB-CE1 3.4Å
224L96.7Very high93.9Very high33 Ų3339.4 Ų39.417%0.17318%0.182CC..Hα-helixtrans-59.2-47.6174.2-179.661.2000111.1Y220 L221 S226 V227 F228 V241 H244 L248Y220-L224 VanDerWaalsContact O-CB 3.3Å; Y220-L224 WeakPolarHBondContact O-CB 3.35Å; Y220-L224 PolarHBondContact O-N 2.8Å; L221-L224 PolarHBondContact O-N 2.89Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 3.31Å; L224-V227 PolarHBondContact O-N 2.99Å; L224-F228 HydrophobicContact CD1-CE2 3.81Å; L224-F228 HydrophobicContact CG-CE2 4.33Å; L224-F228 WeakPolarHBondContact O-CD2 3.43Å; L224-V241 HydrophobicContact CD1-CG1 4.02Å; L224-H244 HydrophobicContact CB-CB 4.2Å; L224-H244 HydrophobicContact CD1-CB 3.99Å; L224-L248 HydrophobicContact CD2-CD1 3.97Å
225W96.2Very high93.5Very high111 Ų11145.1 Ų45.142%0.4221%0.206SC..Hα-helixtrans-61.2-42.9174.6-176.288000111.8T127 L221 H222 S223 V227 F228 F229 M230T127-W225 HydrophobicContact CG2-CD2 4.24Å; T127-W225 HydrophobicContact CG2-CE3 3.53Å; T127-W225 HydrophobicContact CG2-CH2 3.74Å; T127-W225 HydrophobicContact CG2-CZ2 4.41Å; T127-W225 HydrophobicContact CG2-CZ3 3.23Å; L221-W225 PolarHBondContact O-N 3.28Å; H222-W225 PolarHBondContact O-N 3.36Å; S223-W225 PolarHBondContact O-N 3.19Å; W225-V227 VanDerWaalsContact C-N 3.32Å; W225-V227 PolarHBondContact O-N 3.04Å; W225-F228 PolarHBondContact O-N 3.46Å; W225-F228 VanDerWaalsContact O-N 3.13Å; W225-F229 AromaticContact CD1-CD2 3.55Å; W225-F229 AromaticContact CD1-CE2 3.69Å; W225-F229 AromaticContact CD2-CD2 3.91Å; W225-F229 HydrophobicContact CD2-CD2 3.91Å; W225-F229 AromaticContact CE2-CD2 3.55Å; W225-F229 AromaticContact CG-CD2 3.92Å; W225-F229 HydrophobicContact CG-CD2 3.92Å; W225-F229 HydrophobicContact CG-CE2 4.41Å; W225-F229 HydrophobicContact CH2-CB 4.21Å; W225-F229 HydrophobicContact CZ2-CB 4.04Å; W225-F229 HydrophobicContact CZ2-CD2 4.13Å; W225-F229 HydrophobicContact CZ2-CG 4.29Å; W225-F229 AromaticContact NE1-CD2 3.3Å; W225-F229 VanDerWaalsContact NE1-CD2 3.3Å; W225-F229 AromaticContact NE1-CE2 3.59Å; W225-F229 VanDerWaalsContact O-CD2 3.28Å; W225-F229 WeakPolarHBondContact O-CD2 3.3Å; W225-F229 PolarHBondContact O-N 3.38Å; W225-F229 VanDerWaalsContact O-N 3.14Å; W225-M230 HydrophobicContact CE3-CG 4.29Å; W225-M230 HydrophobicContact CE3-SD 4.28Å; W225-M230 HydrophobicContact CH2-CG 4.23Å; W225-M230 HydrophobicContact CH2-SD 4.49Å; W225-M230 HydrophobicContact CZ3-CG 3.56Å; W225-M230 HydrophobicContact CZ3-SD 3.55Å; W225-M230 VanDerWaalsContact CZ3-SD 3.55Å
226S94.3Very high93.2Very high2 Ų243.7 Ų43.71%0.01420%0.199CC..Hα-helixtrans-63.1-36.3-180-61.30000112.4H222 S223 L224 F228 F229 M230 D231H222-S226 PolarHBondContact CE1-OG 2.87Å; H222-S226 PolarHBondContact NE2-OG 3.18Å; H222-S226 WeakPolarHBondContact O-CB 3.18Å; H222-S226 PolarHBondContact O-N 3.4Å; H222-S226 PolarHBondContact O-OG 3.29Å; S223-S226 PolarHBondContact O-N 3.46Å; L224-S226 VanDerWaalsContact C-N 3.34Å; L224-S226 PolarHBondContact O-N 3.31Å; S226-F228 PolarHBondContact O-N 2.87Å; S226-F229 PolarHBondContact O-N 3.02Å; S226-M230 CarbonylContact O-C 3.55Å; S226-M230 WeakPolarHBondContact O-CA 3.25Å; S226-M230 PolarHBondContact O-N 2.87Å; S226-D231 PolarHBondContact O-N 2.84Å
227V93Very high93Very high4 Ų443.8 Ų43.82%0.02420%0.2CC..Hα-helixtrans-59.5-35.6175.4171.20000112S223 L224 W225 W233 L240 V241S223-V227 WeakPolarHBondContact O-CG2 3.47Å; S223-V227 PolarHBondContact O-N 3.05Å; L224-V227 PolarHBondContact O-N 2.99Å; W225-V227 VanDerWaalsContact C-N 3.32Å; W225-V227 PolarHBondContact O-N 3.04Å; V227-W233 PolarHBondContact O-NE1 3.35Å; V227-L240 HydrophobicContact CG2-CD2 3.84Å; V227-L240 HydrophobicContact CG2-CG 4.38Å; V227-V241 HydrophobicContact CG1-CG2 3.66Å
228F93.7Very high92.8Very high98 Ų9850.4 Ų50.443%0.4323%0.229SC..Hα-helixtrans-81.9-34.2179.9-71.1-69.7000113.8L224 W225 S226 W233 V241L224-F228 HydrophobicContact CD1-CE2 3.81Å; L224-F228 HydrophobicContact CG-CE2 4.33Å; L224-F228 WeakPolarHBondContact O-CD2 3.43Å; W225-F228 PolarHBondContact O-N 3.46Å; W225-F228 VanDerWaalsContact O-N 3.13Å; S226-F228 PolarHBondContact O-N 2.87Å; F228-W233 AromaticContact CD1-CZ2 3.78Å; F228-W233 HydrophobicContact CD1-CZ2 3.78Å; F228-W233 HydrophobicContact CE1-CH2 4.2Å; F228-W233 AromaticContact CE1-CZ2 3.82Å; F228-W233 HydrophobicContact CE1-CZ2 3.82Å; F228-V241 HydrophobicContact CE1-CG2 4.44Å; F228-V241 HydrophobicContact CE2-CG1 4.33Å; F228-V241 HydrophobicContact CE2-CG2 4.3Å; F228-V241 HydrophobicContact CZ-CG1 3.91Å; F228-V241 HydrophobicContact CZ-CG2 3.91Å
229F92.2Very high92.7Very high143 Ų14351.9 Ų51.963%0.62724%0.238SC*.Hα-helixtrans-122.6-15.2-165.2-58.2-69.2000115.7W225 S226W225-F229 AromaticContact CD1-CD2 3.55Å; W225-F229 AromaticContact CD1-CE2 3.69Å; W225-F229 AromaticContact CD2-CD2 3.91Å; W225-F229 HydrophobicContact CD2-CD2 3.91Å; W225-F229 AromaticContact CE2-CD2 3.55Å; W225-F229 AromaticContact CG-CD2 3.92Å; W225-F229 HydrophobicContact CG-CD2 3.92Å; W225-F229 HydrophobicContact CG-CE2 4.41Å; W225-F229 HydrophobicContact CH2-CB 4.21Å; W225-F229 HydrophobicContact CZ2-CB 4.04Å; W225-F229 HydrophobicContact CZ2-CD2 4.13Å; W225-F229 HydrophobicContact CZ2-CG 4.29Å; W225-F229 AromaticContact NE1-CD2 3.3Å; W225-F229 VanDerWaalsContact NE1-CD2 3.3Å; W225-F229 AromaticContact NE1-CE2 3.59Å; W225-F229 VanDerWaalsContact O-CD2 3.28Å; W225-F229 WeakPolarHBondContact O-CD2 3.3Å; W225-F229 PolarHBondContact O-N 3.38Å; W225-F229 VanDerWaalsContact O-N 3.14Å; S226-F229 PolarHBondContact O-N 3.02Å
230M88.6Confident92.6Very high65 Ų6553.8 Ų53.832%0.3225%0.248SC..THydrogen-bonded Turntrans-121.9-43.5-177.1-61.7-170.979.800113.5R130 W225 S226R130-M230 HydrophobicContact CG-CE 3.88Å; R130-M230 HydrophobicContact CG-SD 4.3Å; W225-M230 HydrophobicContact CE3-CG 4.29Å; W225-M230 HydrophobicContact CE3-SD 4.28Å; W225-M230 HydrophobicContact CH2-CG 4.23Å; W225-M230 HydrophobicContact CH2-SD 4.49Å; W225-M230 HydrophobicContact CZ3-CG 3.56Å; W225-M230 HydrophobicContact CZ3-SD 3.55Å; W225-M230 VanDerWaalsContact CZ3-SD 3.55Å; S226-M230 CarbonylContact O-C 3.55Å; S226-M230 WeakPolarHBondContact O-CA 3.25Å; S226-M230 PolarHBondContact O-N 2.87Å
231D88.5Confident92.6Very high16 Ų1653.7 Ų53.79%0.08625%0.249CC..SBendtrans-87150.9-170.7-64.6-5.1000111.1R130 K161 S226R130-D231 IonicContact CZ-OD1 3.36Å; R130-D231 IonicContact NH2-OD1 3.55Å; R130-D231 PolarHBondContact NH2-OD1 2.8Å; K161-D231 WeakPolarHBondContact CE-OD2 3.44Å; K161-D231 IonicContact NZ-OD2 2.67Å; K161-D231 PolarHBondContact NZ-OD2 3.19Å; S226-D231 PolarHBondContact O-N 2.84Å
232S82.7Confident92.6Very high61 Ų6155.2 Ų55.243%0.42726%0.258SS..PPolyproline II helixtrans-74.6134.1175.7-48.60000111.2R234S232-R234 PolarHBondContact O-NH1 3.35Å; S232-R234 VanDerWaalsContact O-NH1 3.12Å
233W87.1Confident92.6Very high123 Ų12356.1 Ų56.147%0.46626%0.262SS..PPolyproline II helixtrans-71141.3175-80.760.6000111.1V227 F228 S237V227-W233 PolarHBondContact O-NE1 3.35Å; F228-W233 AromaticContact CD1-CZ2 3.78Å; F228-W233 HydrophobicContact CD1-CZ2 3.78Å; F228-W233 HydrophobicContact CE1-CH2 4.2Å; F228-W233 AromaticContact CE1-CZ2 3.82Å; F228-W233 HydrophobicContact CE1-CZ2 3.82Å; W233-S237 WeakPolarHBondContact CA-OG 3.23Å; W233-S237 VanDerWaalsContact CE3-CB 3.45Å
234R86.6Confident92.7Very high31 Ų3156.5 Ų56.512%0.11726%0.262CS..  trans-138.1172.3-177.8-61.8179.7-171.389-6.9108.8E157 S232 D236 S237 R384E157-R234 IonicContact OE1-NH1 3.74Å; E157-R234 IonicContact OE1-NH2 2.81Å; E157-R234 IonicContact OE2-NH2 3.18Å; E157-R234 PolarHBondContact OE2-NH2 3.21Å; S232-R234 PolarHBondContact O-NH1 3.35Å; S232-R234 VanDerWaalsContact O-NH1 3.12Å; R234-D236 PolarHBondContact O-N 3.33Å; R234-S237 PolarHBondContact N-OG 3.38Å; R234-S237 VanDerWaalsContact O-CB 3.28Å; R234-S237 WeakPolarHBondContact O-CB 3.37Å; R234-S237 PolarHBondContact O-N 3.08Å; R234-S237 PolarHBondContact O-OG 3.23Å; R234-R384 HydrophobicContact CB-CB 4.38Å
235K88.3Confident92.7Very high120 Ų12057.8 Ų57.852%0.52227%0.274SS..THydrogen-bonded Turntrans-58.5-24.7-177.4-68.9172.8-173.5161.50114.8R384 D386K235-R384 WeakPolarHBondContact CG-O 3.41Å; K235-R384 PolarHBondContact N-O 3.42Å; K235-D386 WeakPolarHBondContact CE-OD1 3.34Å
236D92.1Very high92.8Very high7 Ų753.4 Ų53.44%0.03726%0.259CS..THydrogen-bonded Turntrans-98.41.7178.464-33.2000113.9R234 F238 V239 L240 R384R234-D236 PolarHBondContact O-N 3.33Å; D236-F238 VanDerWaalsContact C-N 3.3Å; D236-F238 PolarHBondContact O-N 3.34Å; D236-V239 PolarHBondContact O-N 3.46Å; D236-V239 VanDerWaalsContact O-N 3.07Å; D236-L240 PolarHBondContact O-N 3.29Å; D236-R384 WeakPolarHBondContact OD2-CD 3.33Å; D236-R384 IonicContact OD2-CZ 3.78Å; D236-R384 IonicContact OD2-NH1 3.97Å; D236-R384 PolarHBondContact OD2-NH1 2.89Å
237S92.4Very high92.9Very high4 Ų453.7 Ų53.73%0.02826%0.261CS..Hα-helixtrans-56.9-39.3-175.3-75.40000113.5W233 R234 L240 V241W233-S237 WeakPolarHBondContact CA-OG 3.23Å; W233-S237 VanDerWaalsContact CE3-CB 3.45Å; R234-S237 PolarHBondContact N-OG 3.38Å; R234-S237 VanDerWaalsContact O-CB 3.28Å; R234-S237 WeakPolarHBondContact O-CB 3.37Å; R234-S237 PolarHBondContact O-N 3.08Å; R234-S237 PolarHBondContact O-OG 3.23Å; S237-L240 WeakPolarHBondContact O-CB 3.36Å; S237-L240 PolarHBondContact O-N 3.34Å; S237-V241 WeakPolarHBondContact O-CG2 3.35Å; S237-V241 PolarHBondContact O-N 3.18Å
238F94.5Very high93.1Very high147 Ų14754.9 Ų54.965%0.64527%0.267SS*.Hα-helixtrans-64.5-43.5177.1-179.9-98.6000112.3D236 L240 V241 L242D236-F238 VanDerWaalsContact C-N 3.3Å; D236-F238 PolarHBondContact O-N 3.34Å; F238-L240 VanDerWaalsContact C-N 3.28Å; F238-L240 PolarHBondContact O-N 2.9Å; F238-V241 PolarHBondContact O-N 3.46Å; F238-L242 PolarHBondContact O-N 2.92Å
239V96Very high93.2Very high31 Ų3153.6 Ų53.619%0.18826%0.264CS..Hα-helixtrans-65.8-36.4177.1-179.20000110.3D236 L242 H243 M357 Y360 W361D236-V239 PolarHBondContact O-N 3.46Å; D236-V239 VanDerWaalsContact O-N 3.07Å; V239-L242 PolarHBondContact O-N 3.32Å; V239-H243 WeakPolarHBondContact O-CB 3.41Å; V239-H243 PolarHBondContact O-N 3.33Å; V239-M357 HydrophobicContact CG1-CG 4.31Å; V239-Y360 HydrophobicContact CB-CE1 4.12Å; V239-Y360 HydrophobicContact CG1-CD1 4.03Å; V239-Y360 HydrophobicContact CG1-CE1 4.03Å; V239-Y360 HydrophobicContact CG2-CE1 3.87Å; V239-W361 HydrophobicContact CG1-CZ2 3.96Å
240L95.1Very high93.5Very high44 Ų4447.5 Ų47.523%0.2324%0.238CC..Hα-helixtrans-62.8-44.4174-176.764.6000112V227 D236 S237 F238 H243 H244V227-L240 HydrophobicContact CG2-CD2 3.84Å; V227-L240 HydrophobicContact CG2-CG 4.38Å; D236-L240 PolarHBondContact O-N 3.29Å; S237-L240 WeakPolarHBondContact O-CB 3.36Å; S237-L240 PolarHBondContact O-N 3.34Å; F238-L240 VanDerWaalsContact C-N 3.28Å; F238-L240 PolarHBondContact O-N 2.9Å; L240-H243 WeakPolarHBondContact O-CB 3.33Å; L240-H243 PolarHBondContact O-N 3.08Å; L240-H244 PolarHBondContact O-CD2 3.36Å; L240-H244 PolarHBondContact O-N 3.18Å
241V97Very high93.9Very high20 Ų2044.8 Ų44.812%0.12123%0.225CC..Hα-helixtrans-59.4-47.7173.8170.10000110.7L224 V227 F228 S237 F238 H243 H244 C245L224-V241 HydrophobicContact CD1-CG1 4.02Å; V227-V241 HydrophobicContact CG1-CG2 3.66Å; F228-V241 HydrophobicContact CE1-CG2 4.44Å; F228-V241 HydrophobicContact CE2-CG1 4.33Å; F228-V241 HydrophobicContact CE2-CG2 4.3Å; F228-V241 HydrophobicContact CZ-CG1 3.91Å; F228-V241 HydrophobicContact CZ-CG2 3.91Å; S237-V241 WeakPolarHBondContact O-CG2 3.35Å; S237-V241 PolarHBondContact O-N 3.18Å; F238-V241 PolarHBondContact O-N 3.46Å; V241-H243 VanDerWaalsContact C-N 3.28Å; V241-H243 PolarHBondContact O-N 3.25Å; V241-H244 PolarHBondContact O-N 3.49Å; V241-H244 VanDerWaalsContact O-N 3.14Å; V241-C245 PolarHBondContact O-N 3.45Å; V241-C245 PolarHBondContact O-SG 2.89Å
242L97Very high94.2Very high89 Ų8945.5 Ų45.547%0.46623%0.228SC..Hα-helixtrans-60.5-39.8178-175.762.9000111.6F238 V239 C245 L246 M357F238-L242 PolarHBondContact O-N 2.92Å; V239-L242 PolarHBondContact O-N 3.32Å; L242-C245 PolarHBondContact O-N 3.45Å; L242-L246 VanDerWaalsContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CB 3.43Å; L242-L246 PolarHBondContact O-N 3.12Å; L242-M357 HydrophobicContact CB-CE 4.15Å; L242-M357 HydrophobicContact CD2-CE 3.63Å; L242-M357 HydrophobicContact CG-CE 3.55Å
243H97.5Very high94.7Very high21 Ų2143.2 Ų43.210%0.09721%0.211CC..Hα-helixtrans-61-45.8173.4168.279.9000112.3Y220 V239 L240 V241 C245 L246 A247 L354 M357 W361Y220-H243 AromaticContact CE1-NE2 3.84Å; V239-H243 WeakPolarHBondContact O-CB 3.41Å; V239-H243 PolarHBondContact O-N 3.33Å; L240-H243 WeakPolarHBondContact O-CB 3.33Å; L240-H243 PolarHBondContact O-N 3.08Å; V241-H243 VanDerWaalsContact C-N 3.28Å; V241-H243 PolarHBondContact O-N 3.25Å; H243-C245 PolarHBondContact O-N 2.77Å; H243-L246 PolarHBondContact O-N 2.89Å; H243-A247 VanDerWaalsContact O-CB 3.29Å; H243-A247 WeakPolarHBondContact O-CB 3.33Å; H243-A247 PolarHBondContact O-N 3.11Å; H243-L354 WeakPolarHBondContact ND1-CD1 3.5Å; H243-M357 HydrophobicContact CB-SD 3.78Å; H243-W361 HydrophobicContact CB-CH2 3.63Å; H243-W361 HydrophobicContact CB-CZ2 4.28Å; H243-W361 AromaticContact CG-CH2 3.59Å; H243-W361 AromaticContact ND1-CH2 3.74Å
244H97.1Very high95Very high16 Ų1637.4 Ų37.47%0.07419%0.19CC..Hα-helixtrans-61.6-43.2176.9-75.3-69.1000111.6Y220 S223 L224 L240 V241 L246 A247 L248Y220-H244 AromaticContact CD1-ND1 3.3Å; Y220-H244 VanDerWaalsContact CD1-ND1 3.3Å; Y220-H244 WeakPolarHBondContact CD1-ND1 3.48Å; Y220-H244 AromaticContact CE1-ND1 3.79Å; S223-H244 WeakPolarHBondContact CB-CE1 3.4Å; L224-H244 HydrophobicContact CB-CB 4.2Å; L224-H244 HydrophobicContact CD1-CB 3.99Å; L240-H244 PolarHBondContact O-CD2 3.36Å; L240-H244 PolarHBondContact O-N 3.18Å; V241-H244 PolarHBondContact O-N 3.49Å; V241-H244 VanDerWaalsContact O-N 3.14Å; H244-L246 PolarHBondContact O-N 3.24Å; H244-A247 PolarHBondContact O-N 3.48Å; H244-L248 WeakPolarHBondContact O-CB 3.3Å; H244-L248 VanDerWaalsContact O-CG 3.27Å; H244-L248 WeakPolarHBondContact O-CG 3.22Å; H244-L248 PolarHBondContact O-N 3.26Å
245C97.3Very high95.3Very high61 Ų6136.4 Ų36.441%0.41219%0.187SC..Hα-helixtrans-60.4-45174.4-67.50000111.8V241 L242 H243 L249V241-C245 PolarHBondContact O-N 3.45Å; V241-C245 PolarHBondContact O-SG 2.89Å; L242-C245 PolarHBondContact O-N 3.45Å; H243-C245 PolarHBondContact O-N 2.77Å; C245-L249 WeakPolarHBondContact O-CB 3.47Å; C245-L249 PolarHBondContact O-N 3.17Å
246L97.5Very high95.5Very high19 Ų1931.4 Ų31.410%0.09917%0.165CC..Hα-helixtrans-64.6-43178.6-172.4155.8000111.4L242 H243 H244 L249 L250 L350 L354 M357L242-L246 VanDerWaalsContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CB 3.43Å; L242-L246 PolarHBondContact O-N 3.12Å; H243-L246 PolarHBondContact O-N 2.89Å; H244-L246 PolarHBondContact O-N 3.24Å; L246-L249 PolarHBondContact O-N 3.04Å; L246-L250 HydrophobicContact CD2-CD1 3.37Å; L246-L250 HydrophobicContact CD2-CG 3.93Å; L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 WeakPolarHBondContact O-CG 3.32Å; L246-L250 PolarHBondContact O-N 3.02Å; L246-L350 HydrophobicContact CG-CD2 4.29Å; L246-L354 HydrophobicContact CD2-CB 3.82Å; L246-L354 HydrophobicContact CD2-CD1 4.38Å; L246-M357 HydrophobicContact CD1-CE 3.91Å
247A97.3Very high95.4Very high8 Ų831.8 Ų31.87%0.06617%0.167CC..Hα-helixtrans-66.2-42178.600000112.1Y220 H243 H244 L249 L250 L251Y220-A247 HydrophobicContact CD1-CB 3.59Å; Y220-A247 HydrophobicContact CE1-CB 3.26Å; Y220-A247 HydrophobicContact CE2-CB 4.21Å; Y220-A247 HydrophobicContact CG-CB 4.26Å; H243-A247 VanDerWaalsContact O-CB 3.29Å; H243-A247 WeakPolarHBondContact O-CB 3.33Å; H243-A247 PolarHBondContact O-N 3.11Å; H244-A247 PolarHBondContact O-N 3.48Å; A247-L249 VanDerWaalsContact C-N 3.31Å; A247-L249 PolarHBondContact O-N 3.37Å; A247-L250 PolarHBondContact O-N 3.17Å; A247-L251 WeakPolarHBondContact O-CB 3.21Å; A247-L251 VanDerWaalsContact O-CG 3.28Å; A247-L251 WeakPolarHBondContact O-CG 3.28Å; A247-L251 PolarHBondContact O-N 2.85Å
248L97.4Very high95.3Very high28 Ų2833.3 Ų33.315%0.14717%0.172CC..Hα-helixtrans-58.9-44.4172.8-73.7170.2000111.2L217 Y220 L221 L224 H244 L251 E252L217-L248 HydrophobicContact CD2-CD2 3.99Å; Y220-L248 VanDerWaalsContact CB-CD2 3.49Å; L221-L248 HydrophobicContact CD2-CD1 3.98Å; L221-L248 HydrophobicContact CD2-CD2 4.1Å; L221-L248 HydrophobicContact CG-CD2 3.86Å; L224-L248 HydrophobicContact CD2-CD1 3.97Å; H244-L248 WeakPolarHBondContact O-CB 3.3Å; H244-L248 VanDerWaalsContact O-CG 3.27Å; H244-L248 WeakPolarHBondContact O-CG 3.22Å; H244-L248 PolarHBondContact O-N 3.26Å; L248-L251 PolarHBondContact O-N 2.98Å; L248-E252 WeakPolarHBondContact O-CB 3.17Å; L248-E252 PolarHBondContact O-N 3.33Å
249L96.1Very high95.2Very high72 Ų7226.8 Ų26.838%0.37714%0.144SC..Hα-helixtrans-66.6-43.3178.6-170.660.6000112.2C245 L246 A247 T253 F346 L350C245-L249 WeakPolarHBondContact O-CB 3.47Å; C245-L249 PolarHBondContact O-N 3.17Å; L246-L249 PolarHBondContact O-N 3.04Å; A247-L249 VanDerWaalsContact C-N 3.31Å; A247-L249 PolarHBondContact O-N 3.37Å; L249-T253 HydrophobicContact CD1-CG2 3.91Å; L249-T253 HydrophobicContact CG-CG2 4.37Å; L249-T253 VanDerWaalsContact O-CB 3.28Å; L249-T253 WeakPolarHBondContact O-CB 3.23Å; L249-T253 WeakPolarHBondContact O-CG2 3.25Å; L249-T253 PolarHBondContact O-N 3.39Å; L249-T253 PolarHBondContact O-OG1 3.48Å; L249-F346 HydrophobicContact CD1-CZ 3.94Å; L249-F346 HydrophobicContact CD2-CE2 4.1Å; L249-F346 HydrophobicContact CD2-CZ 3.68Å; L249-F346 HydrophobicContact CG-CE1 4.49Å; L249-F346 HydrophobicContact CG-CZ 3.76Å; L249-L350 HydrophobicContact CB-CD1 4.35Å; L249-L350 HydrophobicContact CD2-CD1 3.74Å; L249-L350 HydrophobicContact CD2-CD2 3.82Å; L249-L350 HydrophobicContact CD2-CG 4.43Å; L249-L350 HydrophobicContact CG-CD1 3.75Å
250L97.1Very high95.1Very high14 Ų1425.3 Ų25.37%0.07314%0.135CC..Hα-helixtrans-61.2-45.3174.7-83.4177.2000111.8L246 A247 S254 F347 L350 L351 L354L246-L250 HydrophobicContact CD2-CD1 3.37Å; L246-L250 HydrophobicContact CD2-CG 3.93Å; L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 WeakPolarHBondContact O-CG 3.32Å; L246-L250 PolarHBondContact O-N 3.02Å; A247-L250 PolarHBondContact O-N 3.17Å; L250-S254 WeakPolarHBondContact O-CB 3.45Å; L250-S254 PolarHBondContact O-N 2.96Å; L250-S254 PolarHBondContact O-OG 2.91Å; L250-F347 HydrophobicContact CD2-CD2 3.83Å; L250-F347 HydrophobicContact CD2-CE2 3.52Å; L250-F347 HydrophobicContact CD2-CZ 4.17Å; L250-L350 HydrophobicContact CD2-CB 3.47Å; L250-L350 VanDerWaalsContact CD2-CB 3.47Å; L250-L350 HydrophobicContact CD2-CD1 4.03Å; L250-L350 HydrophobicContact CD2-CG 4.43Å; L250-L350 HydrophobicContact CG-CB 3.87Å; L250-L350 HydrophobicContact CG-CD1 4.28Å; L250-L351 HydrophobicContact CD1-CD2 4.01Å; L250-L351 HydrophobicContact CD2-CD2 3.96Å; L250-L351 HydrophobicContact CD2-CG 4Å; L250-L354 HydrophobicContact CD1-CD2 4.02Å
251L96.9Very high95.1Very high9 Ų924.9 Ų24.95%0.04713%0.13CC..Hα-helixtrans-63.6-49179.8-77.3168.2000111.4Y213 Q216 L217 Y220 A247 L248 S254 L255 L267Y213-L251 HydrophobicContact CD1-CB 4.29Å; Y213-L251 HydrophobicContact CD1-CD2 3.73Å; Y213-L251 WeakPolarHBondContact CD1-O 3.43Å; Y213-L251 HydrophobicContact CE1-CB 4.35Å; Y213-L251 HydrophobicContact CE1-CD2 3.58Å; Y213-L251 VanDerWaalsContact CE1-O 3.3Å; Y213-L251 WeakPolarHBondContact CE1-O 3.39Å; Q216-L251 HydrophobicContact CB-CD1 4.18Å; Q216-L251 HydrophobicContact CB-CD2 4.46Å; Q216-L251 HydrophobicContact CG-CD1 3.77Å; Q216-L251 HydrophobicContact CG-CD2 4.24Å; L217-L251 HydrophobicContact CD2-CB 3.53Å; L217-L251 HydrophobicContact CD2-CD1 4.1Å; L217-L251 HydrophobicContact CD2-CG 4.46Å; L217-L251 HydrophobicContact CG-CB 3.97Å; L217-L251 HydrophobicContact CG-CD1 4.25Å; Y220-L251 HydrophobicContact CD2-CD1 3.58Å; Y220-L251 HydrophobicContact CE2-CD1 3.91Å; Y220-L251 HydrophobicContact CG-CD1 4.42Å; A247-L251 WeakPolarHBondContact O-CB 3.21Å; A247-L251 VanDerWaalsContact O-CG 3.28Å; A247-L251 WeakPolarHBondContact O-CG 3.28Å; A247-L251 PolarHBondContact O-N 2.85Å; L248-L251 PolarHBondContact O-N 2.98Å; L251-S254 PolarHBondContact O-OG 3.47Å; L251-S254 VanDerWaalsContact O-OG 3.05Å; L251-L255 PolarHBondContact O-N 3.28Å; L251-L267 HydrophobicContact CD2-CD1 4.02Å; L251-L267 HydrophobicContact CD2-CD2 4.25Å; L251-L267 HydrophobicContact CD2-CG 4.44Å
252E94.6Very high94.9Very high30 Ų3024 Ų2414%0.1413%0.125CC..Hα-helixtrans-66.5-48.1-179-173.760.8-163.800111.1Q115 L248 S254 L255 L256Q115-E252 PolarHBondContact NE2-OE2 2.87Å; L248-E252 WeakPolarHBondContact O-CB 3.17Å; L248-E252 PolarHBondContact O-N 3.33Å; E252-S254 PolarHBondContact O-N 3.4Å; E252-L255 WeakPolarHBondContact O-CB 3.32Å; E252-L255 PolarHBondContact O-N 2.75Å; E252-L256 HydrophobicContact CG-CD1 4.11Å; E252-L256 WeakPolarHBondContact O-CG 3.33Å; E252-L256 PolarHBondContact O-N 3.1Å
253T92.9Very high94.9Very high13 Ų1320.2 Ų20.28%0.0811%0.108CC..Hα-helixtrans-71-32.5-176.560.30000113.1L249 L255 L256 L257 F346L249-T253 HydrophobicContact CD1-CG2 3.91Å; L249-T253 HydrophobicContact CG-CG2 4.37Å; L249-T253 VanDerWaalsContact O-CB 3.28Å; L249-T253 WeakPolarHBondContact O-CB 3.23Å; L249-T253 WeakPolarHBondContact O-CG2 3.25Å; L249-T253 PolarHBondContact O-N 3.39Å; L249-T253 PolarHBondContact O-OG1 3.48Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.44Å; T253-L256 PolarHBondContact O-N 2.96Å; T253-L257 VanDerWaalsContact O-CB 3.28Å; T253-L257 WeakPolarHBondContact O-CB 3.38Å; T253-L257 WeakPolarHBondContact O-CG 3.37Å; T253-L257 PolarHBondContact O-N 2.98Å; T253-F346 HydrophobicContact CG2-CE1 3.55Å; T253-F346 HydrophobicContact CG2-CZ 4.06Å
254S94.4Very high94.8Very high2 Ų219.2 Ų19.21%0.01410%0.103CC..Hα-helixtrans-66.9-32.4172.756.90000112.3Y213 L250 L251 E252 R258 I259 H260Y213-S254 VanDerWaalsContact CE1-OG 3.31Å; Y213-S254 WeakPolarHBondContact CE1-OG 3.18Å; Y213-S254 PolarHBondContact OH-OG 3.15Å; L250-S254 WeakPolarHBondContact O-CB 3.45Å; L250-S254 PolarHBondContact O-N 2.96Å; L250-S254 PolarHBondContact O-OG 2.91Å; L251-S254 PolarHBondContact O-OG 3.47Å; L251-S254 VanDerWaalsContact O-OG 3.05Å; E252-S254 PolarHBondContact O-N 3.4Å; S254-R258 CarbonylContact O-C 3.39Å; S254-R258 PolarHBondContact O-N 3.24Å; S254-I259 CarbonylContact O-C 3.5Å; S254-I259 WeakPolarHBondContact O-CA 3.31Å; S254-I259 PolarHBondContact O-N 3.44Å; S254-H260 PolarHBondContact O-N 3.48Å
255L93Very high94.8Very high10 Ų1018.6 Ų18.65%0.05210%0.1CC..Hα-helixtrans-70.3-46.5174.1-168.468.8000111.6Q115 T205 Y213 L251 E252 T253 L257 R258 H260Q115-L255 HydrophobicContact CG-CD2 4.06Å; T205-L255 HydrophobicContact CG2-CD1 3.52Å; T205-L255 WeakPolarHBondContact OG1-CD1 3.28Å; Y213-L255 HydrophobicContact CD1-CB 4.25Å; Y213-L255 HydrophobicContact CD1-CD1 4.47Å; Y213-L255 HydrophobicContact CE1-CB 4.47Å; Y213-L255 HydrophobicContact CG-CD1 4.37Å; L251-L255 PolarHBondContact O-N 3.28Å; E252-L255 WeakPolarHBondContact O-CB 3.32Å; E252-L255 PolarHBondContact O-N 2.75Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.44Å; L255-L257 VanDerWaalsContact C-N 3.35Å; L255-L257 PolarHBondContact O-N 2.74Å; L255-R258 PolarHBondContact O-N 3.27Å; L255-H260 HydrophobicContact CD1-CB 4.31Å
256L91.7Very high94.7Very high15 Ų1516.3 Ų16.38%0.0799%0.085CC..Hα-helixtrans-62.7-40.3179.3-64172000112.4I107 I111 F201 E252 T253 R258I107-L256 HydrophobicContact CG2-CB 4.06Å; I107-L256 HydrophobicContact CG2-CD1 3.71Å; I107-L256 HydrophobicContact CG2-CG 4.5Å; I111-L256 HydrophobicContact CG1-CD1 3.79Å; I111-L256 HydrophobicContact CG1-CD2 4.01Å; F201-L256 WeakPolarHBondContact CD1-O 3.4Å; F201-L256 WeakPolarHBondContact CE1-O 3.22Å; E252-L256 HydrophobicContact CG-CD1 4.11Å; E252-L256 WeakPolarHBondContact O-CG 3.33Å; E252-L256 PolarHBondContact O-N 3.1Å; T253-L256 PolarHBondContact O-N 2.96Å; L256-R258 VanDerWaalsContact C-N 3.29Å; L256-R258 PolarHBondContact O-N 2.92Å
257L90.6Very high94.7Very high14 Ų1416 Ų167%0.0738%0.083CC..THydrogen-bonded Turntrans-89.111179.2-62.5174.3000113.2I107 N194 Y200 T253 L255 I259I107-L257 HydrophobicContact CD1-CD2 3.82Å; I107-L257 HydrophobicContact CG1-CD2 4.11Å; N194-L257 PolarHBondContact ND2-O 3.2Å; Y200-L257 PolarHBondContact OH-O 2.86Å; T253-L257 VanDerWaalsContact O-CB 3.28Å; T253-L257 WeakPolarHBondContact O-CB 3.38Å; T253-L257 WeakPolarHBondContact O-CG 3.37Å; T253-L257 PolarHBondContact O-N 2.98Å; L255-L257 VanDerWaalsContact C-N 3.35Å; L255-L257 PolarHBondContact O-N 2.74Å; L257-I259 HydrophobicContact CB-CD1 3.77Å; L257-I259 HydrophobicContact CB-CG1 3.91Å; L257-I259 HydrophobicContact CD1-CD1 4.16Å; L257-I259 VanDerWaalsContact O-CG1 3.3Å; L257-I259 WeakPolarHBondContact O-CG1 3.3Å; L257-I259 PolarHBondContact O-N 3.4Å
258R91.3Very high94.7Very high36 Ų3616.6 Ų16.614%0.1368%0.084CC..THydrogen-bonded Turntrans50.131.6-179.5-52.7-170.860.9-178.8-3.3114.2D27 N194 Y200 I203 S254 L255 L256 H260D27-R258 IonicContact OD1-CZ 3.29Å; D27-R258 IonicContact OD1-NH2 3.18Å; D27-R258 PolarHBondContact OD1-NH2 3.18Å; N194-R258 PolarHBondContact ND2-O 2.9Å; Y200-R258 HydrophobicContact CE1-CG 4.01Å; Y200-R258 HydrophobicContact CE2-CG 4.49Å; I203-R258 VanDerWaalsContact CG2-NH1 3.32Å; S254-R258 CarbonylContact O-C 3.39Å; S254-R258 PolarHBondContact O-N 3.24Å; L255-R258 PolarHBondContact O-N 3.27Å; L256-R258 VanDerWaalsContact C-N 3.29Å; L256-R258 PolarHBondContact O-N 2.92Å; R258-H260 WeakPolarHBondContact CA-ND1 3.43Å
259I92.2Very high94.7Very high10 Ų1015.4 Ų15.45%0.0518%0.078CC..  trans-91.815.1171.7-50.5170.8000109.2F191 S254 L257 R261 A262 G263 F347F191-I259 HydrophobicContact CE1-CB 4.39Å; F191-I259 HydrophobicContact CE1-CD1 4.11Å; F191-I259 HydrophobicContact CE1-CG1 3.95Å; F191-I259 HydrophobicContact CE1-CG2 3.61Å; F191-I259 HydrophobicContact CZ-CG2 3.64Å; S254-I259 CarbonylContact O-C 3.5Å; S254-I259 WeakPolarHBondContact O-CA 3.31Å; S254-I259 PolarHBondContact O-N 3.44Å; L257-I259 HydrophobicContact CB-CD1 3.77Å; L257-I259 HydrophobicContact CB-CG1 3.91Å; L257-I259 HydrophobicContact CD1-CD1 4.16Å; L257-I259 VanDerWaalsContact O-CG1 3.3Å; L257-I259 WeakPolarHBondContact O-CG1 3.3Å; L257-I259 PolarHBondContact O-N 3.4Å; I259-R261 PolarHBondContact O-N 3.23Å; I259-R261 VanDerWaalsContact O-N 3.1Å; I259-A262 HydrophobicContact CG2-CB 3.77Å; I259-A262 PolarHBondContact O-N 2.84Å; I259-G263 PolarHBondContact O-N 3.3Å; I259-G263 VanDerWaalsContact O-N 3.17Å; I259-F347 HydrophobicContact CD1-CD1 4.14Å; I259-F347 HydrophobicContact CD1-CE1 4.46Å; I259-F347 HydrophobicContact CD1-CG 4.2Å; I259-F347 HydrophobicContact CG2-CD1 4.33Å; I259-F347 HydrophobicContact CG2-CE1 3.65Å; I259-F347 HydrophobicContact CG2-CZ 3.86Å
260H93.4Very high94.7Very high1 Ų112.6 Ų12.61%0.0056%0.063CC..Hα-helixtrans-57.1-32.6-173.752.2-79000112.7E29 Y209 Y213 S254 L255 R258 A262 G263 V264E29-H260 IonicContact OE1-CE1 2.76Å; E29-H260 IonicContact OE1-NE2 3.51Å; E29-H260 PolarHBondContact OE1-NE2 3.48Å; E29-H260 IonicContact OE2-CE1 3.02Å; E29-H260 IonicContact OE2-NE2 2.8Å; E29-H260 PolarHBondContact OE2-NE2 3.44Å; Y209-H260 AromaticContact CD1-CD2 3.81Å; Y209-H260 AromaticContact CD2-CD2 3.49Å; Y209-H260 VanDerWaalsContact CD2-CD2 3.49Å; Y209-H260 WeakPolarHBondContact CD2-CD2 3.42Å; Y209-H260 AromaticContact CD2-NE2 3.83Å; Y209-H260 AromaticContact CE2-CD2 3.76Å; Y209-H260 AromaticContact CE2-NE2 3.94Å; Y209-H260 AromaticContact CG-CD2 3.53Å; Y213-H260 HydrophobicContact CE2-CB 3.79Å; Y213-H260 WeakPolarHBondContact OH-CA 3.3Å; Y213-H260 PolarHBondContact OH-O 3.31Å; S254-H260 PolarHBondContact O-N 3.48Å; L255-H260 HydrophobicContact CD1-CB 4.31Å; R258-H260 WeakPolarHBondContact CA-ND1 3.43Å; H260-A262 PolarHBondContact O-N 2.97Å; H260-G263 PolarHBondContact O-N 3.36Å; H260-V264 WeakPolarHBondContact O-CG2 3.13Å; H260-V264 PolarHBondContact O-N 2.95Å
261R94Very high94.6Very high34 Ų3412 Ų1213%0.1286%0.06CC..Hα-helixtrans-56.3-46.3173.2-74.2174.568.5-158.97.9112.9E29 D183 C189 V190 I259 L265E29-R261 VanDerWaalsContact OE1-CD 3.25Å; E29-R261 WeakPolarHBondContact OE1-CD 3.43Å; D183-R261 IonicContact OD1-CZ 3.85Å; D183-R261 IonicContact OD1-NE 3.19Å; D183-R261 PolarHBondContact OD1-NE 2.97Å; D183-R261 IonicContact OD1-NH2 2.71Å; D183-R261 PolarHBondContact OD1-NH2 3.06Å; D183-R261 WeakPolarHBondContact OD2-CG 3.39Å; D183-R261 IonicContact OD2-CZ 2.63Å; D183-R261 IonicContact OD2-NE 3.62Å; D183-R261 PolarHBondContact OD2-NE 2.94Å; D183-R261 IonicContact OD2-NH2 3.24Å; C189-R261 PolarHBondContact O-NH1 3.41Å; V190-R261 HydrophobicContact CG1-CB 3.52Å; V190-R261 HydrophobicContact CG2-CB 4.46Å; V190-R261 PolarHBondContact O-NH1 2.94Å; I259-R261 PolarHBondContact O-N 3.23Å; I259-R261 VanDerWaalsContact O-N 3.1Å; R261-L265 PolarHBondContact O-N 3.44Å
262A94.4Very high94.6Very high2 Ų213.2 Ų13.22%0.0177%0.066CC..Hα-helixtrans-71.7-35.7176.800000111.3V190 F191 I259 H260 L265 T266V190-A262 HydrophobicContact CG1-CB 3.81Å; F191-A262 HydrophobicContact CZ-CB 4.49Å; I259-A262 HydrophobicContact CG2-CB 3.77Å; I259-A262 PolarHBondContact O-N 2.84Å; H260-A262 PolarHBondContact O-N 2.97Å; A262-L265 PolarHBondContact O-N 3.49Å; A262-T266 PolarHBondContact O-N 3.4Å; A262-T266 PolarHBondContact O-OG1 3.33Å
263G95.8Very high94.7Very high9 Ų911.8 Ų11.89%0.0936%0.059CC..Hα-helixtrans-67.7-37.7176.900000112.9Y213 I259 H260 T266 L267Y213-G263 WeakPolarHBondContact OH-CA 3.44Å; I259-G263 PolarHBondContact O-N 3.3Å; I259-G263 VanDerWaalsContact O-N 3.17Å; H260-G263 PolarHBondContact O-N 3.36Å; G263-T266 WeakPolarHBondContact O-CA 3.06Å; G263-T266 VanDerWaalsContact O-CB 3.22Å; G263-T266 WeakPolarHBondContact O-CB 3.43Å; G263-T266 PolarHBondContact O-N 2.83Å; G263-T266 VanDerWaalsContact O-N 3.15Å; G263-L267 WeakPolarHBondContact O-CG 3.27Å; G263-L267 PolarHBondContact O-N 2.94Å
264V95.8Very high94.9Very high1 Ų112.6 Ų12.61%0.0066%0.063CC..Hα-helixtrans-66.6-41.5172.8-178.40000111.4V175 V176 Y209 L212 Y213 H260 T266 L267 F268V175-V264 HydrophobicContact CB-CG1 4.32Å; V175-V264 HydrophobicContact CG1-CG1 3.89Å; V176-V264 HydrophobicContact CG2-CB 4.28Å; V176-V264 HydrophobicContact CG2-CG1 3.34Å; Y209-V264 HydrophobicContact CD1-CG2 3.49Å; Y209-V264 VanDerWaalsContact CD1-CG2 3.49Å; Y209-V264 HydrophobicContact CE1-CB 4.29Å; Y209-V264 HydrophobicContact CE1-CG2 3.7Å; L212-V264 HydrophobicContact CD2-CB 4.09Å; L212-V264 HydrophobicContact CD2-CG1 3.54Å; L212-V264 HydrophobicContact CD2-CG2 3.47Å; L212-V264 VanDerWaalsContact CD2-CG2 3.47Å; Y213-V264 HydrophobicContact CD2-CG2 4.26Å; Y213-V264 HydrophobicContact CE2-CG2 3.49Å; Y213-V264 VanDerWaalsContact CE2-CG2 3.49Å; Y213-V264 PolarHBondContact OH-N 3.44Å; H260-V264 WeakPolarHBondContact O-CG2 3.13Å; H260-V264 PolarHBondContact O-N 2.95Å; V264-T266 PolarHBondContact O-N 3.21Å; V264-L267 PolarHBondContact O-N 3.02Å; V264-L267 VanDerWaalsContact O-N 3.15Å; V264-F268 WeakPolarHBondContact O-CB 3.48Å; V264-F268 PolarHBondContact O-N 3.45Å
265L96.2Very high95Very high2 Ų212.8 Ų12.81%0.016%0.064CC..Hα-helixtrans-58.2-36.6173.7-179.360000111V176 Y184 P187 R261 A262 F268 L269 K323 V324V176-L265 HydrophobicContact CG1-CD1 4.26Å; Y184-L265 HydrophobicContact CD2-CD1 3.62Å; Y184-L265 HydrophobicContact CE2-CD1 4.43Å; Y184-L265 HydrophobicContact CG-CD1 4.48Å; P187-L265 HydrophobicContact CB-CD2 4.01Å; R261-L265 PolarHBondContact O-N 3.44Å; A262-L265 PolarHBondContact O-N 3.49Å; L265-F268 HydrophobicContact CD1-CD1 4.49Å; L265-L269 HydrophobicContact CD1-CD1 4.49Å; L265-L269 HydrophobicContact CG-CD1 4.46Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.38Å; L265-L269 PolarHBondContact O-N 3.05Å; L265-K323 HydrophobicContact CD2-CB 4.34Å; L265-V324 HydrophobicContact CB-CG2 4.49Å; L265-V324 HydrophobicContact CD2-CG2 4.07Å; L265-V324 HydrophobicContact CG-CG2 3.94Å
266T96.9Very high95.3Very high14 Ų1414.3 Ų14.39%0.0867%0.071CC..Hα-helixtrans-61.3-56.6171.7-52.60000110.4A262 G263 V264 F268 L269 H270 F320 V324 L354A262-T266 PolarHBondContact O-N 3.4Å; A262-T266 PolarHBondContact O-OG1 3.33Å; G263-T266 WeakPolarHBondContact O-CA 3.06Å; G263-T266 VanDerWaalsContact O-CB 3.22Å; G263-T266 WeakPolarHBondContact O-CB 3.43Å; G263-T266 PolarHBondContact O-N 2.83Å; G263-T266 VanDerWaalsContact O-N 3.15Å; V264-T266 PolarHBondContact O-N 3.21Å; T266-F268 VanDerWaalsContact C-N 3.3Å; T266-F268 PolarHBondContact O-N 3.19Å; T266-L269 PolarHBondContact O-N 3Å; T266-L269 VanDerWaalsContact O-N 3.07Å; T266-H270 PolarHBondContact O-N 2.86Å; T266-H270 PolarHBondContact O-ND1 3.4Å; T266-F320 HydrophobicContact CG2-CD2 4.33Å; T266-F320 HydrophobicContact CG2-CE2 3.84Å; T266-V324 WeakPolarHBondContact OG1-CG1 2.91Å; T266-L354 HydrophobicContact CG2-CD2 4.34Å
267L97Very high95.5Very high11 Ų1115 Ų156%0.0587%0.074CC..Hα-helixtrans-52.6-46.9179.3-65.3175.5000112.7L212 Q216 L251 G263 V264 L269 H270 D271L212-L267 HydrophobicContact CD2-CD1 4.04Å; Q216-L267 HydrophobicContact CB-CD1 4.29Å; Q216-L267 HydrophobicContact CG-CD1 3.92Å; Q216-L267 HydrophobicContact CG-CD2 3.68Å; Q216-L267 HydrophobicContact CG-CG 4.45Å; L251-L267 HydrophobicContact CD2-CD1 4.02Å; L251-L267 HydrophobicContact CD2-CD2 4.25Å; L251-L267 HydrophobicContact CD2-CG 4.44Å; G263-L267 WeakPolarHBondContact O-CG 3.27Å; G263-L267 PolarHBondContact O-N 2.94Å; V264-L267 PolarHBondContact O-N 3.02Å; V264-L267 VanDerWaalsContact O-N 3.15Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 PolarHBondContact O-N 3.42Å; L267-H270 PolarHBondContact O-N 3.02Å; L267-D271 PolarHBondContact O-N 3.5Å; L267-D271 VanDerWaalsContact O-N 3.08Å
268F96.9Very high95.8Very high22 Ų2214.7 Ų14.710%0.0967%0.072CC..Hα-helixtrans-56.1-40.7178.5174.5-112.5000113.4W169 L173 V176 V177 Y184 V264 L265 T266W169-F268 AromaticContact CE2-CE2 3.92Å; W169-F268 AromaticContact CZ2-CE2 3.98Å; W169-F268 HydrophobicContact CZ2-CE2 3.98Å; W169-F268 AromaticContact NE1-CD2 3.66Å; W169-F268 AromaticContact NE1-CE2 3.58Å; W169-F268 PolarHBondContact NE1-O 3.23Å; L173-F268 HydrophobicContact CB-CD2 4.37Å; L173-F268 HydrophobicContact CB-CE2 4Å; L173-F268 HydrophobicContact CD1-CE2 3.64Å; L173-F268 HydrophobicContact CD1-CZ 4.05Å; L173-F268 HydrophobicContact CG-CE2 4.44Å; V176-F268 HydrophobicContact CB-CG 4.45Å; V176-F268 HydrophobicContact CG1-CD1 4.28Å; V176-F268 HydrophobicContact CG2-CB 4.05Å; V176-F268 HydrophobicContact CG2-CG 4.4Å; V177-F268 HydrophobicContact CG2-CE1 4.37Å; V177-F268 HydrophobicContact CG2-CE2 4.49Å; V177-F268 HydrophobicContact CG2-CZ 4.05Å; Y184-F268 HydrophobicContact CD2-CD1 4.15Å; Y184-F268 AromaticContact CD2-CE1 3.87Å; Y184-F268 HydrophobicContact CD2-CE1 3.87Å; Y184-F268 HydrophobicContact CE2-CD1 4.24Å; Y184-F268 AromaticContact CE2-CE1 3.71Å; Y184-F268 HydrophobicContact CE2-CE1 3.71Å; V264-F268 WeakPolarHBondContact O-CB 3.48Å; V264-F268 PolarHBondContact O-N 3.45Å; L265-F268 HydrophobicContact CD1-CD1 4.49Å; T266-F268 VanDerWaalsContact C-N 3.3Å; T266-F268 PolarHBondContact O-N 3.19Å
269L97.1Very high96.1Very high2 Ų215.4 Ų15.41%0.018%0.078CC..Hα-helixtrans-75.9-23.5179.2-67.7174.7000113Y184 L265 T266 L267 L315 L319 F320 V324Y184-L269 HydrophobicContact CE2-CD2 4.25Å; L265-L269 HydrophobicContact CD1-CD1 4.49Å; L265-L269 HydrophobicContact CG-CD1 4.46Å; L265-L269 VanDerWaalsContact O-CG 3.31Å; L265-L269 WeakPolarHBondContact O-CG 3.38Å; L265-L269 PolarHBondContact O-N 3.05Å; T266-L269 PolarHBondContact O-N 3Å; T266-L269 VanDerWaalsContact O-N 3.07Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 PolarHBondContact O-N 3.42Å; L269-L315 HydrophobicContact CD2-CD2 4.37Å; L269-L315 VanDerWaalsContact O-CB 3.23Å; L269-L315 WeakPolarHBondContact O-CB 3.44Å; L269-L319 HydrophobicContact CD1-CB 4.36Å; L269-L319 HydrophobicContact CD2-CB 4Å; L269-L319 HydrophobicContact CD2-CD1 4.06Å; L269-F320 HydrophobicContact CD1-CB 4.37Å; L269-V324 HydrophobicContact CD1-CG2 4.01Å
270H96.7Very high96.3Very high13 Ų1315.4 Ų15.46%0.068%0.079CC..Hα-helixtrans-94.9-45.2-171.9-69.668.6000113T266 L267 L272 C273 R316 F320 H358T266-H270 PolarHBondContact O-N 2.86Å; T266-H270 PolarHBondContact O-ND1 3.4Å; L267-H270 PolarHBondContact O-N 3.02Å; H270-L272 VanDerWaalsContact C-N 3.29Å; H270-L272 PolarHBondContact O-N 3.12Å; H270-C273 PolarHBondContact O-N 3Å; H270-R316 PolarHBondContact O-NH2 3.09Å; H270-F320 AromaticContact CE1-CD2 3.39Å; H270-F320 WeakPolarHBondContact CE1-CD2 3.22Å; H270-F320 AromaticContact CE1-CE2 3.78Å; H270-F320 AromaticContact CE1-CG 3.66Å; H270-F320 AromaticContact NE2-CG 3.98Å; H270-H358 AromaticContact CD2-CE1 3.32Å; H270-H358 PolarHBondContact CD2-CE1 2.87Å; H270-H358 AromaticContact CD2-NE2 3.36Å; H270-H358 PolarHBondContact CD2-NE2 3.46Å; H270-H358 AromaticContact NE2-CE1 2.92Å; H270-H358 PolarHBondContact NE2-CE1 2.95Å; H270-H358 AromaticContact NE2-ND1 3.79Å; H270-H358 AromaticContact NE2-NE2 3.51Å
271D95.4Very high96.4Very high2 Ų216.8 Ų16.81%0.0119%0.085CC..Hα-helixtrans-63.3-32.8-167.2-69.3-13000112.9W169 L267 C273 D274 V275W169-D271 HydrophobicContact CB-CB 3.91Å; W169-D271 HydrophobicContact CG-CB 4.48Å; L267-D271 PolarHBondContact O-N 3.5Å; L267-D271 VanDerWaalsContact O-N 3.08Å; D271-C273 PolarHBondContact O-N 3.27Å; D271-D274 PolarHBondContact O-N 2.67Å; D271-V275 PolarHBondContact O-N 3.35Å
272L96.3Very high96.4Very high34 Ų3417 Ų1718%0.1789%0.089CC..Hα-helixtrans-62.4-38.8-176.4-172.957.1000113.4W169 H270 D274 V275 F276 L315W169-L272 HydrophobicContact CD2-CB 4.37Å; W169-L272 HydrophobicContact CD2-CD1 3.93Å; W169-L272 HydrophobicContact CE3-CD1 4.2Å; W169-L272 HydrophobicContact CG-CB 4.2Å; W169-L272 HydrophobicContact CG-CD1 4.41Å; W169-L272 HydrophobicContact CH2-CD1 4.34Å; W169-L272 HydrophobicContact CZ2-CD1 4.09Å; W169-L272 HydrophobicContact CZ2-CD2 3.79Å; W169-L272 HydrophobicContact CZ2-CG 4.4Å; W169-L272 HydrophobicContact CZ3-CD1 4.4Å; H270-L272 VanDerWaalsContact C-N 3.29Å; H270-L272 PolarHBondContact O-N 3.12Å; L272-D274 PolarHBondContact O-N 3.06Å; L272-V275 WeakPolarHBondContact O-CB 3.03Å; L272-V275 PolarHBondContact O-N 3.25Å; L272-F276 HydrophobicContact CD1-CE1 4.42Å; L272-F276 HydrophobicContact CD1-CE2 4.27Å; L272-F276 HydrophobicContact CD1-CZ 3.95Å; L272-F276 HydrophobicContact CD2-CE2 4.33Å; L272-F276 HydrophobicContact CD2-CZ 4.4Å; L272-F276 HydrophobicContact CG-CE2 3.88Å; L272-F276 HydrophobicContact CG-CZ 4.04Å; L272-F276 PolarHBondContact O-N 2.89Å; L272-L315 HydrophobicContact CB-CD1 3.98Å; L272-L315 HydrophobicContact CD2-CD1 4.04Å; L272-L315 HydrophobicContact CG-CD1 4.37Å
273C96.9Very high96.5Very high0 Ų017.6 Ų17.60%09%0.092CC..Hα-helixtrans-58.6-41.9178.5-65.60000111H270 D271 V275 F276 L277 F308 S311 W312H270-C273 PolarHBondContact O-N 3Å; D271-C273 PolarHBondContact O-N 3.27Å; C273-V275 VanDerWaalsContact C-N 3.32Å; C273-V275 PolarHBondContact O-N 3.26Å; C273-F276 PolarHBondContact O-N 3.15Å; C273-L277 PolarHBondContact O-N 2.68Å; C273-L277 VanDerWaalsContact O-N 3.1Å; C273-F308 HydrophobicContact CB-CD2 4.39Å; C273-F308 WeakPolarHBondContact O-CD2 3.27Å; C273-S311 VanDerWaalsContact SG-C 3.5Å; C273-S311 PolarHBondContact SG-O 2.92Å; C273-S311 PolarHBondContact SG-OG 2.64Å; C273-W312 HydrophobicContact CB-CE3 4.46Å
274D96.3Very high96.3Very high30 Ų3018.6 Ų18.616%0.1610%0.096CC..Hα-helixtrans-73.5-27.5-174.9-63.2-23.6000111.5F165 D271 L272 F276 L277 E278 R316F165-D274 HydrophobicContact CD1-CB 4.42Å; F165-D274 HydrophobicContact CD2-CB 3.45Å; F165-D274 VanDerWaalsContact CD2-CB 3.45Å; F165-D274 HydrophobicContact CE1-CB 4.49Å; F165-D274 HydrophobicContact CE2-CB 3.55Å; F165-D274 HydrophobicContact CG-CB 3.93Å; F165-D274 HydrophobicContact CZ-CB 4.1Å; D271-D274 PolarHBondContact O-N 2.67Å; L272-D274 PolarHBondContact O-N 3.06Å; D274-F276 PolarHBondContact O-N 3.19Å; D274-L277 PolarHBondContact O-N 3.23Å; D274-E278 WeakPolarHBondContact O-CB 3.22Å; D274-E278 VanDerWaalsContact O-CG 3.31Å; D274-E278 WeakPolarHBondContact O-CG 3.39Å; D274-E278 PolarHBondContact O-N 3.5Å; D274-R316 IonicContact OD1-CZ 3.77Å; D274-R316 IonicContact OD1-NH1 3.57Å; D274-R316 IonicContact OD1-NH2 3.19Å; D274-R316 PolarHBondContact OD1-NH2 3.27Å; D274-R316 IonicContact OD2-CZ 3.34Å; D274-R316 IonicContact OD2-NH2 2.9Å; D274-R316 PolarHBondContact OD2-NH2 3.07Å
275V97.8Very high96.1Very high7 Ų719.8 Ų19.84%0.04210%0.1CC..Hα-helixtrans-57.5-49.5168.8-179.40000110.6F165 F166 D271 L272 C273 L277 E278 I279F165-V275 HydrophobicContact CB-CG2 3.73Å; F166-V275 HydrophobicContact CB-CG1 4.22Å; F166-V275 HydrophobicContact CB-CG2 3.97Å; F166-V275 HydrophobicContact CD2-CG1 4.18Å; D271-V275 PolarHBondContact O-N 3.35Å; L272-V275 WeakPolarHBondContact O-CB 3.03Å; L272-V275 PolarHBondContact O-N 3.25Å; C273-V275 VanDerWaalsContact C-N 3.32Å; C273-V275 PolarHBondContact O-N 3.26Å; V275-L277 PolarHBondContact O-N 2.79Å; V275-E278 PolarHBondContact O-N 3.45Å; V275-I279 HydrophobicContact CG1-CD1 3.83Å; V275-I279 VanDerWaalsContact O-CG1 3.27Å; V275-I279 WeakPolarHBondContact O-CG1 3.28Å; V275-I279 PolarHBondContact O-N 2.91Å
276F98.1Very high95.9Very high42 Ų4221 Ų2118%0.18411%0.107CC..Hα-helixtrans-64.4-41.2179.8-60.8-39.3000112.2L272 C273 D274 I279 S280 F304 L307 F308 S311L272-F276 HydrophobicContact CD1-CE1 4.42Å; L272-F276 HydrophobicContact CD1-CE2 4.27Å; L272-F276 HydrophobicContact CD1-CZ 3.95Å; L272-F276 HydrophobicContact CD2-CE2 4.33Å; L272-F276 HydrophobicContact CD2-CZ 4.4Å; L272-F276 HydrophobicContact CG-CE2 3.88Å; L272-F276 HydrophobicContact CG-CZ 4.04Å; L272-F276 PolarHBondContact O-N 2.89Å; C273-F276 PolarHBondContact O-N 3.15Å; D274-F276 PolarHBondContact O-N 3.19Å; F276-I279 PolarHBondContact O-N 3.45Å; F276-S280 WeakPolarHBondContact O-CB 3.4Å; F276-S280 PolarHBondContact O-N 2.93Å; F276-F304 HydrophobicContact CB-CD1 4.33Å; F276-F304 AromaticContact CD1-CD1 3.87Å; F276-F304 HydrophobicContact CD1-CD1 3.87Å; F276-F304 AromaticContact CD1-CE1 3.96Å; F276-F304 HydrophobicContact CD1-CE1 3.96Å; F276-L307 HydrophobicContact CB-CB 4.4Å; F276-L307 HydrophobicContact CD1-CB 4.35Å; F276-L307 HydrophobicContact CD2-CB 4.07Å; F276-L307 HydrophobicContact CE2-CB 4.41Å; F276-L307 HydrophobicContact CG-CB 4.04Å; F276-F308 HydrophobicContact CB-CB 3.9Å; F276-S311 WeakPolarHBondContact CD2-OG 3.49Å
277L97Very high95.5Very high30 Ų3022.9 Ų22.916%0.15711%0.112CC..Hα-helixtrans-62.1-47.2177.4177.9129.9000112.2C273 D274 V275 S280 K281 F308C273-L277 PolarHBondContact O-N 2.68Å; C273-L277 VanDerWaalsContact O-N 3.1Å; D274-L277 PolarHBondContact O-N 3.23Å; V275-L277 PolarHBondContact O-N 2.79Å; L277-S280 WeakPolarHBondContact O-CB 3.47Å; L277-S280 PolarHBondContact O-N 3.08Å; L277-K281 HydrophobicContact CD2-CD 4.1Å; L277-K281 VanDerWaalsContact CD2-NZ 3.3Å; L277-K281 WeakPolarHBondContact O-CG 3.39Å; L277-K281 PolarHBondContact O-N 3.39Å; L277-F308 HydrophobicContact CB-CB 4.48Å; L277-F308 HydrophobicContact CB-CD2 3.6Å; L277-F308 HydrophobicContact CB-CE2 3.84Å; L277-F308 HydrophobicContact CB-CG 3.94Å; L277-F308 HydrophobicContact CB-CZ 4.43Å; L277-F308 HydrophobicContact CD1-CD1 4.06Å; L277-F308 HydrophobicContact CD1-CD2 3.98Å; L277-F308 HydrophobicContact CD1-CE1 3.56Å; L277-F308 HydrophobicContact CD1-CE2 3.44Å; L277-F308 VanDerWaalsContact CD1-CE2 3.44Å; L277-F308 HydrophobicContact CD1-CG 4.23Å; L277-F308 HydrophobicContact CD1-CZ 3.22Å; L277-F308 HydrophobicContact CG-CD2 4.41Å; L277-F308 HydrophobicContact CG-CE2 4.26Å; L277-F308 HydrophobicContact CG-CZ 4.41Å
278E97.2Very high95Very high7 Ų724.3 Ų24.33%0.03312%0.12CC..Hα-helixtrans-68.8-36-178.7-65.4-54.6150.200111.8S158 K161 F165 D274 V275 S280 K281 I282S158-E278 WeakPolarHBondContact CA-OE2 3.33Å; S158-E278 WeakPolarHBondContact CB-OE2 3.43Å; S158-E278 PolarHBondContact OG-OE2 2.9Å; K161-E278 HydrophobicContact CB-CG 4Å; F165-E278 HydrophobicContact CD2-CG 4.15Å; F165-E278 HydrophobicContact CE2-CG 4.14Å; D274-E278 WeakPolarHBondContact O-CB 3.22Å; D274-E278 VanDerWaalsContact O-CG 3.31Å; D274-E278 WeakPolarHBondContact O-CG 3.39Å; D274-E278 PolarHBondContact O-N 3.5Å; V275-E278 PolarHBondContact O-N 3.45Å; E278-S280 VanDerWaalsContact C-N 3.34Å; E278-S280 PolarHBondContact O-N 2.95Å; E278-K281 PolarHBondContact O-N 3.48Å; E278-K281 IonicContact OE1-NZ 3.77Å; E278-K281 PolarHBondContact OE1-NZ 3.36Å; E278-K281 WeakPolarHBondContact OE2-CD 3.28Å; E278-K281 IonicContact OE2-NZ 3.83Å; E278-I282 WeakPolarHBondContact O-CB 3.41Å; E278-I282 WeakPolarHBondContact O-CD1 3.16Å; E278-I282 WeakPolarHBondContact O-CG1 3.28Å; E278-I282 PolarHBondContact O-N 3.01Å
279I97.6Very high94.6Very high51 Ų5126.1 Ų26.126%0.26213%0.126SC..Hα-helixtrans-63.5-41.2171.8-65.8167.8000111.1V275 F276 I282 N283 F304V275-I279 HydrophobicContact CG1-CD1 3.83Å; V275-I279 VanDerWaalsContact O-CG1 3.27Å; V275-I279 WeakPolarHBondContact O-CG1 3.28Å; V275-I279 PolarHBondContact O-N 2.91Å; F276-I279 PolarHBondContact O-N 3.45Å; I279-I282 PolarHBondContact O-N 3.22Å; I279-N283 PolarHBondContact O-N 3.5Å; I279-N283 PolarHBondContact O-ND2 2.66Å; I279-F304 HydrophobicContact CB-CD1 3.78Å; I279-F304 HydrophobicContact CB-CE1 4.06Å; I279-F304 HydrophobicContact CB-CG 4.09Å; I279-F304 HydrophobicContact CD1-CD1 4.07Å; I279-F304 HydrophobicContact CD1-CE1 3.56Å; I279-F304 HydrophobicContact CD1-CZ 4.16Å; I279-F304 HydrophobicContact CG1-CE1 4.41Å; I279-F304 HydrophobicContact CG2-CB 4.32Å; I279-F304 HydrophobicContact CG2-CD1 3.61Å; I279-F304 HydrophobicContact CG2-CD2 3.66Å; I279-F304 HydrophobicContact CG2-CE1 3.71Å; I279-F304 HydrophobicContact CG2-CE2 3.75Å; I279-F304 HydrophobicContact CG2-CG 3.58Å; I279-F304 HydrophobicContact CG2-CZ 3.77Å
280S96.2Very high94Very high10 Ų1033.5 Ų33.57%0.0715%0.153CC..Hα-helixtrans-59.1-52.2175.7-1780000110.9F276 L277 E278 I282 N283 V284 A301F276-S280 WeakPolarHBondContact O-CB 3.4Å; F276-S280 PolarHBondContact O-N 2.93Å; L277-S280 WeakPolarHBondContact O-CB 3.47Å; L277-S280 PolarHBondContact O-N 3.08Å; E278-S280 VanDerWaalsContact C-N 3.34Å; E278-S280 PolarHBondContact O-N 2.95Å; S280-I282 PolarHBondContact O-N 2.81Å; S280-N283 PolarHBondContact O-N 2.9Å; S280-N283 VanDerWaalsContact O-N 3.11Å; S280-V284 WeakPolarHBondContact O-CG2 3.5Å; S280-V284 PolarHBondContact O-N 3.09Å; S280-A301 PolarHBondContact OG-O 3.21Å
281K94.6Very high93.3Very high29 Ų2934.2 Ų34.213%0.12616%0.164CC..Hα-helixtrans-56.7-46.8177.8-72.6175.8-178168.90113.1S158 L277 E278 N283 V284 Y285S158-K281 WeakPolarHBondContact OG-CD 3.3Å; L277-K281 HydrophobicContact CD2-CD 4.1Å; L277-K281 VanDerWaalsContact CD2-NZ 3.3Å; L277-K281 WeakPolarHBondContact O-CG 3.39Å; L277-K281 PolarHBondContact O-N 3.39Å; E278-K281 PolarHBondContact O-N 3.48Å; E278-K281 IonicContact OE1-NZ 3.77Å; E278-K281 PolarHBondContact OE1-NZ 3.36Å; E278-K281 WeakPolarHBondContact OE2-CD 3.28Å; E278-K281 IonicContact OE2-NZ 3.83Å; K281-N283 PolarHBondContact O-N 2.81Å; K281-V284 WeakPolarHBondContact O-CB 3.07Å; K281-V284 PolarHBondContact O-N 3.25Å; K281-V284 VanDerWaalsContact O-N 3.07Å; K281-Y285 HydrophobicContact CB-CD2 4.45Å; K281-Y285 HydrophobicContact CB-CE2 3.86Å; K281-Y285 WeakPolarHBondContact O-CD2 3.31Å; K281-Y285 PolarHBondContact O-N 2.82Å
282I95.4Very high92.8Very high39 Ų3940.7 Ų40.720%0.219%0.192CC..Hα-helixtrans-53.8-44.4177.1-73.3163.5000110.8L155 E278 I279 S280 Y285 L286L155-I282 HydrophobicContact CD1-CB 4.11Å; L155-I282 HydrophobicContact CD1-CG1 4.1Å; L155-I282 HydrophobicContact CD1-CG2 3.79Å; E278-I282 WeakPolarHBondContact O-CB 3.41Å; E278-I282 WeakPolarHBondContact O-CD1 3.16Å; E278-I282 WeakPolarHBondContact O-CG1 3.28Å; E278-I282 PolarHBondContact O-N 3.01Å; I279-I282 PolarHBondContact O-N 3.22Å; S280-I282 PolarHBondContact O-N 2.81Å; I282-Y285 PolarHBondContact O-N 3.32Å; I282-L286 HydrophobicContact CG2-CD1 3.84Å; I282-L286 WeakPolarHBondContact O-CB 3.34Å; I282-L286 VanDerWaalsContact O-CG 3.29Å; I282-L286 WeakPolarHBondContact O-CG 3.17Å; I282-L286 PolarHBondContact O-N 3.38Å
283N94.8Very high92.3Very high15 Ų1544 Ų448%0.0822%0.216CC..Hα-helixtrans-71.5-36.3178.7-78.4-80.4000112.4I279 S280 K281 Y285 L286 R287 H297 I300 A301I279-N283 PolarHBondContact O-N 3.5Å; I279-N283 PolarHBondContact O-ND2 2.66Å; S280-N283 PolarHBondContact O-N 2.9Å; S280-N283 VanDerWaalsContact O-N 3.11Å; K281-N283 PolarHBondContact O-N 2.81Å; N283-Y285 VanDerWaalsContact C-N 3.27Å; N283-Y285 PolarHBondContact O-N 2.56Å; N283-L286 PolarHBondContact O-N 2.93Å; N283-R287 PolarHBondContact O-N 3.24Å; N283-H297 HydrophobicContact CB-CB 4.43Å; N283-H297 WeakPolarHBondContact CB-O 3.28Å; N283-H297 WeakPolarHBondContact O-CB 3.36Å; N283-H297 PolarHBondContact OD1-ND1 3.37Å; N283-I300 HydrophobicContact CB-CB 4.45Å; N283-I300 HydrophobicContact CB-CG2 4.32Å; N283-I300 VanDerWaalsContact CG-CG2 3.48Å; N283-I300 WeakPolarHBondContact ND2-CG2 3.49Å; N283-A301 HydrophobicContact CB-CB 3.85Å
284V92.1Very high91.9Very high30 Ų3048 Ų4818%0.18223%0.232CC..Hα-helixtrans-58.3-41.6170.8175.90000110.9S280 K281 R287 A301S280-V284 WeakPolarHBondContact O-CG2 3.5Å; S280-V284 PolarHBondContact O-N 3.09Å; K281-V284 WeakPolarHBondContact O-CB 3.07Å; K281-V284 PolarHBondContact O-N 3.25Å; K281-V284 VanDerWaalsContact O-N 3.07Å; V284-R287 WeakPolarHBondContact O-CB 3.48Å; V284-R287 WeakPolarHBondContact O-CD 3.36Å; V284-R287 WeakPolarHBondContact O-CG 3.21Å; V284-R287 PolarHBondContact O-N 3.42Å; V284-A301 HydrophobicContact CG2-CB 3.67Å
285Y90.9Very high91.5Very high25 Ų2552.1 Ų52.110%0.09826%0.258CS..Hα-helixtrans-71.4-34.4179.1-62.2-31.9000113.3I151 K154 L155 K281 I282 N283 R287I151-Y285 HydrophobicContact CG2-CD1 4.1Å; I151-Y285 HydrophobicContact CG2-CG 3.98Å; K154-Y285 HydrophobicContact CB-CD2 4.26Å; K154-Y285 HydrophobicContact CB-CE1 4.09Å; K154-Y285 HydrophobicContact CB-CE2 3.72Å; K154-Y285 HydrophobicContact CD-CE1 4.1Å; L155-Y285 HydrophobicContact CB-CD2 4.23Å; L155-Y285 HydrophobicContact CD1-CD2 4.34Å; K281-Y285 HydrophobicContact CB-CD2 4.45Å; K281-Y285 HydrophobicContact CB-CE2 3.86Å; K281-Y285 WeakPolarHBondContact O-CD2 3.31Å; K281-Y285 PolarHBondContact O-N 2.82Å; I282-Y285 PolarHBondContact O-N 3.32Å; N283-Y285 VanDerWaalsContact C-N 3.27Å; N283-Y285 PolarHBondContact O-N 2.56Å; Y285-R287 VanDerWaalsContact C-N 3.26Å; Y285-R287 PolarHBondContact O-N 2.94Å
286L92.4Very high91.3Very high29 Ų2956.5 Ų56.515%0.15228%0.28CS..Hα-helixtrans-81.7-1.1178.3-68.2172.1000113.9V145 V147 L155 I282 N283 I288 H297V145-L286 HydrophobicContact CG1-CD2 4.19Å; V147-L286 HydrophobicContact CG2-CD2 4.2Å; L155-L286 HydrophobicContact CD1-CD1 4.45Å; L155-L286 HydrophobicContact CD1-CD2 4.42Å; L155-L286 HydrophobicContact CD1-CG 4.1Å; L155-L286 HydrophobicContact CD2-CD2 3.75Å; L155-L286 HydrophobicContact CD2-CG 4.32Å; I282-L286 HydrophobicContact CG2-CD1 3.84Å; I282-L286 WeakPolarHBondContact O-CB 3.34Å; I282-L286 VanDerWaalsContact O-CG 3.29Å; I282-L286 WeakPolarHBondContact O-CG 3.17Å; I282-L286 PolarHBondContact O-N 3.38Å; N283-L286 PolarHBondContact O-N 2.93Å; L286-I288 VanDerWaalsContact C-N 3.26Å; L286-I288 PolarHBondContact O-N 3.47Å; L286-H297 PolarHBondContact O-CD2 3.39Å; L286-H297 VanDerWaalsContact O-CD2 3.29Å
287R90Very high91Very high53 Ų5355.8 Ų55.820%0.228%0.277CS..THydrogen-bonded Turntrans-60.4-33.7-177.680.1179.5-179.5-126.66.8113.2N283 V284 Y285 P293 Y294 M298 C380N283-R287 PolarHBondContact O-N 3.24Å; V284-R287 WeakPolarHBondContact O-CB 3.48Å; V284-R287 WeakPolarHBondContact O-CD 3.36Å; V284-R287 WeakPolarHBondContact O-CG 3.21Å; V284-R287 PolarHBondContact O-N 3.42Å; Y285-R287 VanDerWaalsContact C-N 3.26Å; Y285-R287 PolarHBondContact O-N 2.94Å; R287-P293 CarbonylContact O-C 3.48Å; R287-P293 WeakPolarHBondContact O-CA 3.37Å; R287-Y294 PolarHBondContact O-N 3.12Å; R287-M298 HydrophobicContact CB-CE 4.45Å; R287-C380 VanDerWaalsContact NH1-CB 3.35Å; R287-C380 PolarHBondContact NH1-O 3.05Å
288I86.3Confident90.7Very high41 Ų4156.9 Ų56.921%0.2128%0.282CS..EExtended strand (participates in β ladder)trans-124.4121.8179.1-71156.5000108L286 K292 P293 L397L286-I288 VanDerWaalsContact C-N 3.26Å; L286-I288 PolarHBondContact O-N 3.47Å; I288-K292 WeakPolarHBondContact CA-O 3.33Å; I288-P293 HydrophobicContact CG1-CB 4.3Å; I288-L397 HydrophobicContact CB-CD1 4.39Å; I288-L397 HydrophobicContact CD1-CD1 3.64Å; I288-L397 HydrophobicContact CD1-CD2 3.73Å; I288-L397 HydrophobicContact CD1-CG 4.07Å; I288-L397 HydrophobicContact CG2-CD1 4.05Å
289R87.2Confident90.4Very high59 Ų5960.1 Ų60.122%0.22330%0.302CS..EExtended strand (participates in β ladder)trans-136130.6178.2-63.6177.1-72.6160.40.7108.4V145 V147 G291 K292 Y294V145-R289 HydrophobicContact CG1-CG 4.08Å; V147-R289 HydrophobicContact CG2-CG 4.16Å; R289-G291 PolarHBondContact O-N 3.05Å; R289-K292 PolarHBondContact N-O 2.74Å; R289-K292 PolarHBondContact O-N 3.26Å; R289-Y294 HydrophobicContact CB-CD2 4.28Å; R289-Y294 HydrophobicContact CB-CE2 3.83Å; R289-Y294 VanDerWaalsContact NH2-CE1 3.25Å
290R84.5Confident90.3Very high157 Ų15760.1 Ų60.159%0.59230%0.302SS*.THydrogen-bonded Turntrans51.939.1-175.5-53.3-178.9179.7-177.2-2.8112.3G144 G146 K292G144-R290 PolarHBondContact O-NH2 3.18Å; G146-R290 PolarHBondContact O-N 2.85Å; R290-K292 PolarHBondContact O-N 2.74Å; R290-K292 VanDerWaalsContact O-N 3.1Å
291G82.1Confident90.2Very high28 Ų2859.7 Ų59.729%0.28930%0.299SS..THydrogen-bonded Turntrans70.9-5-175.700000115.9R289R289-G291 PolarHBondContact O-N 3.05Å
292K85.4Confident90.1Very high138 Ų13861.9 Ų61.960%0.631%0.313SS*.EExtended strand (participates in β ladder)trans-92.4127.6179.8-66.5-175.6179-176.30111.1I288 R289 R290 Y294I288-K292 WeakPolarHBondContact CA-O 3.33Å; R289-K292 PolarHBondContact N-O 2.74Å; R289-K292 PolarHBondContact O-N 3.26Å; R290-K292 PolarHBondContact O-N 2.74Å; R290-K292 VanDerWaalsContact O-N 3.1Å; K292-Y294 HydrophobicContact CB-CE2 4.04Å; K292-Y294 VanDerWaalsContact O-CD2 3.23Å; K292-Y294 WeakPolarHBondContact O-CD2 3.39Å; K292-Y294 WeakPolarHBondContact O-CE2 3.33Å
293P86.6Confident90.2Very high103 Ų10364.4 Ų64.467%0.66933%0.325SS*.EExtended strand (participates in β ladder)trans-76.5138.1172.631.2-33.2000111.1R287 I288R287-P293 CarbonylContact O-C 3.48Å; R287-P293 WeakPolarHBondContact O-CA 3.37Å; I288-P293 HydrophobicContact CG1-CB 4.3Å
294Y88.1Confident90.3Very high86 Ų8666.1 Ų66.134%0.33733%0.332SS..  trans-118.1101.2177.4-70.8-91.2000109.1R287 R289 K292 I296 H297R287-Y294 PolarHBondContact O-N 3.12Å; R289-Y294 HydrophobicContact CB-CD2 4.28Å; R289-Y294 HydrophobicContact CB-CE2 3.83Å; R289-Y294 VanDerWaalsContact NH2-CE1 3.25Å; K292-Y294 HydrophobicContact CB-CE2 4.04Å; K292-Y294 VanDerWaalsContact O-CD2 3.23Å; K292-Y294 WeakPolarHBondContact O-CD2 3.39Å; K292-Y294 WeakPolarHBondContact O-CE2 3.33Å; Y294-I296 VanDerWaalsContact C-N 3.29Å; Y294-I296 PolarHBondContact O-N 2.63Å; Y294-H297 PolarHBondContact O-N 3.2Å
295T87.3Confident90.5Very high116 Ų11666.1 Ų66.171%0.71233%0.33SS*.Hα-helixtrans-63.5-31.4-174.4530000113.5H297 M298 T299T295-H297 VanDerWaalsContact C-N 3.26Å; T295-H297 PolarHBondContact O-N 2.93Å; T295-M298 WeakPolarHBondContact O-CB 3.44Å; T295-M298 PolarHBondContact O-N 3.08Å; T295-T299 PolarHBondContact O-N 3.45Å; T295-T299 VanDerWaalsContact O-N 3.11Å; T295-T299 PolarHBondContact O-OG1 3.12Å
296I93.2Very high90.8Very high98 Ų9867.3 Ų67.350%0.50335%0.345SS..Hα-helixtrans-55.9-40.1177.6-173.758.7000112.5Y294 M298 T299 I300Y294-I296 VanDerWaalsContact C-N 3.29Å; Y294-I296 PolarHBondContact O-N 2.63Å; I296-M298 VanDerWaalsContact C-N 3.31Å; I296-M298 PolarHBondContact O-N 3.44Å; I296-T299 PolarHBondContact O-N 3.33Å; I296-I300 HydrophobicContact CD1-CD1 4.38Å; I296-I300 HydrophobicContact CD1-CG1 4.5Å; I296-I300 HydrophobicContact CG1-CD1 4.03Å; I296-I300 WeakPolarHBondContact O-CG1 3.3Å; I296-I300 PolarHBondContact O-N 2.9Å
297H92.4Very high91Very high27 Ų2769.3 Ų69.313%0.12536%0.356CS..Hα-helixtrans-67.5-34178.5-75.4-59.5000111.5N283 L286 Y294 T295 I300 A301N283-H297 HydrophobicContact CB-CB 4.43Å; N283-H297 WeakPolarHBondContact CB-O 3.28Å; N283-H297 WeakPolarHBondContact O-CB 3.36Å; N283-H297 PolarHBondContact OD1-ND1 3.37Å; L286-H297 PolarHBondContact O-CD2 3.39Å; L286-H297 VanDerWaalsContact O-CD2 3.29Å; Y294-H297 PolarHBondContact O-N 3.2Å; T295-H297 VanDerWaalsContact C-N 3.26Å; T295-H297 PolarHBondContact O-N 2.93Å; H297-I300 PolarHBondContact O-N 2.95Å; H297-A301 VanDerWaalsContact O-CB 3.23Å; H297-A301 WeakPolarHBondContact O-CB 3.01Å; H297-A301 PolarHBondContact O-N 3.44Å
298M89.8Confident91.4Very high53 Ų5367.1 Ų67.126%0.26135%0.348SS..Hα-helixtrans-64.7-43.5173.7-167.461.170.800111.6R287 T295 I296 I300 A301 N302 C380R287-M298 HydrophobicContact CB-CE 4.45Å; T295-M298 WeakPolarHBondContact O-CB 3.44Å; T295-M298 PolarHBondContact O-N 3.08Å; I296-M298 VanDerWaalsContact C-N 3.31Å; I296-M298 PolarHBondContact O-N 3.44Å; M298-I300 PolarHBondContact O-N 3.16Å; M298-A301 PolarHBondContact O-N 3.19Å; M298-N302 PolarHBondContact O-N 3.18Å; M298-C380 WeakPolarHBondContact CE-SG 3.49Å
299T91.5Very high92Very high75 Ų7566 Ų6646%0.4635%0.345SS..Hα-helixtrans-60.8-47.6177.3-53.90000111.2T295 I296 A301 N302 I303T295-T299 PolarHBondContact O-N 3.45Å; T295-T299 VanDerWaalsContact O-N 3.11Å; T295-T299 PolarHBondContact O-OG1 3.12Å; I296-T299 PolarHBondContact O-N 3.33Å; T299-A301 PolarHBondContact O-N 3.48Å; T299-N302 PolarHBondContact O-N 3.42Å; T299-I303 HydrophobicContact CG2-CD1 4.06Å; T299-I303 WeakPolarHBondContact O-CG1 3.17Å; T299-I303 PolarHBondContact O-N 2.86Å
300I96.2Very high92.5Very high51 Ų5167.2 Ų67.226%0.26236%0.358SS..Hα-helixtrans-62.4-44.9177.1-63.9169000110.4N283 I296 H297 M298 N302 I303 F304N283-I300 HydrophobicContact CB-CB 4.45Å; N283-I300 HydrophobicContact CB-CG2 4.32Å; N283-I300 VanDerWaalsContact CG-CG2 3.48Å; N283-I300 WeakPolarHBondContact ND2-CG2 3.49Å; I296-I300 HydrophobicContact CD1-CD1 4.38Å; I296-I300 HydrophobicContact CD1-CG1 4.5Å; I296-I300 HydrophobicContact CG1-CD1 4.03Å; I296-I300 WeakPolarHBondContact O-CG1 3.3Å; I296-I300 PolarHBondContact O-N 2.9Å; H297-I300 PolarHBondContact O-N 2.95Å; M298-I300 PolarHBondContact O-N 3.16Å; I300-N302 VanDerWaalsContact C-N 3.32Å; I300-N302 PolarHBondContact O-N 3.45Å; I300-I303 PolarHBondContact O-N 2.94Å; I300-F304 HydrophobicContact CG2-CD2 3.59Å; I300-F304 HydrophobicContact CG2-CE2 3.81Å; I300-F304 WeakPolarHBondContact O-CD2 3.32Å; I300-F304 PolarHBondContact O-N 3.5Å
301A94.2Very high93.1Very high1 Ų160.3 Ų60.31%0.00833%0.334CS..Hα-helixtrans-56.6-44.717800000112.3S280 N283 V284 H297 M298 T299 F304 F305S280-A301 PolarHBondContact OG-O 3.21Å; N283-A301 HydrophobicContact CB-CB 3.85Å; V284-A301 HydrophobicContact CG2-CB 3.67Å; H297-A301 VanDerWaalsContact O-CB 3.23Å; H297-A301 WeakPolarHBondContact O-CB 3.01Å; H297-A301 PolarHBondContact O-N 3.44Å; M298-A301 PolarHBondContact O-N 3.19Å; T299-A301 PolarHBondContact O-N 3.48Å; A301-F304 PolarHBondContact O-N 2.77Å; A301-F305 VanDerWaalsContact O-CB 3.26Å; A301-F305 WeakPolarHBondContact O-CB 3.31Å; A301-F305 PolarHBondContact O-N 3.18Å
302N92.7Very high93.9Very high76 Ų7659.4 Ų59.441%0.40632%0.322SS..Hα-helixtrans-67.4-41.8178.8-71.7-15.9000112.5M298 T299 I300 F305 A306M298-N302 PolarHBondContact O-N 3.18Å; T299-N302 PolarHBondContact O-N 3.42Å; I300-N302 VanDerWaalsContact C-N 3.32Å; I300-N302 PolarHBondContact O-N 3.45Å; N302-F305 PolarHBondContact O-N 3.34Å; N302-A306 WeakPolarHBondContact O-CB 3.06Å; N302-A306 PolarHBondContact O-N 2.79Å
303I96.2Very high94.5Very high91 Ų9155.8 Ų55.847%0.46731%0.311SS..Hα-helixtrans-59.9-50.6175.2-68.6166.3000110.1T299 I300 F305 A306 L307T299-I303 HydrophobicContact CG2-CD1 4.06Å; T299-I303 WeakPolarHBondContact O-CG1 3.17Å; T299-I303 PolarHBondContact O-N 2.86Å; I300-I303 PolarHBondContact O-N 2.94Å; I303-F305 VanDerWaalsContact C-N 3.33Å; I303-F305 PolarHBondContact O-N 3.42Å; I303-A306 PolarHBondContact O-N 3.19Å; I303-L307 HydrophobicContact CG2-CD1 4.21Å; I303-L307 WeakPolarHBondContact O-CG 3.44Å; I303-L307 PolarHBondContact O-N 3.27Å
304F97.5Very high95Very high51 Ų5154.2 Ų54.222%0.22430%0.3CS..Hα-helixtrans-68.9-30.9-179.7-85-86.3000112.8F276 I279 I300 A301 L307 F308F276-F304 HydrophobicContact CB-CD1 4.33Å; F276-F304 AromaticContact CD1-CD1 3.87Å; F276-F304 HydrophobicContact CD1-CD1 3.87Å; F276-F304 AromaticContact CD1-CE1 3.96Å; F276-F304 HydrophobicContact CD1-CE1 3.96Å; I279-F304 HydrophobicContact CB-CD1 3.78Å; I279-F304 HydrophobicContact CB-CE1 4.06Å; I279-F304 HydrophobicContact CB-CG 4.09Å; I279-F304 HydrophobicContact CD1-CD1 4.07Å; I279-F304 HydrophobicContact CD1-CE1 3.56Å; I279-F304 HydrophobicContact CD1-CZ 4.16Å; I279-F304 HydrophobicContact CG1-CE1 4.41Å; I279-F304 HydrophobicContact CG2-CB 4.32Å; I279-F304 HydrophobicContact CG2-CD1 3.61Å; I279-F304 HydrophobicContact CG2-CD2 3.66Å; I279-F304 HydrophobicContact CG2-CE1 3.71Å; I279-F304 HydrophobicContact CG2-CE2 3.75Å; I279-F304 HydrophobicContact CG2-CG 3.58Å; I279-F304 HydrophobicContact CG2-CZ 3.77Å; I300-F304 HydrophobicContact CG2-CD2 3.59Å; I300-F304 HydrophobicContact CG2-CE2 3.81Å; I300-F304 WeakPolarHBondContact O-CD2 3.32Å; I300-F304 PolarHBondContact O-N 3.5Å; A301-F304 PolarHBondContact O-N 2.77Å; F304-L307 HydrophobicContact CD1-CD1 4.33Å; F304-L307 PolarHBondContact O-N 2.98Å; F304-F308 VanDerWaalsContact O-CB 3.29Å; F304-F308 WeakPolarHBondContact O-CB 3.25Å; F304-F308 PolarHBondContact O-N 3.22Å
305F96.3Very high95.5Very high30 Ų3051.3 Ų51.313%0.13229%0.29CS..Hα-helixtrans-65.2-41.3171.3-177.1-95000111.6A301 N302 I303 F308 A309 M368 T369 L372A301-F305 VanDerWaalsContact O-CB 3.26Å; A301-F305 WeakPolarHBondContact O-CB 3.31Å; A301-F305 PolarHBondContact O-N 3.18Å; N302-F305 PolarHBondContact O-N 3.34Å; I303-F305 VanDerWaalsContact C-N 3.33Å; I303-F305 PolarHBondContact O-N 3.42Å; F305-F308 HydrophobicContact CD2-CD1 4.21Å; F305-F308 HydrophobicContact CE2-CD1 4.17Å; F305-F308 HydrophobicContact CE2-CE1 4.42Å; F305-F308 WeakPolarHBondContact O-CB 3.27Å; F305-F308 PolarHBondContact O-N 2.98Å; F305-A309 WeakPolarHBondContact O-CB 3.43Å; F305-A309 PolarHBondContact O-N 3.45Å; F305-M368 HydrophobicContact CE1-CG 4.38Å; F305-M368 HydrophobicContact CE2-CB 4.28Å; F305-M368 HydrophobicContact CE2-CG 3.61Å; F305-M368 HydrophobicContact CZ-CB 3.84Å; F305-M368 HydrophobicContact CZ-CG 3.45Å; F305-M368 VanDerWaalsContact CZ-CG 3.45Å; F305-T369 WeakPolarHBondContact CE1-OG1 3.4Å; F305-L372 HydrophobicContact CD1-CD1 3.3Å; F305-L372 HydrophobicContact CD2-CD1 4.45Å; F305-L372 HydrophobicContact CE1-CD1 3.21Å; F305-L372 HydrophobicContact CE2-CD1 4.38Å; F305-L372 HydrophobicContact CG-CD1 3.96Å; F305-L372 HydrophobicContact CZ-CD1 3.81Å
306A96.6Very high96Very high51 Ų5146.3 Ų46.342%0.42126%0.258SS..Hα-helixtrans-64.9-41.7174.800000111.8N302 I303 F308 A309 T310N302-A306 WeakPolarHBondContact O-CB 3.06Å; N302-A306 PolarHBondContact O-N 2.79Å; I303-A306 PolarHBondContact O-N 3.19Å; A306-F308 VanDerWaalsContact C-N 3.34Å; A306-A309 PolarHBondContact O-N 3.29Å; A306-T310 WeakPolarHBondContact O-CB 3.4Å; A306-T310 WeakPolarHBondContact O-CG2 3.23Å; A306-T310 PolarHBondContact O-N 3.43Å; A306-T310 PolarHBondContact O-OG1 2.84Å
307L97.9Very high96.2Very high70 Ų7042.8 Ų42.837%0.36624%0.24SC..Hα-helixtrans-62.6-40.6173.1-70.4173.9000111.8F276 I303 F304 T310 S311F276-L307 HydrophobicContact CB-CB 4.4Å; F276-L307 HydrophobicContact CD1-CB 4.35Å; F276-L307 HydrophobicContact CD2-CB 4.07Å; F276-L307 HydrophobicContact CE2-CB 4.41Å; F276-L307 HydrophobicContact CG-CB 4.04Å; I303-L307 HydrophobicContact CG2-CD1 4.21Å; I303-L307 WeakPolarHBondContact O-CG 3.44Å; I303-L307 PolarHBondContact O-N 3.27Å; F304-L307 HydrophobicContact CD1-CD1 4.33Å; F304-L307 PolarHBondContact O-N 2.98Å; L307-T310 WeakPolarHBondContact CA-OG1 3.39Å; L307-T310 PolarHBondContact O-OG1 3.17Å; L307-T310 VanDerWaalsContact O-OG1 3.12Å; L307-S311 WeakPolarHBondContact O-CB 3.26Å; L307-S311 PolarHBondContact O-N 3.03Å; L307-S311 PolarHBondContact O-OG 2.83Å
308F98.1Very high96.5Very high8 Ų846.5 Ų46.54%0.03525%0.254CS..Hα-helixtrans-61-52.5173.5162.5-111.4000111.6C273 F276 L277 F304 F305 A306 T310 S311 W312 I365C273-F308 HydrophobicContact CB-CD2 4.39Å; C273-F308 WeakPolarHBondContact O-CD2 3.27Å; F276-F308 HydrophobicContact CB-CB 3.9Å; L277-F308 HydrophobicContact CB-CB 4.48Å; L277-F308 HydrophobicContact CB-CD2 3.6Å; L277-F308 HydrophobicContact CB-CE2 3.84Å; L277-F308 HydrophobicContact CB-CG 3.94Å; L277-F308 HydrophobicContact CB-CZ 4.43Å; L277-F308 HydrophobicContact CD1-CD1 4.06Å; L277-F308 HydrophobicContact CD1-CD2 3.98Å; L277-F308 HydrophobicContact CD1-CE1 3.56Å; L277-F308 HydrophobicContact CD1-CE2 3.44Å; L277-F308 VanDerWaalsContact CD1-CE2 3.44Å; L277-F308 HydrophobicContact CD1-CG 4.23Å; L277-F308 HydrophobicContact CD1-CZ 3.22Å; L277-F308 HydrophobicContact CG-CD2 4.41Å; L277-F308 HydrophobicContact CG-CE2 4.26Å; L277-F308 HydrophobicContact CG-CZ 4.41Å; F304-F308 VanDerWaalsContact O-CB 3.29Å; F304-F308 WeakPolarHBondContact O-CB 3.25Å; F304-F308 PolarHBondContact O-N 3.22Å; F305-F308 HydrophobicContact CD2-CD1 4.21Å; F305-F308 HydrophobicContact CE2-CD1 4.17Å; F305-F308 HydrophobicContact CE2-CE1 4.42Å; F305-F308 WeakPolarHBondContact O-CB 3.27Å; F305-F308 PolarHBondContact O-N 2.98Å; A306-F308 VanDerWaalsContact C-N 3.34Å; F308-T310 PolarHBondContact O-N 3.1Å; F308-S311 PolarHBondContact O-N 3.17Å; F308-S311 PolarHBondContact O-OG 3.15Å; F308-W312 HydrophobicContact CE2-CD2 4.48Å; F308-W312 AromaticContact CE2-CE3 3.51Å; F308-W312 HydrophobicContact CE2-CE3 3.51Å; F308-W312 AromaticContact CE2-CZ3 4Å; F308-W312 HydrophobicContact CE2-CZ3 4Å; F308-W312 AromaticContact CZ-CE3 3.8Å; F308-W312 HydrophobicContact CZ-CE3 3.8Å; F308-W312 HydrophobicContact CZ-CZ3 4.18Å; F308-W312 WeakPolarHBondContact O-CB 3.25Å; F308-W312 PolarHBondContact O-N 2.94Å; F308-I365 HydrophobicContact CE1-CD1 3.62Å; F308-I365 HydrophobicContact CE1-CG1 3.68Å; F308-I365 HydrophobicContact CE1-CG2 4.16Å; F308-I365 HydrophobicContact CE2-CD1 4.27Å; F308-I365 HydrophobicContact CZ-CD1 3.36Å; F308-I365 HydrophobicContact CZ-CG1 3.8Å
309A97.6Very high96.9Very high18 Ų1844.9 Ų44.915%0.14925%0.246CC..Hα-helixtrans-62.8-42.1-177.700000112.3F305 A306 V313 I365F305-A309 WeakPolarHBondContact O-CB 3.43Å; F305-A309 PolarHBondContact O-N 3.45Å; A306-A309 PolarHBondContact O-N 3.29Å; A309-V313 PolarHBondContact O-N 3.4Å; A309-I365 HydrophobicContact CB-CG2 3.76Å
310T97.8Very high97.2Very high83 Ų8341.3 Ų41.351%0.50922%0.224SC..Hα-helixtrans-68.8-46177.552.30000111.9A306 L307 F308 W312 V313 V314A306-T310 WeakPolarHBondContact O-CB 3.4Å; A306-T310 WeakPolarHBondContact O-CG2 3.23Å; A306-T310 PolarHBondContact O-N 3.43Å; A306-T310 PolarHBondContact O-OG1 2.84Å; L307-T310 WeakPolarHBondContact CA-OG1 3.39Å; L307-T310 PolarHBondContact O-OG1 3.17Å; L307-T310 VanDerWaalsContact O-OG1 3.12Å; F308-T310 PolarHBondContact O-N 3.1Å; T310-W312 VanDerWaalsContact C-N 3.31Å; T310-W312 PolarHBondContact O-N 3.23Å; T310-V313 PolarHBondContact O-N 2.83Å; T310-V314 WeakPolarHBondContact O-CG2 3.25Å; T310-V314 PolarHBondContact O-N 3.42Å
311S97.9Very high97.2Very high12 Ų1238.9 Ų38.98%0.08421%0.212CC..Hα-helixtrans-63.5-34.117665.80000112.5C273 F276 L307 F308 V313 V314 L315C273-S311 VanDerWaalsContact SG-C 3.5Å; C273-S311 PolarHBondContact SG-O 2.92Å; C273-S311 PolarHBondContact SG-OG 2.64Å; F276-S311 WeakPolarHBondContact CD2-OG 3.49Å; L307-S311 WeakPolarHBondContact O-CB 3.26Å; L307-S311 PolarHBondContact O-N 3.03Å; L307-S311 PolarHBondContact O-OG 2.83Å; F308-S311 PolarHBondContact O-N 3.17Å; F308-S311 PolarHBondContact O-OG 3.15Å; S311-V313 PolarHBondContact O-N 3.5Å; S311-V314 PolarHBondContact O-N 2.99Å; S311-L315 VanDerWaalsContact O-CB 3.25Å; S311-L315 WeakPolarHBondContact O-CB 3.25Å; S311-L315 WeakPolarHBondContact O-CG 3.07Å; S311-L315 PolarHBondContact O-N 3.19Å
312W98.4Very high97.4Very high9 Ų939 Ų393%0.03421%0.212CC..Iπ-helixtrans-59.4-46.8175.1-172.8-79.6000111.7C273 F308 T310 R316 L317 H358 W361 F362 I365C273-W312 HydrophobicContact CB-CE3 4.46Å; F308-W312 HydrophobicContact CE2-CD2 4.48Å; F308-W312 AromaticContact CE2-CE3 3.51Å; F308-W312 HydrophobicContact CE2-CE3 3.51Å; F308-W312 AromaticContact CE2-CZ3 4Å; F308-W312 HydrophobicContact CE2-CZ3 4Å; F308-W312 AromaticContact CZ-CE3 3.8Å; F308-W312 HydrophobicContact CZ-CE3 3.8Å; F308-W312 HydrophobicContact CZ-CZ3 4.18Å; F308-W312 WeakPolarHBondContact O-CB 3.25Å; F308-W312 PolarHBondContact O-N 2.94Å; T310-W312 VanDerWaalsContact C-N 3.31Å; T310-W312 PolarHBondContact O-N 3.23Å; W312-R316 WeakPolarHBondContact O-CB 3.41Å; W312-R316 PolarHBondContact O-N 3.46Å; W312-L317 PolarHBondContact O-N 3.05Å; W312-L317 VanDerWaalsContact O-N 3.17Å; W312-H358 HydrophobicContact CZ2-CB 4.25Å; W312-H358 PolarHBondContact NE1-O 3.5Å; W312-W361 HydrophobicContact CH2-CB 3.64Å; W312-W361 HydrophobicContact CH2-CD2 4.31Å; W312-W361 AromaticContact CH2-CE3 3.91Å; W312-W361 HydrophobicContact CH2-CE3 3.91Å; W312-W361 HydrophobicContact CH2-CG 4.26Å; W312-W361 HydrophobicContact CZ2-CB 3.5Å; W312-W361 VanDerWaalsContact CZ2-CB 3.5Å; W312-W361 HydrophobicContact CZ2-CE3 4.23Å; W312-W361 HydrophobicContact CZ2-CG 4.47Å; W312-F362 AromaticContact CD1-CD2 3.66Å; W312-I365 HydrophobicContact CB-CD1 3.9Å; W312-I365 HydrophobicContact CD2-CD1 3.3Å; W312-I365 HydrophobicContact CE3-CD1 3.7Å; W312-I365 HydrophobicContact CG-CD1 3.38Å; W312-I365 HydrophobicContact CZ2-CD1 4.38Å; W312-I365 HydrophobicContact CZ3-CD1 4.33Å
313V98.1Very high97.5Very high62 Ų6236.4 Ų36.438%0.37620%0.197SC..Iπ-helixtrans-63.2-49.7177.2176.40000110.3A309 T310 S311 L317 Y318 F362A309-V313 PolarHBondContact O-N 3.4Å; T310-V313 PolarHBondContact O-N 2.83Å; S311-V313 PolarHBondContact O-N 3.5Å; V313-L317 CarbonylContact O-C 3.6Å; V313-L317 WeakPolarHBondContact O-CB 3.42Å; V313-L317 PolarHBondContact O-N 3.04Å; V313-Y318 WeakPolarHBondContact O-CB 3.21Å; V313-Y318 PolarHBondContact O-N 3.29Å; V313-F362 HydrophobicContact CG2-CD2 4.36Å; V313-F362 HydrophobicContact CG2-CE2 3.48Å; V313-F362 VanDerWaalsContact CG2-CE2 3.48Å; V313-F362 HydrophobicContact CG2-CZ 4Å
314V98.1Very high97.5Very high71 Ų7132.1 Ų32.143%0.4318%0.175SC..Iπ-helixtrans-68.4-49.2-176176.80000111.8T310 S311 Y318 L319T310-V314 WeakPolarHBondContact O-CG2 3.25Å; T310-V314 PolarHBondContact O-N 3.42Å; S311-V314 PolarHBondContact O-N 2.99Å; V314-Y318 WeakPolarHBondContact O-CB 3.46Å; V314-L319 HydrophobicContact CG1-CD1 4.24Å; V314-L319 HydrophobicContact CG1-CG 4.4Å; V314-L319 WeakPolarHBondContact O-CB 3.44Å; V314-L319 VanDerWaalsContact O-CG 3.3Å; V314-L319 WeakPolarHBondContact O-CG 3.4Å; V314-L319 PolarHBondContact O-N 3.42Å
315L98Very high97.5Very high25 Ų2529.7 Ų29.713%0.13117%0.165CC..Iπ-helixtrans-84.7-45.8-170.6-55.1-179.2000112.6L269 L272 S311 L319 F320L269-L315 HydrophobicContact CD2-CD2 4.37Å; L269-L315 VanDerWaalsContact O-CB 3.23Å; L269-L315 WeakPolarHBondContact O-CB 3.44Å; L272-L315 HydrophobicContact CB-CD1 3.98Å; L272-L315 HydrophobicContact CD2-CD1 4.04Å; L272-L315 HydrophobicContact CG-CD1 4.37Å; S311-L315 VanDerWaalsContact O-CB 3.25Å; S311-L315 WeakPolarHBondContact O-CB 3.25Å; S311-L315 WeakPolarHBondContact O-CG 3.07Å; S311-L315 PolarHBondContact O-N 3.19Å; L315-L319 HydrophobicContact CD2-CD1 3.82Å; L315-F320 VanDerWaalsContact O-CB 3.3Å; L315-F320 WeakPolarHBondContact O-CB 3.23Å; L315-F320 PolarHBondContact O-N 3.34Å
316R98Very high97.6Very high10 Ų1028.4 Ų28.44%0.03816%0.159CC..Iπ-helixtrans-93.7-33.4-173.6-60.6-171.1-177.8-166.8-1.7113.8H270 D274 W312H270-R316 PolarHBondContact O-NH2 3.09Å; D274-R316 IonicContact OD1-CZ 3.77Å; D274-R316 IonicContact OD1-NH1 3.57Å; D274-R316 IonicContact OD1-NH2 3.19Å; D274-R316 PolarHBondContact OD1-NH2 3.27Å; D274-R316 IonicContact OD2-CZ 3.34Å; D274-R316 IonicContact OD2-NH2 2.9Å; D274-R316 PolarHBondContact OD2-NH2 3.07Å; W312-R316 WeakPolarHBondContact O-CB 3.41Å; W312-R316 PolarHBondContact O-N 3.46Å
317L97.8Very high97.5Very high25 Ų2526 Ų2613%0.13114%0.14CC..Iπ-helixtrans-94.3-30.1179.2-59.2-176.8000113.6Y76 W312 V313 P321 F355 H358 I359 F362Y76-L317 PolarHBondContact OH-O 2.91Å; W312-L317 PolarHBondContact O-N 3.05Å; W312-L317 VanDerWaalsContact O-N 3.17Å; V313-L317 CarbonylContact O-C 3.6Å; V313-L317 WeakPolarHBondContact O-CB 3.42Å; V313-L317 PolarHBondContact O-N 3.04Å; L317-P321 WeakPolarHBondContact O-CD 3.3Å; L317-P321 WeakPolarHBondContact O-CG 3.38Å; L317-F355 HydrophobicContact CD2-CE2 4.24Å; L317-H358 HydrophobicContact CD2-CB 4.16Å; L317-I359 HydrophobicContact CD2-CG1 4.36Å; L317-F362 HydrophobicContact CD1-CB 4.08Å; L317-F362 HydrophobicContact CD1-CD1 3.79Å; L317-F362 HydrophobicContact CD1-CD2 3.7Å; L317-F362 HydrophobicContact CD1-CE1 4.1Å; L317-F362 HydrophobicContact CD1-CE2 4.02Å; L317-F362 HydrophobicContact CD1-CG 3.58Å; L317-F362 HydrophobicContact CD1-CZ 4.21Å
318Y97.6Very high97.4Very high105 Ų10522.7 Ų22.741%0.41212%0.122SC..Iπ-helixtrans-102.8-64.1-178.5-176.8-112.1000113.4M73 Y76 V313 V314 P321 L322M73-Y318 HydrophobicContact CE-CE1 3.6Å; M73-Y318 HydrophobicContact CE-CE2 4.42Å; M73-Y318 WeakPolarHBondContact CE-OH 3.48Å; Y76-Y318 HydrophobicContact CE2-CD2 4.05Å; Y76-Y318 HydrophobicContact CE2-CE2 4.47Å; Y76-Y318 WeakPolarHBondContact OH-CA 3.47Å; V313-Y318 WeakPolarHBondContact O-CB 3.21Å; V313-Y318 PolarHBondContact O-N 3.29Å; V314-Y318 WeakPolarHBondContact O-CB 3.46Å; Y318-P321 WeakPolarHBondContact O-CD 3.24Å; Y318-P321 WeakPolarHBondContact O-CG 3.4Å; Y318-L322 HydrophobicContact CD2-CD1 3.62Å; Y318-L322 HydrophobicContact CE2-CD1 3.34Å; Y318-L322 HydrophobicContact CG-CD1 4.32Å; Y318-L322 WeakPolarHBondContact O-CB 3.2Å; Y318-L322 VanDerWaalsContact O-CG 3.27Å; Y318-L322 WeakPolarHBondContact O-CG 3.37Å; Y318-L322 PolarHBondContact O-N 3.11Å
319L97.6Very high97.2Very high19 Ų1922.3 Ų22.310%0.09912%0.121CC..Iπ-helixtrans-68.9-42.1-175.5-67.8-178000113M73 L269 V314 L315 L322 K323M73-L319 HydrophobicContact SD-CD2 4.08Å; L269-L319 HydrophobicContact CD1-CB 4.36Å; L269-L319 HydrophobicContact CD2-CB 4Å; L269-L319 HydrophobicContact CD2-CD1 4.06Å; V314-L319 HydrophobicContact CG1-CD1 4.24Å; V314-L319 HydrophobicContact CG1-CG 4.4Å; V314-L319 WeakPolarHBondContact O-CB 3.44Å; V314-L319 VanDerWaalsContact O-CG 3.3Å; V314-L319 WeakPolarHBondContact O-CG 3.4Å; V314-L319 PolarHBondContact O-N 3.42Å; L315-L319 HydrophobicContact CD2-CD1 3.82Å; L319-L322 PolarHBondContact O-N 2.98Å; L319-K323 HydrophobicContact CB-CD 4.49Å; L319-K323 HydrophobicContact CD2-CD 4.39Å; L319-K323 WeakPolarHBondContact O-CB 3.5Å; L319-K323 WeakPolarHBondContact O-CG 3.43Å; L319-K323 PolarHBondContact O-N 3.23Å
320F97.8Very high97.1Very high0 Ų022.3 Ų22.30%012%0.117CC..Iπ-helixtrans-57.1-53.4179.2169.9-115.5000113.5T266 L269 H270 L315 L322 V324 L325 L351 L354 F355T266-F320 HydrophobicContact CG2-CD2 4.33Å; T266-F320 HydrophobicContact CG2-CE2 3.84Å; L269-F320 HydrophobicContact CD1-CB 4.37Å; H270-F320 AromaticContact CE1-CD2 3.39Å; H270-F320 WeakPolarHBondContact CE1-CD2 3.22Å; H270-F320 AromaticContact CE1-CE2 3.78Å; H270-F320 AromaticContact CE1-CG 3.66Å; H270-F320 AromaticContact NE2-CG 3.98Å; L315-F320 VanDerWaalsContact O-CB 3.3Å; L315-F320 WeakPolarHBondContact O-CB 3.23Å; L315-F320 PolarHBondContact O-N 3.34Å; F320-L322 PolarHBondContact O-N 3.11Å; F320-V324 HydrophobicContact CD2-CB 3.65Å; F320-V324 HydrophobicContact CD2-CG1 4.19Å; F320-V324 HydrophobicContact CD2-CG2 3.84Å; F320-V324 HydrophobicContact CE2-CB 3.77Å; F320-V324 HydrophobicContact CE2-CG1 3.8Å; F320-V324 HydrophobicContact CE2-CG2 4.28Å; F320-V324 WeakPolarHBondContact O-CA 3.5Å; F320-V324 WeakPolarHBondContact O-CB 3.1Å; F320-V324 PolarHBondContact O-N 3.28Å; F320-L325 HydrophobicContact CE1-CD1 4.27Å; F320-L325 HydrophobicContact CE1-CG 4.26Å; F320-L325 HydrophobicContact CZ-CG 4.29Å; F320-L325 PolarHBondContact O-N 2.8Å; F320-L351 HydrophobicContact CE2-CD2 4.36Å; F320-L351 HydrophobicContact CZ-CD2 4.31Å; F320-L354 HydrophobicContact CZ-CD2 4.11Å; F320-F355 HydrophobicContact CD1-CD2 4.01Å; F320-F355 HydrophobicContact CE1-CB 3.95Å; F320-F355 HydrophobicContact CE1-CD2 4.14Å; F320-F355 HydrophobicContact CE1-CG 4.47Å
321P97.6Very high96.9Very high0 Ų018.4 Ų18.40%09%0.093CC..Iπ-helixtrans-64.5-42.117818.6-27.8000112.9Y76 L79 L317 Y318 L325 Y326 F355Y76-P321 HydrophobicContact CE1-CB 4.29Å; Y76-P321 HydrophobicContact CE1-CG 3.93Å; L79-P321 HydrophobicContact CD2-CB 3.69Å; L317-P321 WeakPolarHBondContact O-CD 3.3Å; L317-P321 WeakPolarHBondContact O-CG 3.38Å; Y318-P321 WeakPolarHBondContact O-CD 3.24Å; Y318-P321 WeakPolarHBondContact O-CG 3.4Å; P321-L325 HydrophobicContact CB-CD1 4Å; P321-L325 WeakPolarHBondContact O-CB 3.47Å; P321-L325 PolarHBondContact O-N 2.76Å; P321-Y326 PolarHBondContact O-N 3.18Å; P321-F355 HydrophobicContact CB-CE2 4.16Å; P321-F355 HydrophobicContact CB-CZ 4.32Å; P321-F355 HydrophobicContact CG-CE2 3.82Å; P321-F355 HydrophobicContact CG-CZ 4.19Å
322L96.8Very high96.7Very high3 Ų317.9 Ų17.92%0.0169%0.089CC..Iπ-helixtrans-77.7-25.3-174.5-58.2-179.9000113.7M73 P74 Y76 L79 Y318 L319 F320 Y326M73-L322 HydrophobicContact CE-CD1 3.91Å; M73-L322 HydrophobicContact CG-CB 3.62Å; M73-L322 HydrophobicContact CG-CD1 4.23Å; M73-L322 HydrophobicContact SD-CB 3.76Å; M73-L322 HydrophobicContact SD-CD1 4.08Å; P74-L322 WeakPolarHBondContact CD-O 3.25Å; P74-L322 HydrophobicContact CG-CB 4.41Å; P74-L322 HydrophobicContact CG-CD2 4.14Å; Y76-L322 HydrophobicContact CD1-CD2 4.18Å; Y76-L322 HydrophobicContact CD2-CD2 4.49Å; Y76-L322 HydrophobicContact CE1-CD2 4.33Å; Y76-L322 HydrophobicContact CG-CD2 4.27Å; L79-L322 HydrophobicContact CB-CD2 4.32Å; L79-L322 HydrophobicContact CD2-CD2 4.18Å; Y318-L322 HydrophobicContact CD2-CD1 3.62Å; Y318-L322 HydrophobicContact CE2-CD1 3.34Å; Y318-L322 HydrophobicContact CG-CD1 4.32Å; Y318-L322 WeakPolarHBondContact O-CB 3.2Å; Y318-L322 VanDerWaalsContact O-CG 3.27Å; Y318-L322 WeakPolarHBondContact O-CG 3.37Å; Y318-L322 PolarHBondContact O-N 3.11Å; L319-L322 PolarHBondContact O-N 2.98Å; F320-L322 PolarHBondContact O-N 3.11Å; L322-Y326 VanDerWaalsContact O-CB 3.23Å; L322-Y326 WeakPolarHBondContact O-CB 3.49Å
323K95.8Very high96.5Very high21 Ų2118.2 Ų18.29%0.0919%0.091CC..Iπ-helixtrans-95.8-54174.8-65.6-175.6170.9-72.80112M73 Y184 P187 L265 L319 A327M73-K323 HydrophobicContact SD-CG 4.32Å; Y184-K323 HydrophobicContact CD2-CD 4.46Å; Y184-K323 HydrophobicContact CE2-CD 4.12Å; Y184-K323 PolarHBondContact O-NZ 3.49Å; P187-K323 HydrophobicContact CB-CB 4.26Å; P187-K323 WeakPolarHBondContact CB-O 3.48Å; P187-K323 HydrophobicContact CG-CB 4.16Å; P187-K323 HydrophobicContact CG-CG 4.32Å; L265-K323 HydrophobicContact CD2-CB 4.34Å; L319-K323 HydrophobicContact CB-CD 4.49Å; L319-K323 HydrophobicContact CD2-CD 4.39Å; L319-K323 WeakPolarHBondContact O-CB 3.5Å; L319-K323 WeakPolarHBondContact O-CG 3.43Å; L319-K323 PolarHBondContact O-N 3.23Å; K323-A327 WeakPolarHBondContact O-CB 3.41Å; K323-A327 PolarHBondContact O-N 2.8Å
324V96.9Very high96.2Very high1 Ų115.4 Ų15.41%0.0067%0.073CC..Iπ-helixtrans-86.3-55.2-171.5-177.30000112L265 T266 L269 F320 Y326 A327 S328 L351L265-V324 HydrophobicContact CB-CG2 4.49Å; L265-V324 HydrophobicContact CD2-CG2 4.07Å; L265-V324 HydrophobicContact CG-CG2 3.94Å; T266-V324 WeakPolarHBondContact OG1-CG1 2.91Å; L269-V324 HydrophobicContact CD1-CG2 4.01Å; F320-V324 HydrophobicContact CD2-CB 3.65Å; F320-V324 HydrophobicContact CD2-CG1 4.19Å; F320-V324 HydrophobicContact CD2-CG2 3.84Å; F320-V324 HydrophobicContact CE2-CB 3.77Å; F320-V324 HydrophobicContact CE2-CG1 3.8Å; F320-V324 HydrophobicContact CE2-CG2 4.28Å; F320-V324 WeakPolarHBondContact O-CA 3.5Å; F320-V324 WeakPolarHBondContact O-CB 3.1Å; F320-V324 PolarHBondContact O-N 3.28Å; V324-Y326 VanDerWaalsContact C-N 3.29Å; V324-Y326 PolarHBondContact O-N 3.29Å; V324-A327 PolarHBondContact O-N 3.43Å; V324-S328 WeakPolarHBondContact O-CB 3.44Å; V324-S328 PolarHBondContact O-N 2.71Å; V324-S328 PolarHBondContact O-OG 3.09Å; V324-L351 HydrophobicContact CG1-CD1 4.28Å; V324-L351 HydrophobicContact CG1-CD2 4.41Å
325L97.3Very high95.9Very high0 Ų012.1 Ų12.10%05%0.053CC..Iπ-helixtrans-63.9-37.6-179-71.8175.6000111.8L79 F320 P321 S328 S329 L351 W352 F355L79-L325 HydrophobicContact CD1-CB 4.25Å; F320-L325 HydrophobicContact CE1-CD1 4.27Å; F320-L325 HydrophobicContact CE1-CG 4.26Å; F320-L325 HydrophobicContact CZ-CG 4.29Å; F320-L325 PolarHBondContact O-N 2.8Å; P321-L325 HydrophobicContact CB-CD1 4Å; P321-L325 WeakPolarHBondContact O-CB 3.47Å; P321-L325 PolarHBondContact O-N 2.76Å; L325-S328 WeakPolarHBondContact CA-OG 3.2Å; L325-S328 PolarHBondContact O-OG 2.96Å; L325-S328 VanDerWaalsContact O-OG 3.11Å; L325-S329 VanDerWaalsContact O-CB 3.25Å; L325-S329 WeakPolarHBondContact O-CB 3.43Å; L325-S329 PolarHBondContact O-N 2.86Å; L325-S329 PolarHBondContact O-OG 2.81Å; L325-L351 HydrophobicContact CD2-CB 3.51Å; L325-W352 HydrophobicContact CD1-CD2 4.16Å; L325-W352 HydrophobicContact CD1-CE3 4.08Å; L325-W352 HydrophobicContact CD1-CH2 4.26Å; L325-W352 HydrophobicContact CD1-CZ2 4.33Å; L325-W352 HydrophobicContact CD1-CZ3 4.12Å; L325-W352 HydrophobicContact CD2-CD2 4.21Å; L325-W352 HydrophobicContact CD2-CG 4.17Å; L325-F355 HydrophobicContact CD1-CB 3.89Å; L325-F355 HydrophobicContact CD1-CD1 4.15Å; L325-F355 HydrophobicContact CD1-CD2 4.36Å; L325-F355 HydrophobicContact CD1-CG 3.88Å
326Y96.6Very high95.6Very high3 Ų311 Ų111%0.0125%0.047CC..Hα-helixtrans-63.1-45.5173.8-167.8-124.3000111.9P74 E78 L79 K82 L188 P321 L322 V324 S329 W330 G331P74-Y326 HydrophobicContact CB-CD1 4.18Å; P74-Y326 HydrophobicContact CB-CD2 4.27Å; P74-Y326 HydrophobicContact CB-CE1 3.82Å; P74-Y326 HydrophobicContact CB-CE2 3.93Å; P74-Y326 HydrophobicContact CB-CG 4.39Å; P74-Y326 HydrophobicContact CG-CD1 3.46Å; P74-Y326 VanDerWaalsContact CG-CD1 3.46Å; P74-Y326 HydrophobicContact CG-CD2 3.79Å; P74-Y326 HydrophobicContact CG-CE1 3.63Å; P74-Y326 HydrophobicContact CG-CE2 3.96Å; P74-Y326 HydrophobicContact CG-CG 3.54Å; E78-Y326 HydrophobicContact CG-CE2 4.27Å; E78-Y326 PolarHBondContact OE1-OH 3.37Å; E78-Y326 VanDerWaalsContact OE1-OH 3.1Å; L79-Y326 HydrophobicContact CB-CD2 4.26Å; L79-Y326 HydrophobicContact CD1-CD2 3.88Å; L79-Y326 HydrophobicContact CD1-CG 4.36Å; K82-Y326 HydrophobicContact CB-CE2 3.82Å; K82-Y326 HydrophobicContact CG-CE2 3.94Å; L188-Y326 HydrophobicContact CD1-CD1 4.44Å; L188-Y326 HydrophobicContact CD1-CE1 3.95Å; L188-Y326 HydrophobicContact CD2-CD1 3.67Å; L188-Y326 HydrophobicContact CD2-CE1 3.74Å; L188-Y326 HydrophobicContact CG-CD1 4.22Å; L188-Y326 HydrophobicContact CG-CE1 4.21Å; P321-Y326 PolarHBondContact O-N 3.18Å; L322-Y326 VanDerWaalsContact O-CB 3.23Å; L322-Y326 WeakPolarHBondContact O-CB 3.49Å; V324-Y326 VanDerWaalsContact C-N 3.29Å; V324-Y326 PolarHBondContact O-N 3.29Å; Y326-S329 PolarHBondContact O-N 2.93Å; Y326-W330 HydrophobicContact CD2-CB 3.98Å; Y326-W330 AromaticContact CE1-CD1 3.96Å; Y326-W330 HydrophobicContact CE2-CB 3.73Å; Y326-W330 HydrophobicContact CE2-CG 4.02Å; Y326-W330 HydrophobicContact CG-CB 4.48Å; Y326-W330 AromaticContact CZ-CD1 3.49Å; Y326-W330 VanDerWaalsContact CZ-CD1 3.49Å; Y326-W330 AromaticContact CZ-CG 3.95Å; Y326-W330 WeakPolarHBondContact O-CA 3.02Å; Y326-W330 WeakPolarHBondContact O-CB 3.44Å; Y326-W330 PolarHBondContact O-N 3.39Å; Y326-W330 VanDerWaalsContact OH-CD1 3.26Å; Y326-G331 PolarHBondContact O-N 2.94Å
327A95.5Very high95.1Very high2 Ų210.7 Ų10.72%0.0175%0.047CC..Iπ-helixtrans-65-44.6176.600000112.7P187 F191 K323 V324 S329 G331 A332P187-A327 HydrophobicContact CB-CB 4.08Å; P187-A327 WeakPolarHBondContact O-CB 3.48Å; F191-A327 WeakPolarHBondContact CD2-O 3.43Å; F191-A327 HydrophobicContact CE2-CB 4.44Å; F191-A327 WeakPolarHBondContact CE2-O 3.28Å; K323-A327 WeakPolarHBondContact O-CB 3.41Å; K323-A327 PolarHBondContact O-N 2.8Å; V324-A327 PolarHBondContact O-N 3.43Å; A327-S329 PolarHBondContact O-N 3.23Å; A327-G331 CarbonylContact O-C 3.49Å; A327-G331 WeakPolarHBondContact O-CA 3.26Å; A327-G331 PolarHBondContact O-N 3.43Å; A327-A332 PolarHBondContact O-N 2.99Å
328S94.9Very high94.4Very high0 Ų09.8 Ų9.80%04%0.044CC..Iπ-helixtrans-66.7-27179.870.10000112.8V324 L325 A332 F344 N348 L351V324-S328 WeakPolarHBondContact O-CB 3.44Å; V324-S328 PolarHBondContact O-N 2.71Å; V324-S328 PolarHBondContact O-OG 3.09Å; L325-S328 WeakPolarHBondContact CA-OG 3.2Å; L325-S328 PolarHBondContact O-OG 2.96Å; L325-S328 VanDerWaalsContact O-OG 3.11Å; S328-A332 WeakPolarHBondContact O-CB 3.44Å; S328-F344 VanDerWaalsContact O-CE2 3.26Å; S328-F344 WeakPolarHBondContact O-CE2 3.41Å; S328-N348 VanDerWaalsContact CB-OD1 3.28Å; S328-N348 WeakPolarHBondContact CB-OD1 3.16Å; S328-N348 PolarHBondContact O-ND2 3.15Å; S328-N348 PolarHBondContact O-OD1 2.71Å; S328-N348 PolarHBondContact OG-OD1 2.71Å; S328-L351 WeakPolarHBondContact OG-CD1 3.42Å
329S95.2Very high93.7Very high0 Ų07.8 Ų7.80%04%0.035CC..Iπ-helixtrans-91.2-74.1176.5-50.20000111.2A86 L325 Y326 A327 Y333 N348A86-S329 WeakPolarHBondContact CB-O 3.48Å; L325-S329 VanDerWaalsContact O-CB 3.25Å; L325-S329 WeakPolarHBondContact O-CB 3.43Å; L325-S329 PolarHBondContact O-N 2.86Å; L325-S329 PolarHBondContact O-OG 2.81Å; Y326-S329 PolarHBondContact O-N 2.93Å; A327-S329 PolarHBondContact O-N 3.23Å; S329-Y333 PolarHBondContact O-N 2.93Å; S329-Y333 VanDerWaalsContact O-N 3.11Å; S329-N348 PolarHBondContact N-OD1 3.37Å; S329-N348 PolarHBondContact OG-OD1 2.98Å
330W95Very high92.9Very high18 Ų187.6 Ų7.67%0.0683%0.034CC..Iπ-helixtrans-73.9-39.9-174.9-172.9-119.1000113.1K82 I85 L188 Y326 A332 Y333 I334K82-W330 HydrophobicContact CB-CB 3.94Å; K82-W330 HydrophobicContact CB-CD2 3.76Å; K82-W330 HydrophobicContact CB-CE3 3.71Å; K82-W330 HydrophobicContact CB-CG 3.87Å; K82-W330 HydrophobicContact CB-CZ3 4.49Å; K82-W330 HydrophobicContact CD-CD2 3.81Å; K82-W330 HydrophobicContact CD-CE3 3.78Å; K82-W330 HydrophobicContact CD-CH2 3.87Å; K82-W330 HydrophobicContact CD-CZ2 3.88Å; K82-W330 HydrophobicContact CD-CZ3 3.81Å; K82-W330 HydrophobicContact CG-CD2 3.94Å; K82-W330 HydrophobicContact CG-CE3 4.14Å; K82-W330 HydrophobicContact CG-CG 4.18Å; I85-W330 HydrophobicContact CG2-CZ3 4.25Å; L188-W330 HydrophobicContact CD2-CB 4.43Å; Y326-W330 HydrophobicContact CD2-CB 3.98Å; Y326-W330 AromaticContact CE1-CD1 3.96Å; Y326-W330 HydrophobicContact CE2-CB 3.73Å; Y326-W330 HydrophobicContact CE2-CG 4.02Å; Y326-W330 HydrophobicContact CG-CB 4.48Å; Y326-W330 AromaticContact CZ-CD1 3.49Å; Y326-W330 VanDerWaalsContact CZ-CD1 3.49Å; Y326-W330 AromaticContact CZ-CG 3.95Å; Y326-W330 WeakPolarHBondContact O-CA 3.02Å; Y326-W330 WeakPolarHBondContact O-CB 3.44Å; Y326-W330 PolarHBondContact O-N 3.39Å; Y326-W330 VanDerWaalsContact OH-CD1 3.26Å; W330-A332 VanDerWaalsContact C-N 3.34Å; W330-A332 PolarHBondContact O-N 3.42Å; W330-Y333 HydrophobicContact CD2-CD1 4.48Å; W330-Y333 AromaticContact CE3-CD1 3.7Å; W330-Y333 HydrophobicContact CE3-CD1 3.7Å; W330-Y333 HydrophobicContact CE3-CE1 4.45Å; W330-Y333 HydrophobicContact CE3-CG 4.09Å; W330-Y333 AromaticContact CH2-CD1 3.67Å; W330-Y333 HydrophobicContact CH2-CD1 3.67Å; W330-Y333 AromaticContact CH2-CE1 3.7Å; W330-Y333 HydrophobicContact CH2-CE1 3.7Å; W330-Y333 HydrophobicContact CZ2-CD1 4.45Å; W330-Y333 AromaticContact CZ3-CD1 3.24Å; W330-Y333 HydrophobicContact CZ3-CD1 3.24Å; W330-Y333 AromaticContact CZ3-CE1 3.56Å; W330-Y333 HydrophobicContact CZ3-CE1 3.56Å; W330-Y333 AromaticContact CZ3-CG 3.94Å; W330-Y333 HydrophobicContact CZ3-CG 3.94Å; W330-Y333 WeakPolarHBondContact O-CA 3.14Å; W330-Y333 WeakPolarHBondContact O-CB 3.26Å; W330-Y333 PolarHBondContact O-N 3.1Å; W330-Y333 VanDerWaalsContact O-N 3.1Å; W330-I334 HydrophobicContact CD2-CG2 4.07Å; W330-I334 HydrophobicContact CG-CG2 4.47Å; W330-I334 HydrophobicContact CH2-CG2 4.41Å; W330-I334 HydrophobicContact CZ2-CG2 3.77Å; W330-I334 PolarHBondContact O-N 2.85Å
331G94.2Very high92.1Very high0 Ų08.4 Ų8.40%04%0.038CC..Iπ-helixtrans-60.1-43.1175.100000112.3Y326 A327 Y333 I334 C335Y326-G331 PolarHBondContact O-N 2.94Å; A327-G331 CarbonylContact O-C 3.49Å; A327-G331 WeakPolarHBondContact O-CA 3.26Å; A327-G331 PolarHBondContact O-N 3.43Å; G331-Y333 VanDerWaalsContact C-N 3.34Å; G331-Y333 PolarHBondContact O-N 3.36Å; G331-I334 VanDerWaalsContact O-CG1 3.29Å; G331-I334 WeakPolarHBondContact O-CG1 3.25Å; G331-C335 VanDerWaalsContact O-CB 3.29Å; G331-C335 WeakPolarHBondContact O-CB 3.21Å; G331-C335 PolarHBondContact O-N 3.42Å; G331-C335 VanDerWaalsContact O-N 3.1Å; G331-C335 PolarHBondContact O-SG 3.19Å
332A93.5Very high91.2Very high1 Ų19.5 Ų9.51%0.0084%0.042CC..Hα-helixtrans-62.9-39.7172.400000111.9F191 A327 S328 W330 L336 F344F191-A332 HydrophobicContact CD1-CB 4.24Å; F191-A332 HydrophobicContact CD2-CB 4.38Å; F191-A332 HydrophobicContact CE1-CB 4.4Å; F191-A332 HydrophobicContact CG-CB 4.22Å; A327-A332 PolarHBondContact O-N 2.99Å; S328-A332 WeakPolarHBondContact O-CB 3.44Å; W330-A332 VanDerWaalsContact C-N 3.34Å; W330-A332 PolarHBondContact O-N 3.42Å; A332-L336 WeakPolarHBondContact O-CA 3.44Å; A332-L336 WeakPolarHBondContact O-CB 3.27Å; A332-L336 PolarHBondContact O-N 3.35Å; A332-F344 HydrophobicContact CB-CD2 3.84Å; A332-F344 HydrophobicContact CB-CE2 3.96Å
333Y93.4Very high90.5Very high17 Ų179.8 Ų9.87%0.0675%0.046CC..Hα-helixtrans-60.4-56174.7179.3-90.6000112.5L65 I85 A86 E89 M90 S329 W330 G331 C335 L336 V337L65-Y333 HydrophobicContact CD1-CE1 4.44Å; I85-Y333 HydrophobicContact CG2-CE2 4.43Å; A86-Y333 HydrophobicContact CB-CD2 4.48Å; E89-Y333 HydrophobicContact CB-CE2 4Å; E89-Y333 HydrophobicContact CG-CE2 4.41Å; E89-Y333 WeakPolarHBondContact OE2-CE2 3.21Å; E89-Y333 PolarHBondContact OE2-OH 2.84Å; M90-Y333 HydrophobicContact CG-CD2 3.94Å; M90-Y333 WeakPolarHBondContact SD-CA 3.41Å; M90-Y333 HydrophobicContact SD-CD2 3.89Å; M90-Y333 HydrophobicContact SD-CG 4.32Å; S329-Y333 PolarHBondContact O-N 2.93Å; S329-Y333 VanDerWaalsContact O-N 3.11Å; W330-Y333 HydrophobicContact CD2-CD1 4.48Å; W330-Y333 AromaticContact CE3-CD1 3.7Å; W330-Y333 HydrophobicContact CE3-CD1 3.7Å; W330-Y333 HydrophobicContact CE3-CE1 4.45Å; W330-Y333 HydrophobicContact CE3-CG 4.09Å; W330-Y333 AromaticContact CH2-CD1 3.67Å; W330-Y333 HydrophobicContact CH2-CD1 3.67Å; W330-Y333 AromaticContact CH2-CE1 3.7Å; W330-Y333 HydrophobicContact CH2-CE1 3.7Å; W330-Y333 HydrophobicContact CZ2-CD1 4.45Å; W330-Y333 AromaticContact CZ3-CD1 3.24Å; W330-Y333 HydrophobicContact CZ3-CD1 3.24Å; W330-Y333 AromaticContact CZ3-CE1 3.56Å; W330-Y333 HydrophobicContact CZ3-CE1 3.56Å; W330-Y333 AromaticContact CZ3-CG 3.94Å; W330-Y333 HydrophobicContact CZ3-CG 3.94Å; W330-Y333 WeakPolarHBondContact O-CA 3.14Å; W330-Y333 WeakPolarHBondContact O-CB 3.26Å; W330-Y333 PolarHBondContact O-N 3.1Å; W330-Y333 VanDerWaalsContact O-N 3.1Å; G331-Y333 VanDerWaalsContact C-N 3.34Å; G331-Y333 PolarHBondContact O-N 3.36Å; Y333-C335 PolarHBondContact O-N 2.82Å; Y333-L336 PolarHBondContact O-N 2.99Å; Y333-V337 HydrophobicContact CD2-CB 4.34Å; Y333-V337 HydrophobicContact CD2-CG2 4.37Å; Y333-V337 HydrophobicContact CE2-CB 4.23Å; Y333-V337 HydrophobicContact CE2-CG2 3.84Å; Y333-V337 WeakPolarHBondContact O-CB 3.11Å; Y333-V337 VanDerWaalsContact O-CG1 3.31Å; Y333-V337 WeakPolarHBondContact O-CG1 3Å; Y333-V337 PolarHBondContact O-N 2.89Å
334I93.3Very high90.2Very high3 Ų39 Ų92%0.0154%0.043CC..Hα-helixtrans-63.9-30-177.165.8-178.3000112.8L65 H68 C69 L188 W330 G331L65-I334 HydrophobicContact CB-CB 4.21Å; L65-I334 HydrophobicContact CD2-CG2 4.44Å; H68-I334 HydrophobicContact CB-CD1 4.39Å; C69-I334 HydrophobicContact CB-CD1 4.35Å; C69-I334 WeakPolarHBondContact SG-CD1 3.21Å; L188-I334 HydrophobicContact CB-CD1 4.2Å; L188-I334 HydrophobicContact CD2-CD1 4.38Å; W330-I334 HydrophobicContact CD2-CG2 4.07Å; W330-I334 HydrophobicContact CG-CG2 4.47Å; W330-I334 HydrophobicContact CH2-CG2 4.41Å; W330-I334 HydrophobicContact CZ2-CG2 3.77Å; W330-I334 PolarHBondContact O-N 2.85Å; G331-I334 VanDerWaalsContact O-CG1 3.29Å; G331-I334 WeakPolarHBondContact O-CG1 3.25Å
335C91.8Very high89.9Confident1 Ų110.6 Ų10.61%0.0075%0.051CC..Hα-helixtrans-87-33.2-178.6-64.20000113.6F191 R192 G331 Y333 R339F191-C335 HydrophobicContact CB-CB 3.8Å; R192-C335 VanDerWaalsContact CA-SG 3.59Å; G331-C335 VanDerWaalsContact O-CB 3.29Å; G331-C335 WeakPolarHBondContact O-CB 3.21Å; G331-C335 PolarHBondContact O-N 3.42Å; G331-C335 VanDerWaalsContact O-N 3.1Å; G331-C335 PolarHBondContact O-SG 3.19Å; Y333-C335 PolarHBondContact O-N 2.82Å; C335-R339 PolarHBondContact O-NH1 3.29Å
336L90.5Very high89.5Confident2 Ų214.8 Ų14.81%0.017%0.07CC..Hα-helixtrans-122.92.4-166.7-50.8174.8000113.7M90 F191 N194 I195 A332 Y333 G338 R339 N341M90-L336 HydrophobicContact CE-CB 4.04Å; F191-L336 HydrophobicContact CD1-CD1 4.29Å; N194-L336 WeakPolarHBondContact O-CD2 3.41Å; I195-L336 HydrophobicContact CG1-CD2 4.47Å; A332-L336 WeakPolarHBondContact O-CA 3.44Å; A332-L336 WeakPolarHBondContact O-CB 3.27Å; A332-L336 PolarHBondContact O-N 3.35Å; Y333-L336 PolarHBondContact O-N 2.99Å; L336-G338 PolarHBondContact O-N 3.26Å; L336-R339 WeakPolarHBondContact O-CA 3.21Å; L336-R339 WeakPolarHBondContact O-CB 3.44Å; L336-R339 PolarHBondContact O-N 3.2Å; L336-N341 HydrophobicContact CB-CB 4.23Å; L336-N341 HydrophobicContact CD1-CB 4.39Å
337V87.9Confident89.3Confident4 Ų414.9 Ų14.92%0.0247%0.07CC..THydrogen-bonded Turntrans-57.8130.7173.967.20000110.6Y57 L62 L65 Y333 R339Y57-V337 HydrophobicContact CD1-CG2 4.12Å; Y57-V337 HydrophobicContact CE1-CG2 3.45Å; Y57-V337 VanDerWaalsContact CE1-CG2 3.45Å; L62-V337 HydrophobicContact CD2-CG1 3.72Å; L65-V337 HydrophobicContact CD1-CG1 3.63Å; Y333-V337 HydrophobicContact CD2-CB 4.34Å; Y333-V337 HydrophobicContact CD2-CG2 4.37Å; Y333-V337 HydrophobicContact CE2-CB 4.23Å; Y333-V337 HydrophobicContact CE2-CG2 3.84Å; Y333-V337 WeakPolarHBondContact O-CB 3.11Å; Y333-V337 VanDerWaalsContact O-CG1 3.31Å; Y333-V337 WeakPolarHBondContact O-CG1 3Å; Y333-V337 PolarHBondContact O-N 2.89Å; V337-R339 PolarHBondContact O-N 3.25Å
338G82.6Confident89.2Confident6 Ų614.9 Ų14.96%0.0627%0.07CC..THydrogen-bonded Turntrans82.8-10-175.300000114.8L336L336-G338 PolarHBondContact O-N 3.26Å
339R84.4Confident89.2Confident63 Ų6319.6 Ų19.624%0.2389%0.094CC..SBendtrans-111.7173179.2-58.1179.5176.5133.5-0.8110.9P52 F97 C335 L336 V337 N341P52-R339 HydrophobicContact CG-CG 3.82Å; F97-R339 WeakPolarHBondContact CE1-O 3.43Å; F97-R339 WeakPolarHBondContact CZ-O 3.29Å; C335-R339 PolarHBondContact O-NH1 3.29Å; L336-R339 WeakPolarHBondContact O-CA 3.21Å; L336-R339 WeakPolarHBondContact O-CB 3.44Å; L336-R339 PolarHBondContact O-N 3.2Å; V337-R339 PolarHBondContact O-N 3.25Å; R339-N341 PolarHBondContact O-N 3.46Å
340E79.9Confident89.3Confident15 Ų1520.9 Ų20.97%0.0710%0.101CC..  trans-62.9122.4179.3177.260.6-167.300111.4L49 F196 R342L49-E340 HydrophobicContact CD1-CB 4.07Å; L49-E340 VanDerWaalsContact CD1-OE2 3.26Å; L49-E340 WeakPolarHBondContact CD1-OE2 3.04Å; L49-E340 HydrophobicContact CG-CB 4.13Å; L49-E340 VanDerWaalsContact CG-OE2 3.25Å; L49-E340 WeakPolarHBondContact CG-OE2 3.29Å; F196-E340 HydrophobicContact CB-CB 3.89Å; F196-E340 HydrophobicContact CB-CG 3.76Å; F196-E340 HydrophobicContact CD1-CG 4.19Å; F196-E340 HydrophobicContact CG-CG 3.99Å; E340-R342 WeakPolarHBondContact OE1-CB 3.39Å; E340-R342 WeakPolarHBondContact OE1-CD 3.39Å; E340-R342 WeakPolarHBondContact OE1-CG 3.49Å; E340-R342 IonicContact OE1-CZ 3.84Å; E340-R342 IonicContact OE1-NE 2.78Å; E340-R342 PolarHBondContact OE1-NE 3.02Å; E340-R342 IonicContact OE1-NH1 2.99Å; E340-R342 PolarHBondContact OE1-NH1 3.18Å; E340-R342 IonicContact OE2-CZ 3.69Å; E340-R342 IonicContact OE2-NE 3.92Å; E340-R342 IonicContact OE2-NH1 3.86Å; E340-R342 PolarHBondContact OE2-NH1 3.41Å; E340-R342 IonicContact OE2-NH2 3.63Å
341N81.4Confident89.4Confident17 Ų1720.1 Ų20.19%0.09110%0.098CC..  trans-148.335.8179.4-161.215.1000113M90 L336 R339 G343 F344M90-N341 HydrophobicContact CE-CB 3.85Å; M90-N341 WeakPolarHBondContact CE-ND2 3.42Å; L336-N341 HydrophobicContact CB-CB 4.23Å; L336-N341 HydrophobicContact CD1-CB 4.39Å; R339-N341 PolarHBondContact O-N 3.46Å; N341-G343 PolarHBondContact O-N 3.14Å; N341-G343 VanDerWaalsContact O-N 3.09Å; N341-F344 HydrophobicContact CB-CB 4.47Å; N341-F344 WeakPolarHBondContact ND2-CB 3.49Å; N341-F344 WeakPolarHBondContact ND2-CD2 3.44Å; N341-F344 WeakPolarHBondContact O-CB 3.28Å; N341-F344 PolarHBondContact O-N 3.19Å
342R77.7Confident89.5Confident22 Ų2222.3 Ų22.38%0.08311%0.107CC..THydrogen-bonded Turntrans-57.9-24.8-176.9-73.1177.9-166.4119.1-1.2113.9F47 F97 P98 N99 F103 E340 F344F47-R342 PolarHBondContact O-NH1 2.9Å; F97-R342 HydrophobicContact CB-CG 4.47Å; P98-R342 WeakPolarHBondContact O-CD 3.5Å; N99-R342 PolarHBondContact OD1-O 3.37Å; F103-R342 HydrophobicContact CD1-CB 3.57Å; F103-R342 HydrophobicContact CD1-CG 4.35Å; F103-R342 HydrophobicContact CE1-CB 3.42Å; F103-R342 VanDerWaalsContact CE1-CB 3.42Å; F103-R342 HydrophobicContact CE1-CG 4.46Å; F103-R342 HydrophobicContact CG-CB 4.31Å; F103-R342 HydrophobicContact CZ-CB 4.08Å; E340-R342 WeakPolarHBondContact OE1-CB 3.39Å; E340-R342 WeakPolarHBondContact OE1-CD 3.39Å; E340-R342 WeakPolarHBondContact OE1-CG 3.49Å; E340-R342 IonicContact OE1-CZ 3.84Å; E340-R342 IonicContact OE1-NE 2.78Å; E340-R342 PolarHBondContact OE1-NE 3.02Å; E340-R342 IonicContact OE1-NH1 2.99Å; E340-R342 PolarHBondContact OE1-NH1 3.18Å; E340-R342 IonicContact OE2-CZ 3.69Å; E340-R342 IonicContact OE2-NE 3.92Å; E340-R342 IonicContact OE2-NH1 3.86Å; E340-R342 PolarHBondContact OE2-NH1 3.41Å; E340-R342 IonicContact OE2-NH2 3.63Å; R342-F344 VanDerWaalsContact C-N 3.29Å; R342-F344 PolarHBondContact O-N 2.78Å
343G82.4Confident89.7Confident10 Ų1023.5 Ų23.510%0.10312%0.119CC..THydrogen-bonded Turntrans-73.7-13.3175.500000115.3N341 L345 F347N341-G343 PolarHBondContact O-N 3.14Å; N341-G343 VanDerWaalsContact O-N 3.09Å; G343-L345 PolarHBondContact O-N 2.71Å; G343-F347 WeakPolarHBondContact O-CB 3.45Å; G343-F347 PolarHBondContact O-N 3.23Å
344F89.4Confident89.9Confident4 Ų423.1 Ų23.12%0.01812%0.118CC..Hα-helixtrans-55.8-54.2-172.6175.4-98000114A86 F87 M90 S328 A332 N341 R342 N348A86-F344 HydrophobicContact CB-CE2 4.27Å; A86-F344 HydrophobicContact CB-CZ 3.69Å; F87-F344 HydrophobicContact CD1-CE1 4.03Å; F87-F344 HydrophobicContact CE1-CE1 4.35Å; F87-F344 HydrophobicContact CG-CE1 4.45Å; M90-F344 HydrophobicContact CB-CD1 3.93Å; M90-F344 HydrophobicContact CB-CE1 4.13Å; M90-F344 HydrophobicContact CB-CG 4.28Å; M90-F344 HydrophobicContact SD-CD2 4.3Å; M90-F344 HydrophobicContact SD-CE2 4.26Å; S328-F344 VanDerWaalsContact O-CE2 3.26Å; S328-F344 WeakPolarHBondContact O-CE2 3.41Å; A332-F344 HydrophobicContact CB-CD2 3.84Å; A332-F344 HydrophobicContact CB-CE2 3.96Å; N341-F344 HydrophobicContact CB-CB 4.47Å; N341-F344 WeakPolarHBondContact ND2-CB 3.49Å; N341-F344 WeakPolarHBondContact ND2-CD2 3.44Å; N341-F344 WeakPolarHBondContact O-CB 3.28Å; N341-F344 PolarHBondContact O-N 3.19Å; R342-F344 VanDerWaalsContact C-N 3.29Å; R342-F344 PolarHBondContact O-N 2.78Å; F344-N348 VanDerWaalsContact CD2-ND2 3.25Å; F344-N348 WeakPolarHBondContact CD2-ND2 3.31Å; F344-N348 VanDerWaalsContact CE2-ND2 3.25Å; F344-N348 WeakPolarHBondContact CE2-ND2 3.03Å; F344-N348 VanDerWaalsContact O-CB 3.31Å; F344-N348 WeakPolarHBondContact O-CB 3.49Å; F344-N348 PolarHBondContact O-N 2.9Å; F344-N348 PolarHBondContact O-ND2 2.94Å
345L90.2Very high90.1Very high34 Ų3423.9 Ų23.918%0.17812%0.121CC..Hα-helixtrans-64.5-50.7-172.5-177.969.5000109.7F87 G343 F347 N348 L349F87-L345 HydrophobicContact CD1-CD1 3.85Å; F87-L345 HydrophobicContact CE1-CD1 3.96Å; G343-L345 PolarHBondContact O-N 2.71Å; L345-F347 PolarHBondContact O-N 3.03Å; L345-N348 PolarHBondContact O-N 3.19Å; L345-L349 HydrophobicContact CD1-CD1 4.23Å; L345-L349 HydrophobicContact CD1-CG 4.31Å; L345-L349 HydrophobicContact CG-CD1 3.95Å; L345-L349 HydrophobicContact CG-CG 4.38Å; L345-L349 WeakPolarHBondContact O-CB 3.22Å; L345-L349 WeakPolarHBondContact O-CG 3.2Å; L345-L349 PolarHBondContact O-N 2.78Å
346F89.9Confident90.4Very high89 Ų8928.3 Ų28.339%0.3915%0.148SC..Hα-helixtrans-57.2-51.7179.4171.2-98.4000111.8L249 T253 N348 L349 L350L249-F346 HydrophobicContact CD1-CZ 3.94Å; L249-F346 HydrophobicContact CD2-CE2 4.1Å; L249-F346 HydrophobicContact CD2-CZ 3.68Å; L249-F346 HydrophobicContact CG-CE1 4.49Å; L249-F346 HydrophobicContact CG-CZ 3.76Å; T253-F346 HydrophobicContact CG2-CE1 3.55Å; T253-F346 HydrophobicContact CG2-CZ 4.06Å; F346-N348 PolarHBondContact O-N 3.19Å; F346-L349 PolarHBondContact O-N 2.8Å; F346-L350 HydrophobicContact CD1-CD1 4.26Å; F346-L350 HydrophobicContact CE1-CD1 3.64Å; F346-L350 HydrophobicContact CE2-CD1 4.15Å; F346-L350 HydrophobicContact CZ-CD1 3.6Å; F346-L350 HydrophobicContact CZ-CG 4.46Å; F346-L350 WeakPolarHBondContact O-CG 3.37Å; F346-L350 PolarHBondContact O-N 3.36Å
347F91.6Very high90.8Very high4 Ų429 Ų292%0.01815%0.152CC..Hα-helixtrans-65.3-42.9-177.7-172.4-105.9000112.4L250 I259 G343 L345 L350 L351L250-F347 HydrophobicContact CD2-CD2 3.83Å; L250-F347 HydrophobicContact CD2-CE2 3.52Å; L250-F347 HydrophobicContact CD2-CZ 4.17Å; I259-F347 HydrophobicContact CD1-CD1 4.14Å; I259-F347 HydrophobicContact CD1-CE1 4.46Å; I259-F347 HydrophobicContact CD1-CG 4.2Å; I259-F347 HydrophobicContact CG2-CD1 4.33Å; I259-F347 HydrophobicContact CG2-CE1 3.65Å; I259-F347 HydrophobicContact CG2-CZ 3.86Å; G343-F347 WeakPolarHBondContact O-CB 3.45Å; G343-F347 PolarHBondContact O-N 3.23Å; L345-F347 PolarHBondContact O-N 3.03Å; F347-L350 PolarHBondContact O-N 2.98Å; F347-L351 HydrophobicContact CD1-CD1 3.79Å; F347-L351 HydrophobicContact CD1-CG 4.4Å; F347-L351 HydrophobicContact CE1-CD1 3.38Å; F347-L351 HydrophobicContact CE1-CG 4.06Å; F347-L351 HydrophobicContact CZ-CD1 4.02Å; F347-L351 HydrophobicContact CZ-CD2 4.47Å; F347-L351 HydrophobicContact CZ-CG 4.3Å; F347-L351 PolarHBondContact O-N 3.41Å; F347-L351 VanDerWaalsContact O-N 3.08Å
348N94.3Very high91.2Very high2 Ų228.9 Ų28.91%0.01115%0.15CC..Hα-helixtrans-66.4-39.9177.3-81.8-81.8000111.8F87 S328 S329 F344 L345 F346 L350 L351 W352F87-N348 HydrophobicContact CE1-CB 3.97Å; F87-N348 HydrophobicContact CZ-CB 3.71Å; S328-N348 VanDerWaalsContact CB-OD1 3.28Å; S328-N348 WeakPolarHBondContact CB-OD1 3.16Å; S328-N348 PolarHBondContact O-ND2 3.15Å; S328-N348 PolarHBondContact O-OD1 2.71Å; S328-N348 PolarHBondContact OG-OD1 2.71Å; S329-N348 PolarHBondContact N-OD1 3.37Å; S329-N348 PolarHBondContact OG-OD1 2.98Å; F344-N348 VanDerWaalsContact CD2-ND2 3.25Å; F344-N348 WeakPolarHBondContact CD2-ND2 3.31Å; F344-N348 VanDerWaalsContact CE2-ND2 3.25Å; F344-N348 WeakPolarHBondContact CE2-ND2 3.03Å; F344-N348 VanDerWaalsContact O-CB 3.31Å; F344-N348 WeakPolarHBondContact O-CB 3.49Å; F344-N348 PolarHBondContact O-N 2.9Å; F344-N348 PolarHBondContact O-ND2 2.94Å; L345-N348 PolarHBondContact O-N 3.19Å; F346-N348 PolarHBondContact O-N 3.19Å; N348-L350 VanDerWaalsContact C-N 3.27Å; N348-L350 PolarHBondContact O-N 2.87Å; N348-L351 PolarHBondContact O-N 3.19Å; N348-W352 WeakPolarHBondContact O-CB 3.36Å; N348-W352 PolarHBondContact O-N 2.99Å
349L94.9Very high91.9Very high100 Ų10032.5 Ų32.552%0.52417%0.168SC..Hα-helixtrans-58.8-39.9176-73.9175.7000111.9L345 F346 G353L345-L349 HydrophobicContact CD1-CD1 4.23Å; L345-L349 HydrophobicContact CD1-CG 4.31Å; L345-L349 HydrophobicContact CG-CD1 3.95Å; L345-L349 HydrophobicContact CG-CG 4.38Å; L345-L349 WeakPolarHBondContact O-CB 3.22Å; L345-L349 WeakPolarHBondContact O-CG 3.2Å; L345-L349 PolarHBondContact O-N 2.78Å; F346-L349 PolarHBondContact O-N 2.8Å; L349-G353 PolarHBondContact O-N 2.93Å
350L96.5Very high92.5Very high26 Ų2633.4 Ų33.414%0.13617%0.172CC..Hα-helixtrans-64.7-45.6174.4-64.2177.6000112.1L246 L249 L250 F346 F347 N348 W352 G353 L354L246-L350 HydrophobicContact CG-CD2 4.29Å; L249-L350 HydrophobicContact CB-CD1 4.35Å; L249-L350 HydrophobicContact CD2-CD1 3.74Å; L249-L350 HydrophobicContact CD2-CD2 3.82Å; L249-L350 HydrophobicContact CD2-CG 4.43Å; L249-L350 HydrophobicContact CG-CD1 3.75Å; L250-L350 HydrophobicContact CD2-CB 3.47Å; L250-L350 VanDerWaalsContact CD2-CB 3.47Å; L250-L350 HydrophobicContact CD2-CD1 4.03Å; L250-L350 HydrophobicContact CD2-CG 4.43Å; L250-L350 HydrophobicContact CG-CB 3.87Å; L250-L350 HydrophobicContact CG-CD1 4.28Å; F346-L350 HydrophobicContact CD1-CD1 4.26Å; F346-L350 HydrophobicContact CE1-CD1 3.64Å; F346-L350 HydrophobicContact CE2-CD1 4.15Å; F346-L350 HydrophobicContact CZ-CD1 3.6Å; F346-L350 HydrophobicContact CZ-CG 4.46Å; F346-L350 WeakPolarHBondContact O-CG 3.37Å; F346-L350 PolarHBondContact O-N 3.36Å; F347-L350 PolarHBondContact O-N 2.98Å; N348-L350 VanDerWaalsContact C-N 3.27Å; N348-L350 PolarHBondContact O-N 2.87Å; L350-W352 PolarHBondContact O-N 3.42Å; L350-G353 PolarHBondContact O-N 2.61Å; L350-L354 PolarHBondContact O-N 3.33Å
351L97.3Very high93.4Very high2 Ų233.8 Ų33.81%0.0117%0.172CC..Hα-helixtrans-63.9-39.5177.5-71.7175000112.8L250 F320 V324 L325 S328 F347 N348 L354 F355L250-L351 HydrophobicContact CD1-CD2 4.01Å; L250-L351 HydrophobicContact CD2-CD2 3.96Å; L250-L351 HydrophobicContact CD2-CG 4Å; F320-L351 HydrophobicContact CE2-CD2 4.36Å; F320-L351 HydrophobicContact CZ-CD2 4.31Å; V324-L351 HydrophobicContact CG1-CD1 4.28Å; V324-L351 HydrophobicContact CG1-CD2 4.41Å; L325-L351 HydrophobicContact CD2-CB 3.51Å; S328-L351 WeakPolarHBondContact OG-CD1 3.42Å; F347-L351 HydrophobicContact CD1-CD1 3.79Å; F347-L351 HydrophobicContact CD1-CG 4.4Å; F347-L351 HydrophobicContact CE1-CD1 3.38Å; F347-L351 HydrophobicContact CE1-CG 4.06Å; F347-L351 HydrophobicContact CZ-CD1 4.02Å; F347-L351 HydrophobicContact CZ-CD2 4.47Å; F347-L351 HydrophobicContact CZ-CG 4.3Å; F347-L351 PolarHBondContact O-N 3.41Å; F347-L351 VanDerWaalsContact O-N 3.08Å; N348-L351 PolarHBondContact O-N 3.19Å; L351-L354 WeakPolarHBondContact O-CB 3.22Å; L351-L354 PolarHBondContact O-N 3.06Å; L351-F355 PolarHBondContact O-N 3.49Å
352W97.2Very high94.1Very high47 Ų4736 Ų3618%0.17818%0.181CC..Hα-helixtrans-67-38.9174-81100.9000111.4F80 A83 F87 L325 N348 L350 L354 F355 V356F80-W352 AromaticContact CD1-CH2 3.88Å; F80-W352 HydrophobicContact CD1-CH2 3.88Å; F80-W352 HydrophobicContact CD1-CZ3 4.47Å; F80-W352 AromaticContact CE1-CH2 3.59Å; F80-W352 HydrophobicContact CE1-CH2 3.59Å; F80-W352 AromaticContact CE1-CZ3 3.79Å; F80-W352 HydrophobicContact CE1-CZ3 3.79Å; A83-W352 HydrophobicContact CB-CZ2 4.07Å; F87-W352 AromaticContact CE2-CD1 3.9Å; F87-W352 AromaticContact CE2-NE1 3.44Å; F87-W352 AromaticContact CZ-CD1 3.59Å; F87-W352 AromaticContact CZ-NE1 3.61Å; L325-W352 HydrophobicContact CD1-CD2 4.16Å; L325-W352 HydrophobicContact CD1-CE3 4.08Å; L325-W352 HydrophobicContact CD1-CH2 4.26Å; L325-W352 HydrophobicContact CD1-CZ2 4.33Å; L325-W352 HydrophobicContact CD1-CZ3 4.12Å; L325-W352 HydrophobicContact CD2-CD2 4.21Å; L325-W352 HydrophobicContact CD2-CG 4.17Å; N348-W352 WeakPolarHBondContact O-CB 3.36Å; N348-W352 PolarHBondContact O-N 2.99Å; L350-W352 PolarHBondContact O-N 3.42Å; W352-L354 VanDerWaalsContact C-N 3.32Å; W352-L354 PolarHBondContact O-N 2.65Å; W352-F355 HydrophobicContact CE3-CD1 4.09Å; W352-F355 HydrophobicContact CZ3-CD1 4Å; W352-F355 HydrophobicContact CZ3-CE1 4.37Å; W352-F355 WeakPolarHBondContact O-CB 3.45Å; W352-F355 PolarHBondContact O-N 2.92Å; W352-V356 WeakPolarHBondContact O-CG2 3.08Å; W352-V356 PolarHBondContact O-N 3.36Å
353G97.5Very high95Very high26 Ų2637.6 Ų37.627%0.26819%0.193SC..Hα-helixtrans-58.6-43.1171.300000112.4L349 L350 F355 V356 M357L349-G353 PolarHBondContact O-N 2.93Å; L350-G353 PolarHBondContact O-N 2.61Å; G353-F355 PolarHBondContact O-N 3.03Å; G353-V356 PolarHBondContact O-N 3.35Å; G353-M357 WeakPolarHBondContact O-CG 3.36Å; G353-M357 PolarHBondContact O-N 2.67Å; G353-M357 VanDerWaalsContact O-N 3.15Å
354L97.7Very high95.6Very high8 Ų838.4 Ų38.44%0.04219%0.194CC..Hα-helixtrans-60.7-42.8173.6-178.661.5000111.7H243 L246 L250 T266 F320 L350 L351 W352 V356 M357 H358H243-L354 WeakPolarHBondContact ND1-CD1 3.5Å; L246-L354 HydrophobicContact CD2-CB 3.82Å; L246-L354 HydrophobicContact CD2-CD1 4.38Å; L250-L354 HydrophobicContact CD1-CD2 4.02Å; T266-L354 HydrophobicContact CG2-CD2 4.34Å; F320-L354 HydrophobicContact CZ-CD2 4.11Å; L350-L354 PolarHBondContact O-N 3.33Å; L351-L354 WeakPolarHBondContact O-CB 3.22Å; L351-L354 PolarHBondContact O-N 3.06Å; W352-L354 VanDerWaalsContact C-N 3.32Å; W352-L354 PolarHBondContact O-N 2.65Å; L354-V356 PolarHBondContact O-N 3Å; L354-M357 WeakPolarHBondContact O-CB 3.25Å; L354-M357 PolarHBondContact O-N 2.97Å; L354-H358 VanDerWaalsContact CG-CE1 3.47Å; L354-H358 WeakPolarHBondContact CG-CE1 3.48Å; L354-H358 PolarHBondContact O-N 2.53Å; L354-H358 VanDerWaalsContact O-N 3.11Å; L354-H358 PolarHBondContact O-ND1 3.48Å
355F98Very high95.8Very high20 Ų2038.8 Ų38.89%0.08820%0.196CC..Hα-helixtrans-61.9-41.6176.3-174.2-122.8000113L317 F320 P321 L325 L351 W352 G353 M357 H358 I359L317-F355 HydrophobicContact CD2-CE2 4.24Å; F320-F355 HydrophobicContact CD1-CD2 4.01Å; F320-F355 HydrophobicContact CE1-CB 3.95Å; F320-F355 HydrophobicContact CE1-CD2 4.14Å; F320-F355 HydrophobicContact CE1-CG 4.47Å; P321-F355 HydrophobicContact CB-CE2 4.16Å; P321-F355 HydrophobicContact CB-CZ 4.32Å; P321-F355 HydrophobicContact CG-CE2 3.82Å; P321-F355 HydrophobicContact CG-CZ 4.19Å; L325-F355 HydrophobicContact CD1-CB 3.89Å; L325-F355 HydrophobicContact CD1-CD1 4.15Å; L325-F355 HydrophobicContact CD1-CD2 4.36Å; L325-F355 HydrophobicContact CD1-CG 3.88Å; L351-F355 PolarHBondContact O-N 3.49Å; W352-F355 HydrophobicContact CE3-CD1 4.09Å; W352-F355 HydrophobicContact CZ3-CD1 4Å; W352-F355 HydrophobicContact CZ3-CE1 4.37Å; W352-F355 WeakPolarHBondContact O-CB 3.45Å; W352-F355 PolarHBondContact O-N 2.92Å; G353-F355 PolarHBondContact O-N 3.03Å; F355-M357 VanDerWaalsContact C-N 3.3Å; F355-M357 PolarHBondContact O-N 3.33Å; F355-H358 WeakPolarHBondContact O-CB 3.29Å; F355-H358 PolarHBondContact O-N 3.24Å; F355-H358 VanDerWaalsContact O-N 3.08Å; F355-I359 HydrophobicContact CD1-CD1 4.09Å; F355-I359 HydrophobicContact CE1-CD1 3.74Å; F355-I359 HydrophobicContact CE1-CG1 4.45Å; F355-I359 HydrophobicContact CZ-CD1 4.09Å; F355-I359 HydrophobicContact CZ-CG1 4.37Å; F355-I359 PolarHBondContact O-N 2.9Å; F355-I359 VanDerWaalsContact O-N 3.08Å
356V97.9Very high96.1Very high93 Ų9339.9 Ų39.956%0.56421%0.205SC*.Hα-helixtrans-60.6-40.4175.7172.80000111.1W352 G353 L354 H358 I359 Y360W352-V356 WeakPolarHBondContact O-CG2 3.08Å; W352-V356 PolarHBondContact O-N 3.36Å; G353-V356 PolarHBondContact O-N 3.35Å; L354-V356 PolarHBondContact O-N 3Å; V356-H358 VanDerWaalsContact C-N 3.31Å; V356-H358 PolarHBondContact O-N 3.1Å; V356-I359 PolarHBondContact O-N 3.19Å; V356-Y360 PolarHBondContact O-N 3.17Å
357M97.6Very high96.3Very high18 Ų1842.7 Ų42.79%0.08921%0.213CC..Hα-helixtrans-62.3-37.5173.8-64.7173.7-177.200112.1V239 L242 H243 L246 G353 L354 F355 I359 Y360 W361V239-M357 HydrophobicContact CG1-CG 4.31Å; L242-M357 HydrophobicContact CB-CE 4.15Å; L242-M357 HydrophobicContact CD2-CE 3.63Å; L242-M357 HydrophobicContact CG-CE 3.55Å; H243-M357 HydrophobicContact CB-SD 3.78Å; L246-M357 HydrophobicContact CD1-CE 3.91Å; G353-M357 WeakPolarHBondContact O-CG 3.36Å; G353-M357 PolarHBondContact O-N 2.67Å; G353-M357 VanDerWaalsContact O-N 3.15Å; L354-M357 WeakPolarHBondContact O-CB 3.25Å; L354-M357 PolarHBondContact O-N 2.97Å; F355-M357 VanDerWaalsContact C-N 3.3Å; F355-M357 PolarHBondContact O-N 3.33Å; M357-I359 PolarHBondContact O-N 2.75Å; M357-Y360 WeakPolarHBondContact O-CB 3.47Å; M357-Y360 PolarHBondContact O-N 3.1Å; M357-W361 HydrophobicContact CB-CE3 4.1Å; M357-W361 HydrophobicContact CB-CH2 4.17Å; M357-W361 HydrophobicContact CB-CZ3 3.75Å; M357-W361 VanDerWaalsContact O-CE3 3.22Å; M357-W361 PolarHBondContact O-N 2.95Å
358H97.6Very high96.2Very high0 Ų044 Ų440%022%0.219CC..Hα-helixtrans-64.2-39.2175.2-62.6138.4000113.2H270 W312 L317 L354 F355 V356 Y360 F362H270-H358 AromaticContact CD2-CE1 3.32Å; H270-H358 PolarHBondContact CD2-CE1 2.87Å; H270-H358 AromaticContact CD2-NE2 3.36Å; H270-H358 PolarHBondContact CD2-NE2 3.46Å; H270-H358 AromaticContact NE2-CE1 2.92Å; H270-H358 PolarHBondContact NE2-CE1 2.95Å; H270-H358 AromaticContact NE2-ND1 3.79Å; H270-H358 AromaticContact NE2-NE2 3.51Å; W312-H358 HydrophobicContact CZ2-CB 4.25Å; W312-H358 PolarHBondContact NE1-O 3.5Å; L317-H358 HydrophobicContact CD2-CB 4.16Å; L354-H358 VanDerWaalsContact CG-CE1 3.47Å; L354-H358 WeakPolarHBondContact CG-CE1 3.48Å; L354-H358 PolarHBondContact O-N 2.53Å; L354-H358 VanDerWaalsContact O-N 3.11Å; L354-H358 PolarHBondContact O-ND1 3.48Å; F355-H358 WeakPolarHBondContact O-CB 3.29Å; F355-H358 PolarHBondContact O-N 3.24Å; F355-H358 VanDerWaalsContact O-N 3.08Å; V356-H358 VanDerWaalsContact C-N 3.31Å; V356-H358 PolarHBondContact O-N 3.1Å; H358-Y360 VanDerWaalsContact C-N 3.33Å; H358-F362 VanDerWaalsContact O-CB 3.31Å; H358-F362 WeakPolarHBondContact O-CB 3.34Å; H358-F362 PolarHBondContact O-N 2.9Å
359I97.6Very high96.2Very high82 Ų8246.5 Ų46.542%0.42124%0.235SC..Hα-helixtrans-62.7-44.5173.4-63170.6000109.7L317 F355 V356 M357 F362 T363L317-I359 HydrophobicContact CD2-CG1 4.36Å; F355-I359 HydrophobicContact CD1-CD1 4.09Å; F355-I359 HydrophobicContact CE1-CD1 3.74Å; F355-I359 HydrophobicContact CE1-CG1 4.45Å; F355-I359 HydrophobicContact CZ-CD1 4.09Å; F355-I359 HydrophobicContact CZ-CG1 4.37Å; F355-I359 PolarHBondContact O-N 2.9Å; F355-I359 VanDerWaalsContact O-N 3.08Å; V356-I359 PolarHBondContact O-N 3.19Å; M357-I359 PolarHBondContact O-N 2.75Å; I359-F362 WeakPolarHBondContact O-CB 3.49Å; I359-F362 PolarHBondContact O-N 3.16Å; I359-T363 WeakPolarHBondContact O-CG2 3.38Å; I359-T363 PolarHBondContact O-N 3.1Å
360Y97.2Very high96Very high83 Ų8346.4 Ų46.433%0.32523%0.233SC..Hα-helixtrans-56.8-52.4176.4169.9-98.7000112.1V239 V356 M357 H358 F362 T363 F364V239-Y360 HydrophobicContact CB-CE1 4.12Å; V239-Y360 HydrophobicContact CG1-CD1 4.03Å; V239-Y360 HydrophobicContact CG1-CE1 4.03Å; V239-Y360 HydrophobicContact CG2-CE1 3.87Å; V356-Y360 PolarHBondContact O-N 3.17Å; M357-Y360 WeakPolarHBondContact O-CB 3.47Å; M357-Y360 PolarHBondContact O-N 3.1Å; H358-Y360 VanDerWaalsContact C-N 3.33Å; Y360-F362 VanDerWaalsContact C-N 3.32Å; Y360-F362 PolarHBondContact O-N 3.01Å; Y360-T363 WeakPolarHBondContact O-CB 3.19Å; Y360-T363 PolarHBondContact O-N 2.7Å; Y360-T363 VanDerWaalsContact O-N 3.15Å; Y360-T363 PolarHBondContact O-OG1 3.35Å; Y360-F364 HydrophobicContact CD1-CE2 4.11Å; Y360-F364 HydrophobicContact CD2-CE2 4.44Å; Y360-F364 HydrophobicContact CE1-CD2 4.36Å; Y360-F364 AromaticContact CE1-CE2 3.5Å; Y360-F364 HydrophobicContact CE1-CE2 3.5Å; Y360-F364 HydrophobicContact CE1-CZ 4.28Å; Y360-F364 AromaticContact CE2-CE2 3.89Å; Y360-F364 HydrophobicContact CE2-CE2 3.89Å; Y360-F364 HydrophobicContact CE2-CZ 4.4Å; Y360-F364 AromaticContact CZ-CE2 3.39Å; Y360-F364 AromaticContact CZ-CZ 3.84Å; Y360-F364 WeakPolarHBondContact OH-CZ 3.38Å
361W97.2Very high95.6Very high23 Ų2350.9 Ų50.99%0.08725%0.248CC..Hα-helixtrans-67-32.1179-72.3-51.4000113.4V239 H243 W312 M357 T363 F364 I365V239-W361 HydrophobicContact CG1-CZ2 3.96Å; H243-W361 HydrophobicContact CB-CH2 3.63Å; H243-W361 HydrophobicContact CB-CZ2 4.28Å; H243-W361 AromaticContact CG-CH2 3.59Å; H243-W361 AromaticContact ND1-CH2 3.74Å; W312-W361 HydrophobicContact CH2-CB 3.64Å; W312-W361 HydrophobicContact CH2-CD2 4.31Å; W312-W361 AromaticContact CH2-CE3 3.91Å; W312-W361 HydrophobicContact CH2-CE3 3.91Å; W312-W361 HydrophobicContact CH2-CG 4.26Å; W312-W361 HydrophobicContact CZ2-CB 3.5Å; W312-W361 VanDerWaalsContact CZ2-CB 3.5Å; W312-W361 HydrophobicContact CZ2-CE3 4.23Å; W312-W361 HydrophobicContact CZ2-CG 4.47Å; M357-W361 HydrophobicContact CB-CE3 4.1Å; M357-W361 HydrophobicContact CB-CH2 4.17Å; M357-W361 HydrophobicContact CB-CZ3 3.75Å; M357-W361 VanDerWaalsContact O-CE3 3.22Å; M357-W361 PolarHBondContact O-N 2.95Å; W361-T363 PolarHBondContact O-N 3.27Å; W361-F364 WeakPolarHBondContact O-CB 3.4Å; W361-F364 PolarHBondContact O-N 3.34Å; W361-I365 PolarHBondContact O-N 2.77Å
362F97.2Very high95.1Very high63 Ų6352.5 Ų52.528%0.27626%0.257SS..Hα-helixtrans-56.8-33.6173.5-177.4-117.4000112.2W312 V313 L317 H358 I359 Y360 F364 I365 V366W312-F362 AromaticContact CD1-CD2 3.66Å; V313-F362 HydrophobicContact CG2-CD2 4.36Å; V313-F362 HydrophobicContact CG2-CE2 3.48Å; V313-F362 VanDerWaalsContact CG2-CE2 3.48Å; V313-F362 HydrophobicContact CG2-CZ 4Å; L317-F362 HydrophobicContact CD1-CB 4.08Å; L317-F362 HydrophobicContact CD1-CD1 3.79Å; L317-F362 HydrophobicContact CD1-CD2 3.7Å; L317-F362 HydrophobicContact CD1-CE1 4.1Å; L317-F362 HydrophobicContact CD1-CE2 4.02Å; L317-F362 HydrophobicContact CD1-CG 3.58Å; L317-F362 HydrophobicContact CD1-CZ 4.21Å; H358-F362 VanDerWaalsContact O-CB 3.31Å; H358-F362 WeakPolarHBondContact O-CB 3.34Å; H358-F362 PolarHBondContact O-N 2.9Å; I359-F362 WeakPolarHBondContact O-CB 3.49Å; I359-F362 PolarHBondContact O-N 3.16Å; Y360-F362 VanDerWaalsContact C-N 3.32Å; Y360-F362 PolarHBondContact O-N 3.01Å; F362-F364 VanDerWaalsContact C-N 3.27Å; F362-F364 PolarHBondContact O-N 3.1Å; F362-I365 HydrophobicContact CD2-CB 4.48Å; F362-I365 WeakPolarHBondContact O-CB 3.31Å; F362-I365 PolarHBondContact O-N 3.14Å; F362-I365 VanDerWaalsContact O-N 3.14Å; F362-V366 HydrophobicContact CD1-CG2 4.14Å; F362-V366 HydrophobicContact CD2-CG2 4.4Å; F362-V366 HydrophobicContact CE1-CG2 3.7Å; F362-V366 HydrophobicContact CE2-CG2 3.98Å; F362-V366 HydrophobicContact CG-CG2 4.47Å; F362-V366 HydrophobicContact CZ-CG2 3.61Å; F362-V366 WeakPolarHBondContact O-CG2 3.5Å; F362-V366 PolarHBondContact O-N 2.84Å
363T96.1Very high94.7Very high55 Ų5555.7 Ų55.734%0.33728%0.281SS..Hα-helixtrans-61.3-33.8174.9750000113I359 Y360 W361 R367I359-T363 WeakPolarHBondContact O-CG2 3.38Å; I359-T363 PolarHBondContact O-N 3.1Å; Y360-T363 WeakPolarHBondContact O-CB 3.19Å; Y360-T363 PolarHBondContact O-N 2.7Å; Y360-T363 VanDerWaalsContact O-N 3.15Å; Y360-T363 PolarHBondContact O-OG1 3.35Å; W361-T363 PolarHBondContact O-N 3.27Å; T363-R367 VanDerWaalsContact O-CG 3.27Å; T363-R367 WeakPolarHBondContact O-CG 3.33Å; T363-R367 PolarHBondContact O-N 3.04Å; T363-R367 VanDerWaalsContact O-N 3.13Å
364F94.4Very high94.3Very high27 Ų2759 Ų5912%0.11830%0.296CS..Hα-helixtrans-71.1-40.4174.3-69.5-87000111.5Y360 W361 F362 V366 R367 M368 I383 R384Y360-F364 HydrophobicContact CD1-CE2 4.11Å; Y360-F364 HydrophobicContact CD2-CE2 4.44Å; Y360-F364 HydrophobicContact CE1-CD2 4.36Å; Y360-F364 AromaticContact CE1-CE2 3.5Å; Y360-F364 HydrophobicContact CE1-CE2 3.5Å; Y360-F364 HydrophobicContact CE1-CZ 4.28Å; Y360-F364 AromaticContact CE2-CE2 3.89Å; Y360-F364 HydrophobicContact CE2-CE2 3.89Å; Y360-F364 HydrophobicContact CE2-CZ 4.4Å; Y360-F364 AromaticContact CZ-CE2 3.39Å; Y360-F364 AromaticContact CZ-CZ 3.84Å; Y360-F364 WeakPolarHBondContact OH-CZ 3.38Å; W361-F364 WeakPolarHBondContact O-CB 3.4Å; W361-F364 PolarHBondContact O-N 3.34Å; F362-F364 VanDerWaalsContact C-N 3.27Å; F362-F364 PolarHBondContact O-N 3.1Å; F364-V366 PolarHBondContact O-N 3.31Å; F364-R367 PolarHBondContact O-N 3.21Å; F364-M368 WeakPolarHBondContact O-CB 3.38Å; F364-M368 PolarHBondContact O-N 2.6Å; F364-I383 HydrophobicContact CB-CD1 3.96Å; F364-I383 HydrophobicContact CD1-CD1 3.74Å; F364-I383 HydrophobicContact CD1-CG1 4Å; F364-I383 HydrophobicContact CG-CD1 4.33Å; F364-I383 VanDerWaalsContact O-CD1 3.24Å; F364-I383 WeakPolarHBondContact O-CD1 3.34Å; F364-R384 HydrophobicContact CD1-CG 3.86Å; F364-R384 HydrophobicContact CE1-CG 4.13Å
365I95Very high93.5Very high12 Ų1260.7 Ų60.76%0.06231%0.309CS..Hα-helixtrans-60.1-48.5177.2-56.7176.7000109.7F308 A309 W312 W361 F362 R367 M368 T369F308-I365 HydrophobicContact CE1-CD1 3.62Å; F308-I365 HydrophobicContact CE1-CG1 3.68Å; F308-I365 HydrophobicContact CE1-CG2 4.16Å; F308-I365 HydrophobicContact CE2-CD1 4.27Å; F308-I365 HydrophobicContact CZ-CD1 3.36Å; F308-I365 HydrophobicContact CZ-CG1 3.8Å; A309-I365 HydrophobicContact CB-CG2 3.76Å; W312-I365 HydrophobicContact CB-CD1 3.9Å; W312-I365 HydrophobicContact CD2-CD1 3.3Å; W312-I365 HydrophobicContact CE3-CD1 3.7Å; W312-I365 HydrophobicContact CG-CD1 3.38Å; W312-I365 HydrophobicContact CZ2-CD1 4.38Å; W312-I365 HydrophobicContact CZ3-CD1 4.33Å; W361-I365 PolarHBondContact O-N 2.77Å; F362-I365 HydrophobicContact CD2-CB 4.48Å; F362-I365 WeakPolarHBondContact O-CB 3.31Å; F362-I365 PolarHBondContact O-N 3.14Å; F362-I365 VanDerWaalsContact O-N 3.14Å; I365-R367 PolarHBondContact O-N 3Å; I365-M368 PolarHBondContact O-N 3.05Å; I365-T369 WeakPolarHBondContact O-CB 3.12Å; I365-T369 PolarHBondContact O-N 3.4Å; I365-T369 PolarHBondContact O-OG1 3.46Å
366V95.6Very high92.3Very high58 Ų5864 Ų6435%0.35233%0.332SS..Hα-helixtrans-58.9-46.7177.3172.80000111.4F362 F364 M368 T369 I370F362-V366 HydrophobicContact CD1-CG2 4.14Å; F362-V366 HydrophobicContact CD2-CG2 4.4Å; F362-V366 HydrophobicContact CE1-CG2 3.7Å; F362-V366 HydrophobicContact CE2-CG2 3.98Å; F362-V366 HydrophobicContact CG-CG2 4.47Å; F362-V366 HydrophobicContact CZ-CG2 3.61Å; F362-V366 WeakPolarHBondContact O-CG2 3.5Å; F362-V366 PolarHBondContact O-N 2.84Å; F364-V366 PolarHBondContact O-N 3.31Å; V366-M368 VanDerWaalsContact C-N 3.32Å; V366-M368 PolarHBondContact O-N 3.26Å; V366-T369 PolarHBondContact O-N 3.47Å; V366-I370 HydrophobicContact CG1-CD1 3.85Å; V366-I370 HydrophobicContact CG1-CG1 4.45Å; V366-I370 VanDerWaalsContact O-CG1 3.31Å; V366-I370 WeakPolarHBondContact O-CG1 3.41Å; V366-I370 PolarHBondContact O-N 3.48Å
367R93.3Very high90.7Very high148 Ų14867.7 Ų67.756%0.55835%0.348SS*.Hα-helixtrans-60.8-40.4177.6-74.6172179.4168.40.6112.4T363 F364 I365 R371 I383T363-R367 VanDerWaalsContact O-CG 3.27Å; T363-R367 WeakPolarHBondContact O-CG 3.33Å; T363-R367 PolarHBondContact O-N 3.04Å; T363-R367 VanDerWaalsContact O-N 3.13Å; F364-R367 PolarHBondContact O-N 3.21Å; I365-R367 PolarHBondContact O-N 3Å; R367-R371 WeakPolarHBondContact O-CG 3.38Å; R367-R371 PolarHBondContact O-N 3.22Å; R367-R371 VanDerWaalsContact O-N 3.12Å; R367-I383 HydrophobicContact CB-CD1 3.76Å
368M91.3Very high89Confident31 Ų3173.7 Ų73.715%0.15338%0.376CS..Hα-helixtrans-67.4-43.6176.4-175.964.3176.200111.4F305 F364 I365 V366 I370 R371 L372 A379 I383F305-M368 HydrophobicContact CE1-CG 4.38Å; F305-M368 HydrophobicContact CE2-CB 4.28Å; F305-M368 HydrophobicContact CE2-CG 3.61Å; F305-M368 HydrophobicContact CZ-CB 3.84Å; F305-M368 HydrophobicContact CZ-CG 3.45Å; F305-M368 VanDerWaalsContact CZ-CG 3.45Å; F364-M368 WeakPolarHBondContact O-CB 3.38Å; F364-M368 PolarHBondContact O-N 2.6Å; I365-M368 PolarHBondContact O-N 3.05Å; V366-M368 VanDerWaalsContact C-N 3.32Å; V366-M368 PolarHBondContact O-N 3.26Å; M368-I370 PolarHBondContact O-N 2.9Å; M368-R371 PolarHBondContact O-N 2.99Å; M368-L372 HydrophobicContact CE-CD1 4.34Å; M368-L372 HydrophobicContact CE-CG 4.4Å; M368-L372 HydrophobicContact CG-CD1 4.18Å; M368-L372 WeakPolarHBondContact O-CG 3.19Å; M368-L372 PolarHBondContact O-N 2.76Å; M368-A379 WeakPolarHBondContact CE-O 3.29Å; M368-I383 HydrophobicContact CB-CD1 4.36Å; M368-I383 HydrophobicContact SD-CG2 3.87Å
369T92.4Very high87.3Confident55 Ų5574 Ų7434%0.33738%0.378SS..Hα-helixtrans-60-44.6175.7-58.70000111.6F305 I365 V366 R371 L372 V373F305-T369 WeakPolarHBondContact CE1-OG1 3.4Å; I365-T369 WeakPolarHBondContact O-CB 3.12Å; I365-T369 PolarHBondContact O-N 3.4Å; I365-T369 PolarHBondContact O-OG1 3.46Å; V366-T369 PolarHBondContact O-N 3.47Å; T369-R371 VanDerWaalsContact C-N 3.33Å; T369-R371 PolarHBondContact O-N 3.26Å; T369-L372 PolarHBondContact O-N 3Å; T369-V373 WeakPolarHBondContact O-CG2 3.42Å; T369-V373 PolarHBondContact O-N 2.63Å; T369-V373 VanDerWaalsContact O-N 3.15Å
370I91.6Very high85.6Confident97 Ų9771.4 Ų71.450%0.49737%0.367SS..Hα-helixtrans-59.1-46.7175.6-67.7165.9000110V366 M368 L372 V373 T374V366-I370 HydrophobicContact CG1-CD1 3.85Å; V366-I370 HydrophobicContact CG1-CG1 4.45Å; V366-I370 VanDerWaalsContact O-CG1 3.31Å; V366-I370 WeakPolarHBondContact O-CG1 3.41Å; V366-I370 PolarHBondContact O-N 3.48Å; M368-I370 PolarHBondContact O-N 2.9Å; I370-L372 PolarHBondContact O-N 3.36Å; I370-V373 PolarHBondContact O-N 3.24Å; I370-V373 VanDerWaalsContact O-N 3.13Å; I370-T374 HydrophobicContact CG2-CG2 4.06Å; I370-T374 WeakPolarHBondContact O-CG2 3.43Å; I370-T374 PolarHBondContact O-N 3.1Å; I370-T374 PolarHBondContact O-OG1 3.18Å; I370-T374 VanDerWaalsContact O-OG1 3.11Å
371R87.6Confident84.2Confident120 Ų12070.1 Ų70.145%0.45336%0.364SS..Hα-helixtrans-61-41.1177.7-75.2-177.9-177.8-170.9-1.3113.1R367 M368 T369 V373 T374 S375R367-R371 WeakPolarHBondContact O-CG 3.38Å; R367-R371 PolarHBondContact O-N 3.22Å; R367-R371 VanDerWaalsContact O-N 3.12Å; M368-R371 PolarHBondContact O-N 2.99Å; T369-R371 VanDerWaalsContact C-N 3.33Å; T369-R371 PolarHBondContact O-N 3.26Å; R371-V373 PolarHBondContact O-N 3.4Å; R371-T374 PolarHBondContact O-N 3.06Å; R371-S375 CarbonylContact O-C 3.49Å; R371-S375 WeakPolarHBondContact O-CA 3.17Å; R371-S375 PolarHBondContact O-N 3Å
372L87.1Confident82.9Confident37 Ų3770.6 Ų70.619%0.19437%0.368CS..Hα-helixtrans-60.8-32.8175.9-78.1162.4000112.6F305 M368 T369 I370 A379F305-L372 HydrophobicContact CD1-CD1 3.3Å; F305-L372 HydrophobicContact CD2-CD1 4.45Å; F305-L372 HydrophobicContact CE1-CD1 3.21Å; F305-L372 HydrophobicContact CE2-CD1 4.38Å; F305-L372 HydrophobicContact CG-CD1 3.96Å; F305-L372 HydrophobicContact CZ-CD1 3.81Å; M368-L372 HydrophobicContact CE-CD1 4.34Å; M368-L372 HydrophobicContact CE-CG 4.4Å; M368-L372 HydrophobicContact CG-CD1 4.18Å; M368-L372 WeakPolarHBondContact O-CG 3.19Å; M368-L372 PolarHBondContact O-N 2.76Å; T369-L372 PolarHBondContact O-N 3Å; I370-L372 PolarHBondContact O-N 3.36Å; L372-A379 VanDerWaalsContact CA-CB 3.46Å; L372-A379 HydrophobicContact CB-CB 4.21Å; L372-A379 HydrophobicContact CD2-CB 3.46Å; L372-A379 VanDerWaalsContact CD2-CB 3.46Å; L372-A379 HydrophobicContact CG-CB 3.8Å
373V88Confident82Confident113 Ų11368.5 Ų68.569%0.68536%0.36SS*.Hα-helixtrans-82.7-42.4178176.30000111.9T369 I370 R371T369-V373 WeakPolarHBondContact O-CG2 3.42Å; T369-V373 PolarHBondContact O-N 2.63Å; T369-V373 VanDerWaalsContact O-N 3.15Å; I370-V373 PolarHBondContact O-N 3.24Å; I370-V373 VanDerWaalsContact O-N 3.13Å; R371-V373 PolarHBondContact O-N 3.4Å
374T89.1Confident81.1Confident95 Ų9568 Ų6858%0.58335%0.352SS*.Hα-helixtrans-82.7-33.8-174.460.40000113.6I370 R371I370-T374 HydrophobicContact CG2-CG2 4.06Å; I370-T374 WeakPolarHBondContact O-CG2 3.43Å; I370-T374 PolarHBondContact O-N 3.1Å; I370-T374 PolarHBondContact O-OG1 3.18Å; I370-T374 VanDerWaalsContact O-OG1 3.11Å; R371-T374 PolarHBondContact O-N 3.06Å
375S81.3Confident80.2Confident45 Ų4567.3 Ų67.332%0.31535%0.349SS..  trans-139.364.4-171.4-53.10000111R371 L377 E378 A379R371-S375 CarbonylContact O-C 3.49Å; R371-S375 WeakPolarHBondContact O-CA 3.17Å; R371-S375 PolarHBondContact O-N 3Å; S375-L377 PolarHBondContact O-N 3.2Å; S375-E378 PolarHBondContact O-N 3.21Å; S375-A379 WeakPolarHBondContact O-CB 3.46Å; S375-A379 PolarHBondContact O-N 3.06Å
376P73Confident79.1Confident88 Ų8870 Ų7057%0.57136%0.364SS*.THydrogen-bonded Turntrans-56.2-30.1-174.1-23.732.4000114
377L64.1Low77.7Confident171 Ų17170.5 Ų70.590%0.89537%0.374SS*.THydrogen-bonded Turntrans-71.5-27.8179-63.3174.3000113.2S375S375-L377 PolarHBondContact O-N 3.2Å
378E62Low76.1Confident145 Ų14568.4 Ų68.468%0.67838%0.377SS*.THydrogen-bonded Turntrans-102.3-15.9179.4-66.3-177.5171.600112.9S375 C380S375-E378 PolarHBondContact O-N 3.21Å; E378-C380 PolarHBondContact O-N 3.21Å
379A62.3Low74.7Confident5 Ų570 Ų704%0.04139%0.386CS..THydrogen-bonded Turntrans-69.34.9-173.600000115.1M368 L372 S375 E381M368-A379 WeakPolarHBondContact CE-O 3.29Å; L372-A379 VanDerWaalsContact CA-CB 3.46Å; L372-A379 HydrophobicContact CB-CB 4.21Å; L372-A379 HydrophobicContact CD2-CB 3.46Å; L372-A379 VanDerWaalsContact CD2-CB 3.46Å; L372-A379 HydrophobicContact CG-CB 3.8Å; S375-A379 WeakPolarHBondContact O-CB 3.46Å; S375-A379 PolarHBondContact O-N 3.06Å; A379-E381 PolarHBondContact O-N 2.83Å
380C61.1Low73.1Confident28 Ų2869 Ų6919%0.18938%0.377CS..THydrogen-bonded Turntrans-78.8-4.6179.5-78.40000114.1R287 M298 E378R287-C380 VanDerWaalsContact NH1-CB 3.35Å; R287-C380 PolarHBondContact NH1-O 3.05Å; M298-C380 WeakPolarHBondContact CE-SG 3.49Å; E378-C380 PolarHBondContact O-N 3.21Å
381E68.2Low71.4Confident57 Ų5772 Ų7227%0.26639%0.387SS..SBendtrans-105.3135.3-176.8-61.5-173.9176.500112.3A379 I383 K390 N394A379-E381 PolarHBondContact O-N 2.83Å; E381-I383 PolarHBondContact O-N 3.34Å; E381-K390 WeakPolarHBondContact OE2-CD 3.35Å; E381-K390 IonicContact OE2-NZ 2.78Å; E381-K390 PolarHBondContact OE2-NZ 3.35Å; E381-N394 PolarHBondContact OE1-ND2 3.23Å
382D71.2Confident70.1Confident33 Ų3369.4 Ų69.418%0.17638%0.384CS..  trans-65.6130.3172-168.8-26.6000109.6R384 E385 K390D382-R384 PolarHBondContact O-N 3.29Å; D382-R384 WeakPolarHBondContact OD1-CB 3.45Å; D382-R384 WeakPolarHBondContact OD1-CG 3.49Å; D382-R384 IonicContact OD1-CZ 3.32Å; D382-R384 PolarHBondContact OD1-N 2.88Å; D382-R384 IonicContact OD1-NE 3.44Å; D382-R384 PolarHBondContact OD1-NE 3.42Å; D382-R384 IonicContact OD1-NH2 2.71Å; D382-R384 IonicContact OD2-CZ 2.71Å; D382-R384 IonicContact OD2-NE 3.35Å; D382-R384 PolarHBondContact OD2-NE 2.92Å; D382-R384 IonicContact OD2-NH2 3.61Å; D382-R384 PolarHBondContact OD2-NH2 3.23Å; D382-E385 HydrophobicContact CB-CG 4.06Å; D382-K390 WeakPolarHBondContact O-CE 3.16Å; D382-K390 PolarHBondContact O-NZ 2.92Å
383I78.3Confident68.8Low19 Ų1969.4 Ų69.410%0.09738%0.384CS..THydrogen-bonded Turntrans-74.6-13.9-177.267.8174.6000113.1F364 R367 M368 E381F364-I383 HydrophobicContact CB-CD1 3.96Å; F364-I383 HydrophobicContact CD1-CD1 3.74Å; F364-I383 HydrophobicContact CD1-CG1 4Å; F364-I383 HydrophobicContact CG-CD1 4.33Å; F364-I383 VanDerWaalsContact O-CD1 3.24Å; F364-I383 WeakPolarHBondContact O-CD1 3.34Å; R367-I383 HydrophobicContact CB-CD1 3.76Å; M368-I383 HydrophobicContact CB-CD1 4.36Å; M368-I383 HydrophobicContact SD-CG2 3.87Å; E381-I383 PolarHBondContact O-N 3.34Å
384R76.4Confident67.5Low43 Ų4367.4 Ų67.416%0.16237%0.37CS..THydrogen-bonded Turntrans-89.6-18-177.5-58.2174.7-66.2171.3-1.3113.2R234 K235 D236 F364 D382R234-R384 HydrophobicContact CB-CB 4.38Å; K235-R384 WeakPolarHBondContact CG-O 3.41Å; K235-R384 PolarHBondContact N-O 3.42Å; D236-R384 WeakPolarHBondContact OD2-CD 3.33Å; D236-R384 IonicContact OD2-CZ 3.78Å; D236-R384 IonicContact OD2-NH1 3.97Å; D236-R384 PolarHBondContact OD2-NH1 2.89Å; F364-R384 HydrophobicContact CD1-CG 3.86Å; F364-R384 HydrophobicContact CE1-CG 4.13Å; D382-R384 PolarHBondContact O-N 3.29Å; D382-R384 WeakPolarHBondContact OD1-CB 3.45Å; D382-R384 WeakPolarHBondContact OD1-CG 3.49Å; D382-R384 IonicContact OD1-CZ 3.32Å; D382-R384 PolarHBondContact OD1-N 2.88Å; D382-R384 IonicContact OD1-NE 3.44Å; D382-R384 PolarHBondContact OD1-NE 3.42Å; D382-R384 IonicContact OD1-NH2 2.71Å; D382-R384 IonicContact OD2-CZ 2.71Å; D382-R384 IonicContact OD2-NE 3.35Å; D382-R384 PolarHBondContact OD2-NE 2.92Å; D382-R384 IonicContact OD2-NH2 3.61Å; D382-R384 PolarHBondContact OD2-NH2 3.23Å
385E75.8Confident65.7Low13 Ų1368.6 Ų68.66%0.06137%0.37CS..SBendtrans-70.2146.7175.9-68.3-176.6167.700110.8K154 D382K154-E385 WeakPolarHBondContact CE-OE1 3.41Å; K154-E385 VanDerWaalsContact NZ-CD 3.29Å; K154-E385 IonicContact NZ-OE1 2.92Å; K154-E385 PolarHBondContact NZ-OE1 3.38Å; K154-E385 IonicContact NZ-OE2 2.76Å; K154-E385 PolarHBondContact NZ-OE2 2.83Å; D382-E385 HydrophobicContact CB-CG 4.06Å
386D70.9Confident64.4Low70 Ų7068.9 Ų68.937%0.37437%0.368SS..  trans-74152.5178.6-71.3-32.4000111K235 V388 D389 K390K235-D386 WeakPolarHBondContact CE-OD1 3.34Å; D386-V388 PolarHBondContact O-N 3.06Å; D386-V388 VanDerWaalsContact O-N 3.1Å; D386-D389 PolarHBondContact O-N 3.06Å; D386-K390 PolarHBondContact O-N 3.27Å
387A67.2Low63.4Low68 Ų6867.1 Ų67.156%0.56235%0.354SS*.Hα-helixtrans-61.9-22.1-175.900000113.4K391A387-K391 PolarHBondContact O-N 3.49Å
388V58.3Low62.1Low104 Ų10462.8 Ų62.863%0.6334%0.337SS*.Hα-helixtrans-69.6-48.5177.2-179.40000110.5D386 K390 K391 V392D386-V388 PolarHBondContact O-N 3.06Å; D386-V388 VanDerWaalsContact O-N 3.1Å; V388-K390 VanDerWaalsContact C-N 3.28Å; V388-K390 PolarHBondContact O-N 3.18Å; V388-K391 PolarHBondContact O-N 3.14Å; V388-K391 VanDerWaalsContact O-N 3.16Å; V388-V392 PolarHBondContact O-N 2.71Å
389D62.1Low61Low65 Ų6559.9 Ų59.935%0.34833%0.326SS..Hα-helixtrans-64.2-36.2-179.4-61.4-28.9000111.4D386 K391 V392 D393D386-D389 PolarHBondContact O-N 3.06Å; D389-K391 VanDerWaalsContact C-N 3.34Å; D389-K391 PolarHBondContact O-N 2.84Å; D389-V392 PolarHBondContact O-N 2.86Å; D389-D393 PolarHBondContact O-N 3.49Å; D389-D393 VanDerWaalsContact O-N 3.11Å
390K60Low60.3Low34 Ų3463.8 Ų63.815%0.14834%0.343CS..Hα-helixtrans-59.5-41.1174.6-67.4174.8170.3-112.40113.1E381 D382 D386 V388 V392 N394E381-K390 WeakPolarHBondContact OE2-CD 3.35Å; E381-K390 IonicContact OE2-NZ 2.78Å; E381-K390 PolarHBondContact OE2-NZ 3.35Å; D382-K390 WeakPolarHBondContact O-CE 3.16Å; D382-K390 PolarHBondContact O-NZ 2.92Å; D386-K390 PolarHBondContact O-N 3.27Å; V388-K390 VanDerWaalsContact C-N 3.28Å; V388-K390 PolarHBondContact O-N 3.18Å; K390-V392 VanDerWaalsContact C-N 3.35Å; K390-N394 WeakPolarHBondContact O-CB 3.29Å; K390-N394 PolarHBondContact O-N 3.17Å; K390-N394 PolarHBondContact O-ND2 3.33Å
391K56.1Low59.5Low159 Ų15968.9 Ų68.969%0.69136%0.362SS*.Hα-helixtrans-67-38.1179.9-75.6-176.2-179.6-174.90111.6A387 V388 D389 M395A387-K391 PolarHBondContact O-N 3.49Å; V388-K391 PolarHBondContact O-N 3.14Å; V388-K391 VanDerWaalsContact O-N 3.16Å; D389-K391 VanDerWaalsContact C-N 3.34Å; D389-K391 PolarHBondContact O-N 2.84Å; K391-M395 VanDerWaalsContact O-CB 3.22Å; K391-M395 WeakPolarHBondContact O-CB 3.47Å; K391-M395 PolarHBondContact O-N 2.89Å
392V58.9Low58.2Low66 Ų6670 Ų7040%0.437%0.373SS..Hα-helixtrans-65.1-47.9177.7178.80000110.4V388 D389 K390 N394 M395 N396V388-V392 PolarHBondContact O-N 2.71Å; D389-V392 PolarHBondContact O-N 2.86Å; K390-V392 VanDerWaalsContact C-N 3.35Å; V392-N394 PolarHBondContact O-N 3.17Å; V392-M395 PolarHBondContact O-N 3.41Å; V392-N396 WeakPolarHBondContact O-CB 3.34Å; V392-N396 VanDerWaalsContact O-CG 3.3Å; V392-N396 PolarHBondContact O-N 2.85Å
393D60.9Low56.7Low37 Ų3772.5 Ų72.520%0.19839%0.389CS..Hα-helixtrans-62.3-42.4179.8-74.9-11.1000111.7K154 D389 L397K154-D393 IonicContact NZ-OD2 2.93Å; K154-D393 PolarHBondContact NZ-OD2 3.28Å; D389-D393 PolarHBondContact O-N 3.49Å; D389-D393 VanDerWaalsContact O-N 3.11Å; D393-L397 PolarHBondContact O-N 3.12Å; D393-L397 VanDerWaalsContact O-N 3.11Å
394N59.8Low54.9Low70 Ų7074.1 Ų74.137%0.37440%0.402SS..Hα-helixtrans-71.2-35.9178.4-75.6-24.8000113.5E381 K390 V392 L397 C398E381-N394 PolarHBondContact OE1-ND2 3.23Å; K390-N394 WeakPolarHBondContact O-CB 3.29Å; K390-N394 PolarHBondContact O-N 3.17Å; K390-N394 PolarHBondContact O-ND2 3.33Å; V392-N394 PolarHBondContact O-N 3.17Å; N394-L397 PolarHBondContact O-N 2.8Å; N394-C398 PolarHBondContact O-N 3.4Å
395M51.9Low53.3Low121 Ų12178.1 Ų78.160%0.59642%0.423SS*.Hα-helixtrans-66.8-42.2176.3-167.7172-163.200111.1K391 V392 L397 C398 N399K391-M395 VanDerWaalsContact O-CB 3.22Å; K391-M395 WeakPolarHBondContact O-CB 3.47Å; K391-M395 PolarHBondContact O-N 2.89Å; V392-M395 PolarHBondContact O-N 3.41Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 3.4Å; M395-C398 PolarHBondContact O-N 3.19Å; M395-N399 WeakPolarHBondContact O-CB 3.35Å; M395-N399 VanDerWaalsContact O-CG 3.24Å; M395-N399 PolarHBondContact O-N 2.97Å; M395-N399 PolarHBondContact O-ND2 3.07Å
396N53.1Low51.6Low50 Ų5080.8 Ų80.827%0.26744%0.44SS..Hα-helixtrans-63.5-35.9175.2-71-8.6000111.6E150 V392 H400E150-N396 VanDerWaalsContact CD-ND2 3.32Å; E150-N396 PolarHBondContact OE1-ND2 2.93Å; E150-N396 PolarHBondContact OE2-ND2 2.85Å; V392-N396 WeakPolarHBondContact O-CB 3.34Å; V392-N396 VanDerWaalsContact O-CG 3.3Å; V392-N396 PolarHBondContact O-N 2.85Å; N396-H400 PolarHBondContact O-N 3.17Å
397L53.7Low50.3Low52 Ų5281.3 Ų81.327%0.27245%0.446SS..Hα-helixtrans-69.9-39.8176.1-146.275.9000113.2I288 D393 N394 M395 K401I288-L397 HydrophobicContact CB-CD1 4.39Å; I288-L397 HydrophobicContact CD1-CD1 3.64Å; I288-L397 HydrophobicContact CD1-CD2 3.73Å; I288-L397 HydrophobicContact CD1-CG 4.07Å; I288-L397 HydrophobicContact CG2-CD1 4.05Å; D393-L397 PolarHBondContact O-N 3.12Å; D393-L397 VanDerWaalsContact O-N 3.11Å; N394-L397 PolarHBondContact O-N 2.8Å; M395-L397 VanDerWaalsContact C-N 3.28Å; M395-L397 PolarHBondContact O-N 3.4Å; L397-K401 PolarHBondContact O-N 2.97Å
398C36.2Very low48.9Very low80 Ų8084.5 Ų84.554%0.54145%0.452SS..Hα-helixtrans-67.9-47.1175.9-89.10000112N394 M395 H400 K401 T402N394-C398 PolarHBondContact O-N 3.4Å; M395-C398 PolarHBondContact O-N 3.19Å; C398-H400 PolarHBondContact O-N 3.45Å; C398-K401 WeakPolarHBondContact O-CB 3.33Å; C398-K401 PolarHBondContact O-N 3.06Å; C398-T402 PolarHBondContact O-N 3.27Å; C398-T402 VanDerWaalsContact O-N 3.08Å; C398-T402 PolarHBondContact O-OG1 3.1Å; C398-T402 VanDerWaalsContact O-OG1 3.12Å
399N39.5Very low48Very low83 Ų8385 Ų8544%0.44445%0.452SS..Hα-helixtrans-57.5-38.6-180-71.3-13.6000111.4M395 K401 T402 T403M395-N399 WeakPolarHBondContact O-CB 3.35Å; M395-N399 VanDerWaalsContact O-CG 3.24Å; M395-N399 PolarHBondContact O-N 2.97Å; M395-N399 PolarHBondContact O-ND2 3.07Å; N399-K401 PolarHBondContact O-N 2.93Å; N399-T402 PolarHBondContact O-N 3.46Å; N399-T403 PolarHBondContact O-N 3.46Å; N399-T403 PolarHBondContact O-OG1 3.42Å
400H47.4Very low47.2Very low87 Ų8787.1 Ų87.140%0.40346%0.463SS..Hα-helixtrans-71.2-28.5179.7-143.3-53.3000113.7N396 C398 S404N396-H400 PolarHBondContact O-N 3.17Å; C398-H400 PolarHBondContact O-N 3.45Å; H400-S404 WeakPolarHBondContact O-CB 3.35Å; H400-S404 PolarHBondContact O-N 3.43Å; H400-S404 PolarHBondContact O-OG 3.41Å
401K44.2Very low46.4Very low136 Ų13691.7 Ų91.759%0.59149%0.489SS*.Hα-helixtrans-68.1-48.4170.4-85.6-175.2175-177.40110.8L397 C398 N399 T403 S404 E405L397-K401 PolarHBondContact O-N 2.97Å; C398-K401 WeakPolarHBondContact O-CB 3.33Å; C398-K401 PolarHBondContact O-N 3.06Å; N399-K401 PolarHBondContact O-N 2.93Å; K401-T403 PolarHBondContact O-N 3.34Å; K401-S404 PolarHBondContact O-N 2.99Å; K401-E405 PolarHBondContact O-N 3.09Å
402T40Very low45.8Very low80 Ų8092.3 Ų92.349%0.49149%0.494SS..Hα-helixtrans-63.5-41.8-177.9-41.70000111.6C398 N399 S404 E405 T406C398-T402 PolarHBondContact O-N 3.27Å; C398-T402 VanDerWaalsContact O-N 3.08Å; C398-T402 PolarHBondContact O-OG1 3.1Å; C398-T402 VanDerWaalsContact O-OG1 3.12Å; N399-T402 PolarHBondContact O-N 3.46Å; T402-S404 VanDerWaalsContact C-N 3.35Å; T402-S404 PolarHBondContact O-N 3.44Å; T402-E405 PolarHBondContact O-N 3.24Å; T402-T406 WeakPolarHBondContact O-CB 3.35Å; T402-T406 PolarHBondContact O-N 3.01Å; T402-T406 PolarHBondContact O-OG1 2.78Å
403T40.6Very low45.1Very low86 Ų8695.3 Ų95.353%0.52851%0.508SS..Hα-helixtrans-64.6-37.9176.3-49.40000112.3N399 K401 V407N399-T403 PolarHBondContact O-N 3.46Å; N399-T403 PolarHBondContact O-OG1 3.42Å; K401-T403 PolarHBondContact O-N 3.34Å; T403-V407 VanDerWaalsContact O-CG2 3.25Å; T403-V407 WeakPolarHBondContact O-CG2 3.34Å; T403-V407 PolarHBondContact O-N 2.84Å; T403-V407 VanDerWaalsContact O-N 3.13Å
404S40.1Very low44Very low52 Ų52101 Ų10136%0.36453%0.533SS..Hα-helixtrans-70.8-36.9179.1-54.70000112.2H400 K401 T402 L408H400-S404 WeakPolarHBondContact O-CB 3.35Å; H400-S404 PolarHBondContact O-N 3.43Å; H400-S404 PolarHBondContact O-OG 3.41Å; K401-S404 PolarHBondContact O-N 2.99Å; T402-S404 VanDerWaalsContact C-N 3.35Å; T402-S404 PolarHBondContact O-N 3.44Å; S404-L408 PolarHBondContact O-N 3.17Å
405E42Very low42.8Very low128 Ų128105.7 Ų105.760%0.59856%0.556SS**Hα-helixtrans-73-36.3176.1-73.6175174.600112.2K401 T402 L408 N409K401-E405 PolarHBondContact O-N 3.09Å; T402-E405 PolarHBondContact O-N 3.24Å; E405-L408 PolarHBondContact O-N 3.31Å; E405-N409 WeakPolarHBondContact O-CB 3.49Å; E405-N409 PolarHBondContact O-N 3.07Å
406T40.1Very low42Very low69 Ų69104.8 Ų104.842%0.42356%0.558SS.*Hα-helixtrans-70.3-36.5178.8-43.80000111.8T402 N410T402-T406 WeakPolarHBondContact O-CB 3.35Å; T402-T406 PolarHBondContact O-N 3.01Å; T402-T406 PolarHBondContact O-OG1 2.78Å; T406-N410 WeakPolarHBondContact O-CB 3.41Å; T406-N410 PolarHBondContact O-N 2.86Å
407V43.5Very low41Very low81 Ų81108.5 Ų108.549%0.49158%0.582SS.*Hα-helixtrans-71.2-34.8175.7174.70000111.7T403 N411T403-V407 VanDerWaalsContact O-CG2 3.25Å; T403-V407 WeakPolarHBondContact O-CG2 3.34Å; T403-V407 PolarHBondContact O-N 2.84Å; T403-V407 VanDerWaalsContact O-N 3.13Å; V407-N411 WeakPolarHBondContact O-CB 3.31Å; V407-N411 VanDerWaalsContact O-CG 3.24Å; V407-N411 PolarHBondContact O-N 3.26Å; V407-N411 PolarHBondContact O-ND2 2.88Å
408L38Very low39.8Very low134 Ų134111.8 Ų111.870%0.70261%0.605SS**Hα-helixtrans-71.7-38.4175.6-111135.1000112.8S404 E405S404-L408 PolarHBondContact O-N 3.17Å; E405-L408 PolarHBondContact O-N 3.31Å
409N40.6Very low39.6Very low116 Ų116115.8 Ų115.862%0.6262%0.621SS**Hα-helixtrans-74.9-33.3177.6-90.3-5000113.4E405E405-N409 WeakPolarHBondContact O-CB 3.49Å; E405-N409 PolarHBondContact O-N 3.07Å
410N44.6Very low39.1Very low108 Ų108118.3 Ų118.358%0.57864%0.64SS**Hα-helixtrans-75.8-26.2178.3-75.6-10.5000113.1T406 H412T406-N410 WeakPolarHBondContact O-CB 3.41Å; T406-N410 PolarHBondContact O-N 2.86Å; N410-H412 VanDerWaalsContact C-N 3.3Å; N410-H412 PolarHBondContact O-N 3.15Å
411N42.9Very low38.3Very low130 Ų130119.2 Ų119.270%0.69566%0.662SS**THydrogen-bonded Turntrans-77.4-10.1178-76.1-13.1000114.3V407V407-N411 WeakPolarHBondContact O-CB 3.31Å; V407-N411 VanDerWaalsContact O-CG 3.24Å; V407-N411 PolarHBondContact O-N 3.26Å; V407-N411 PolarHBondContact O-ND2 2.88Å
412H43.8Very low37.6Very low172 Ų172117.3 Ų117.380%0.79667%0.666SS**THydrogen-bonded Turntrans-93.3-12.8175.7-128.952.4000113.9N410N410-H412 VanDerWaalsContact C-N 3.3Å; N410-H412 PolarHBondContact O-N 3.15Å
413N44.4Very low37.1Very low130 Ų130121 Ų12170%0.69568%0.682SS**THydrogen-bonded Turntrans-123.10.9-168.1-74.7-15.2000116.5
414H38.4Very low36.9Very low157 Ų157122.5 Ų122.573%0.72769%0.687SS**  trans-152.792.7176.5-109.5-83.5000113.8
415I34.5Very low37Very low167 Ų167125.3 Ų125.386%0.85670%0.702SS**  trans-84.2104.8146.1-63.6172.1000104.9
416T33.9Very low37.1Very low103 Ų103125.9 Ų125.963%0.63271%0.709SS**  trans161.5137.3146.2-65.50000109.8
417T32Very low37.1Very low127 Ų127126.9 Ų126.978%0.77972%0.715SS**  trans80.7107.3166.733.50000120.2
418T28.8Very low37Very low122 Ų122125.9 Ų125.975%0.74871%0.712SS**  trans-51.1135.7157.945.80000113
419N32.3Very low37.4Very low163 Ų163124.4 Ų124.487%0.87270%0.7SS**  trans-168.8146.4134.6-91-22.6000111.5
420T28.9Very low37.8Very low137 Ų137123 Ų12384%0.8469%0.692SS**  trans-55.4134.6-176.649.10000115.7
421A30.7Very low38.1Very low105 Ų105121.5 Ų121.587%0.86869%0.687SS**  trans-163.4145.7149.100000111
422S30.5Very low38.6Very low97 Ų97122 Ų12268%0.67868%0.682SS**  trans-69.9134-159.958.70000117.2
423D29.5Very low39Very low156 Ų156117.4 Ų117.483%0.83466%0.661SS**  trans-87.8100161.4-122.1-11.8000108.9
424N34.9Very low39.5Very low118 Ų118115.2 Ų115.263%0.63165%0.649SS**  trans-135.110.4-173.1-103.5-13.6000114.9
425T41.9Very low40.2Very low111 Ų111113.6 Ų113.668%0.68164%0.639SS**SBendtrans-101.3-34.5-17119.70000115.2S428T425-S428 PolarHBondContact O-OG 2.87Å
426D44.7Very low41.1Very low140 Ų140113.4 Ų113.475%0.74963%0.628SS**Hα-helixtrans-84.2-26.6-175.9-82-23.4000114.8S428D426-S428 VanDerWaalsContact C-N 3.28Å; D426-S428 PolarHBondContact O-N 2.95Å
427T40.7Very low42.1Very low90 Ų90113.1 Ų113.155%0.55262%0.622SS**Hα-helixtrans-69.2-27.217544.30000112.1F429 V431T427-F429 PolarHBondContact O-N 3.46Å; T427-V431 WeakPolarHBondContact O-CB 3.23Å; T427-V431 WeakPolarHBondContact O-CG2 3.34Å; T427-V431 PolarHBondContact O-N 3.47Å
428S40.2Very low43.1Very low60 Ų60112.1 Ų112.142%0.4261%0.608SS.*Hα-helixtrans-68.5-32.9-176.379.50000114T425 D426 K432T425-S428 PolarHBondContact O-OG 2.87Å; D426-S428 VanDerWaalsContact C-N 3.28Å; D426-S428 PolarHBondContact O-N 2.95Å; S428-K432 WeakPolarHBondContact O-CG 3.33Å; S428-K432 PolarHBondContact O-N 3.48Å; S428-K432 VanDerWaalsContact O-N 3.09Å
429F47.1Very low43.9Very low104 Ų104110.9 Ų110.946%0.45660%0.597SS.*Hα-helixtrans-79.2-41.9-179.2-171.7-99.1000111.9T427 V431 K432 Q433T427-F429 PolarHBondContact O-N 3.46Å; F429-V431 VanDerWaalsContact C-N 3.33Å; F429-V431 PolarHBondContact O-N 3.31Å; F429-K432 WeakPolarHBondContact O-CB 3.22Å; F429-K432 PolarHBondContact O-N 2.93Å; F429-K432 VanDerWaalsContact O-N 3.12Å; F429-Q433 HydrophobicContact CE1-CG 4.13Å; F429-Q433 HydrophobicContact CZ-CG 4.47Å; F429-Q433 PolarHBondContact O-N 2.95Å
430I50.1Low44.7Very low87 Ų87109.2 Ų109.245%0.44659%0.588SS.*Hα-helixtrans-62.5-42.8174.1-62.7-175.6000110.1K432 Q433 I434I430-K432 VanDerWaalsContact C-N 3.31Å; I430-K432 PolarHBondContact O-N 3.49Å; I430-Q433 PolarHBondContact O-N 3.42Å; I430-I434 HydrophobicContact CG2-CD1 3.71Å; I430-I434 HydrophobicContact CG2-CG1 4.36Å; I430-I434 WeakPolarHBondContact O-CB 3.16Å; I430-I434 VanDerWaalsContact O-CG1 3.31Å; I430-I434 WeakPolarHBondContact O-CG1 3.47Å; I430-I434 PolarHBondContact O-N 2.81Å
431V50.4Low45.5Very low76 Ų76107.5 Ų107.546%0.46157%0.574SS.*Hα-helixtrans-62.6-36.1173.6170.70000111.7T427 F429 K435T427-V431 WeakPolarHBondContact O-CB 3.23Å; T427-V431 WeakPolarHBondContact O-CG2 3.34Å; T427-V431 PolarHBondContact O-N 3.47Å; F429-V431 VanDerWaalsContact C-N 3.33Å; F429-V431 PolarHBondContact O-N 3.31Å; V431-K435 HydrophobicContact CG1-CD 4.29Å; V431-K435 PolarHBondContact O-N 2.79Å; V431-K435 WeakPolarHBondContact O-CG 3.14Å; V431-K435 WeakPolarHBondContact O-CB 3.33Å; V431-K435 VanDerWaalsContact O-CB 3.24Å
432K52.7Low46.2Very low139 Ų139107.6 Ų107.660%0.60456%0.56SS**Hα-helixtrans-68.4-40.3175.6-85.8177.8179.1174.90113.2S428 F429 I430 R436S428-K432 WeakPolarHBondContact O-CG 3.33Å; S428-K432 PolarHBondContact O-N 3.48Å; S428-K432 VanDerWaalsContact O-N 3.09Å; F429-K432 WeakPolarHBondContact O-CB 3.22Å; F429-K432 PolarHBondContact O-N 2.93Å; F429-K432 VanDerWaalsContact O-N 3.12Å; I430-K432 VanDerWaalsContact C-N 3.31Å; I430-K432 PolarHBondContact O-N 3.49Å; K432-R436 WeakPolarHBondContact O-CB 3.3Å; K432-R436 PolarHBondContact O-N 3.38Å
433Q52Low46.7Very low76 Ų76109.3 Ų109.336%0.35556%0.561SS.*Hα-helixtrans-69.1-44176.2-81.8-87.6-13.200111.4F429 I430 R436 I437F429-Q433 HydrophobicContact CE1-CG 4.13Å; F429-Q433 HydrophobicContact CZ-CG 4.47Å; F429-Q433 PolarHBondContact O-N 2.95Å; I430-Q433 PolarHBondContact O-N 3.42Å; Q433-R436 PolarHBondContact O-N 2.6Å; Q433-R436 VanDerWaalsContact O-N 3.17Å; Q433-I437 WeakPolarHBondContact O-CG1 3.45Å; Q433-I437 PolarHBondContact O-N 3.3Å; Q433-I437 VanDerWaalsContact O-N 3.09Å
434I55.1Low47.2Very low84 Ų84109.5 Ų109.543%0.43156%0.562SS.*Hα-helixtrans-63-45.5175.2-67.1173.2000110.8I430 R436 I437 E438I430-I434 HydrophobicContact CG2-CD1 3.71Å; I430-I434 HydrophobicContact CG2-CG1 4.36Å; I430-I434 WeakPolarHBondContact O-CB 3.16Å; I430-I434 VanDerWaalsContact O-CG1 3.31Å; I430-I434 WeakPolarHBondContact O-CG1 3.47Å; I430-I434 PolarHBondContact O-N 2.81Å; I434-R436 VanDerWaalsContact C-N 3.25Å; I434-R436 PolarHBondContact O-N 2.78Å; I434-I437 CarbonylContact O-C 3.53Å; I434-I437 PolarHBondContact O-N 3.48Å; I434-I437 VanDerWaalsContact O-N 3.08Å; I434-E438 HydrophobicContact CG2-CG 4.42Å; I434-E438 PolarHBondContact O-N 2.8Å
435K53.5Low47.3Very low123 Ų123108 Ų10854%0.53556%0.561SS.*Hα-helixtrans-61.1-31.6174-86.4-174.6174.4-178.70113.2V431 I437 E438 N439V431-K435 HydrophobicContact CG1-CD 4.29Å; V431-K435 PolarHBondContact O-N 2.79Å; V431-K435 WeakPolarHBondContact O-CG 3.14Å; V431-K435 WeakPolarHBondContact O-CB 3.33Å; V431-K435 VanDerWaalsContact O-CB 3.24Å; K435-I437 VanDerWaalsContact C-N 3.34Å; K435-E438 PolarHBondContact O-N 3.48Å; K435-N439 VanDerWaalsContact O-CB 3.24Å; K435-N439 WeakPolarHBondContact O-CB 3.47Å; K435-N439 PolarHBondContact O-N 2.73Å
436R54.2Low47Very low164 Ų164111 Ų11162%0.61957%0.567SS**Hα-helixtrans-71-33.1176.3-155.3-178.6-73.1176.8-4.6111.4K432 Q433 I434 N440K432-R436 WeakPolarHBondContact O-CB 3.3Å; K432-R436 PolarHBondContact O-N 3.38Å; Q433-R436 PolarHBondContact O-N 2.6Å; Q433-R436 VanDerWaalsContact O-N 3.17Å; I434-R436 VanDerWaalsContact C-N 3.25Å; I434-R436 PolarHBondContact O-N 2.78Å; R436-N440 WeakPolarHBondContact O-CB 3.33Å; R436-N440 PolarHBondContact O-N 2.61Å
437I53.5Low46.5Very low97 Ų97109.6 Ų109.650%0.49756%0.563SS.*Hα-helixtrans-75.5-35.2174-64.5167.8000111.5Q433 I434 K435 N441Q433-I437 WeakPolarHBondContact O-CG1 3.45Å; Q433-I437 PolarHBondContact O-N 3.3Å; Q433-I437 VanDerWaalsContact O-N 3.09Å; I434-I437 CarbonylContact O-C 3.53Å; I434-I437 PolarHBondContact O-N 3.48Å; I434-I437 VanDerWaalsContact O-N 3.08Å; K435-I437 VanDerWaalsContact C-N 3.34Å; I437-N441 PolarHBondContact O-ND2 3Å
438E52.4Low46.2Very low105 Ų105112 Ų11249%0.49157%0.573SS.*Hα-helixtrans-75-43176.1-74.6178.1160.400112.6I434 K435 N440 N441 N442I434-E438 HydrophobicContact CG2-CG 4.42Å; I434-E438 PolarHBondContact O-N 2.8Å; K435-E438 PolarHBondContact O-N 3.48Å; E438-N440 VanDerWaalsContact C-N 3.28Å; E438-N440 PolarHBondContact O-N 3.48Å; E438-N441 PolarHBondContact O-N 2.8Å; E438-N442 PolarHBondContact O-N 3.19Å
439N46.8Very low46.1Very low96 Ų96118.2 Ų118.251%0.51359%0.592SS.*Hα-helixtrans-67.4-26.6178.2-81.6-1.1000113.1K435 N441 N443K435-N439 VanDerWaalsContact O-CB 3.24Å; K435-N439 WeakPolarHBondContact O-CB 3.47Å; K435-N439 PolarHBondContact O-N 2.73Å; N439-N441 VanDerWaalsContact C-N 3.28Å; N439-N443 PolarHBondContact O-ND2 2.99Å
440N48.7Very low45.6Very low129 Ų129117.8 Ų117.869%0.6960%0.6SS**THydrogen-bonded Turntrans-77.4-12.4172.4-80.5-2.1000113.3R436 E438R436-N440 WeakPolarHBondContact O-CB 3.33Å; R436-N440 PolarHBondContact O-N 2.61Å; E438-N440 VanDerWaalsContact C-N 3.28Å; E438-N440 PolarHBondContact O-N 3.48Å
441N46.6Very low44.9Very low100 Ų100120.8 Ų120.854%0.53562%0.616SS.*THydrogen-bonded Turntrans-104.1-15.4176.2-73.8-42.4000113.7I437 E438 N439I437-N441 PolarHBondContact O-ND2 3Å; E438-N441 PolarHBondContact O-N 2.8Å; N439-N441 VanDerWaalsContact C-N 3.28Å
442N45Very low44Very low107 Ų107122.3 Ų122.357%0.57263%0.625SS**SBendtrans-102.71-176.4-75.7-14.6000115E438 D444E438-N442 PolarHBondContact O-N 3.19Å; N442-D444 VanDerWaalsContact C-N 3.29Å; N442-D444 PolarHBondContact O-N 3.09Å
443N41Very low43.1Very low134 Ų134123.7 Ų123.772%0.71764%0.639SS**THydrogen-bonded Turntrans-86.212.3179.4-80.5-16.6000114.9N439N439-N443 PolarHBondContact O-ND2 2.99Å
444D39.6Very low42.1Very low160 Ų160123.4 Ų123.486%0.85666%0.657SS**THydrogen-bonded Turntrans-105.216.5176.3-79.8-26.5000114.5N442N442-D444 VanDerWaalsContact C-N 3.29Å; N442-D444 PolarHBondContact O-N 3.09Å
445S37.3Very low41.1Very low85 Ų85125.1 Ų125.159%0.59468%0.677SS**SBendtrans-145.8118.5176.963.50000115.3
446H35.1Very low39.9Very low176 Ų176125 Ų12582%0.81569%0.687SS**  trans70.899.1158.9-72.9-77000119
447T34.2Very low38.7Very low110 Ų110123.9 Ų123.968%0.67570%0.702SS**  64.112584.349.60000118.4
448N34.1Very low37.5Very low140 Ų140126.3 Ų126.375%0.74972%0.715SS**  trans96.596.9157.4-56.1-32.2000117.1
449K38.3Very low36.4Very low191 Ų191126.1 Ų126.183%0.8373%0.725SS**  75.7153.980.1-91-162.3173.9174.90114
450P37.8Very low35.8Very low94 Ų94128.1 Ų128.161%0.6174%0.74SS**  cis-150-171.9-35.640.6-20.5000115.3
451L33.9Very low34.8Very low151 Ų151131.2 Ų131.279%0.79175%0.748SS**  trans78.2145.1153.2-64.6160.8000119.1
452T32Very low34.2Very low107 Ų107132.2 Ų132.266%0.65676%0.761SS**  cis-176.4147.7-2222.10000106.1
453N34.4Very low33.9Very low168 Ų168138.4 Ų138.490%0.89879%0.794SS**  trans139.8118.2160.6-75.4-10000106.6
454G31.4Very low33.5Very low70 Ų70138.6 Ų138.672%0.72280%0.798SS**  cis124.8107.626.400000106.5
455S32.8Very low33.2Very low121 Ų121137.5 Ų137.585%0.84680%0.795SS**  trans158.296.5150.6-710000112.6
456T28.5Very low33Very low121 Ų121140.4 Ų140.474%0.74281%0.806SS**  trans9.1128.7135.9110000120.8
457C28.5Very low32.9Very low140 Ų140138.3 Ų138.395%0.94681%0.806SS**  -158.2132.2124.9-106.40000110.5
458I30.2Very low32.8Very low148 Ų148140.1 Ų140.176%0.75981%0.814SS**  trans-109.6156.4-169-73.8171.4000110.3
459S29.3Very low32.7Very low101 Ų101140.1 Ų140.171%0.70682%0.818SS**  trans82.1135.1162.1-110.90000115.9
460T33.2Very low32.3Very low137 Ų137136.4 Ų136.484%0.8482%0.818SS**  cis-161.7155.846.2-17.30000112
461K28.7Very low31.9Very low195 Ų195139.7 Ų139.785%0.84883%0.833SS**  trans-73.6173.7-179.5-92.4177.8170.2178.60116.2
462C32.3Very low31.7Very low121 Ų121138.8 Ų138.882%0.81884%0.837SS**  trans107.9125.9154.6-64.10000113.9
463N39.4Very low31.7Very low236 Ų236141.6 Ų141.6100%1.26285%0.853SS**  cis-120.2018.5-82.9-30.5000114

Retrieved 463 of 463 residues in 167.7 ms (Link to these results)

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