A0A5K4EW37_SCHMA Loading...

Solute carrier family 43 member 3 AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4EW37, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 471 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   AlphaSync Parameters   PDB   PAE   Table  
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
1M48Very low59.4Low190 Ų190116.2 Ų116.294%0.93654%0.542SS*.  0-62.70-111.9152.417200112.6R3 K4 E5M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 2.7Å; M1-K4 PolarHBondContact O-N 3.41Å; M1-E5 PolarHBondContact O-N 2.92Å
2Q53.6Low60.5Low130 Ų130112.5 Ų112.561%0.60754%0.538SS*.Hα-helixtrans-54.8-30.1-171.9-67.8-175.7-12.800117.2R6Q2-R6 WeakPolarHBondContact O-CB 3.47Å; Q2-R6 WeakPolarHBondContact O-CD 3.24Å; Q2-R6 WeakPolarHBondContact O-CG 3.49Å; Q2-R6 PolarHBondContact O-N 2.78Å; Q2-R6 PolarHBondContact O-NE 3.24Å; Q2-R6 VanDerWaalsContact O-NE 3.08Å
3R55.2Low61.5Low225 Ų225109.6 Ų109.685%0.84952%0.522SS*.Hα-helixtrans-72.8-36.9175.6-86.6-171.7-179.8-179.11.5112.9M1 A7M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 2.7Å; R3-A7 PolarHBondContact O-N 2.98Å
4K54.5Low62.8Low176 Ų176107.4 Ų107.477%0.76552%0.521SS*.Hα-helixtrans-71.2-43.5178.4-82.5-171.8174.6-1760110.9M1 R6 A7 Q8M1-K4 PolarHBondContact O-N 3.41Å; K4-R6 PolarHBondContact O-N 3.48Å; K4-A7 PolarHBondContact O-N 3.03Å; K4-Q8 WeakPolarHBondContact O-CG 3.29Å; K4-Q8 PolarHBondContact O-N 3.42Å
5E57.3Low63.7Low92 Ų92100.9 Ų100.943%0.4349%0.49SS..Hα-helixtrans-64-40177.2-68.4161.1174.300112.1M1 A7 Q8 L9M1-E5 PolarHBondContact O-N 2.92Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 3.42Å; E5-Q8 WeakPolarHBondContact O-CB 3.48Å; E5-Q8 PolarHBondContact O-N 2.98Å; E5-Q8 VanDerWaalsContact O-N 3.13Å; E5-L9 PolarHBondContact O-N 2.92Å
6R58.7Low64.6Low95 Ų9597.1 Ų97.136%0.35848%0.477SS..Hα-helixtrans-60.1-41.8174.2-77.7178.2-125.7-155.61.7112.1Q2 K4 Q8 D10Q2-R6 WeakPolarHBondContact O-CB 3.47Å; Q2-R6 WeakPolarHBondContact O-CD 3.24Å; Q2-R6 WeakPolarHBondContact O-CG 3.49Å; Q2-R6 PolarHBondContact O-N 2.78Å; Q2-R6 PolarHBondContact O-NE 3.24Å; Q2-R6 VanDerWaalsContact O-NE 3.08Å; K4-R6 PolarHBondContact O-N 3.48Å; R6-Q8 VanDerWaalsContact C-N 3.3Å; R6-Q8 PolarHBondContact O-N 2.81Å; R6-D10 PolarHBondContact O-N 3.29Å
7A60.6Low65.7Low47 Ų4796.2 Ų96.239%0.38847%0.474SS..Hα-helixtrans-68.1-28.9176.400000112.7R3 K4 E5 N11R3-A7 PolarHBondContact O-N 2.98Å; K4-A7 PolarHBondContact O-N 3.03Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 3.42Å; A7-N11 WeakPolarHBondContact O-CB 3.4Å; A7-N11 VanDerWaalsContact O-CG 3.3Å; A7-N11 PolarHBondContact O-N 3.35Å; A7-N11 PolarHBondContact O-ND2 3.42Å
8Q61.4Low66.9Low133 Ų13391.1 Ų91.162%0.62145%0.449SS*.Hα-helixtrans-67.8-46.7176.7-75.6176.6-29.400112K4 E5 R6 D10 N11 C12K4-Q8 WeakPolarHBondContact O-CG 3.29Å; K4-Q8 PolarHBondContact O-N 3.42Å; E5-Q8 WeakPolarHBondContact O-CB 3.48Å; E5-Q8 PolarHBondContact O-N 2.98Å; E5-Q8 VanDerWaalsContact O-N 3.13Å; R6-Q8 VanDerWaalsContact C-N 3.3Å; R6-Q8 PolarHBondContact O-N 2.81Å; Q8-D10 VanDerWaalsContact C-N 3.28Å; Q8-D10 PolarHBondContact O-N 3.35Å; Q8-N11 PolarHBondContact O-N 3.02Å; Q8-N11 VanDerWaalsContact O-N 3.1Å; Q8-C12 PolarHBondContact O-N 2.84Å; Q8-C12 PolarHBondContact O-SG 3.17Å; Q8-C12 VanDerWaalsContact O-SG 3.37Å
9L67.8Low68.1Low56 Ų5687.1 Ų87.129%0.29343%0.428SS..Hα-helixtrans-60.9-38.3176-76.5165.8000112.2E5 N11 M204E5-L9 PolarHBondContact O-N 2.92Å; L9-N11 PolarHBondContact O-N 3.42Å; L9-M204 HydrophobicContact CD1-CE 3.98Å; L9-M204 HydrophobicContact CD2-CE 4.35Å
10D68.6Low69.2Low23 Ų2387.2 Ų87.212%0.12343%0.427CS..Hα-helixtrans-70-16179-69.9-18000113R6 Q8 R18 R97R6-D10 PolarHBondContact O-N 3.29Å; Q8-D10 VanDerWaalsContact C-N 3.28Å; Q8-D10 PolarHBondContact O-N 3.35Å; D10-R18 PolarHBondContact O-NH1 3.49Å; D10-R97 IonicContact OD1-CZ 2.87Å; D10-R97 IonicContact OD1-NH1 2.66Å; D10-R97 IonicContact OD1-NH2 2.7Å; D10-R97 PolarHBondContact OD1-NH2 3.22Å
11N68.2Low70.3Confident111 Ų11185.5 Ų85.559%0.59442%0.422SS*.THydrogen-bonded Turntrans-111.711.5-177.6-66.8-30.9000113.4A7 Q8 L9 F13A7-N11 WeakPolarHBondContact O-CB 3.4Å; A7-N11 VanDerWaalsContact O-CG 3.3Å; A7-N11 PolarHBondContact O-N 3.35Å; A7-N11 PolarHBondContact O-ND2 3.42Å; Q8-N11 PolarHBondContact O-N 3.02Å; Q8-N11 VanDerWaalsContact O-N 3.1Å; L9-N11 PolarHBondContact O-N 3.42Å; N11-F13 VanDerWaalsContact C-N 3.26Å; N11-F13 PolarHBondContact O-N 3.37Å
12C72.2Confident72.4Confident72 Ų7276.5 Ų76.549%0.48638%0.378SS..SBendtrans-64.1-28.3-180-73.20000113.7Q8Q8-C12 PolarHBondContact O-N 2.84Å; Q8-C12 PolarHBondContact O-SG 3.17Å; Q8-C12 VanDerWaalsContact O-SG 3.37Å
13F73.6Confident74.4Confident75 Ų7571.5 Ų71.533%0.32936%0.355SS..SBendtrans-115.3139.9178.8-73.1-81.6000110.9N11 I17 R18 F205N11-F13 VanDerWaalsContact C-N 3.26Å; N11-F13 PolarHBondContact O-N 3.37Å; F13-I17 HydrophobicContact CD1-CG2 4.31Å; F13-R18 HydrophobicContact CB-CB 4.05Å; F13-F205 HydrophobicContact CD2-CB 4.47Å; F13-F205 HydrophobicContact CE2-CB 4.01Å; F13-F205 HydrophobicContact CE2-CD1 4.14Å; F13-F205 HydrophobicContact CE2-CG 4.29Å
14P79.3Confident76.3Confident79 Ų7965.6 Ų65.651%0.51334%0.339SS..  trans-51.9143.2166.9-2635.1000111.2S16 I17 R18P14-S16 VanDerWaalsContact C-N 3.32Å; P14-S16 PolarHBondContact O-N 3.34Å; P14-I17 HydrophobicContact CB-CB 4.49Å; P14-I17 HydrophobicContact CB-CD1 4.23Å; P14-I17 HydrophobicContact CB-CG1 4.29Å; P14-I17 HydrophobicContact CG-CD1 3.96Å; P14-I17 PolarHBondContact O-N 3.24Å; P14-I17 VanDerWaalsContact O-N 3.14Å; P14-R18 PolarHBondContact O-N 2.98Å
15S76.8Confident78.3Confident9 Ų958.8 Ų58.86%0.06331%0.311CS..Hα-helixtrans-56.5-43.5-171.373.20000112.6R18 R19S15-R18 PolarHBondContact O-N 3.13Å; S15-R19 VanDerWaalsContact O-CG 3.29Å; S15-R19 WeakPolarHBondContact O-CG 3.37Å; S15-R19 PolarHBondContact O-N 2.94Å
16S77.2Confident80.1Confident40 Ų4054.4 Ų54.428%0.2829%0.291SS..Hα-helixtrans-65.4-42.7178.6-175.90000112.7P14 R19 H20P14-S16 VanDerWaalsContact C-N 3.32Å; P14-S16 PolarHBondContact O-N 3.34Å; S16-R19 PolarHBondContact O-N 3.39Å; S16-H20 PolarHBondContact O-N 3.46Å; S16-H20 PolarHBondContact O-ND1 2.93Å
17I84.2Confident81.8Confident83 Ų8351.2 Ų51.243%0.42628%0.28SS..Hα-helixtrans-65.8-46.8178.1-61.8179.3000110F13 P14 R19 H20 V21F13-I17 HydrophobicContact CD1-CG2 4.31Å; P14-I17 HydrophobicContact CB-CB 4.49Å; P14-I17 HydrophobicContact CB-CD1 4.23Å; P14-I17 HydrophobicContact CB-CG1 4.29Å; P14-I17 HydrophobicContact CG-CD1 3.96Å; P14-I17 PolarHBondContact O-N 3.24Å; P14-I17 VanDerWaalsContact O-N 3.14Å; I17-R19 PolarHBondContact O-N 3.22Å; I17-H20 PolarHBondContact O-N 3.03Å; I17-V21 HydrophobicContact CG2-CG2 3.73Å; I17-V21 VanDerWaalsContact O-CB 3.24Å; I17-V21 WeakPolarHBondContact O-CB 3.44Å; I17-V21 VanDerWaalsContact O-CG2 3.29Å; I17-V21 WeakPolarHBondContact O-CG2 3.47Å; I17-V21 PolarHBondContact O-N 3.36Å
18R87.3Confident83.5Confident3 Ų352.4 Ų52.41%0.01128%0.28CS..Hα-helixtrans-55.3-38.8179.4-178178.4176.8161.71.1112.2D10 F13 P14 S15 G22 I206 T208 F217D10-R18 PolarHBondContact O-NH1 3.49Å; F13-R18 HydrophobicContact CB-CB 4.05Å; P14-R18 PolarHBondContact O-N 2.98Å; S15-R18 PolarHBondContact O-N 3.13Å; R18-G22 VanDerWaalsContact O-CA 3.26Å; R18-G22 WeakPolarHBondContact O-CA 3.46Å; R18-G22 PolarHBondContact O-N 2.76Å; R18-I206 VanDerWaalsContact CZ-O 3.25Å; R18-I206 PolarHBondContact NE-O 2.62Å; R18-I206 PolarHBondContact NH2-O 3.46Å; R18-T208 VanDerWaalsContact NH2-CG2 3.29Å; R18-F217 VanDerWaalsContact CZ-CZ 3.47Å
19R89.5Confident85.2Confident15 Ų1546.2 Ų46.26%0.05725%0.251CS..Hα-helixtrans-64.9-55.5-179.9-77.3177.356.2-165.7-16.6112.5S15 S16 I17 G22 L23 M149 F150 F217 E221S15-R19 VanDerWaalsContact O-CG 3.29Å; S15-R19 WeakPolarHBondContact O-CG 3.37Å; S15-R19 PolarHBondContact O-N 2.94Å; S16-R19 PolarHBondContact O-N 3.39Å; I17-R19 PolarHBondContact O-N 3.22Å; R19-G22 PolarHBondContact O-N 3.38Å; R19-L23 WeakPolarHBondContact O-CB 3.35Å; R19-L23 PolarHBondContact O-N 3.18Å; R19-M149 HydrophobicContact CB-SD 4.32Å; R19-M149 HydrophobicContact CG-CB 3.8Å; R19-M149 HydrophobicContact CG-CG 4.3Å; R19-M149 HydrophobicContact CG-SD 3.56Å; R19-M149 VanDerWaalsContact CG-SD 3.56Å; R19-M149 PolarHBondContact NE-O 2.98Å; R19-M149 PolarHBondContact NH2-O 3.2Å; R19-F150 HydrophobicContact CB-CE1 4.3Å; R19-F150 HydrophobicContact CB-CE2 4.16Å; R19-F150 HydrophobicContact CB-CZ 3.68Å; R19-F150 WeakPolarHBondContact O-CZ 3.38Å; R19-F217 WeakPolarHBondContact CD-O 3.47Å; R19-F217 HydrophobicContact CG-CB 4.14Å; R19-F217 PolarHBondContact NH1-O 2.93Å; R19-E221 IonicContact CZ-OE2 3.14Å; R19-E221 VanDerWaalsContact NH1-CD 3.28Å; R19-E221 IonicContact NH1-OE1 2.61Å; R19-E221 IonicContact NH1-OE2 2.81Å; R19-E221 PolarHBondContact NH1-OE2 3.32Å; R19-E221 IonicContact NH2-OE2 3.06Å; R19-E221 PolarHBondContact NH2-OE2 3.25Å
20H90.3Very high86.5Confident89 Ų8943.6 Ų43.641%0.41224%0.237SC..Hα-helixtrans-68.9-46.7-176.3-64.692.4000111.2S16 I17 G22 L23 I24S16-H20 PolarHBondContact O-N 3.46Å; S16-H20 PolarHBondContact O-ND1 2.93Å; I17-H20 PolarHBondContact O-N 3.03Å; H20-G22 VanDerWaalsContact C-N 3.34Å; H20-G22 PolarHBondContact O-N 3.09Å; H20-L23 PolarHBondContact O-N 3.1Å; H20-I24 VanDerWaalsContact O-CG1 3.31Å; H20-I24 WeakPolarHBondContact O-CG1 3.35Å; H20-I24 PolarHBondContact O-N 3.39Å
21V92.2Very high87.7Confident53 Ų5345.2 Ų45.232%0.32124%0.243SC..Hα-helixtrans-62.7-43.3175.7174.80000110.5I17 L23 I24 L25 I206I17-V21 HydrophobicContact CG2-CG2 3.73Å; I17-V21 VanDerWaalsContact O-CB 3.24Å; I17-V21 WeakPolarHBondContact O-CB 3.44Å; I17-V21 VanDerWaalsContact O-CG2 3.29Å; I17-V21 WeakPolarHBondContact O-CG2 3.47Å; I17-V21 PolarHBondContact O-N 3.36Å; V21-L23 PolarHBondContact O-N 2.78Å; V21-I24 PolarHBondContact O-N 3.49Å; V21-L25 HydrophobicContact CG1-CD1 3.54Å; V21-L25 HydrophobicContact CG1-CG 3.98Å; V21-L25 VanDerWaalsContact O-CB 3.32Å; V21-L25 WeakPolarHBondContact O-CB 3.46Å; V21-L25 VanDerWaalsContact O-CG 3.25Å; V21-L25 WeakPolarHBondContact O-CG 3.28Å; V21-L25 PolarHBondContact O-N 2.97Å; V21-I206 HydrophobicContact CG1-CD1 4.46Å
22G92.7Very high89Confident0 Ų044.5 Ų44.50%024%0.235CC..Hα-helixtrans-60.2-42.6177.800000112.9R18 R19 H20 G26 I146R18-G22 VanDerWaalsContact O-CA 3.26Å; R18-G22 WeakPolarHBondContact O-CA 3.46Å; R18-G22 PolarHBondContact O-N 2.76Å; R19-G22 PolarHBondContact O-N 3.38Å; H20-G22 VanDerWaalsContact C-N 3.34Å; H20-G22 PolarHBondContact O-N 3.09Å; G22-G26 PolarHBondContact O-N 2.91Å; G22-I146 WeakPolarHBondContact O-CD1 3.46Å
23L94.4Very high90Very high26 Ų2642.5 Ų42.514%0.13622%0.218CC..Hα-helixtrans-64.9-47.4175.9-178.162.8000112R19 H20 V21 G26 I27 I146 F150 C157 I161R19-L23 WeakPolarHBondContact O-CB 3.35Å; R19-L23 PolarHBondContact O-N 3.18Å; H20-L23 PolarHBondContact O-N 3.1Å; V21-L23 PolarHBondContact O-N 2.78Å; L23-G26 PolarHBondContact O-N 3.48Å; L23-I27 HydrophobicContact CD1-CD1 4.26Å; L23-I27 HydrophobicContact CG-CD1 4.15Å; L23-I27 WeakPolarHBondContact O-CG1 3.31Å; L23-I27 PolarHBondContact O-N 3.43Å; L23-I146 HydrophobicContact CB-CG2 4.23Å; L23-I146 HydrophobicContact CD1-CG2 4.34Å; L23-F150 HydrophobicContact CB-CE2 4.04Å; L23-F150 HydrophobicContact CB-CZ 4.28Å; L23-F150 HydrophobicContact CD2-CE2 4.17Å; L23-F150 HydrophobicContact CD2-CZ 4.2Å; L23-C157 HydrophobicContact CD1-CB 4.12Å; L23-I161 HydrophobicContact CD1-CD1 4.19Å; L23-I161 HydrophobicContact CD1-CG1 4.39Å
24I95.5Very high90.9Very high101 Ų10139 Ų3952%0.51820%0.203SC..Hα-helixtrans-61-49.3179.1-67.1165.9000110.4H20 V21 G26 I27 L28H20-I24 VanDerWaalsContact O-CG1 3.31Å; H20-I24 WeakPolarHBondContact O-CG1 3.35Å; H20-I24 PolarHBondContact O-N 3.39Å; V21-I24 PolarHBondContact O-N 3.49Å; I24-G26 VanDerWaalsContact C-N 3.34Å; I24-G26 PolarHBondContact O-N 3.46Å; I24-I27 PolarHBondContact O-N 3.13Å; I24-L28 HydrophobicContact CG2-CD1 4.07Å; I24-L28 WeakPolarHBondContact O-CG 3.22Å; I24-L28 PolarHBondContact O-N 2.9Å
25L95.6Very high91.3Very high33 Ų3335.2 Ų35.217%0.17318%0.178CC..Hα-helixtrans-65.6-36.9178.6-66.8178.8000111.7V21 I27 L28 D29 M198 F201 M202 I206V21-L25 HydrophobicContact CG1-CD1 3.54Å; V21-L25 HydrophobicContact CG1-CG 3.98Å; V21-L25 VanDerWaalsContact O-CB 3.32Å; V21-L25 WeakPolarHBondContact O-CB 3.46Å; V21-L25 VanDerWaalsContact O-CG 3.25Å; V21-L25 WeakPolarHBondContact O-CG 3.28Å; V21-L25 PolarHBondContact O-N 2.97Å; L25-I27 VanDerWaalsContact C-N 3.33Å; L25-I27 PolarHBondContact O-N 3.08Å; L25-L28 PolarHBondContact O-N 3.1Å; L25-D29 WeakPolarHBondContact O-CB 3.3Å; L25-D29 PolarHBondContact O-N 3.05Å; L25-M198 HydrophobicContact CB-CE 3.61Å; L25-M198 HydrophobicContact CD2-CE 3.66Å; L25-M198 HydrophobicContact CD2-SD 4.35Å; L25-M198 HydrophobicContact CG-CE 4.18Å; L25-M198 WeakPolarHBondContact O-CE 3.22Å; L25-F201 HydrophobicContact CD1-CD1 3.83Å; L25-F201 HydrophobicContact CD1-CE1 3.42Å; L25-F201 VanDerWaalsContact CD1-CE1 3.42Å; L25-M202 HydrophobicContact CB-CE 4.47Å; L25-M202 HydrophobicContact CB-SD 3.44Å; L25-M202 WeakPolarHBondContact CB-SD 3.48Å; L25-M202 HydrophobicContact CD1-SD 4.31Å; L25-I206 HydrophobicContact CD1-CD1 4.47Å; L25-I206 HydrophobicContact CD1-CG1 4.4Å
26G95.6Very high92Very high0 Ų034.9 Ų34.90%018%0.176CC..Hα-helixtrans-63.6-37.7174.700000113.1G22 L23 I24 L30 N143G22-G26 PolarHBondContact O-N 2.91Å; L23-G26 PolarHBondContact O-N 3.48Å; I24-G26 VanDerWaalsContact C-N 3.34Å; I24-G26 PolarHBondContact O-N 3.46Å; G26-L30 WeakPolarHBondContact O-CG 3.45Å; G26-L30 PolarHBondContact O-N 3.22Å; G26-L30 VanDerWaalsContact O-N 3.15Å; G26-N143 VanDerWaalsContact CA-OD1 3.23Å; G26-N143 WeakPolarHBondContact CA-OD1 3.21Å
27I95.6Very high92.6Very high27 Ų2733.1 Ų33.114%0.13816%0.163CC..Hα-helixtrans-64.6-48.4172.5-70.3165.9000110.2L23 I24 L25 L30 F31 L160 A164 F317L23-I27 HydrophobicContact CD1-CD1 4.26Å; L23-I27 HydrophobicContact CG-CD1 4.15Å; L23-I27 WeakPolarHBondContact O-CG1 3.31Å; L23-I27 PolarHBondContact O-N 3.43Å; I24-I27 PolarHBondContact O-N 3.13Å; L25-I27 VanDerWaalsContact C-N 3.33Å; L25-I27 PolarHBondContact O-N 3.08Å; I27-L30 PolarHBondContact O-N 3.24Å; I27-F31 WeakPolarHBondContact O-CB 3.47Å; I27-F31 PolarHBondContact O-N 2.81Å; I27-L160 HydrophobicContact CD1-CB 4.1Å; I27-L160 HydrophobicContact CD1-CD1 4.3Å; I27-L160 HydrophobicContact CG1-CB 4.44Å; I27-A164 HydrophobicContact CG2-CB 4.08Å; I27-F317 HydrophobicContact CG2-CE2 3.75Å; I27-F317 HydrophobicContact CG2-CZ 4.17Å
28L95.8Very high92.7Very high73 Ų7330.4 Ų30.438%0.38215%0.148SC..Hα-helixtrans-64.4-41.4179.6-66.9172.6000112.5I24 L25 L30 F31 F32 M198I24-L28 HydrophobicContact CG2-CD1 4.07Å; I24-L28 WeakPolarHBondContact O-CG 3.22Å; I24-L28 PolarHBondContact O-N 2.9Å; L25-L28 PolarHBondContact O-N 3.1Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 3.06Å; L28-F31 PolarHBondContact O-N 3.21Å; L28-F32 HydrophobicContact CD2-CD2 4.48Å; L28-F32 HydrophobicContact CD2-CE2 3.98Å; L28-F32 WeakPolarHBondContact O-CD2 3.49Å; L28-F32 PolarHBondContact O-N 2.89Å; L28-M198 HydrophobicContact CB-CE 4.03Å
29D96.1Very high92.5Very high3 Ų330.7 Ų30.72%0.01615%0.151CC..Hα-helixtrans-57.1-47.8176.4178.354.7000110.6L25 F33 K100 S139 N143 M198L25-D29 WeakPolarHBondContact O-CB 3.3Å; L25-D29 PolarHBondContact O-N 3.05Å; D29-F33 CarbonylContact O-C 3.55Å; D29-F33 WeakPolarHBondContact O-CA 3.43Å; D29-F33 VanDerWaalsContact O-CB 3.24Å; D29-F33 WeakPolarHBondContact O-CB 3.31Å; D29-F33 PolarHBondContact O-N 2.87Å; D29-K100 IonicContact OD1-NZ 3.45Å; D29-K100 PolarHBondContact OD1-NZ 3.07Å; D29-K100 IonicContact OD2-NZ 3.89Å; D29-K100 PolarHBondContact OD2-NZ 3.06Å; D29-S139 PolarHBondContact OD2-OG 3.34Å; D29-N143 PolarHBondContact OD2-ND2 3.22Å; D29-M198 HydrophobicContact CB-CE 3.96Å; D29-M198 HydrophobicContact CB-CG 3.99Å
30L95.7Very high92.3Very high0 Ų030.7 Ų30.70%015%0.151CC..Hα-helixtrans-77.7-31.1178.6-65.3179000113.7G26 I27 L28 G34 L140 N143 I161 A164 F165 S168G26-L30 WeakPolarHBondContact O-CG 3.45Å; G26-L30 PolarHBondContact O-N 3.22Å; G26-L30 VanDerWaalsContact O-N 3.15Å; I27-L30 PolarHBondContact O-N 3.24Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 3.06Å; L30-G34 WeakPolarHBondContact O-CA 3.32Å; L30-G34 PolarHBondContact O-N 2.89Å; L30-L140 HydrophobicContact CD1-CD1 3.65Å; L30-L140 HydrophobicContact CD2-CB 4.48Å; L30-N143 HydrophobicContact CD1-CB 3.74Å; L30-N143 HydrophobicContact CG-CB 4.23Å; L30-I161 HydrophobicContact CD1-CB 4.25Å; L30-I161 HydrophobicContact CD1-CG2 3.32Å; L30-I161 WeakPolarHBondContact CD1-O 3.46Å; L30-A164 HydrophobicContact CB-CB 4.16Å; L30-F165 HydrophobicContact CB-CB 4.32Å; L30-F165 HydrophobicContact CD1-CB 4.45Å; L30-F165 HydrophobicContact CD2-CD2 4.26Å; L30-S168 VanDerWaalsContact O-CB 3.3Å; L30-S168 WeakPolarHBondContact O-CB 3.36Å
31F94.6Very high91.8Very high57 Ų5730.9 Ų30.925%0.2516%0.155CC..Hα-helixtrans-67-44.3178.2-170.5-88.5000111.4I27 L28 A164 S168 V170I27-F31 WeakPolarHBondContact O-CB 3.47Å; I27-F31 PolarHBondContact O-N 2.81Å; L28-F31 PolarHBondContact O-N 3.21Å; F31-A164 HydrophobicContact CB-CB 4.22Å; F31-S168 WeakPolarHBondContact O-CA 3.18Å; F31-S168 WeakPolarHBondContact O-CB 2.93Å; F31-V170 HydrophobicContact CE1-CG1 4.01Å; F31-V170 HydrophobicContact CZ-CG1 4.02Å
32F94.1Very high91.4Very high97 Ų9729.5 Ų29.543%0.42515%0.148SC..Hα-helixtrans-91.2-32.8-179.5-69.7-67.2000113.7L28L28-F32 HydrophobicContact CD2-CD2 4.48Å; L28-F32 HydrophobicContact CD2-CE2 3.98Å; L28-F32 WeakPolarHBondContact O-CD2 3.49Å; L28-F32 PolarHBondContact O-N 2.89Å
33F94.5Very high91.1Very high30 Ų3029.8 Ų29.813%0.13215%0.15CC..Hα-helixtrans-123.528-173-43.9-63.6000113D29 Y107 L191 S195 M198D29-F33 CarbonylContact O-C 3.55Å; D29-F33 WeakPolarHBondContact O-CA 3.43Å; D29-F33 VanDerWaalsContact O-CB 3.24Å; D29-F33 WeakPolarHBondContact O-CB 3.31Å; D29-F33 PolarHBondContact O-N 2.87Å; F33-Y107 WeakPolarHBondContact CA-OH 3.27Å; F33-Y107 HydrophobicContact CB-CE1 4.03Å; F33-Y107 WeakPolarHBondContact O-CE2 3.25Å; F33-Y107 VanDerWaalsContact O-CZ 3.25Å; F33-Y107 PolarHBondContact O-OH 2.89Å; F33-L191 HydrophobicContact CD1-CD2 4.29Å; F33-L191 HydrophobicContact CE1-CD2 4.03Å; F33-S195 VanDerWaalsContact CE1-N 3.35Å; F33-M198 HydrophobicContact CD2-CB 4.01Å; F33-M198 HydrophobicContact CD2-CG 4.17Å; F33-M198 HydrophobicContact CE2-CB 3.71Å; F33-M198 HydrophobicContact CE2-CG 4.05Å
34G91Very high90.7Very high0 Ų030.3 Ų30.30%015%0.152CC..SBendtrans-89.6-142.5175.600000114L30 Y36 Y107 S168L30-G34 WeakPolarHBondContact O-CA 3.32Å; L30-G34 PolarHBondContact O-N 2.89Å; G34-Y36 PolarHBondContact O-N 3.16Å; G34-Y107 PolarHBondContact O-OH 3.41Å; G34-S168 VanDerWaalsContact C-OG 3.29Å
35G89.7Confident90.2Very high0 Ų028 Ų280%015%0.153CC..SBendtrans-75.948.5-175.900000115.7H37 Y38 F165 S168G35-H37 PolarHBondContact O-N 3.28Å; G35-H37 VanDerWaalsContact O-N 3.07Å; G35-Y38 WeakPolarHBondContact O-CB 3.24Å; G35-Y38 WeakPolarHBondContact O-CD2 3.28Å; G35-Y38 PolarHBondContact O-N 3.17Å; G35-F165 VanDerWaalsContact N-CE2 3.34Å; G35-S168 WeakPolarHBondContact CA-OG 3.4Å; G35-S168 PolarHBondContact N-OG 3.34Å
36Y91.5Very high89.9Confident3 Ų327 Ų271%0.01215%0.148CC..G310 helixtrans-59.4-23.818074.2-100.1000113.3G34 Y38 G39 Y107 T111 F114 V132 S168 F188G34-Y36 PolarHBondContact O-N 3.16Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y36-G39 WeakPolarHBondContact O-CA 3.36Å; Y36-G39 PolarHBondContact O-N 2.77Å; Y36-Y107 AromaticContact CD1-CZ 3.98Å; Y36-Y107 WeakPolarHBondContact CD1-OH 3.27Å; Y36-Y107 HydrophobicContact CE1-CE1 4.26Å; Y36-Y107 HydrophobicContact CE1-CE2 4.24Å; Y36-Y107 AromaticContact CE1-CZ 3.63Å; Y36-Y107 WeakPolarHBondContact CE1-OH 3.43Å; Y36-T111 PolarHBondContact OH-OG1 3.41Å; Y36-F114 HydrophobicContact CE2-CD2 4.48Å; Y36-F114 HydrophobicContact CE2-CE2 4.47Å; Y36-F114 WeakPolarHBondContact OH-CD2 3.34Å; Y36-V132 HydrophobicContact CD1-CG1 4.37Å; Y36-V132 HydrophobicContact CE1-CG1 3.65Å; Y36-V132 HydrophobicContact CE2-CG1 4.39Å; Y36-V132 WeakPolarHBondContact OH-CG2 3.36Å; Y36-S168 WeakPolarHBondContact CB-O 3.11Å; Y36-S168 PolarHBondContact N-OG 2.61Å; Y36-S168 VanDerWaalsContact N-OG 3.09Å; Y36-F188 AromaticContact CE2-CE1 3.85Å; Y36-F188 HydrophobicContact CE2-CE1 3.85Å
37H89.6Confident89.7Confident2 Ų227.2 Ų27.21%0.00915%0.149CC..G310 helixtrans-59.7-23.1174.464.5-81.2000112.8G35 G39 F40 W76 V132 S136G35-H37 PolarHBondContact O-N 3.28Å; G35-H37 VanDerWaalsContact O-N 3.07Å; H37-G39 PolarHBondContact O-N 3.25Å; H37-F40 WeakPolarHBondContact O-CB 3.12Å; H37-F40 VanDerWaalsContact O-CD1 3.26Å; H37-F40 WeakPolarHBondContact O-CD1 3.35Å; H37-F40 PolarHBondContact O-N 2.85Å; H37-W76 HydrophobicContact CB-CE3 4.46Å; H37-V132 HydrophobicContact CB-CG1 4.34Å; H37-S136 PolarHBondContact CE1-OG 3Å
38Y84.9Confident89.4Confident27 Ų2728.1 Ų28.111%0.10615%0.152CC..G310 helixtrans-66.5-21.4169.4-74.9-72.4000112.9G35 Y36 F73 F77 Q80 F165G35-Y38 WeakPolarHBondContact O-CB 3.24Å; G35-Y38 WeakPolarHBondContact O-CD2 3.28Å; G35-Y38 PolarHBondContact O-N 3.17Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y38-F73 HydrophobicContact CD1-CE2 4.02Å; Y38-F73 AromaticContact CD1-CZ 3.82Å; Y38-F73 HydrophobicContact CD1-CZ 3.82Å; Y38-F73 HydrophobicContact CE1-CE2 4.45Å; Y38-F73 HydrophobicContact CE1-CZ 4.03Å; Y38-F77 HydrophobicContact CE1-CD2 4.07Å; Y38-F77 HydrophobicContact CE1-CE2 4.18Å; Y38-F77 WeakPolarHBondContact OH-CE2 3.23Å; Y38-Q80 PolarHBondContact OH-OE1 3.14Å; Y38-F165 HydrophobicContact CD2-CE1 4.24Å; Y38-F165 AromaticContact CE2-CE1 3.8Å; Y38-F165 HydrophobicContact CE2-CE1 3.8Å; Y38-F165 HydrophobicContact CE2-CZ 4.04Å
39G84.2Confident89Confident8 Ų828.5 Ų28.58%0.08216%0.161CC..G310 helixtrans-95.29.4175.400000113.6Y36 H37 N41 S42 A172Y36-G39 WeakPolarHBondContact O-CA 3.36Å; Y36-G39 PolarHBondContact O-N 2.77Å; H37-G39 PolarHBondContact O-N 3.25Å; G39-N41 PolarHBondContact O-N 3.46Å; G39-S42 PolarHBondContact O-N 2.93Å; G39-S42 VanDerWaalsContact O-N 3.14Å; G39-S42 PolarHBondContact O-OG 3.34Å; G39-A172 WeakPolarHBondContact O-CB 3.35Å
40F84.7Confident88.8Confident15 Ų1531.5 Ų31.57%0.06618%0.177CC..G310 helixtrans-59.2-20.8-173.487-76.7000114H37 S42 L43 I44 F69 F73 W76H37-F40 WeakPolarHBondContact O-CB 3.12Å; H37-F40 VanDerWaalsContact O-CD1 3.26Å; H37-F40 WeakPolarHBondContact O-CD1 3.35Å; H37-F40 PolarHBondContact O-N 2.85Å; F40-S42 PolarHBondContact O-N 3.29Å; F40-L43 WeakPolarHBondContact O-CA 3.21Å; F40-L43 WeakPolarHBondContact O-CB 3.33Å; F40-L43 PolarHBondContact O-N 3.23Å; F40-I44 HydrophobicContact CD2-CD1 4.43Å; F40-I44 HydrophobicContact CD2-CG1 4.15Å; F40-I44 HydrophobicContact CE2-CD1 3.85Å; F40-I44 HydrophobicContact CE2-CG1 3.99Å; F40-I44 HydrophobicContact CZ-CD1 4.45Å; F40-I44 PolarHBondContact O-N 3.41Å; F40-F69 HydrophobicContact CE2-CB 4.28Å; F40-F73 HydrophobicContact CD1-CB 4.28Å; F40-F73 AromaticContact CD1-CD2 3.47Å; F40-F73 HydrophobicContact CD1-CD2 3.47Å; F40-F73 VanDerWaalsContact CD1-CD2 3.47Å; F40-F73 HydrophobicContact CD1-CE2 4.14Å; F40-F73 HydrophobicContact CD1-CG 4.13Å; F40-F73 HydrophobicContact CE1-CB 3.46Å; F40-F73 VanDerWaalsContact CE1-CB 3.46Å; F40-F73 HydrophobicContact CE1-CD1 4.39Å; F40-F73 AromaticContact CE1-CD2 3.24Å; F40-F73 HydrophobicContact CE1-CD2 3.24Å; F40-F73 HydrophobicContact CE1-CE2 4.07Å; F40-F73 AromaticContact CE1-CG 3.43Å; F40-F73 HydrophobicContact CE1-CG 3.43Å; F40-F73 VanDerWaalsContact CE1-CG 3.43Å; F40-F73 HydrophobicContact CE2-CB 4.41Å; F40-F73 HydrophobicContact CZ-CB 3.54Å; F40-F73 HydrophobicContact CZ-CD2 4.22Å; F40-F73 HydrophobicContact CZ-CG 4.04Å; F40-W76 HydrophobicContact CB-CZ3 4.01Å; F40-W76 HydrophobicContact CD1-CZ3 4.26Å; F40-W76 HydrophobicContact CD2-CH2 4.37Å; F40-W76 HydrophobicContact CD2-CZ3 4.16Å; F40-W76 HydrophobicContact CG-CH2 4.44Å; F40-W76 AromaticContact CG-CZ3 3.84Å; F40-W76 HydrophobicContact CG-CZ3 3.84Å
41N80.2Confident88.5Confident93 Ų9332.7 Ų32.750%0.49719%0.188SC..G310 helixtrans-52.8-35.5176.1-74.2-25.1000112G39 L43 I44G39-N41 PolarHBondContact O-N 3.46Å; N41-L43 PolarHBondContact O-N 3.48Å; N41-I44 HydrophobicContact CB-CD1 4.49Å; N41-I44 PolarHBondContact O-N 2.95Å
42S83Confident88.3Confident25 Ų2530 Ų3018%0.17518%0.176CC..G310 helixtrans-67.7-21.5176.265.70000113.4G39 F40 A172 Y173 S176G39-S42 PolarHBondContact O-N 2.93Å; G39-S42 VanDerWaalsContact O-N 3.14Å; G39-S42 PolarHBondContact O-OG 3.34Å; F40-S42 PolarHBondContact O-N 3.29Å; S42-A172 PolarHBondContact OG-O 3.17Å; S42-Y173 PolarHBondContact OG-N 3.35Å; S42-S176 WeakPolarHBondContact O-CB 3.36Å; S42-S176 PolarHBondContact O-OG 3.02Å
43L86.5Confident88.2Confident6 Ų626.7 Ų26.73%0.03116%0.162CC..G310 helixtrans-93.3-10.9-177.1-60.7171.9000113.1F40 N41 G45 I46 Y47 A172 I175 L184 F188F40-L43 WeakPolarHBondContact O-CA 3.21Å; F40-L43 WeakPolarHBondContact O-CB 3.33Å; F40-L43 PolarHBondContact O-N 3.23Å; N41-L43 PolarHBondContact O-N 3.48Å; L43-G45 VanDerWaalsContact C-N 3.31Å; L43-G45 PolarHBondContact O-N 3Å; L43-I46 HydrophobicContact CD2-CD1 4.3Å; L43-I46 PolarHBondContact O-N 3.38Å; L43-I46 VanDerWaalsContact O-N 3.12Å; L43-Y47 HydrophobicContact CB-CD2 3.97Å; L43-Y47 HydrophobicContact CB-CE2 3.96Å; L43-Y47 HydrophobicContact CD1-CE2 4.41Å; L43-Y47 WeakPolarHBondContact O-CD2 3.41Å; L43-Y47 PolarHBondContact O-N 2.94Å; L43-A172 HydrophobicContact CD1-CB 3.99Å; L43-A172 WeakPolarHBondContact CD2-O 3.32Å; L43-A172 HydrophobicContact CG-CB 4.18Å; L43-I175 HydrophobicContact CD2-CB 4.01Å; L43-I175 HydrophobicContact CD2-CG2 3.7Å; L43-L184 HydrophobicContact CD2-CD1 4.45Å; L43-F188 HydrophobicContact CD1-CZ 3.92Å
44I86.1Confident87.9Confident36 Ų3626.8 Ų26.819%0.18517%0.168CC..Hα-helixtrans-55.5-46.4-176.8-67.7175.8000111F40 N41 I46 Y47 K48 F69F40-I44 HydrophobicContact CD2-CD1 4.43Å; F40-I44 HydrophobicContact CD2-CG1 4.15Å; F40-I44 HydrophobicContact CE2-CD1 3.85Å; F40-I44 HydrophobicContact CE2-CG1 3.99Å; F40-I44 HydrophobicContact CZ-CD1 4.45Å; F40-I44 PolarHBondContact O-N 3.41Å; N41-I44 HydrophobicContact CB-CD1 4.49Å; N41-I44 PolarHBondContact O-N 2.95Å; I44-I46 VanDerWaalsContact C-N 3.29Å; I44-I46 PolarHBondContact O-N 3.12Å; I44-Y47 PolarHBondContact O-N 2.97Å; I44-K48 HydrophobicContact CG2-CD 4.19Å; I44-K48 HydrophobicContact CG2-CG 4.34Å; I44-K48 WeakPolarHBondContact O-CG 3.38Å; I44-K48 PolarHBondContact O-N 3.32Å; I44-F69 HydrophobicContact CD1-CB 4.17Å; I44-F69 HydrophobicContact CD1-CG 4.43Å; I44-F69 HydrophobicContact CG1-CB 4.43Å; I44-F69 HydrophobicContact CG1-CD1 4.05Å; I44-F69 HydrophobicContact CG1-CG 4.24Å; I44-F69 HydrophobicContact CG2-CD1 4.27Å; I44-F69 HydrophobicContact CG2-CD2 4.01Å; I44-F69 HydrophobicContact CG2-CE1 4.25Å; I44-F69 HydrophobicContact CG2-CE2 4.01Å; I44-F69 HydrophobicContact CG2-CG 4.15Å; I44-F69 HydrophobicContact CG2-CZ 4.13Å
45G84.7Confident87.9Confident52 Ų5231.2 Ų31.254%0.53619%0.186SC..Hα-helixtrans-58.9-39.4179.600000113.2L43 K48 S49L43-G45 VanDerWaalsContact C-N 3.31Å; L43-G45 PolarHBondContact O-N 3Å; G45-K48 PolarHBondContact O-N 3.19Å; G45-S49 PolarHBondContact O-N 3.34Å; G45-S49 VanDerWaalsContact O-N 3.1Å
46I89.8Confident87.7Confident13 Ų1336.8 Ų36.87%0.06722%0.216CC..Hα-helixtrans-69.9-46.8178.1-62166.9000110.4L43 I44 K48 S49 L50 H179 L184L43-I46 HydrophobicContact CD2-CD1 4.3Å; L43-I46 PolarHBondContact O-N 3.38Å; L43-I46 VanDerWaalsContact O-N 3.12Å; I44-I46 VanDerWaalsContact C-N 3.29Å; I44-I46 PolarHBondContact O-N 3.12Å; I46-K48 VanDerWaalsContact C-N 3.27Å; I46-K48 PolarHBondContact O-N 2.77Å; I46-S49 WeakPolarHBondContact O-CA 3.4Å; I46-S49 WeakPolarHBondContact O-CB 3.36Å; I46-S49 PolarHBondContact O-N 3.34Å; I46-S49 PolarHBondContact O-OG 3.2Å; I46-L50 PolarHBondContact O-N 3.26Å; I46-L50 VanDerWaalsContact O-N 3.12Å; I46-H179 HydrophobicContact CD1-CB 3.51Å; I46-H179 HydrophobicContact CG1-CB 4.26Å; I46-H179 WeakPolarHBondContact CG2-NE2 3.33Å; I46-L184 HydrophobicContact CG2-CB 4.47Å; I46-L184 HydrophobicContact CG2-CD1 4.08Å; I46-L184 HydrophobicContact CG2-CD2 3.88Å; I46-L184 HydrophobicContact CG2-CG 4.36Å
47Y91.1Very high87.5Confident4 Ų440.3 Ų40.32%0.01624%0.24CC..Hα-helixtrans-64.1-33177.7-78.8-64.3000112.9L43 I44 L50 G51 L52 F114 T117 F125 L184 F188L43-Y47 HydrophobicContact CB-CD2 3.97Å; L43-Y47 HydrophobicContact CB-CE2 3.96Å; L43-Y47 HydrophobicContact CD1-CE2 4.41Å; L43-Y47 WeakPolarHBondContact O-CD2 3.41Å; L43-Y47 PolarHBondContact O-N 2.94Å; I44-Y47 PolarHBondContact O-N 2.97Å; Y47-L50 HydrophobicContact CD1-CD1 4.16Å; Y47-L50 HydrophobicContact CE1-CD1 4.45Å; Y47-L50 PolarHBondContact O-N 3.39Å; Y47-G51 PolarHBondContact O-N 2.85Å; Y47-L52 HydrophobicContact CD1-CD2 4.08Å; Y47-L52 HydrophobicContact CG-CD2 4.07Å; Y47-L52 WeakPolarHBondContact O-CB 3.36Å; Y47-L52 PolarHBondContact O-N 3.06Å; Y47-F114 WeakPolarHBondContact OH-CD1 3.26Å; Y47-F114 PolarHBondContact OH-O 3.24Å; Y47-T117 HydrophobicContact CD1-CG2 4.32Å; Y47-T117 HydrophobicContact CE1-CG2 4.08Å; Y47-F125 HydrophobicContact CD1-CE2 4.38Å; Y47-F125 AromaticContact CD2-CE2 3.84Å; Y47-F125 HydrophobicContact CD2-CE2 3.84Å; Y47-F125 HydrophobicContact CD2-CZ 4.4Å; Y47-F125 HydrophobicContact CE1-CD2 4.41Å; Y47-F125 HydrophobicContact CE1-CE2 4.29Å; Y47-F125 AromaticContact CE2-CE2 3.71Å; Y47-F125 HydrophobicContact CE2-CE2 3.71Å; Y47-F125 HydrophobicContact CG-CE2 4.17Å; Y47-F125 AromaticContact CZ-CE2 3.95Å; Y47-L184 HydrophobicContact CD1-CD2 4.34Å; Y47-L184 HydrophobicContact CE1-CD2 3.79Å; Y47-F188 WeakPolarHBondContact OH-CE2 3.1Å
48K89.6Confident87.3Confident46 Ų4644.1 Ų44.120%0.226%0.263CS..Hα-helixtrans-58.7-45.7168.7-75.7-177.7171.9-176.40110.9I44 G45 I46 L50 G51 Y64 E66 F69I44-K48 HydrophobicContact CG2-CD 4.19Å; I44-K48 HydrophobicContact CG2-CG 4.34Å; I44-K48 WeakPolarHBondContact O-CG 3.38Å; I44-K48 PolarHBondContact O-N 3.32Å; G45-K48 PolarHBondContact O-N 3.19Å; I46-K48 VanDerWaalsContact C-N 3.27Å; I46-K48 PolarHBondContact O-N 2.77Å; K48-L50 PolarHBondContact O-N 2.88Å; K48-G51 WeakPolarHBondContact O-CA 3.35Å; K48-G51 PolarHBondContact O-N 3.16Å; K48-Y64 HydrophobicContact CB-CD1 4.07Å; K48-Y64 HydrophobicContact CB-CE1 3.69Å; K48-Y64 HydrophobicContact CB-CE2 4.48Å; K48-Y64 HydrophobicContact CD-CD1 4.41Å; K48-Y64 HydrophobicContact CD-CD2 4.45Å; K48-Y64 HydrophobicContact CD-CG 4.24Å; K48-Y64 HydrophobicContact CG-CD1 3.74Å; K48-Y64 HydrophobicContact CG-CE1 3.92Å; K48-Y64 HydrophobicContact CG-CG 4.08Å; K48-Y64 WeakPolarHBondContact O-CE1 3.47Å; K48-Y64 VanDerWaalsContact O-CZ 3.29Å; K48-Y64 PolarHBondContact O-OH 2.92Å; K48-E66 IonicContact NZ-OE1 2.68Å; K48-E66 PolarHBondContact NZ-OE1 2.91Å; K48-F69 HydrophobicContact CG-CE2 3.92Å; K48-F69 HydrophobicContact CG-CZ 3.89Å
49S87.8Confident87.1Confident82 Ų8253 Ų5357%0.57331%0.306SS*.Hα-helixtrans-61.6-25.917677.60000114.1G45 I46 G51G45-S49 PolarHBondContact O-N 3.34Å; G45-S49 VanDerWaalsContact O-N 3.1Å; I46-S49 WeakPolarHBondContact O-CA 3.4Å; I46-S49 WeakPolarHBondContact O-CB 3.36Å; I46-S49 PolarHBondContact O-N 3.34Å; I46-S49 PolarHBondContact O-OG 3.2Å; S49-G51 PolarHBondContact O-N 2.95Å
50L91Very high86.9Confident66 Ų6658.2 Ų58.235%0.34634%0.341SS..THydrogen-bonded Turntrans-84.26.1173.6-64.4174.6000113.8I46 Y47 K48 L52 G119 L184I46-L50 PolarHBondContact O-N 3.26Å; I46-L50 VanDerWaalsContact O-N 3.12Å; Y47-L50 HydrophobicContact CD1-CD1 4.16Å; Y47-L50 HydrophobicContact CE1-CD1 4.45Å; Y47-L50 PolarHBondContact O-N 3.39Å; K48-L50 PolarHBondContact O-N 2.88Å; L50-L52 VanDerWaalsContact C-N 3.35Å; L50-G119 PolarHBondContact O-N 3.33Å; L50-L184 HydrophobicContact CD1-CD2 3.5Å; L50-L184 VanDerWaalsContact CD1-CD2 3.5Å
51G89.8Confident86.9Confident24 Ų2459.3 Ų59.325%0.24736%0.357CS..THydrogen-bonded Turntrans7714.3179.600000114.5Y47 K48 S49 F53 A54 G119Y47-G51 PolarHBondContact O-N 2.85Å; K48-G51 WeakPolarHBondContact O-CA 3.35Å; K48-G51 PolarHBondContact O-N 3.16Å; S49-G51 PolarHBondContact O-N 2.95Å; G51-F53 PolarHBondContact O-N 2.96Å; G51-A54 WeakPolarHBondContact O-CB 3.2Å; G51-A54 PolarHBondContact O-N 3.36Å; G51-G119 WeakPolarHBondContact O-CA 2.93Å
52L91.5Very high87.1Confident0 Ų057.2 Ų57.20%035%0.349CS..THydrogen-bonded Turntrans-65.9127179-168.868000110.4Y47 L50 A54 Y64 F69 T117 A122 F125Y47-L52 HydrophobicContact CD1-CD2 4.08Å; Y47-L52 HydrophobicContact CG-CD2 4.07Å; Y47-L52 WeakPolarHBondContact O-CB 3.36Å; Y47-L52 PolarHBondContact O-N 3.06Å; L50-L52 VanDerWaalsContact C-N 3.35Å; L52-A54 PolarHBondContact O-N 3.38Å; L52-A54 VanDerWaalsContact O-N 3.13Å; L52-Y64 WeakPolarHBondContact O-CD1 3.38Å; L52-F69 HydrophobicContact CD2-CE1 3.92Å; L52-F69 HydrophobicContact CD2-CZ 4.44Å; L52-T117 HydrophobicContact CD1-CG2 3.97Å; L52-T117 HydrophobicContact CD2-CG2 4.32Å; L52-A122 HydrophobicContact CD1-CB 3.9Å; L52-F125 HydrophobicContact CD1-CB 4.43Å; L52-F125 HydrophobicContact CD2-CB 4.24Å; L52-F125 HydrophobicContact CD2-CD1 3.94Å; L52-F125 HydrophobicContact CD2-CD2 3.72Å; L52-F125 HydrophobicContact CD2-CE1 4.15Å; L52-F125 HydrophobicContact CD2-CE2 3.94Å; L52-F125 HydrophobicContact CD2-CG 3.71Å; L52-F125 HydrophobicContact CD2-CZ 4.14Å
53F90.6Very high87.3Confident28 Ų2860.7 Ų60.712%0.12336%0.363CS..THydrogen-bonded Turntrans5719.5-175.1-50.6-53.4000115G51 K65 M68 F69 A122 F125 F126G51-F53 PolarHBondContact O-N 2.96Å; F53-K65 HydrophobicContact CB-CB 4.49Å; F53-K65 PolarHBondContact O-N 2.67Å; F53-K65 VanDerWaalsContact O-N 3.12Å; F53-M68 HydrophobicContact CB-CB 4.26Å; F53-M68 HydrophobicContact CD1-CB 3.76Å; F53-M68 HydrophobicContact CD1-CG 4.08Å; F53-M68 HydrophobicContact CD2-CB 3.6Å; F53-M68 HydrophobicContact CE1-CB 3.92Å; F53-M68 HydrophobicContact CE1-CG 4.43Å; F53-M68 HydrophobicContact CE2-CB 3.77Å; F53-M68 HydrophobicContact CG-CB 3.61Å; F53-M68 HydrophobicContact CG-CG 4.21Å; F53-M68 HydrophobicContact CZ-CB 3.92Å; F53-F69 HydrophobicContact CD2-CD1 4.17Å; F53-F69 HydrophobicContact CD2-CD2 4.12Å; F53-F69 AromaticContact CD2-CE1 3.94Å; F53-F69 HydrophobicContact CD2-CE1 3.94Å; F53-F69 AromaticContact CD2-CE2 3.88Å; F53-F69 HydrophobicContact CD2-CE2 3.88Å; F53-F69 HydrophobicContact CD2-CG 4.26Å; F53-F69 AromaticContact CD2-CZ 3.78Å; F53-F69 HydrophobicContact CD2-CZ 3.78Å; F53-F69 HydrophobicContact CE2-CD1 4.11Å; F53-F69 HydrophobicContact CE2-CE1 4.14Å; F53-F69 HydrophobicContact CE2-CG 4.4Å; F53-F69 HydrophobicContact CE2-CZ 4.44Å; F53-A122 HydrophobicContact CD1-CB 4.32Å; F53-A122 HydrophobicContact CE1-CB 4Å; F53-F125 HydrophobicContact CE2-CD1 4.12Å; F53-F125 HydrophobicContact CE2-CE1 4.29Å; F53-F125 HydrophobicContact CZ-CD1 4.12Å; F53-F126 AromaticContact CE1-CE2 3.87Å; F53-F126 HydrophobicContact CE1-CE2 3.87Å; F53-F126 HydrophobicContact CE1-CZ 4.22Å; F53-F126 AromaticContact CZ-CE2 3.76Å; F53-F126 HydrophobicContact CZ-CE2 3.76Å; F53-F126 AromaticContact CZ-CZ 3.94Å; F53-F126 HydrophobicContact CZ-CZ 3.94Å
54A89.5Confident87.2Confident32 Ų3263.2 Ų63.226%0.26437%0.373SS..EExtended strand (participates in β ladder)trans-70.1138.7171.900000110.4G51 L52 C62 M63 Y64G51-A54 WeakPolarHBondContact O-CB 3.2Å; G51-A54 PolarHBondContact O-N 3.36Å; L52-A54 PolarHBondContact O-N 3.38Å; L52-A54 VanDerWaalsContact O-N 3.13Å; A54-C62 HydrophobicContact CB-CB 4.08Å; A54-M63 CarbonylContact C-O 3.49Å; A54-M63 WeakPolarHBondContact CA-O 3.01Å; A54-Y64 HydrophobicContact CB-CD1 4.09Å; A54-Y64 HydrophobicContact CB-CE1 3.69Å
55Y89.6Confident87.2Confident93 Ų9366.9 Ų66.937%0.36539%0.388SS..EExtended strand (participates in β ladder)trans-141.6159.2171.569.1-81.6000110C57 M63 K65Y55-C57 VanDerWaalsContact C-N 3.32Å; Y55-C57 PolarHBondContact O-N 3.03Å; Y55-M63 HydrophobicContact CD1-CB 4.17Å; Y55-M63 WeakPolarHBondContact CD1-O 3.4Å; Y55-M63 HydrophobicContact CD2-CB 4.17Å; Y55-M63 HydrophobicContact CE1-CB 3.8Å; Y55-M63 HydrophobicContact CE2-CB 3.75Å; Y55-M63 HydrophobicContact CE2-CE 4.34Å; Y55-M63 HydrophobicContact CE2-CG 4.49Å; Y55-M63 HydrophobicContact CE2-SD 4.01Å; Y55-M63 HydrophobicContact CG-CB 4.36Å; Y55-M63 PolarHBondContact N-O 2.84Å; Y55-M63 PolarHBondContact O-N 3.38Å; Y55-M63 VanDerWaalsContact O-O 3.09Å; Y55-K65 HydrophobicContact CD1-CB 4.49Å; Y55-K65 HydrophobicContact CD1-CD 4.48Å; Y55-K65 HydrophobicContact CD1-CG 3.51Å; Y55-K65 HydrophobicContact CE1-CB 4.29Å; Y55-K65 HydrophobicContact CE1-CG 3.43Å; Y55-K65 VanDerWaalsContact CE1-CG 3.43Å; Y55-K65 HydrophobicContact CG-CG 4.48Å
56N86.4Confident86.7Confident117 Ų11770.2 Ų70.263%0.62639%0.389SS*.EExtended strand (participates in β ladder)trans52.146.8177.3-149.324.4000113.6T58 M63N56-T58 PolarHBondContact O-N 3.44Å; N56-M63 HydrophobicContact CB-SD 4.46Å
57C86.1Confident86.2Confident77 Ų7775.7 Ų75.752%0.5242%0.419SS..EExtended strand (participates in β ladder)trans-70.9122.7179.8-67.90000111.4Y55 C62Y55-C57 VanDerWaalsContact C-N 3.32Å; Y55-C57 PolarHBondContact O-N 3.03Å; C57-C62 HydrophobicContact CB-CB 4.13Å; C57-C62 WeakPolarHBondContact CB-SG 3.49Å; C57-C62 WeakPolarHBondContact SG-CB 3.39Å; C57-C62 CovalentContact SG-SG 2.04Å; C57-C62 PolarHBondContact SG-SG 3.31Å
58T85.5Confident85.9Confident82 Ų8278.2 Ų78.250%0.50343%0.431SS..EExtended strand (participates in β ladder)trans-117176.317366.10000109.9N56 S60 G61N56-T58 PolarHBondContact O-N 3.44Å; T58-S60 PolarHBondContact O-N 3.48Å; T58-S60 VanDerWaalsContact O-N 3.13Å; T58-S60 PolarHBondContact OG1-N 3.42Å; T58-S60 PolarHBondContact OG1-OG 3.13Å; T58-G61 PolarHBondContact N-O 2.94Å; T58-G61 PolarHBondContact O-N 3.02Å; T58-G61 VanDerWaalsContact O-N 3.11Å; T58-G61 PolarHBondContact OG1-O 3.09Å
59Q81.6Confident85.6Confident214 Ų21476.2 Ų76.2100%142%0.423SS*.THydrogen-bonded Turntrans-58.8-22.9172.9-67.9-177.4-5.900113
60S81Confident85.2Confident118 Ų11874 Ų7483%0.82541%0.412SS*.THydrogen-bonded Turntrans-83.6-8.317968.40000114.6T58T58-S60 PolarHBondContact O-N 3.48Å; T58-S60 VanDerWaalsContact O-N 3.13Å; T58-S60 PolarHBondContact OG1-N 3.42Å; T58-S60 PolarHBondContact OG1-OG 3.13Å
61G84Confident84.8Confident38 Ų3874.4 Ų74.439%0.39241%0.414SS..EExtended strand (participates in β ladder)trans134.1-178.3-17700000113.1T58T58-G61 PolarHBondContact N-O 2.94Å; T58-G61 PolarHBondContact O-N 3.02Å; T58-G61 VanDerWaalsContact O-N 3.11Å; T58-G61 PolarHBondContact OG1-O 3.09Å
62C85.1Confident84.8Confident49 Ų4973.2 Ų73.233%0.33140%0.402SS..EExtended strand (participates in β ladder)trans-114.7147.1177.4-62.50000110.9A54 C57 Y64A54-C62 HydrophobicContact CB-CB 4.08Å; C57-C62 HydrophobicContact CB-CB 4.13Å; C57-C62 WeakPolarHBondContact CB-SG 3.49Å; C57-C62 WeakPolarHBondContact SG-CB 3.39Å; C57-C62 CovalentContact SG-SG 2.04Å; C57-C62 PolarHBondContact SG-SG 3.31Å; C62-Y64 HydrophobicContact CB-CE2 3.98Å; C62-Y64 WeakPolarHBondContact O-CD2 3.25Å; C62-Y64 WeakPolarHBondContact O-CE2 3.37Å
63M86.4Confident84.5Confident98 Ų9874.8 Ų74.848%0.48341%0.409SS..EExtended strand (participates in β ladder)trans-84.3151.8164-59.1-176.775.100109.3A54 Y55 N56A54-M63 CarbonylContact C-O 3.49Å; A54-M63 WeakPolarHBondContact CA-O 3.01Å; Y55-M63 HydrophobicContact CD1-CB 4.17Å; Y55-M63 WeakPolarHBondContact CD1-O 3.4Å; Y55-M63 HydrophobicContact CD2-CB 4.17Å; Y55-M63 HydrophobicContact CE1-CB 3.8Å; Y55-M63 HydrophobicContact CE2-CB 3.75Å; Y55-M63 HydrophobicContact CE2-CE 4.34Å; Y55-M63 HydrophobicContact CE2-CG 4.49Å; Y55-M63 HydrophobicContact CE2-SD 4.01Å; Y55-M63 HydrophobicContact CG-CB 4.36Å; Y55-M63 PolarHBondContact N-O 2.84Å; Y55-M63 PolarHBondContact O-N 3.38Å; Y55-M63 VanDerWaalsContact O-O 3.09Å; N56-M63 HydrophobicContact CB-SD 4.46Å
64Y85.1Confident84.1Confident58 Ų5874.8 Ų74.823%0.22741%0.41CS..EExtended strand (participates in β ladder)trans-126.4138.2-179.7-68.1-90.4000110.6K48 L52 A54 C62 E66K48-Y64 HydrophobicContact CB-CD1 4.07Å; K48-Y64 HydrophobicContact CB-CE1 3.69Å; K48-Y64 HydrophobicContact CB-CE2 4.48Å; K48-Y64 HydrophobicContact CD-CD1 4.41Å; K48-Y64 HydrophobicContact CD-CD2 4.45Å; K48-Y64 HydrophobicContact CD-CG 4.24Å; K48-Y64 HydrophobicContact CG-CD1 3.74Å; K48-Y64 HydrophobicContact CG-CE1 3.92Å; K48-Y64 HydrophobicContact CG-CG 4.08Å; K48-Y64 WeakPolarHBondContact O-CE1 3.47Å; K48-Y64 VanDerWaalsContact O-CZ 3.29Å; K48-Y64 PolarHBondContact O-OH 2.92Å; L52-Y64 WeakPolarHBondContact O-CD1 3.38Å; A54-Y64 HydrophobicContact CB-CD1 4.09Å; A54-Y64 HydrophobicContact CB-CE1 3.69Å; C62-Y64 HydrophobicContact CB-CE2 3.98Å; C62-Y64 WeakPolarHBondContact O-CD2 3.25Å; C62-Y64 WeakPolarHBondContact O-CE2 3.37Å; Y64-E66 VanDerWaalsContact C-N 3.31Å; Y64-E66 PolarHBondContact O-N 3.44Å
65K84.2Confident84.1Confident114 Ų11475.7 Ų75.750%0.49641%0.412SS..  trans-79.785.8172.8-65.5-171.9179-179.80108.1F53 Y55 D67 M68F53-K65 HydrophobicContact CB-CB 4.49Å; F53-K65 PolarHBondContact O-N 2.67Å; F53-K65 VanDerWaalsContact O-N 3.12Å; Y55-K65 HydrophobicContact CD1-CB 4.49Å; Y55-K65 HydrophobicContact CD1-CD 4.48Å; Y55-K65 HydrophobicContact CD1-CG 3.51Å; Y55-K65 HydrophobicContact CE1-CB 4.29Å; Y55-K65 HydrophobicContact CE1-CG 3.43Å; Y55-K65 VanDerWaalsContact CE1-CG 3.43Å; Y55-K65 HydrophobicContact CG-CG 4.48Å; K65-D67 PolarHBondContact O-N 3.39Å; K65-M68 HydrophobicContact CB-CB 4.34Å; K65-M68 HydrophobicContact CB-CG 3.54Å; K65-M68 HydrophobicContact CD-CG 4.24Å; K65-M68 VanDerWaalsContact O-CB 3.3Å; K65-M68 WeakPolarHBondContact O-CB 3.49Å; K65-M68 PolarHBondContact O-N 3.47Å
66E75.6Confident84.2Confident121 Ų12171.3 Ų71.357%0.56540%0.395SS*.THydrogen-bonded Turntrans-60-36-171.7-54.2-154.8134.200112.8K48 Y64 M68 F69K48-E66 IonicContact NZ-OE1 2.68Å; K48-E66 PolarHBondContact NZ-OE1 2.91Å; Y64-E66 VanDerWaalsContact C-N 3.31Å; Y64-E66 PolarHBondContact O-N 3.44Å; E66-M68 PolarHBondContact O-N 2.93Å; E66-M68 VanDerWaalsContact O-N 3.12Å; E66-F69 PolarHBondContact O-N 3.33Å
67D77.9Confident84.1Confident129 Ų12966.3 Ų66.369%0.6937%0.368SS*.Hα-helixtrans-58.2-27.2176.5-59.6-28.5000113.3K65 F69 G70 I71K65-D67 PolarHBondContact O-N 3.39Å; D67-F69 VanDerWaalsContact C-N 3.25Å; D67-F69 PolarHBondContact O-N 3.11Å; D67-G70 PolarHBondContact O-N 3.2Å; D67-I71 HydrophobicContact CB-CD1 4.42Å; D67-I71 VanDerWaalsContact O-CG1 3.31Å; D67-I71 WeakPolarHBondContact O-CG1 3.18Å; D67-I71 PolarHBondContact O-N 3.36Å
68M84.7Confident84.2Confident56 Ų5664.2 Ų64.228%0.27635%0.353SS..Hα-helixtrans-65-29.3-178.1-67-66.8125.100112.5F53 K65 E66 I71 S72F53-M68 HydrophobicContact CB-CB 4.26Å; F53-M68 HydrophobicContact CD1-CB 3.76Å; F53-M68 HydrophobicContact CD1-CG 4.08Å; F53-M68 HydrophobicContact CD2-CB 3.6Å; F53-M68 HydrophobicContact CE1-CB 3.92Å; F53-M68 HydrophobicContact CE1-CG 4.43Å; F53-M68 HydrophobicContact CE2-CB 3.77Å; F53-M68 HydrophobicContact CG-CB 3.61Å; F53-M68 HydrophobicContact CG-CG 4.21Å; F53-M68 HydrophobicContact CZ-CB 3.92Å; K65-M68 HydrophobicContact CB-CB 4.34Å; K65-M68 HydrophobicContact CB-CG 3.54Å; K65-M68 HydrophobicContact CD-CG 4.24Å; K65-M68 VanDerWaalsContact O-CB 3.3Å; K65-M68 WeakPolarHBondContact O-CB 3.49Å; K65-M68 PolarHBondContact O-N 3.47Å; E66-M68 PolarHBondContact O-N 2.93Å; E66-M68 VanDerWaalsContact O-N 3.12Å; M68-I71 HydrophobicContact CE-CD1 3.54Å; M68-I71 HydrophobicContact SD-CD1 4.22Å; M68-S72 WeakPolarHBondContact O-CB 3.48Å; M68-S72 PolarHBondContact O-N 3.29Å; M68-S72 PolarHBondContact O-OG 2.84Å
69F84.2Confident84.4Confident5 Ų561.6 Ų61.62%0.02234%0.338CS..Hα-helixtrans-69-43.7174.8-70.4-76.7000111.4F40 I44 K48 L52 F53 E66 D67 S72 F73 F125F40-F69 HydrophobicContact CE2-CB 4.28Å; I44-F69 HydrophobicContact CD1-CB 4.17Å; I44-F69 HydrophobicContact CD1-CG 4.43Å; I44-F69 HydrophobicContact CG1-CB 4.43Å; I44-F69 HydrophobicContact CG1-CD1 4.05Å; I44-F69 HydrophobicContact CG1-CG 4.24Å; I44-F69 HydrophobicContact CG2-CD1 4.27Å; I44-F69 HydrophobicContact CG2-CD2 4.01Å; I44-F69 HydrophobicContact CG2-CE1 4.25Å; I44-F69 HydrophobicContact CG2-CE2 4.01Å; I44-F69 HydrophobicContact CG2-CG 4.15Å; I44-F69 HydrophobicContact CG2-CZ 4.13Å; K48-F69 HydrophobicContact CG-CE2 3.92Å; K48-F69 HydrophobicContact CG-CZ 3.89Å; L52-F69 HydrophobicContact CD2-CE1 3.92Å; L52-F69 HydrophobicContact CD2-CZ 4.44Å; F53-F69 HydrophobicContact CD2-CD1 4.17Å; F53-F69 HydrophobicContact CD2-CD2 4.12Å; F53-F69 AromaticContact CD2-CE1 3.94Å; F53-F69 HydrophobicContact CD2-CE1 3.94Å; F53-F69 AromaticContact CD2-CE2 3.88Å; F53-F69 HydrophobicContact CD2-CE2 3.88Å; F53-F69 HydrophobicContact CD2-CG 4.26Å; F53-F69 AromaticContact CD2-CZ 3.78Å; F53-F69 HydrophobicContact CD2-CZ 3.78Å; F53-F69 HydrophobicContact CE2-CD1 4.11Å; F53-F69 HydrophobicContact CE2-CE1 4.14Å; F53-F69 HydrophobicContact CE2-CG 4.4Å; F53-F69 HydrophobicContact CE2-CZ 4.44Å; E66-F69 PolarHBondContact O-N 3.33Å; D67-F69 VanDerWaalsContact C-N 3.25Å; D67-F69 PolarHBondContact O-N 3.11Å; F69-S72 WeakPolarHBondContact O-CB 3.06Å; F69-S72 PolarHBondContact O-N 3.4Å; F69-F73 PolarHBondContact O-N 2.67Å; F69-F125 HydrophobicContact CD1-CE1 4.27Å; F69-F125 HydrophobicContact CD1-CZ 4.35Å
70G79.2Confident85Confident35 Ų3551.4 Ų51.436%0.36129%0.29SS..Hα-helixtrans-63.7-43.5174.300000112.2D67 S72 F73 N74D67-G70 PolarHBondContact O-N 3.2Å; G70-S72 VanDerWaalsContact C-N 3.31Å; G70-S72 PolarHBondContact O-N 3.44Å; G70-F73 PolarHBondContact O-N 3.42Å; G70-N74 PolarHBondContact O-N 3.17Å; G70-N74 PolarHBondContact O-ND2 3.15Å
71I83.9Confident85.3Confident74 Ų7446.2 Ų46.238%0.37925%0.253SS..Hα-helixtrans-60-42.8174-67.8164.3000110.5D67 M68 F73 N74 V75 F126D67-I71 HydrophobicContact CB-CD1 4.42Å; D67-I71 VanDerWaalsContact O-CG1 3.31Å; D67-I71 WeakPolarHBondContact O-CG1 3.18Å; D67-I71 PolarHBondContact O-N 3.36Å; M68-I71 HydrophobicContact CE-CD1 3.54Å; M68-I71 HydrophobicContact SD-CD1 4.22Å; I71-F73 PolarHBondContact O-N 2.79Å; I71-N74 PolarHBondContact O-N 3.3Å; I71-V75 HydrophobicContact CG2-CG2 4.32Å; I71-V75 VanDerWaalsContact O-CG2 3.29Å; I71-V75 WeakPolarHBondContact O-CG2 3.3Å; I71-V75 PolarHBondContact O-N 2.76Å; I71-F126 HydrophobicContact CG2-CE1 4.46Å
72S87.8Confident85.5Confident0 Ų046.8 Ų46.80%025%0.251CS..Hα-helixtrans-58.1-49.2177.2-59.80000111.4M68 F69 G70 N74 V75 W76 F126M68-S72 WeakPolarHBondContact O-CB 3.48Å; M68-S72 PolarHBondContact O-N 3.29Å; M68-S72 PolarHBondContact O-OG 2.84Å; F69-S72 WeakPolarHBondContact O-CB 3.06Å; F69-S72 PolarHBondContact O-N 3.4Å; G70-S72 VanDerWaalsContact C-N 3.31Å; G70-S72 PolarHBondContact O-N 3.44Å; S72-N74 PolarHBondContact O-N 3.09Å; S72-V75 PolarHBondContact O-N 2.76Å; S72-W76 PolarHBondContact O-N 2.96Å; S72-W76 PolarHBondContact O-NE1 2.87Å; S72-F126 VanDerWaalsContact OG-CE1 3.29Å; S72-F126 WeakPolarHBondContact OG-CE1 3.3Å; S72-F126 WeakPolarHBondContact OG-CZ 3.28Å
73F85.2Confident85.9Confident33 Ų3347.4 Ų47.415%0.14525%0.25CS..Hα-helixtrans-60.9-43.7176.9179.5-99.6000112.7Y38 F40 F69 G70 I71 V75 W76 F77Y38-F73 HydrophobicContact CD1-CE2 4.02Å; Y38-F73 AromaticContact CD1-CZ 3.82Å; Y38-F73 HydrophobicContact CD1-CZ 3.82Å; Y38-F73 HydrophobicContact CE1-CE2 4.45Å; Y38-F73 HydrophobicContact CE1-CZ 4.03Å; F40-F73 HydrophobicContact CD1-CB 4.28Å; F40-F73 AromaticContact CD1-CD2 3.47Å; F40-F73 HydrophobicContact CD1-CD2 3.47Å; F40-F73 VanDerWaalsContact CD1-CD2 3.47Å; F40-F73 HydrophobicContact CD1-CE2 4.14Å; F40-F73 HydrophobicContact CD1-CG 4.13Å; F40-F73 HydrophobicContact CE1-CB 3.46Å; F40-F73 VanDerWaalsContact CE1-CB 3.46Å; F40-F73 HydrophobicContact CE1-CD1 4.39Å; F40-F73 AromaticContact CE1-CD2 3.24Å; F40-F73 HydrophobicContact CE1-CD2 3.24Å; F40-F73 HydrophobicContact CE1-CE2 4.07Å; F40-F73 AromaticContact CE1-CG 3.43Å; F40-F73 HydrophobicContact CE1-CG 3.43Å; F40-F73 VanDerWaalsContact CE1-CG 3.43Å; F40-F73 HydrophobicContact CE2-CB 4.41Å; F40-F73 HydrophobicContact CZ-CB 3.54Å; F40-F73 HydrophobicContact CZ-CD2 4.22Å; F40-F73 HydrophobicContact CZ-CG 4.04Å; F69-F73 PolarHBondContact O-N 2.67Å; G70-F73 PolarHBondContact O-N 3.42Å; I71-F73 PolarHBondContact O-N 2.79Å; F73-V75 VanDerWaalsContact C-N 3.33Å; F73-V75 PolarHBondContact O-N 2.99Å; F73-W76 HydrophobicContact CB-CE3 4.44Å; F73-W76 HydrophobicContact CD2-CE3 4.16Å; F73-W76 WeakPolarHBondContact O-CB 3.49Å; F73-W76 PolarHBondContact O-N 2.98Å; F73-F77 HydrophobicContact CE1-CB 4.49Å; F73-F77 WeakPolarHBondContact O-CB 3.28Å; F73-F77 PolarHBondContact O-N 3.47Å
74N83Confident86.2Confident27 Ų2742.8 Ų42.814%0.14423%0.227CC..Hα-helixtrans-61.2-42.7176.6-74.1-34.7000111.5G70 I71 S72 W76 F77 V78 H438G70-N74 PolarHBondContact O-N 3.17Å; G70-N74 PolarHBondContact O-ND2 3.15Å; I71-N74 PolarHBondContact O-N 3.3Å; S72-N74 PolarHBondContact O-N 3.09Å; N74-W76 VanDerWaalsContact C-N 3.32Å; N74-W76 PolarHBondContact O-N 3.49Å; N74-F77 PolarHBondContact O-N 3.23Å; N74-V78 VanDerWaalsContact O-CB 3.31Å; N74-V78 WeakPolarHBondContact O-CB 3.4Å; N74-V78 WeakPolarHBondContact O-CG2 3.46Å; N74-V78 PolarHBondContact O-N 2.73Å; N74-H438 PolarHBondContact ND2-NE2 3.02Å
75V88.8Confident86.5Confident51 Ų5141.3 Ų41.331%0.30922%0.224SC..Hα-helixtrans-59-44.5174.9169.10000110.8I71 S72 F73 S79 F126 I130I71-V75 HydrophobicContact CG2-CG2 4.32Å; I71-V75 VanDerWaalsContact O-CG2 3.29Å; I71-V75 WeakPolarHBondContact O-CG2 3.3Å; I71-V75 PolarHBondContact O-N 2.76Å; S72-V75 PolarHBondContact O-N 2.76Å; F73-V75 VanDerWaalsContact C-N 3.33Å; F73-V75 PolarHBondContact O-N 2.99Å; V75-S79 WeakPolarHBondContact O-CB 3.15Å; V75-S79 PolarHBondContact O-N 3.44Å; V75-S79 PolarHBondContact O-OG 3.47Å; V75-F126 HydrophobicContact CB-CD1 4.31Å; V75-F126 HydrophobicContact CG1-CD1 4.25Å; V75-F126 HydrophobicContact CG2-CD1 4.39Å; V75-F126 HydrophobicContact CG2-CE1 4.45Å; V75-I130 HydrophobicContact CG1-CD1 3.9Å; V75-I130 HydrophobicContact CG1-CG1 4.14Å
76W92Very high87Confident1 Ų141.1 Ų41.10%0.00423%0.228CC..Hα-helixtrans-63.4-49.5178.4-53.7-22000112.1H37 F40 S72 F73 N74 S79 Q80 F114 F125 F126 G129 A133H37-W76 HydrophobicContact CB-CE3 4.46Å; F40-W76 HydrophobicContact CB-CZ3 4.01Å; F40-W76 HydrophobicContact CD1-CZ3 4.26Å; F40-W76 HydrophobicContact CD2-CH2 4.37Å; F40-W76 HydrophobicContact CD2-CZ3 4.16Å; F40-W76 HydrophobicContact CG-CH2 4.44Å; F40-W76 AromaticContact CG-CZ3 3.84Å; F40-W76 HydrophobicContact CG-CZ3 3.84Å; S72-W76 PolarHBondContact O-N 2.96Å; S72-W76 PolarHBondContact O-NE1 2.87Å; F73-W76 HydrophobicContact CB-CE3 4.44Å; F73-W76 HydrophobicContact CD2-CE3 4.16Å; F73-W76 WeakPolarHBondContact O-CB 3.49Å; F73-W76 PolarHBondContact O-N 2.98Å; N74-W76 VanDerWaalsContact C-N 3.32Å; N74-W76 PolarHBondContact O-N 3.49Å; W76-S79 PolarHBondContact O-N 3.44Å; W76-Q80 VanDerWaalsContact O-CB 3.24Å; W76-Q80 WeakPolarHBondContact O-CB 3.33Å; W76-Q80 PolarHBondContact O-N 3.24Å; W76-F114 HydrophobicContact CH2-CE1 4.05Å; W76-F114 AromaticContact CH2-CZ 3.87Å; W76-F114 HydrophobicContact CH2-CZ 3.87Å; W76-F114 AromaticContact CZ2-CE1 3.99Å; W76-F114 HydrophobicContact CZ2-CE1 3.99Å; W76-F114 AromaticContact CZ2-CZ 3.86Å; W76-F114 HydrophobicContact CZ2-CZ 3.86Å; W76-F125 HydrophobicContact CH2-CD1 4.29Å; W76-F125 AromaticContact CH2-CE1 3.58Å; W76-F125 HydrophobicContact CH2-CE1 3.58Å; W76-F125 HydrophobicContact CH2-CE2 4.04Å; W76-F125 AromaticContact CH2-CZ 3.44Å; W76-F125 HydrophobicContact CH2-CZ 3.44Å; W76-F125 VanDerWaalsContact CH2-CZ 3.44Å; W76-F125 AromaticContact CZ2-CD1 3.68Å; W76-F125 HydrophobicContact CZ2-CD1 3.68Å; W76-F125 HydrophobicContact CZ2-CD2 4.39Å; W76-F125 AromaticContact CZ2-CE1 3.41Å; W76-F125 HydrophobicContact CZ2-CE1 3.41Å; W76-F125 VanDerWaalsContact CZ2-CE1 3.41Å; W76-F125 HydrophobicContact CZ2-CE2 4.17Å; W76-F125 HydrophobicContact CZ2-CG 4.18Å; W76-F125 AromaticContact CZ2-CZ 3.69Å; W76-F125 HydrophobicContact CZ2-CZ 3.69Å; W76-F125 WeakPolarHBondContact CZ2-O 3.41Å; W76-F125 PolarHBondContact NE1-O 3.37Å; W76-F126 PolarHBondContact NE1-O 3.47Å; W76-G129 VanDerWaalsContact CD1-C 3.42Å; W76-A133 HydrophobicContact CB-CB 4.09Å
77F85.9Confident87.9Confident12 Ų1235.8 Ų35.85%0.05321%0.205CC..Hα-helixtrans-63.1-45.9-178.1-176.3-103.7000111.7Y38 F73 N74 Q80 M81 L277 S434Y38-F77 HydrophobicContact CE1-CD2 4.07Å; Y38-F77 HydrophobicContact CE1-CE2 4.18Å; Y38-F77 WeakPolarHBondContact OH-CE2 3.23Å; F73-F77 HydrophobicContact CE1-CB 4.49Å; F73-F77 WeakPolarHBondContact O-CB 3.28Å; F73-F77 PolarHBondContact O-N 3.47Å; N74-F77 PolarHBondContact O-N 3.23Å; F77-Q80 WeakPolarHBondContact O-CB 3.33Å; F77-Q80 PolarHBondContact O-N 3.11Å; F77-M81 HydrophobicContact CD1-CG 4.45Å; F77-M81 HydrophobicContact CD2-CE 4.17Å; F77-M81 HydrophobicContact CE1-CG 4.2Å; F77-M81 HydrophobicContact CE2-CE 3.67Å; F77-M81 HydrophobicContact CE2-CG 4.4Å; F77-M81 HydrophobicContact CZ-CE 4.11Å; F77-M81 HydrophobicContact CZ-CG 4.18Å; F77-M81 WeakPolarHBondContact O-CB 3.39Å; F77-M81 WeakPolarHBondContact O-CG 3.47Å; F77-M81 PolarHBondContact O-N 3.04Å; F77-L277 HydrophobicContact CZ-CD1 4.45Å; F77-L277 HydrophobicContact CZ-CD2 4.32Å; F77-S434 WeakPolarHBondContact CE1-OG 3.43Å
78V86.7Confident88.6Confident33 Ų3329.7 Ų29.720%0.217%0.172CC..Hα-helixtrans-65.3-44.3178.4174.60000111.4N74 Q80 M81 C82 L435N74-V78 VanDerWaalsContact O-CB 3.31Å; N74-V78 WeakPolarHBondContact O-CB 3.4Å; N74-V78 WeakPolarHBondContact O-CG2 3.46Å; N74-V78 PolarHBondContact O-N 2.73Å; V78-Q80 VanDerWaalsContact C-N 3.34Å; V78-Q80 PolarHBondContact O-N 2.97Å; V78-M81 PolarHBondContact O-N 3.49Å; V78-C82 WeakPolarHBondContact O-CB 3.4Å; V78-C82 PolarHBondContact O-N 3.21Å; V78-C82 PolarHBondContact O-SG 3.43Å; V78-L435 HydrophobicContact CG1-CD1 4.02Å; V78-L435 HydrophobicContact CG2-CD1 4.03Å; V78-L435 HydrophobicContact CG2-CD2 3.18Å; V78-L435 HydrophobicContact CG2-CG 3.79Å
79S91.2Very high89Confident27 Ų2729.7 Ų29.719%0.18917%0.173CC..Hα-helixtrans-61.4-44.9177.9-59.60000111V75 W76 M81 C82 L83V75-S79 WeakPolarHBondContact O-CB 3.15Å; V75-S79 PolarHBondContact O-N 3.44Å; V75-S79 PolarHBondContact O-OG 3.47Å; W76-S79 PolarHBondContact O-N 3.44Å; S79-M81 PolarHBondContact O-N 2.95Å; S79-C82 PolarHBondContact O-N 3.37Å; S79-L83 VanDerWaalsContact O-CB 3.24Å; S79-L83 WeakPolarHBondContact O-CB 3.47Å; S79-L83 WeakPolarHBondContact O-CG 3.23Å; S79-L83 PolarHBondContact O-N 3.01Å
80Q93.1Very high89.5Confident0 Ų033.2 Ų33.20%019%0.188CC..Hα-helixtrans-56.2-50.6174.4177.8-17340.200111.5Y38 W76 F77 V78 C82 L83 I84 A133 I137Y38-Q80 PolarHBondContact OH-OE1 3.14Å; W76-Q80 VanDerWaalsContact O-CB 3.24Å; W76-Q80 WeakPolarHBondContact O-CB 3.33Å; W76-Q80 PolarHBondContact O-N 3.24Å; F77-Q80 WeakPolarHBondContact O-CB 3.33Å; F77-Q80 PolarHBondContact O-N 3.11Å; V78-Q80 VanDerWaalsContact C-N 3.34Å; V78-Q80 PolarHBondContact O-N 2.97Å; Q80-C82 PolarHBondContact O-N 2.99Å; Q80-L83 PolarHBondContact O-N 3.27Å; Q80-I84 WeakPolarHBondContact O-CB 3.33Å; Q80-I84 PolarHBondContact O-N 2.72Å; Q80-A133 HydrophobicContact CB-CB 3.9Å; Q80-A133 HydrophobicContact CG-CB 4.27Å; Q80-A133 WeakPolarHBondContact CG-O 3.44Å; Q80-A133 PolarHBondContact NE2-O 2.86Å; Q80-I137 HydrophobicContact CG-CB 4.03Å; Q80-I137 HydrophobicContact CG-CG2 3.48Å; Q80-I137 VanDerWaalsContact CG-CG2 3.48Å
81M87.4Confident90.3Very high10 Ų1031.7 Ų31.75%0.04917%0.172CC..Hα-helixtrans-68.3-33.3-177.6-65.9-64.2141.100112.9F77 V78 S79 I84 A428F77-M81 HydrophobicContact CD1-CG 4.45Å; F77-M81 HydrophobicContact CD2-CE 4.17Å; F77-M81 HydrophobicContact CE1-CG 4.2Å; F77-M81 HydrophobicContact CE2-CE 3.67Å; F77-M81 HydrophobicContact CE2-CG 4.4Å; F77-M81 HydrophobicContact CZ-CE 4.11Å; F77-M81 HydrophobicContact CZ-CG 4.18Å; F77-M81 WeakPolarHBondContact O-CB 3.39Å; F77-M81 WeakPolarHBondContact O-CG 3.47Å; F77-M81 PolarHBondContact O-N 3.04Å; V78-M81 PolarHBondContact O-N 3.49Å; S79-M81 PolarHBondContact O-N 2.95Å; M81-I84 WeakPolarHBondContact O-CG2 3.49Å; M81-A428 WeakPolarHBondContact O-CA 3.35Å; M81-A428 WeakPolarHBondContact O-CB 3.29Å; M81-A428 PolarHBondContact O-N 2.99Å
82C88.6Confident90.6Very high50 Ų5030.1 Ų30.134%0.33816%0.164SC..Hα-helixtrans-74.1-44.8176.2-650000111.5V78 S79 Q80V78-C82 WeakPolarHBondContact O-CB 3.4Å; V78-C82 PolarHBondContact O-N 3.21Å; V78-C82 PolarHBondContact O-SG 3.43Å; S79-C82 PolarHBondContact O-N 3.37Å; Q80-C82 PolarHBondContact O-N 2.99Å
83L93.3Very high90.8Very high62 Ų6240 Ų4033%0.32520%0.202SC..Hα-helixtrans-80.6-18.1-171.8-63.1172.9000113.4S79 Q80 T85 L86 A87 L134S79-L83 VanDerWaalsContact O-CB 3.24Å; S79-L83 WeakPolarHBondContact O-CB 3.47Å; S79-L83 WeakPolarHBondContact O-CG 3.23Å; S79-L83 PolarHBondContact O-N 3.01Å; Q80-L83 PolarHBondContact O-N 3.27Å; L83-T85 PolarHBondContact O-N 3Å; L83-L86 HydrophobicContact CD2-CD1 3.79Å; L83-L86 WeakPolarHBondContact O-CB 3.42Å; L83-L86 PolarHBondContact O-N 3.17Å; L83-A87 PolarHBondContact O-N 3.11Å; L83-L134 HydrophobicContact CB-CD1 3.68Å; L83-L134 HydrophobicContact CB-CD2 3.79Å; L83-L134 HydrophobicContact CB-CG 4.37Å; L83-L134 HydrophobicContact CD1-CD2 3.78Å; L83-L134 HydrophobicContact CG-CD2 4.42Å
84I92.6Very high91.3Very high1 Ų141.7 Ų41.71%0.00521%0.214CC..Hα-helixtrans-60.2-26.9175.5-168.751.2000113.1Q80 M81 L86 A87 G88 I137 I141Q80-I84 WeakPolarHBondContact O-CB 3.33Å; Q80-I84 PolarHBondContact O-N 2.72Å; M81-I84 WeakPolarHBondContact O-CG2 3.49Å; I84-L86 VanDerWaalsContact C-N 3.33Å; I84-A87 HydrophobicContact CD1-CB 4.05Å; I84-A87 PolarHBondContact O-N 3.19Å; I84-G88 PolarHBondContact O-N 2.94Å; I84-I137 HydrophobicContact CB-CG2 4.42Å; I84-I137 HydrophobicContact CD1-CB 4.34Å; I84-I137 HydrophobicContact CD1-CG1 3.89Å; I84-I137 HydrophobicContact CD1-CG2 3.71Å; I84-I137 HydrophobicContact CG1-CG1 4.03Å; I84-I137 HydrophobicContact CG1-CG2 4.24Å; I84-I141 HydrophobicContact CD1-CD1 3.85Å; I84-I141 HydrophobicContact CD1-CG1 4.49Å; I84-I141 HydrophobicContact CD1-CG2 4.35Å
85T92.4Very high91.7Very high26 Ų2640.5 Ų40.516%0.1621%0.208CC..Hα-helixtrans-62.2-42.9172.3-61.40000111.3L83 A87 G88 I89 G424 I425 A428L83-T85 PolarHBondContact O-N 3Å; T85-A87 VanDerWaalsContact C-N 3.35Å; T85-G88 PolarHBondContact O-N 3.29Å; T85-I89 HydrophobicContact CG2-CD1 4.08Å; T85-I89 WeakPolarHBondContact O-CG1 3.23Å; T85-I89 PolarHBondContact O-N 2.79Å; T85-G424 PolarHBondContact OG1-O 3.32Å; T85-G424 VanDerWaalsContact OG1-O 3.04Å; T85-I425 HydrophobicContact CG2-CG1 3.92Å; T85-I425 PolarHBondContact OG1-N 3.48Å; T85-A428 WeakPolarHBondContact OG1-CB 3.35Å
86L94.5Very high91.9Very high110 Ų11038.1 Ų38.158%0.57619%0.194SC*.Hα-helixtrans-65.1-41.9177.4-58.7178.7000110.8L83 I84 G88 I89 F90L83-L86 HydrophobicContact CD2-CD1 3.79Å; L83-L86 WeakPolarHBondContact O-CB 3.42Å; L83-L86 PolarHBondContact O-N 3.17Å; I84-L86 VanDerWaalsContact C-N 3.33Å; L86-G88 VanDerWaalsContact C-N 3.34Å; L86-G88 PolarHBondContact O-N 3.47Å; L86-I89 PolarHBondContact O-N 3.01Å; L86-F90 VanDerWaalsContact O-CB 3.3Å; L86-F90 WeakPolarHBondContact O-CB 3.38Å; L86-F90 PolarHBondContact O-N 3.43Å
87A93.5Very high92.1Very high10 Ų1038.9 Ų38.98%0.08320%0.197CC..Hα-helixtrans-62.1-40.4174.300000112.3L83 I84 T85 F90 M91 L99 C138L83-A87 PolarHBondContact O-N 3.11Å; I84-A87 HydrophobicContact CD1-CB 4.05Å; I84-A87 PolarHBondContact O-N 3.19Å; T85-A87 VanDerWaalsContact C-N 3.35Å; A87-F90 WeakPolarHBondContact O-CB 3.08Å; A87-F90 PolarHBondContact O-N 3.47Å; A87-M91 PolarHBondContact O-N 3.45Å; A87-L99 HydrophobicContact CB-CD1 4.14Å; A87-C138 WeakPolarHBondContact CB-SG 3.42Å
88G92.2Very high92.6Very high0 Ų039.8 Ų39.80%020%0.204CC..Hα-helixtrans-61.1-47.1174.600000113.1I84 T85 L86 F90 M91 D92 G420I84-G88 PolarHBondContact O-N 2.94Å; T85-G88 PolarHBondContact O-N 3.29Å; L86-G88 VanDerWaalsContact C-N 3.34Å; L86-G88 PolarHBondContact O-N 3.47Å; G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.19Å; G88-M91 WeakPolarHBondContact O-CB 3.29Å; G88-M91 PolarHBondContact O-N 3.09Å; G88-D92 PolarHBondContact O-N 3.47Å; G88-D92 VanDerWaalsContact O-N 3.07Å; G88-G420 VanDerWaalsContact CA-O 3.27Å; G88-G420 WeakPolarHBondContact CA-O 3.24Å
89I93.5Very high93Very high56 Ų5638.6 Ų38.629%0.28720%0.196SC..Hα-helixtrans-62.4-40.6174.8-66.2166.3000110.6T85 L86 D92 R93 T421T85-I89 HydrophobicContact CG2-CD1 4.08Å; T85-I89 WeakPolarHBondContact O-CG1 3.23Å; T85-I89 PolarHBondContact O-N 2.79Å; L86-I89 PolarHBondContact O-N 3.01Å; I89-D92 PolarHBondContact O-N 3.07Å; I89-R93 HydrophobicContact CG2-CG 4.36Å; I89-R93 WeakPolarHBondContact O-CB 3.47Å; I89-R93 WeakPolarHBondContact O-CG 3.38Å; I89-R93 PolarHBondContact O-N 3.03Å; I89-T421 HydrophobicContact CG1-CG2 4.08Å
90F95.5Very high93.3Very high79 Ų7937.4 Ų37.435%0.34619%0.188SC..Hα-helixtrans-62.6-43.7176.9-171.5-83.1000111.3L86 A87 G88 D92 V94 G95 P98 L99L86-F90 VanDerWaalsContact O-CB 3.3Å; L86-F90 WeakPolarHBondContact O-CB 3.38Å; L86-F90 PolarHBondContact O-N 3.43Å; A87-F90 WeakPolarHBondContact O-CB 3.08Å; A87-F90 PolarHBondContact O-N 3.47Å; G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.19Å; F90-D92 PolarHBondContact O-N 3.41Å; F90-V94 HydrophobicContact CD1-CB 4.16Å; F90-V94 HydrophobicContact CD1-CG2 4.42Å; F90-V94 HydrophobicContact CD2-CB 4.49Å; F90-V94 HydrophobicContact CD2-CG2 3.89Å; F90-V94 HydrophobicContact CE1-CB 3.99Å; F90-V94 HydrophobicContact CE1-CG1 4.06Å; F90-V94 HydrophobicContact CE1-CG2 4.38Å; F90-V94 HydrophobicContact CE2-CB 4.32Å; F90-V94 HydrophobicContact CE2-CG1 4.43Å; F90-V94 HydrophobicContact CE2-CG2 3.85Å; F90-V94 HydrophobicContact CG-CB 4.42Å; F90-V94 HydrophobicContact CG-CG2 4.19Å; F90-V94 HydrophobicContact CZ-CB 4.07Å; F90-V94 HydrophobicContact CZ-CG1 3.9Å; F90-V94 HydrophobicContact CZ-CG2 4.1Å; F90-V94 WeakPolarHBondContact O-CA 3.48Å; F90-V94 VanDerWaalsContact O-CB 3.29Å; F90-V94 WeakPolarHBondContact O-CB 3.43Å; F90-V94 PolarHBondContact O-N 3.43Å; F90-G95 PolarHBondContact O-N 2.89Å; F90-P98 HydrophobicContact CE1-CB 4.01Å; F90-P98 HydrophobicContact CZ-CB 4.4Å; F90-L99 HydrophobicContact CD1-CB 3.94Å; F90-L99 HydrophobicContact CD1-CD1 3.95Å; F90-L99 HydrophobicContact CE1-CB 4.23Å
91M94.4Very high93.5Very high3 Ų339.9 Ų39.92%0.01520%0.201CC..Hα-helixtrans-58.1-47.9175.6-163174.971.200111.9A87 G88 G95 L96 L99 I141 F419A87-M91 PolarHBondContact O-N 3.45Å; G88-M91 WeakPolarHBondContact O-CB 3.29Å; G88-M91 PolarHBondContact O-N 3.09Å; M91-G95 CarbonylContact O-C 3.54Å; M91-G95 WeakPolarHBondContact O-CA 3.36Å; M91-G95 PolarHBondContact O-N 3.34Å; M91-G95 VanDerWaalsContact O-N 3.16Å; M91-L96 HydrophobicContact CG-CD1 4.37Å; M91-L96 HydrophobicContact SD-CD1 4.08Å; M91-L99 HydrophobicContact CB-CD2 3.6Å; M91-L99 HydrophobicContact CG-CD2 3.84Å; M91-L99 HydrophobicContact SD-CD2 4.09Å; M91-I141 HydrophobicContact SD-CD1 4.22Å; M91-I141 HydrophobicContact SD-CG1 4.43Å; M91-F419 HydrophobicContact CE-CD1 3.75Å; M91-F419 HydrophobicContact CE-CE1 4.42Å
92D91.8Very high93.9Very high41 Ų4141.1 Ų41.122%0.21921%0.213CC..Hα-helixtrans-72.5-35.6-174-67.2-14.5000111.7G88 I89 F90 G420 T421G88-D92 PolarHBondContact O-N 3.47Å; G88-D92 VanDerWaalsContact O-N 3.07Å; I89-D92 PolarHBondContact O-N 3.07Å; F90-D92 PolarHBondContact O-N 3.41Å; D92-G420 WeakPolarHBondContact OD1-CA 3.33Å; D92-G420 PolarHBondContact OD1-N 2.88Å; D92-G420 VanDerWaalsContact OD1-N 3.13Å; D92-T421 VanDerWaalsContact OD2-CB 3.27Å; D92-T421 WeakPolarHBondContact OD2-CB 3.44Å; D92-T421 PolarHBondContact OD2-N 3.28Å; D92-T421 PolarHBondContact OD2-OG1 3.16Å
93R92.3Very high94.3Very high209 Ų20938.9 Ų38.979%0.78920%0.198SC*.Hα-helixtrans-88.9-47.7-178-69.4-168.9177.2178.51114.2I89I89-R93 HydrophobicContact CG2-CG 4.36Å; I89-R93 WeakPolarHBondContact O-CB 3.47Å; I89-R93 WeakPolarHBondContact O-CG 3.38Å; I89-R93 PolarHBondContact O-N 3.03Å
94V94Very high94.5Very high68 Ų6836.3 Ų36.341%0.41218%0.184SC..THydrogen-bonded Turntrans-90.3-46-173.6-1750000110.3F90 P98 M209F90-V94 HydrophobicContact CD1-CB 4.16Å; F90-V94 HydrophobicContact CD1-CG2 4.42Å; F90-V94 HydrophobicContact CD2-CB 4.49Å; F90-V94 HydrophobicContact CD2-CG2 3.89Å; F90-V94 HydrophobicContact CE1-CB 3.99Å; F90-V94 HydrophobicContact CE1-CG1 4.06Å; F90-V94 HydrophobicContact CE1-CG2 4.38Å; F90-V94 HydrophobicContact CE2-CB 4.32Å; F90-V94 HydrophobicContact CE2-CG1 4.43Å; F90-V94 HydrophobicContact CE2-CG2 3.85Å; F90-V94 HydrophobicContact CG-CB 4.42Å; F90-V94 HydrophobicContact CG-CG2 4.19Å; F90-V94 HydrophobicContact CZ-CB 4.07Å; F90-V94 HydrophobicContact CZ-CG1 3.9Å; F90-V94 HydrophobicContact CZ-CG2 4.1Å; F90-V94 WeakPolarHBondContact O-CA 3.48Å; F90-V94 VanDerWaalsContact O-CB 3.29Å; F90-V94 WeakPolarHBondContact O-CB 3.43Å; F90-V94 PolarHBondContact O-N 3.43Å; V94-P98 HydrophobicContact CG1-CB 3.93Å; V94-P98 HydrophobicContact CG1-CG 4.08Å; V94-M209 WeakPolarHBondContact O-CE 3.48Å
95G92.8Very high94.7Very high2 Ų241.1 Ų41.12%0.02121%0.209CC..  trans137.9170.2175.700000113.9F90 M91 L99 M209F90-G95 PolarHBondContact O-N 2.89Å; M91-G95 CarbonylContact O-C 3.54Å; M91-G95 WeakPolarHBondContact O-CA 3.36Å; M91-G95 PolarHBondContact O-N 3.34Å; M91-G95 VanDerWaalsContact O-N 3.16Å; G95-L99 PolarHBondContact O-N 3.4Å; G95-M209 CarbonylContact C-O 3.34Å; G95-M209 WeakPolarHBondContact CA-O 3.16Å
96L93.4Very high94.9Very high0 Ų042.7 Ų42.70%022%0.216CC..Hα-helixtrans-72-50.6-178.7178.261.8000112.1M91 L99 K100 C142 Q145 F207 M209 M214M91-L96 HydrophobicContact CG-CD1 4.37Å; M91-L96 HydrophobicContact SD-CD1 4.08Å; L96-L99 PolarHBondContact O-N 3.49Å; L96-K100 PolarHBondContact O-N 3.41Å; L96-C142 HydrophobicContact CD1-CB 3.75Å; L96-Q145 HydrophobicContact CD1-CB 4.45Å; L96-Q145 HydrophobicContact CD1-CG 3.81Å; L96-Q145 HydrophobicContact CD2-CB 3.86Å; L96-Q145 HydrophobicContact CD2-CG 3.94Å; L96-F207 HydrophobicContact CD2-CB 4.16Å; L96-F207 HydrophobicContact CD2-CD1 3.61Å; L96-F207 HydrophobicContact CD2-CE1 4.36Å; L96-F207 HydrophobicContact CD2-CG 4.16Å; L96-F207 HydrophobicContact CG-CB 4.22Å; L96-F207 HydrophobicContact CG-CD1 4.06Å; L96-F207 HydrophobicContact CG-CG 4.22Å; L96-M209 PolarHBondContact N-O 2.87Å; L96-M214 HydrophobicContact CD2-CE 4.41Å; L96-M214 HydrophobicContact CD2-CG 3.89Å; L96-M214 HydrophobicContact CD2-SD 4.17Å
97R94.9Very high95.1Very high17 Ų1737.8 Ų37.86%0.06419%0.19CC..Hα-helixtrans-58.9-48.7179.7174.1179.6-63.7159.47.7113D10 L99 K100 L101 A203 M204 F207 T208D10-R97 IonicContact OD1-CZ 2.87Å; D10-R97 IonicContact OD1-NH1 2.66Å; D10-R97 IonicContact OD1-NH2 2.7Å; D10-R97 PolarHBondContact OD1-NH2 3.22Å; R97-L99 VanDerWaalsContact C-N 3.32Å; R97-L99 PolarHBondContact O-N 3.42Å; R97-K100 PolarHBondContact O-N 2.89Å; R97-L101 HydrophobicContact CG-CD1 4.26Å; R97-L101 WeakPolarHBondContact O-CG 3.33Å; R97-L101 PolarHBondContact O-N 2.74Å; R97-A203 WeakPolarHBondContact CD-O 3.23Å; R97-A203 VanDerWaalsContact CG-O 3.32Å; R97-A203 WeakPolarHBondContact CG-O 3.06Å; R97-A203 PolarHBondContact NE-O 3.11Å; R97-M204 PolarHBondContact NH2-O 3.12Å; R97-F207 PolarHBondContact NE-O 3.2Å; R97-F207 PolarHBondContact NH2-O 3.22Å; R97-T208 PolarHBondContact N-O 2.95Å
98P95.7Very high95.3Very high31 Ų3137.8 Ų37.820%0.20119%0.19CC..Hα-helixtrans-60.3-38.8176.5-26.436.8000113.3F90 V94 L101 A102 M209F90-P98 HydrophobicContact CE1-CB 4.01Å; F90-P98 HydrophobicContact CZ-CB 4.4Å; V94-P98 HydrophobicContact CG1-CB 3.93Å; V94-P98 HydrophobicContact CG1-CG 4.08Å; P98-L101 PolarHBondContact O-N 3.39Å; P98-A102 WeakPolarHBondContact O-CB 3.22Å; P98-A102 PolarHBondContact O-N 3.07Å; P98-M209 HydrophobicContact CG-CE 3.59Å; P98-M209 HydrophobicContact CG-SD 4.2Å
99L96.5Very high95.5Very high8 Ų839.8 Ų39.84%0.04221%0.206CC..Hα-helixtrans-63.6-46176.5179.762.2000111.1A87 F90 M91 G95 L96 R97 L101 A102 S103 C138 I141A87-L99 HydrophobicContact CB-CD1 4.14Å; F90-L99 HydrophobicContact CD1-CB 3.94Å; F90-L99 HydrophobicContact CD1-CD1 3.95Å; F90-L99 HydrophobicContact CE1-CB 4.23Å; M91-L99 HydrophobicContact CB-CD2 3.6Å; M91-L99 HydrophobicContact CG-CD2 3.84Å; M91-L99 HydrophobicContact SD-CD2 4.09Å; G95-L99 PolarHBondContact O-N 3.4Å; L96-L99 PolarHBondContact O-N 3.49Å; R97-L99 VanDerWaalsContact C-N 3.32Å; R97-L99 PolarHBondContact O-N 3.42Å; L99-L101 PolarHBondContact O-N 3.19Å; L99-A102 PolarHBondContact O-N 3.19Å; L99-S103 WeakPolarHBondContact O-CB 3.44Å; L99-S103 PolarHBondContact O-N 3.37Å; L99-S103 PolarHBondContact O-OG 2.8Å; L99-C138 HydrophobicContact CD1-CB 4.43Å; L99-I141 HydrophobicContact CD2-CD1 3.87Å; L99-I141 HydrophobicContact CD2-CG1 4.36Å
100K96.7Very high95.7Very high3 Ų337.1 Ų37.11%0.01319%0.193CC..Hα-helixtrans-59.7-46.1177.7-178.760171.8165.60110.8D29 L96 R97 A102 S103 T104 S139 C142 A203 F207D29-K100 IonicContact OD1-NZ 3.45Å; D29-K100 PolarHBondContact OD1-NZ 3.07Å; D29-K100 IonicContact OD2-NZ 3.89Å; D29-K100 PolarHBondContact OD2-NZ 3.06Å; L96-K100 PolarHBondContact O-N 3.41Å; R97-K100 PolarHBondContact O-N 2.89Å; K100-A102 PolarHBondContact O-N 2.84Å; K100-S103 WeakPolarHBondContact CA-OG 3.48Å; K100-S103 PolarHBondContact O-N 3.12Å; K100-S103 PolarHBondContact O-OG 3.2Å; K100-T104 WeakPolarHBondContact O-CB 3.4Å; K100-T104 PolarHBondContact O-N 2.93Å; K100-T104 PolarHBondContact O-OG1 3.32Å; K100-S139 PolarHBondContact NZ-OG 2.82Å; K100-C142 HydrophobicContact CB-CB 4.46Å; K100-C142 HydrophobicContact CD-CB 4.37Å; K100-A203 HydrophobicContact CB-CB 4.16Å; K100-A203 HydrophobicContact CG-CB 3.82Å; K100-F207 HydrophobicContact CB-CD2 4.13Å; K100-F207 HydrophobicContact CB-CE2 4.39Å; K100-F207 HydrophobicContact CD-CE2 4Å; K100-F207 HydrophobicContact CG-CD2 3.83Å; K100-F207 HydrophobicContact CG-CE2 3.83Å
101L96.8Very high95.8Very high52 Ų5233.4 Ų33.427%0.27218%0.176SC..Hα-helixtrans-58.8-47.2176.6-70.6172.4000112.6R97 P98 L99 S103 T104 L105 L200 A203R97-L101 HydrophobicContact CG-CD1 4.26Å; R97-L101 WeakPolarHBondContact O-CG 3.33Å; R97-L101 PolarHBondContact O-N 2.74Å; P98-L101 PolarHBondContact O-N 3.39Å; L99-L101 PolarHBondContact O-N 3.19Å; L101-S103 VanDerWaalsContact C-N 3.35Å; L101-S103 PolarHBondContact O-N 3.07Å; L101-T104 PolarHBondContact O-N 3.36Å; L101-L105 PolarHBondContact O-N 3.16Å; L101-L200 HydrophobicContact CD2-CD1 3.59Å; L101-A203 HydrophobicContact CD2-CB 3.47Å; L101-A203 VanDerWaalsContact CD2-CB 3.47Å; L101-A203 HydrophobicContact CG-CB 3.72Å
102A96.9Very high95.9Very high36 Ų3636.6 Ų36.630%0.29819%0.193SC..Hα-helixtrans-60.8-44.9176.900000111.3P98 L99 K100 T104 L105 M106P98-A102 WeakPolarHBondContact O-CB 3.22Å; P98-A102 PolarHBondContact O-N 3.07Å; L99-A102 PolarHBondContact O-N 3.19Å; K100-A102 PolarHBondContact O-N 2.84Å; A102-T104 PolarHBondContact O-N 3.42Å; A102-L105 PolarHBondContact O-N 3.06Å; A102-M106 WeakPolarHBondContact O-CB 3.33Å; A102-M106 VanDerWaalsContact O-CG 3.24Å; A102-M106 WeakPolarHBondContact O-CG 3.43Å; A102-M106 PolarHBondContact O-N 3Å
103S96.6Very high96.1Very high3 Ų337.4 Ų37.42%0.02120%0.196CC..Hα-helixtrans-61.7-42.9177.472.50000112L99 K100 L101 L105 M106 Y107 S135L99-S103 WeakPolarHBondContact O-CB 3.44Å; L99-S103 PolarHBondContact O-N 3.37Å; L99-S103 PolarHBondContact O-OG 2.8Å; K100-S103 WeakPolarHBondContact CA-OG 3.48Å; K100-S103 PolarHBondContact O-N 3.12Å; K100-S103 PolarHBondContact O-OG 3.2Å; L101-S103 VanDerWaalsContact C-N 3.35Å; L101-S103 PolarHBondContact O-N 3.07Å; S103-L105 PolarHBondContact O-N 3.44Å; S103-M106 PolarHBondContact O-N 3.45Å; S103-Y107 VanDerWaalsContact O-CB 3.29Å; S103-Y107 WeakPolarHBondContact O-CB 3.49Å; S103-Y107 PolarHBondContact O-N 3.39Å; S103-S135 WeakPolarHBondContact O-CB 3.42Å
104T96.9Very high96.2Very high7 Ų727.8 Ų27.84%0.04316%0.16CC..Hα-helixtrans-62-44.3178.5-60.70000111.5K100 L101 A102 Y107 A108 F196 G199K100-T104 WeakPolarHBondContact O-CB 3.4Å; K100-T104 PolarHBondContact O-N 2.93Å; K100-T104 PolarHBondContact O-OG1 3.32Å; L101-T104 PolarHBondContact O-N 3.36Å; A102-T104 PolarHBondContact O-N 3.42Å; T104-Y107 PolarHBondContact O-N 2.94Å; T104-A108 WeakPolarHBondContact O-CB 3.38Å; T104-A108 PolarHBondContact O-N 3.47Å; T104-F196 HydrophobicContact CG2-CD2 4.06Å; T104-G199 WeakPolarHBondContact OG1-CA 3.35Å
105L97.4Very high96.3Very high102 Ų10224.7 Ų24.753%0.53414%0.141SC..Hα-helixtrans-63.5-45.9176.5-75.9167.5000112L101 A102 S103 Y107 A108 A109 F196L101-L105 PolarHBondContact O-N 3.16Å; A102-L105 PolarHBondContact O-N 3.06Å; S103-L105 PolarHBondContact O-N 3.44Å; L105-Y107 VanDerWaalsContact C-N 3.33Å; L105-Y107 PolarHBondContact O-N 3.28Å; L105-A108 PolarHBondContact O-N 3.38Å; L105-A109 WeakPolarHBondContact O-CB 3.42Å; L105-A109 PolarHBondContact O-N 3.36Å; L105-F196 HydrophobicContact CD2-CD2 4.24Å; L105-F196 HydrophobicContact CD2-CE2 3.56Å; L105-F196 HydrophobicContact CG-CE2 4.33Å
106M97.1Very high96.4Very high60 Ų6029.7 Ų29.730%0.29616%0.163SC..Hα-helixtrans-63.5-39.1177.6-70.4169.865.800112A102 S103 G110 L131 L134A102-M106 WeakPolarHBondContact O-CB 3.33Å; A102-M106 VanDerWaalsContact O-CG 3.24Å; A102-M106 WeakPolarHBondContact O-CG 3.43Å; A102-M106 PolarHBondContact O-N 3Å; S103-M106 PolarHBondContact O-N 3.45Å; M106-G110 PolarHBondContact O-N 3.06Å; M106-L131 HydrophobicContact CB-CD2 4.49Å; M106-L131 HydrophobicContact CE-CD2 4.08Å; M106-L134 HydrophobicContact CE-CD2 3.63Å; M106-L134 HydrophobicContact CE-CG 4.07Å
107Y97.6Very high96.4Very high7 Ų729.8 Ų29.83%0.02716%0.164CC..Hα-helixtrans-65.6-47.9178.3-169.7-83000111.6F33 G34 Y36 S103 T104 L105 G110 T111 V132 S135 S195F33-Y107 WeakPolarHBondContact CA-OH 3.27Å; F33-Y107 HydrophobicContact CB-CE1 4.03Å; F33-Y107 WeakPolarHBondContact O-CE2 3.25Å; F33-Y107 VanDerWaalsContact O-CZ 3.25Å; F33-Y107 PolarHBondContact O-OH 2.89Å; G34-Y107 PolarHBondContact O-OH 3.41Å; Y36-Y107 AromaticContact CD1-CZ 3.98Å; Y36-Y107 WeakPolarHBondContact CD1-OH 3.27Å; Y36-Y107 HydrophobicContact CE1-CE1 4.26Å; Y36-Y107 HydrophobicContact CE1-CE2 4.24Å; Y36-Y107 AromaticContact CE1-CZ 3.63Å; Y36-Y107 WeakPolarHBondContact CE1-OH 3.43Å; S103-Y107 VanDerWaalsContact O-CB 3.29Å; S103-Y107 WeakPolarHBondContact O-CB 3.49Å; S103-Y107 PolarHBondContact O-N 3.39Å; T104-Y107 PolarHBondContact O-N 2.94Å; L105-Y107 VanDerWaalsContact C-N 3.33Å; L105-Y107 PolarHBondContact O-N 3.28Å; Y107-G110 PolarHBondContact O-N 2.75Å; Y107-T111 WeakPolarHBondContact CE1-OG1 3.37Å; Y107-T111 VanDerWaalsContact O-CB 3.27Å; Y107-T111 WeakPolarHBondContact O-CB 3.26Å; Y107-T111 PolarHBondContact O-N 2.98Å; Y107-T111 PolarHBondContact O-OG1 3.21Å; Y107-V132 HydrophobicContact CD2-CG1 4.39Å; Y107-V132 HydrophobicContact CE2-CG1 4Å; Y107-S135 WeakPolarHBondContact CA-OG 3.41Å; Y107-S135 VanDerWaalsContact CB-OG 3.28Å; Y107-S135 WeakPolarHBondContact CB-OG 3.34Å; Y107-S135 VanDerWaalsContact CD2-OG 3.29Å; Y107-S135 WeakPolarHBondContact CD2-OG 3.23Å; Y107-S135 PolarHBondContact N-OG 3.42Å; Y107-S195 VanDerWaalsContact CD1-CB 3.46Å; Y107-S195 WeakPolarHBondContact CD1-OG 3.49Å
108A97.6Very high96.2Very high10 Ų1031.4 Ų31.48%0.08318%0.175CC..Hα-helixtrans-60.3-47.8176.500000110.7T104 L105 G110 T111 L112 S192 F196T104-A108 WeakPolarHBondContact O-CB 3.38Å; T104-A108 PolarHBondContact O-N 3.47Å; L105-A108 PolarHBondContact O-N 3.38Å; A108-G110 PolarHBondContact O-N 3.01Å; A108-T111 PolarHBondContact O-N 3.47Å; A108-L112 VanDerWaalsContact O-CB 3.27Å; A108-L112 WeakPolarHBondContact O-CB 3.21Å; A108-L112 PolarHBondContact O-N 2.97Å; A108-S192 PolarHBondContact O-OG 3.13Å; A108-F196 HydrophobicContact CB-CB 4.19Å
109A97.6Very high95.7Very high42 Ų4231.4 Ų31.435%0.34718%0.181SC..Hα-helixtrans-59.4-48.1176.900000112.5L105 L112 M113L105-A109 WeakPolarHBondContact O-CB 3.42Å; L105-A109 PolarHBondContact O-N 3.36Å; A109-L112 PolarHBondContact O-N 3.39Å; A109-M113 VanDerWaalsContact O-CG 3.29Å; A109-M113 WeakPolarHBondContact O-CG 3.46Å; A109-M113 PolarHBondContact O-N 3.12Å
110G97.2Very high95.3Very high0 Ų040.7 Ų40.70%022%0.221CC..Hα-helixtrans-65.1-4017900000113M106 Y107 A108 M113 F114 A128M106-G110 PolarHBondContact O-N 3.06Å; Y107-G110 PolarHBondContact O-N 2.75Å; A108-G110 PolarHBondContact O-N 3.01Å; G110-M113 WeakPolarHBondContact O-CB 3.45Å; G110-M113 PolarHBondContact O-N 3.42Å; G110-F114 PolarHBondContact O-N 3.31Å; G110-F114 VanDerWaalsContact O-N 3.13Å; G110-A128 WeakPolarHBondContact O-CB 3.41Å
111T96.9Very high95Very high0 Ų043.4 Ų43.40%024%0.238CC..Hα-helixtrans-66.3-39.4175.8-56.60000111.1Y36 Y107 A108 M113 F114 A115 F188 L191Y36-T111 PolarHBondContact OH-OG1 3.41Å; Y107-T111 WeakPolarHBondContact CE1-OG1 3.37Å; Y107-T111 VanDerWaalsContact O-CB 3.27Å; Y107-T111 WeakPolarHBondContact O-CB 3.26Å; Y107-T111 PolarHBondContact O-N 2.98Å; Y107-T111 PolarHBondContact O-OG1 3.21Å; A108-T111 PolarHBondContact O-N 3.47Å; T111-M113 VanDerWaalsContact C-N 3.33Å; T111-M113 PolarHBondContact O-N 3.48Å; T111-F114 WeakPolarHBondContact O-CB 3.42Å; T111-F114 PolarHBondContact O-N 3.32Å; T111-A115 PolarHBondContact O-N 2.9Å; T111-F188 HydrophobicContact CG2-CB 4.32Å; T111-F188 HydrophobicContact CG2-CD1 3.8Å; T111-F188 WeakPolarHBondContact CG2-O 3.4Å; T111-L191 HydrophobicContact CG2-CB 3.86Å
112L96.7Very high94.6Very high71 Ų7142 Ų4237%0.37223%0.234SC..Hα-helixtrans-64-37.3173.8-169.965.9000111.9A108 A109 F114 A115 F116 I189A108-L112 VanDerWaalsContact O-CB 3.27Å; A108-L112 WeakPolarHBondContact O-CB 3.21Å; A108-L112 PolarHBondContact O-N 2.97Å; A109-L112 PolarHBondContact O-N 3.39Å; L112-F114 VanDerWaalsContact C-N 3.32Å; L112-F114 PolarHBondContact O-N 3.33Å; L112-A115 VanDerWaalsContact O-CB 3.23Å; L112-A115 WeakPolarHBondContact O-CB 3.41Å; L112-A115 PolarHBondContact O-N 3.2Å; L112-A115 VanDerWaalsContact O-N 3.13Å; L112-F116 HydrophobicContact CD1-CE2 3.8Å; L112-F116 HydrophobicContact CG-CD2 4.42Å; L112-F116 HydrophobicContact CG-CE2 4.02Å; L112-F116 VanDerWaalsContact O-CD2 3.26Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; L112-I189 HydrophobicContact CD1-CG1 3.93Å
113M96.4Very high94.4Very high58 Ų5844.7 Ų44.729%0.28625%0.248SC..Hα-helixtrans-62.6-37173.7-70178.4-177.400112.3A109 G110 T111 A115 F116 T117 L124 T127 A128 L131A109-M113 VanDerWaalsContact O-CG 3.29Å; A109-M113 WeakPolarHBondContact O-CG 3.46Å; A109-M113 PolarHBondContact O-N 3.12Å; G110-M113 WeakPolarHBondContact O-CB 3.45Å; G110-M113 PolarHBondContact O-N 3.42Å; T111-M113 VanDerWaalsContact C-N 3.33Å; T111-M113 PolarHBondContact O-N 3.48Å; M113-A115 VanDerWaalsContact C-N 3.28Å; M113-A115 PolarHBondContact O-N 3.43Å; M113-F116 PolarHBondContact O-N 2.78Å; M113-T117 PolarHBondContact O-N 2.9Å; M113-T117 PolarHBondContact O-OG1 3.21Å; M113-L124 HydrophobicContact CB-CD1 3.75Å; M113-L124 HydrophobicContact CB-CG 4.03Å; M113-L124 HydrophobicContact CG-CD1 3.71Å; M113-L124 WeakPolarHBondContact O-CD2 3.42Å; M113-L124 HydrophobicContact SD-CD1 3.94Å; M113-T127 HydrophobicContact CE-CG2 4.41Å; M113-T127 HydrophobicContact SD-CG2 3.88Å; M113-A128 HydrophobicContact CB-CB 3.64Å; M113-L131 HydrophobicContact CE-CD1 3.86Å; M113-L131 HydrophobicContact SD-CD1 3.75Å
114F95.4Very high94.3Very high6 Ų646.8 Ų46.83%0.02626%0.259CS..Hα-helixtrans-62.4-33.4172.9-82.8-56.6000112.9Y36 Y47 W76 G110 T111 L112 F116 T117 F125 A128 G129 V132 F188Y36-F114 HydrophobicContact CE2-CD2 4.48Å; Y36-F114 HydrophobicContact CE2-CE2 4.47Å; Y36-F114 WeakPolarHBondContact OH-CD2 3.34Å; Y47-F114 WeakPolarHBondContact OH-CD1 3.26Å; Y47-F114 PolarHBondContact OH-O 3.24Å; W76-F114 HydrophobicContact CH2-CE1 4.05Å; W76-F114 AromaticContact CH2-CZ 3.87Å; W76-F114 HydrophobicContact CH2-CZ 3.87Å; W76-F114 AromaticContact CZ2-CE1 3.99Å; W76-F114 HydrophobicContact CZ2-CE1 3.99Å; W76-F114 AromaticContact CZ2-CZ 3.86Å; W76-F114 HydrophobicContact CZ2-CZ 3.86Å; G110-F114 PolarHBondContact O-N 3.31Å; G110-F114 VanDerWaalsContact O-N 3.13Å; T111-F114 WeakPolarHBondContact O-CB 3.42Å; T111-F114 PolarHBondContact O-N 3.32Å; L112-F114 VanDerWaalsContact C-N 3.32Å; L112-F114 PolarHBondContact O-N 3.33Å; F114-F116 VanDerWaalsContact C-N 3.27Å; F114-F116 PolarHBondContact O-N 3.33Å; F114-T117 PolarHBondContact O-N 2.73Å; F114-F125 AromaticContact CD1-CD2 3.87Å; F114-F125 HydrophobicContact CD1-CD2 3.87Å; F114-F125 HydrophobicContact CD1-CE2 4.05Å; F114-F125 AromaticContact CE1-CD2 3.52Å; F114-F125 HydrophobicContact CE1-CD2 3.52Å; F114-F125 AromaticContact CE1-CE2 3.56Å; F114-F125 HydrophobicContact CE1-CE2 3.56Å; F114-F125 HydrophobicContact CE1-CG 4.35Å; F114-F125 HydrophobicContact CE1-CZ 4.42Å; F114-A128 HydrophobicContact CD1-CB 3.76Å; F114-A128 HydrophobicContact CD2-CB 3.76Å; F114-A128 HydrophobicContact CE1-CB 3.81Å; F114-A128 HydrophobicContact CE2-CB 3.84Å; F114-A128 HydrophobicContact CG-CB 3.73Å; F114-A128 HydrophobicContact CZ-CB 3.86Å; F114-G129 VanDerWaalsContact CZ-CA 3.45Å; F114-V132 HydrophobicContact CD2-CG2 4.08Å; F114-V132 HydrophobicContact CE2-CB 4.21Å; F114-V132 HydrophobicContact CE2-CG2 3.88Å; F114-F188 HydrophobicContact CB-CD1 4.03Å; F114-F188 HydrophobicContact CB-CD2 4.11Å; F114-F188 HydrophobicContact CB-CE1 4.04Å; F114-F188 HydrophobicContact CB-CE2 4.12Å; F114-F188 HydrophobicContact CB-CG 4.06Å; F114-F188 HydrophobicContact CB-CZ 4.08Å
115A94.7Very high94.1Very high3 Ų346.6 Ų46.63%0.02526%0.258CS..Hα-helixtrans-60.8-34.9176.400000112.8T111 L112 M113 Q185 F188 I189T111-A115 PolarHBondContact O-N 2.9Å; L112-A115 VanDerWaalsContact O-CB 3.23Å; L112-A115 WeakPolarHBondContact O-CB 3.41Å; L112-A115 PolarHBondContact O-N 3.2Å; L112-A115 VanDerWaalsContact O-N 3.13Å; M113-A115 VanDerWaalsContact C-N 3.28Å; M113-A115 PolarHBondContact O-N 3.43Å; A115-Q185 WeakPolarHBondContact O-CG 3.39Å; A115-F188 HydrophobicContact CB-CB 3.6Å; A115-I189 HydrophobicContact CB-CG1 4.06Å
116F94.4Very high94Very high108 Ų10844 Ų4447%0.47424%0.242SC..THydrogen-bonded Turntrans-102.38.3-175.8-62.7-71000113.8L112 M113 F114 T118 L124 I189L112-F116 HydrophobicContact CD1-CE2 3.8Å; L112-F116 HydrophobicContact CG-CD2 4.42Å; L112-F116 HydrophobicContact CG-CE2 4.02Å; L112-F116 VanDerWaalsContact O-CD2 3.26Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; M113-F116 PolarHBondContact O-N 2.78Å; F114-F116 VanDerWaalsContact C-N 3.27Å; F114-F116 PolarHBondContact O-N 3.33Å; F116-T118 PolarHBondContact O-N 2.9Å; F116-L124 HydrophobicContact CB-CD2 4.34Å; F116-I189 HydrophobicContact CZ-CD1 4.4Å
117T93.9Very high93.9Very high2 Ų244.3 Ų44.31%0.01225%0.247CC..  trans-72.4123.5178.2-64.40000110.6Y47 L52 M113 F114 F125Y47-T117 HydrophobicContact CD1-CG2 4.32Å; Y47-T117 HydrophobicContact CE1-CG2 4.08Å; L52-T117 HydrophobicContact CD1-CG2 3.97Å; L52-T117 HydrophobicContact CD2-CG2 4.32Å; M113-T117 PolarHBondContact O-N 2.9Å; M113-T117 PolarHBondContact O-OG1 3.21Å; F114-T117 PolarHBondContact O-N 2.73Å; T117-F125 HydrophobicContact CG2-CB 3.85Å; T117-F125 HydrophobicContact CG2-CD2 3.93Å; T117-F125 HydrophobicContact CG2-CG 4.33Å
118T90.6Very high93.9Very high50 Ų5044 Ų4431%0.30725%0.246SC..  trans-135.5169.7175.362.90000109.7F116 K120 V121F116-T118 PolarHBondContact O-N 2.9Å; T118-K120 PolarHBondContact O-N 2.92Å; T118-K120 VanDerWaalsContact O-N 3.07Å; T118-V121 CarbonylContact O-C 3.51Å; T118-V121 PolarHBondContact O-N 3.25Å; T118-V121 WeakPolarHBondContact OG1-CG2 3.48Å
119G86Confident93.7Very high32 Ų3243.5 Ų43.533%0.3324%0.242SC..G310 helixtrans-53.1-29.5177.700000115.4L50 G51 V121L50-G119 PolarHBondContact O-N 3.33Å; G51-G119 WeakPolarHBondContact O-CA 2.93Å; G119-V121 VanDerWaalsContact C-N 3.33Å; G119-V121 PolarHBondContact O-N 3.12Å
120K87.3Confident93.7Very high202 Ų20243.7 Ų43.788%0.87824%0.237SC*.G310 helixtrans-73.8-22179.5-65.4-176.5179.9179.40113.9T118T118-K120 PolarHBondContact O-N 2.92Å; T118-K120 VanDerWaalsContact O-N 3.07Å
121V91Very high93.7Very high61 Ų6145.5 Ų45.537%0.3725%0.246SC..G310 helixtrans-125.247.7-175.2-78.30000110.6T118 G119 P123 L124T118-V121 CarbonylContact O-C 3.51Å; T118-V121 PolarHBondContact O-N 3.25Å; T118-V121 WeakPolarHBondContact OG1-CG2 3.48Å; G119-V121 VanDerWaalsContact C-N 3.33Å; G119-V121 PolarHBondContact O-N 3.12Å; V121-P123 VanDerWaalsContact C-N 3.28Å; V121-L124 HydrophobicContact CB-CB 4.21Å; V121-L124 HydrophobicContact CG2-CD2 4.32Å; V121-L124 WeakPolarHBondContact O-CB 3.28Å; V121-L124 PolarHBondContact O-N 2.98Å
122A88.9Confident93.7Very high22 Ų2245.5 Ų45.518%0.18225%0.246CC..Hα-helixtrans-51.6-36.8176.700000114.7L52 F53 L124 F125L52-A122 HydrophobicContact CD1-CB 3.9Å; F53-A122 HydrophobicContact CD1-CB 4.32Å; F53-A122 HydrophobicContact CE1-CB 4Å; A122-L124 PolarHBondContact O-N 3.02Å; A122-F125 VanDerWaalsContact O-CB 3.28Å; A122-F125 WeakPolarHBondContact O-CB 3.28Å; A122-F125 PolarHBondContact O-N 2.9Å; A122-F125 VanDerWaalsContact O-N 3.12Å
123P92.3Very high93.6Very high93 Ų9342.1 Ų42.160%0.60423%0.229SC*.Hα-helixtrans-58.9-27.5174.8-26.636.7000114.2V121 F125 F126 T127V121-P123 VanDerWaalsContact C-N 3.28Å; P123-F125 PolarHBondContact O-N 2.95Å; P123-F126 PolarHBondContact O-N 2.93Å; P123-T127 PolarHBondContact O-N 3.22Å; P123-T127 PolarHBondContact O-OG1 3.11Å
124L94.2Very high93.5Very high47 Ų4740.3 Ų40.325%0.24622%0.22CC..Hα-helixtrans-62.7-33.6178.4-17061.8000111.6M113 F116 V121 A122 F126 T127 A128M113-L124 HydrophobicContact CB-CD1 3.75Å; M113-L124 HydrophobicContact CB-CG 4.03Å; M113-L124 HydrophobicContact CG-CD1 3.71Å; M113-L124 WeakPolarHBondContact O-CD2 3.42Å; M113-L124 HydrophobicContact SD-CD1 3.94Å; F116-L124 HydrophobicContact CB-CD2 4.34Å; V121-L124 HydrophobicContact CB-CB 4.21Å; V121-L124 HydrophobicContact CG2-CD2 4.32Å; V121-L124 WeakPolarHBondContact O-CB 3.28Å; V121-L124 PolarHBondContact O-N 2.98Å; A122-L124 PolarHBondContact O-N 3.02Å; L124-F126 VanDerWaalsContact C-N 3.32Å; L124-F126 PolarHBondContact O-N 3.24Å; L124-T127 PolarHBondContact O-N 2.84Å; L124-A128 WeakPolarHBondContact O-CB 3.46Å; L124-A128 PolarHBondContact O-N 3.19Å
125F93.8Very high93.6Very high3 Ų340.1 Ų40.11%0.01322%0.219CC..Hα-helixtrans-61.9-40.2177-168.4-113.4000112Y47 L52 F53 F69 W76 F114 T117 A122 P123 G129Y47-F125 HydrophobicContact CD1-CE2 4.38Å; Y47-F125 AromaticContact CD2-CE2 3.84Å; Y47-F125 HydrophobicContact CD2-CE2 3.84Å; Y47-F125 HydrophobicContact CD2-CZ 4.4Å; Y47-F125 HydrophobicContact CE1-CD2 4.41Å; Y47-F125 HydrophobicContact CE1-CE2 4.29Å; Y47-F125 AromaticContact CE2-CE2 3.71Å; Y47-F125 HydrophobicContact CE2-CE2 3.71Å; Y47-F125 HydrophobicContact CG-CE2 4.17Å; Y47-F125 AromaticContact CZ-CE2 3.95Å; L52-F125 HydrophobicContact CD1-CB 4.43Å; L52-F125 HydrophobicContact CD2-CB 4.24Å; L52-F125 HydrophobicContact CD2-CD1 3.94Å; L52-F125 HydrophobicContact CD2-CD2 3.72Å; L52-F125 HydrophobicContact CD2-CE1 4.15Å; L52-F125 HydrophobicContact CD2-CE2 3.94Å; L52-F125 HydrophobicContact CD2-CG 3.71Å; L52-F125 HydrophobicContact CD2-CZ 4.14Å; F53-F125 HydrophobicContact CE2-CD1 4.12Å; F53-F125 HydrophobicContact CE2-CE1 4.29Å; F53-F125 HydrophobicContact CZ-CD1 4.12Å; F69-F125 HydrophobicContact CD1-CE1 4.27Å; F69-F125 HydrophobicContact CD1-CZ 4.35Å; W76-F125 HydrophobicContact CH2-CD1 4.29Å; W76-F125 AromaticContact CH2-CE1 3.58Å; W76-F125 HydrophobicContact CH2-CE1 3.58Å; W76-F125 HydrophobicContact CH2-CE2 4.04Å; W76-F125 AromaticContact CH2-CZ 3.44Å; W76-F125 HydrophobicContact CH2-CZ 3.44Å; W76-F125 VanDerWaalsContact CH2-CZ 3.44Å; W76-F125 AromaticContact CZ2-CD1 3.68Å; W76-F125 HydrophobicContact CZ2-CD1 3.68Å; W76-F125 HydrophobicContact CZ2-CD2 4.39Å; W76-F125 AromaticContact CZ2-CE1 3.41Å; W76-F125 HydrophobicContact CZ2-CE1 3.41Å; W76-F125 VanDerWaalsContact CZ2-CE1 3.41Å; W76-F125 HydrophobicContact CZ2-CE2 4.17Å; W76-F125 HydrophobicContact CZ2-CG 4.18Å; W76-F125 AromaticContact CZ2-CZ 3.69Å; W76-F125 HydrophobicContact CZ2-CZ 3.69Å; W76-F125 WeakPolarHBondContact CZ2-O 3.41Å; W76-F125 PolarHBondContact NE1-O 3.37Å; F114-F125 AromaticContact CD1-CD2 3.87Å; F114-F125 HydrophobicContact CD1-CD2 3.87Å; F114-F125 HydrophobicContact CD1-CE2 4.05Å; F114-F125 AromaticContact CE1-CD2 3.52Å; F114-F125 HydrophobicContact CE1-CD2 3.52Å; F114-F125 AromaticContact CE1-CE2 3.56Å; F114-F125 HydrophobicContact CE1-CE2 3.56Å; F114-F125 HydrophobicContact CE1-CG 4.35Å; F114-F125 HydrophobicContact CE1-CZ 4.42Å; T117-F125 HydrophobicContact CG2-CB 3.85Å; T117-F125 HydrophobicContact CG2-CD2 3.93Å; T117-F125 HydrophobicContact CG2-CG 4.33Å; A122-F125 VanDerWaalsContact O-CB 3.28Å; A122-F125 WeakPolarHBondContact O-CB 3.28Å; A122-F125 PolarHBondContact O-N 2.9Å; A122-F125 VanDerWaalsContact O-N 3.12Å; P123-F125 PolarHBondContact O-N 2.95Å; F125-G129 PolarHBondContact O-N 3.12Å
126F94.1Very high93.6Very high48 Ų4840 Ų4021%0.21122%0.218CC..Hα-helixtrans-66.5-50.7176.5-67.8-88.4000110.9F53 I71 S72 V75 W76 P123 L124 A128 G129 I130F53-F126 AromaticContact CE1-CE2 3.87Å; F53-F126 HydrophobicContact CE1-CE2 3.87Å; F53-F126 HydrophobicContact CE1-CZ 4.22Å; F53-F126 AromaticContact CZ-CE2 3.76Å; F53-F126 HydrophobicContact CZ-CE2 3.76Å; F53-F126 AromaticContact CZ-CZ 3.94Å; F53-F126 HydrophobicContact CZ-CZ 3.94Å; I71-F126 HydrophobicContact CG2-CE1 4.46Å; S72-F126 VanDerWaalsContact OG-CE1 3.29Å; S72-F126 WeakPolarHBondContact OG-CE1 3.3Å; S72-F126 WeakPolarHBondContact OG-CZ 3.28Å; V75-F126 HydrophobicContact CB-CD1 4.31Å; V75-F126 HydrophobicContact CG1-CD1 4.25Å; V75-F126 HydrophobicContact CG2-CD1 4.39Å; V75-F126 HydrophobicContact CG2-CE1 4.45Å; W76-F126 PolarHBondContact NE1-O 3.47Å; P123-F126 PolarHBondContact O-N 2.93Å; L124-F126 VanDerWaalsContact C-N 3.32Å; L124-F126 PolarHBondContact O-N 3.24Å; F126-A128 PolarHBondContact O-N 3.35Å; F126-G129 PolarHBondContact O-N 2.94Å; F126-I130 VanDerWaalsContact O-CG1 3.31Å; F126-I130 WeakPolarHBondContact O-CG1 3.43Å; F126-I130 PolarHBondContact O-N 3.47Å
127T95.7Very high93.6Very high65 Ų6535.6 Ų35.640%0.39920%0.2SC..Hα-helixtrans-61.5-43-179.9-52.70000112M113 P123 L124 I130 L131M113-T127 HydrophobicContact CE-CG2 4.41Å; M113-T127 HydrophobicContact SD-CG2 3.88Å; P123-T127 PolarHBondContact O-N 3.22Å; P123-T127 PolarHBondContact O-OG1 3.11Å; L124-T127 PolarHBondContact O-N 2.84Å; T127-I130 PolarHBondContact O-N 3.43Å; T127-L131 HydrophobicContact CG2-CD1 4.35Å; T127-L131 WeakPolarHBondContact O-CG 3.28Å; T127-L131 PolarHBondContact O-N 2.97Å; T127-L131 VanDerWaalsContact O-N 3.1Å
128A96.2Very high93.7Very high0 Ų035.8 Ų35.80%020%0.201CC..Hα-helixtrans-57.3-51.2177.400000111.4G110 M113 F114 L124 F126 L131 V132G110-A128 WeakPolarHBondContact O-CB 3.41Å; M113-A128 HydrophobicContact CB-CB 3.64Å; F114-A128 HydrophobicContact CD1-CB 3.76Å; F114-A128 HydrophobicContact CD2-CB 3.76Å; F114-A128 HydrophobicContact CE1-CB 3.81Å; F114-A128 HydrophobicContact CE2-CB 3.84Å; F114-A128 HydrophobicContact CG-CB 3.73Å; F114-A128 HydrophobicContact CZ-CB 3.86Å; L124-A128 WeakPolarHBondContact O-CB 3.46Å; L124-A128 PolarHBondContact O-N 3.19Å; F126-A128 PolarHBondContact O-N 3.35Å; A128-L131 PolarHBondContact O-N 2.86Å; A128-V132 WeakPolarHBondContact O-CG2 3.16Å; A128-V132 PolarHBondContact O-N 3.5Å
129G95.3Very high93.9Very high0 Ų033.6 Ų33.60%019%0.188CC..Hα-helixtrans-70.5-33-178.600000114W76 F114 F125 F126 L131 V132 A133W76-G129 VanDerWaalsContact CD1-C 3.42Å; F114-G129 VanDerWaalsContact CZ-CA 3.45Å; F125-G129 PolarHBondContact O-N 3.12Å; F126-G129 PolarHBondContact O-N 2.94Å; G129-L131 VanDerWaalsContact C-N 3.35Å; G129-L131 PolarHBondContact O-N 3.33Å; G129-V132 PolarHBondContact O-N 3.48Å; G129-A133 WeakPolarHBondContact O-CB 3.42Å; G129-A133 PolarHBondContact O-N 3Å
130I96Very high94.4Very high46 Ų4632.7 Ų32.724%0.23618%0.175CC..Hα-helixtrans-60.1-47.4171.9-68.4168.2000110.2V75 F126 T127 L134V75-I130 HydrophobicContact CG1-CD1 3.9Å; V75-I130 HydrophobicContact CG1-CG1 4.14Å; F126-I130 VanDerWaalsContact O-CG1 3.31Å; F126-I130 WeakPolarHBondContact O-CG1 3.43Å; F126-I130 PolarHBondContact O-N 3.47Å; T127-I130 PolarHBondContact O-N 3.43Å; I130-L134 VanDerWaalsContact O-CB 3.29Å; I130-L134 WeakPolarHBondContact O-CB 3.44Å; I130-L134 PolarHBondContact O-N 3.41Å
131L97Very high94.7Very high39 Ų3923.2 Ų23.220%0.20413%0.134CC..Hα-helixtrans-63.8-45.9-179.9-73.4175.6000111.9M106 M113 T127 A128 G129 S135M106-L131 HydrophobicContact CB-CD2 4.49Å; M106-L131 HydrophobicContact CE-CD2 4.08Å; M113-L131 HydrophobicContact CE-CD1 3.86Å; M113-L131 HydrophobicContact SD-CD1 3.75Å; T127-L131 HydrophobicContact CG2-CD1 4.35Å; T127-L131 WeakPolarHBondContact O-CG 3.28Å; T127-L131 PolarHBondContact O-N 2.97Å; T127-L131 VanDerWaalsContact O-N 3.1Å; A128-L131 PolarHBondContact O-N 2.86Å; G129-L131 VanDerWaalsContact C-N 3.35Å; G129-L131 PolarHBondContact O-N 3.33Å; L131-S135 WeakPolarHBondContact O-CB 3.33Å; L131-S135 PolarHBondContact O-N 2.92Å; L131-S135 PolarHBondContact O-OG 3.07Å
132V96.9Very high94.9Very high0 Ų020.3 Ų20.30%012%0.116CC..Hα-helixtrans-67.1-43.9178.8171.90000111.7Y36 H37 Y107 F114 A128 G129 S135 S136Y36-V132 HydrophobicContact CD1-CG1 4.37Å; Y36-V132 HydrophobicContact CE1-CG1 3.65Å; Y36-V132 HydrophobicContact CE2-CG1 4.39Å; Y36-V132 WeakPolarHBondContact OH-CG2 3.36Å; H37-V132 HydrophobicContact CB-CG1 4.34Å; Y107-V132 HydrophobicContact CD2-CG1 4.39Å; Y107-V132 HydrophobicContact CE2-CG1 4Å; F114-V132 HydrophobicContact CD2-CG2 4.08Å; F114-V132 HydrophobicContact CE2-CB 4.21Å; F114-V132 HydrophobicContact CE2-CG2 3.88Å; A128-V132 WeakPolarHBondContact O-CG2 3.16Å; A128-V132 PolarHBondContact O-N 3.5Å; G129-V132 PolarHBondContact O-N 3.48Å; V132-S135 WeakPolarHBondContact CA-OG 3.47Å; V132-S135 PolarHBondContact O-OG 2.82Å; V132-S135 VanDerWaalsContact O-OG 3.11Å; V132-S136 WeakPolarHBondContact O-CB 3.43Å; V132-S136 PolarHBondContact O-N 3.28Å; V132-S136 PolarHBondContact O-OG 3.48Å
133A95Very high95.2Very high0 Ų019.3 Ų19.30%011%0.108CC..Hα-helixtrans-63.7-48.3179.500000111W76 Q80 G129 S136 I137W76-A133 HydrophobicContact CB-CB 4.09Å; Q80-A133 HydrophobicContact CB-CB 3.9Å; Q80-A133 HydrophobicContact CG-CB 4.27Å; Q80-A133 WeakPolarHBondContact CG-O 3.44Å; Q80-A133 PolarHBondContact NE2-O 2.86Å; G129-A133 WeakPolarHBondContact O-CB 3.42Å; G129-A133 PolarHBondContact O-N 3Å; A133-S136 PolarHBondContact O-OG 3.32Å; A133-I137 PolarHBondContact O-N 3.41Å
134L95.8Very high95.3Very high20 Ų2015 Ų1511%0.1058%0.08CC..Hα-helixtrans-63.8-46.5177.4179.756000112.3L83 M106 I130 I137 C138L83-L134 HydrophobicContact CB-CD1 3.68Å; L83-L134 HydrophobicContact CB-CD2 3.79Å; L83-L134 HydrophobicContact CB-CG 4.37Å; L83-L134 HydrophobicContact CD1-CD2 3.78Å; L83-L134 HydrophobicContact CG-CD2 4.42Å; M106-L134 HydrophobicContact CE-CD2 3.63Å; M106-L134 HydrophobicContact CE-CG 4.07Å; I130-L134 VanDerWaalsContact O-CB 3.29Å; I130-L134 WeakPolarHBondContact O-CB 3.44Å; I130-L134 PolarHBondContact O-N 3.41Å; L134-I137 HydrophobicContact CD1-CG2 4.4Å; L134-I137 WeakPolarHBondContact O-CG2 3.48Å; L134-I137 PolarHBondContact O-N 3.19Å; L134-C138 WeakPolarHBondContact O-CB 3.47Å; L134-C138 PolarHBondContact O-N 2.87Å; L134-C138 PolarHBondContact O-SG 2.64Å
135S96.4Very high95.2Very high1 Ų112.8 Ų12.81%0.0077%0.068CC..Hα-helixtrans-67.2-38.2-178.554.70000113.3S103 Y107 L131 V132 C138 S139S103-S135 WeakPolarHBondContact O-CB 3.42Å; Y107-S135 WeakPolarHBondContact CA-OG 3.41Å; Y107-S135 VanDerWaalsContact CB-OG 3.28Å; Y107-S135 WeakPolarHBondContact CB-OG 3.34Å; Y107-S135 VanDerWaalsContact CD2-OG 3.29Å; Y107-S135 WeakPolarHBondContact CD2-OG 3.23Å; Y107-S135 PolarHBondContact N-OG 3.42Å; L131-S135 WeakPolarHBondContact O-CB 3.33Å; L131-S135 PolarHBondContact O-N 2.92Å; L131-S135 PolarHBondContact O-OG 3.07Å; V132-S135 WeakPolarHBondContact CA-OG 3.47Å; V132-S135 PolarHBondContact O-OG 2.82Å; V132-S135 VanDerWaalsContact O-OG 3.11Å; S135-C138 WeakPolarHBondContact O-CB 3.26Å; S135-C138 PolarHBondContact O-N 3.17Å; S135-S139 WeakPolarHBondContact O-CB 3.07Å; S135-S139 PolarHBondContact O-N 3.45Å
136S95.5Very high95.2Very high0 Ų012.6 Ų12.60%07%0.067CC..Hα-helixtrans-64.1-41.6177.8610000112H37 V132 A133 S139 L140 F165H37-S136 PolarHBondContact CE1-OG 3Å; V132-S136 WeakPolarHBondContact O-CB 3.43Å; V132-S136 PolarHBondContact O-N 3.28Å; V132-S136 PolarHBondContact O-OG 3.48Å; A133-S136 PolarHBondContact O-OG 3.32Å; S136-S139 WeakPolarHBondContact O-CB 3.4Å; S136-S139 PolarHBondContact O-N 3.34Å; S136-L140 PolarHBondContact O-N 2.83Å; S136-F165 WeakPolarHBondContact O-CE2 3.42Å
137I93.6Very high95Very high17 Ų1710.3 Ų10.39%0.0876%0.057CC..Hα-helixtrans-69.8-36.2174.5-165.872.6000112.1Q80 I84 A133 L134 S139 L140 I141Q80-I137 HydrophobicContact CG-CB 4.03Å; Q80-I137 HydrophobicContact CG-CG2 3.48Å; Q80-I137 VanDerWaalsContact CG-CG2 3.48Å; I84-I137 HydrophobicContact CB-CG2 4.42Å; I84-I137 HydrophobicContact CD1-CB 4.34Å; I84-I137 HydrophobicContact CD1-CG1 3.89Å; I84-I137 HydrophobicContact CD1-CG2 3.71Å; I84-I137 HydrophobicContact CG1-CG1 4.03Å; I84-I137 HydrophobicContact CG1-CG2 4.24Å; A133-I137 PolarHBondContact O-N 3.41Å; L134-I137 HydrophobicContact CD1-CG2 4.4Å; L134-I137 WeakPolarHBondContact O-CG2 3.48Å; L134-I137 PolarHBondContact O-N 3.19Å; I137-S139 VanDerWaalsContact C-N 3.29Å; I137-S139 PolarHBondContact O-N 3.34Å; I137-L140 HydrophobicContact CD1-CB 4.49Å; I137-L140 HydrophobicContact CD1-CD2 3.85Å; I137-L140 WeakPolarHBondContact O-CB 3.36Å; I137-L140 PolarHBondContact O-N 3.48Å; I137-I141 PolarHBondContact O-N 2.87Å
138C95.7Very high94.7Very high5 Ų57.6 Ų7.63%0.0344%0.041CC..Hα-helixtrans-60.7-41.3172.3-710000111.1A87 L99 L134 S135 L140 I141 C142A87-C138 WeakPolarHBondContact CB-SG 3.42Å; L99-C138 HydrophobicContact CD1-CB 4.43Å; L134-C138 WeakPolarHBondContact O-CB 3.47Å; L134-C138 PolarHBondContact O-N 2.87Å; L134-C138 PolarHBondContact O-SG 2.64Å; S135-C138 WeakPolarHBondContact O-CB 3.26Å; S135-C138 PolarHBondContact O-N 3.17Å; C138-L140 VanDerWaalsContact C-N 3.35Å; C138-I141 WeakPolarHBondContact O-CG1 3.3Å; C138-C142 PolarHBondContact O-N 2.91Å; C138-C142 VanDerWaalsContact O-N 3.16Å; C138-C142 PolarHBondContact O-SG 2.88Å
139S95.8Very high94.4Very high5 Ų57.6 Ų7.64%0.0354%0.041CC..Hα-helixtrans-63.5-41.3174.4-172.10000111.4D29 K100 S135 S136 I137 C142 N143D29-S139 PolarHBondContact OD2-OG 3.34Å; K100-S139 PolarHBondContact NZ-OG 2.82Å; S135-S139 WeakPolarHBondContact O-CB 3.07Å; S135-S139 PolarHBondContact O-N 3.45Å; S136-S139 WeakPolarHBondContact O-CB 3.4Å; S136-S139 PolarHBondContact O-N 3.34Å; I137-S139 VanDerWaalsContact C-N 3.29Å; I137-S139 PolarHBondContact O-N 3.34Å; S139-C142 PolarHBondContact O-N 2.77Å; S139-N143 WeakPolarHBondContact O-CB 3.39Å; S139-N143 PolarHBondContact O-N 2.84Å; S139-N143 PolarHBondContact O-ND2 2.94Å; S139-N143 PolarHBondContact OG-ND2 3.49Å
140L95Very high94.2Very high13 Ų138.4 Ų8.47%0.0684%0.044CC..Hα-helixtrans-60.4-50.3177.5-17961.6000112L30 S136 I137 C138 C142 N143 H144 I161 F165L30-L140 HydrophobicContact CD1-CD1 3.65Å; L30-L140 HydrophobicContact CD2-CB 4.48Å; S136-L140 PolarHBondContact O-N 2.83Å; I137-L140 HydrophobicContact CD1-CB 4.49Å; I137-L140 HydrophobicContact CD1-CD2 3.85Å; I137-L140 WeakPolarHBondContact O-CB 3.36Å; I137-L140 PolarHBondContact O-N 3.48Å; C138-L140 VanDerWaalsContact C-N 3.35Å; L140-C142 VanDerWaalsContact C-N 3.27Å; L140-C142 PolarHBondContact O-N 3.34Å; L140-N143 PolarHBondContact O-N 2.66Å; L140-H144 WeakPolarHBondContact CD1-NE2 3.16Å; L140-H144 PolarHBondContact O-CD2 3.46Å; L140-H144 VanDerWaalsContact O-CD2 3.28Å; L140-H144 PolarHBondContact O-N 2.68Å; L140-I161 HydrophobicContact CD1-CG2 3.9Å; L140-F165 HydrophobicContact CB-CD2 4.05Å; L140-F165 HydrophobicContact CB-CE2 4.22Å; L140-F165 HydrophobicContact CD1-CB 3.86Å; L140-F165 HydrophobicContact CD1-CD2 4.29Å; L140-F165 HydrophobicContact CD1-CG 4.11Å; L140-F165 HydrophobicContact CD2-CB 4.49Å; L140-F165 HydrophobicContact CD2-CD1 3.99Å; L140-F165 HydrophobicContact CD2-CD2 4.2Å; L140-F165 HydrophobicContact CD2-CE1 4.24Å; L140-F165 HydrophobicContact CD2-CE2 4.41Å; L140-F165 HydrophobicContact CD2-CG 3.97Å; L140-F165 HydrophobicContact CD2-CZ 4.44Å; L140-F165 HydrophobicContact CG-CD2 4.4Å; L140-F165 HydrophobicContact CG-CG 4.44Å
141I93.8Very high93.6Very high3 Ų39.4 Ų9.42%0.0155%0.054CC..Hα-helixtrans-64.8-32.1179.963.7168000112.6I84 M91 L99 I137 C138 Q145 N423I84-I141 HydrophobicContact CD1-CD1 3.85Å; I84-I141 HydrophobicContact CD1-CG1 4.49Å; I84-I141 HydrophobicContact CD1-CG2 4.35Å; M91-I141 HydrophobicContact SD-CD1 4.22Å; M91-I141 HydrophobicContact SD-CG1 4.43Å; L99-I141 HydrophobicContact CD2-CD1 3.87Å; L99-I141 HydrophobicContact CD2-CG1 4.36Å; I137-I141 PolarHBondContact O-N 2.87Å; C138-I141 WeakPolarHBondContact O-CG1 3.3Å; I141-Q145 PolarHBondContact O-NE2 3.13Å; I141-N423 VanDerWaalsContact CG2-ND2 3.27Å; I141-N423 WeakPolarHBondContact CG2-ND2 3.41Å
142C95.4Very high93Very high0 Ų012.8 Ų12.80%07%0.068CC..Hα-helixtrans-66-50.9173.2-68.90000110.6L96 K100 C138 S139 L140 H144 Q145 F207L96-C142 HydrophobicContact CD1-CB 3.75Å; K100-C142 HydrophobicContact CB-CB 4.46Å; K100-C142 HydrophobicContact CD-CB 4.37Å; C138-C142 PolarHBondContact O-N 2.91Å; C138-C142 VanDerWaalsContact O-N 3.16Å; C138-C142 PolarHBondContact O-SG 2.88Å; S139-C142 PolarHBondContact O-N 2.77Å; L140-C142 VanDerWaalsContact C-N 3.27Å; L140-C142 PolarHBondContact O-N 3.34Å; C142-H144 VanDerWaalsContact C-N 3.29Å; C142-H144 PolarHBondContact O-N 3.11Å; C142-Q145 VanDerWaalsContact O-CB 3.28Å; C142-Q145 WeakPolarHBondContact O-CB 3.31Å; C142-Q145 WeakPolarHBondContact O-CG 3.49Å; C142-Q145 PolarHBondContact O-N 3.42Å; C142-F207 HydrophobicContact CB-CE2 4.34Å; C142-F207 HydrophobicContact CB-CZ 4.15Å; C142-F207 WeakPolarHBondContact O-CE1 3.02Å
143N95.3Very high92.6Very high0 Ų018.7 Ų18.70%09%0.094CC..Hα-helixtrans-61.9-34.5179.6-83.5-69.5000112.3G26 D29 L30 S139 L140 Q145 I146 I161 M202G26-N143 VanDerWaalsContact CA-OD1 3.23Å; G26-N143 WeakPolarHBondContact CA-OD1 3.21Å; D29-N143 PolarHBondContact OD2-ND2 3.22Å; L30-N143 HydrophobicContact CD1-CB 3.74Å; L30-N143 HydrophobicContact CG-CB 4.23Å; S139-N143 WeakPolarHBondContact O-CB 3.39Å; S139-N143 PolarHBondContact O-N 2.84Å; S139-N143 PolarHBondContact O-ND2 2.94Å; S139-N143 PolarHBondContact OG-ND2 3.49Å; L140-N143 PolarHBondContact O-N 2.66Å; N143-Q145 PolarHBondContact O-N 2.92Å; N143-I146 HydrophobicContact CB-CD1 4.41Å; N143-I146 VanDerWaalsContact O-CB 3.25Å; N143-I146 WeakPolarHBondContact O-CB 3.28Å; N143-I146 VanDerWaalsContact O-CG1 3.29Å; N143-I146 WeakPolarHBondContact O-CG1 3.41Å; N143-I146 PolarHBondContact O-N 2.73Å; N143-I146 WeakPolarHBondContact OD1-CD1 3.44Å; N143-I161 HydrophobicContact CB-CG2 3.98Å; N143-I161 WeakPolarHBondContact O-CD1 3.46Å; N143-M202 WeakPolarHBondContact OD1-CE 3.38Å
144H93.8Very high92.3Very high3 Ų320.9 Ų20.91%0.01410%0.103CC..Hα-helixtrans-56.2-24.9172.5-79.4-46.4000114.1L140 C142 I146 S147 S162 V407 F419L140-H144 WeakPolarHBondContact CD1-NE2 3.16Å; L140-H144 PolarHBondContact O-CD2 3.46Å; L140-H144 VanDerWaalsContact O-CD2 3.28Å; L140-H144 PolarHBondContact O-N 2.68Å; C142-H144 VanDerWaalsContact C-N 3.29Å; C142-H144 PolarHBondContact O-N 3.11Å; H144-I146 PolarHBondContact O-N 3.21Å; H144-S147 WeakPolarHBondContact O-CB 3.43Å; H144-S147 PolarHBondContact O-N 2.94Å; H144-S147 PolarHBondContact O-OG 3.35Å; H144-S162 PolarHBondContact CE1-OG 2.94Å; H144-V407 HydrophobicContact CB-CG1 4.28Å; H144-F419 HydrophobicContact CB-CZ 4.44Å
145Q92.8Very high92Very high0 Ų020 Ų200%010%0.098CC..G310 helixtrans-67.2-21.1175.1-56.5-49.6-52.500113.2L96 I141 C142 N143 S147 S148 M214L96-Q145 HydrophobicContact CD1-CB 4.45Å; L96-Q145 HydrophobicContact CD1-CG 3.81Å; L96-Q145 HydrophobicContact CD2-CB 3.86Å; L96-Q145 HydrophobicContact CD2-CG 3.94Å; I141-Q145 PolarHBondContact O-NE2 3.13Å; C142-Q145 VanDerWaalsContact O-CB 3.28Å; C142-Q145 WeakPolarHBondContact O-CB 3.31Å; C142-Q145 WeakPolarHBondContact O-CG 3.49Å; C142-Q145 PolarHBondContact O-N 3.42Å; N143-Q145 PolarHBondContact O-N 2.92Å; Q145-S147 PolarHBondContact O-N 3.15Å; Q145-S148 WeakPolarHBondContact O-CB 3.28Å; Q145-S148 PolarHBondContact O-N 3.36Å; Q145-S148 VanDerWaalsContact O-N 3.08Å; Q145-S148 PolarHBondContact O-OG 2.91Å; Q145-M214 HydrophobicContact CB-CE 4.37Å; Q145-M214 HydrophobicContact CB-CG 4.31Å
146I93.1Very high91.9Very high0 Ų021.9 Ų21.90%011%0.108CC..G310 helixtrans-61.4-33.4175.1-59.8167.4000110.4G22 L23 N143 H144 S148 M149 F150 I161 M202 F207 M214G22-I146 WeakPolarHBondContact O-CD1 3.46Å; L23-I146 HydrophobicContact CB-CG2 4.23Å; L23-I146 HydrophobicContact CD1-CG2 4.34Å; N143-I146 HydrophobicContact CB-CD1 4.41Å; N143-I146 VanDerWaalsContact O-CB 3.25Å; N143-I146 WeakPolarHBondContact O-CB 3.28Å; N143-I146 VanDerWaalsContact O-CG1 3.29Å; N143-I146 WeakPolarHBondContact O-CG1 3.41Å; N143-I146 PolarHBondContact O-N 2.73Å; N143-I146 WeakPolarHBondContact OD1-CD1 3.44Å; H144-I146 PolarHBondContact O-N 3.21Å; I146-S148 PolarHBondContact O-N 2.83Å; I146-S148 VanDerWaalsContact O-N 3.11Å; I146-M149 HydrophobicContact CG2-CE 4.31Å; I146-M149 WeakPolarHBondContact O-CB 3.4Å; I146-M149 WeakPolarHBondContact O-CG 3.47Å; I146-M149 PolarHBondContact O-N 3.24Å; I146-F150 HydrophobicContact CG2-CE2 4.42Å; I146-I161 HydrophobicContact CB-CD1 4.33Å; I146-M202 HydrophobicContact CD1-CE 3.75Å; I146-F207 HydrophobicContact CD1-CE1 4.01Å; I146-F207 HydrophobicContact CD1-CZ 4.04Å; I146-F207 HydrophobicContact CG1-CE1 3.69Å; I146-F207 HydrophobicContact CG1-CZ 4.24Å; I146-M214 HydrophobicContact CG1-CE 4.16Å
147S91.2Very high91.9Very high0 Ų022.1 Ų22.10%011%0.109CC..G310 helixtrans-58.1-26.8176.473.30000113.3H144 Q145 M149 F150H144-S147 WeakPolarHBondContact O-CB 3.43Å; H144-S147 PolarHBondContact O-N 2.94Å; H144-S147 PolarHBondContact O-OG 3.35Å; Q145-S147 PolarHBondContact O-N 3.15Å; S147-M149 PolarHBondContact O-N 3.34Å; S147-F150 CarbonylContact O-C 3.43Å; S147-F150 PolarHBondContact O-N 2.97Å
148S89.3Confident91.9Very high7 Ų721.3 Ų21.35%0.04911%0.105CC..G310 helixtrans-66-17.8177.671.50000113.2Q145 I146 F150 M214 A215Q145-S148 WeakPolarHBondContact O-CB 3.28Å; Q145-S148 PolarHBondContact O-N 3.36Å; Q145-S148 VanDerWaalsContact O-N 3.08Å; Q145-S148 PolarHBondContact O-OG 2.91Å; I146-S148 PolarHBondContact O-N 2.83Å; I146-S148 VanDerWaalsContact O-N 3.11Å; S148-F150 VanDerWaalsContact C-N 3.28Å; S148-M214 WeakPolarHBondContact OG-CB 3.09Å; S148-A215 PolarHBondContact OG-N 3.01Å
149M90.3Very high91.8Very high0 Ų021 Ų210%010%0.103CC..G310 helixtrans-78.2-11.8172.6-48.1-172.3-151.800113.2R19 I146 S147 P151 M214 F217 A218R19-M149 HydrophobicContact CB-SD 4.32Å; R19-M149 HydrophobicContact CG-CB 3.8Å; R19-M149 HydrophobicContact CG-CG 4.3Å; R19-M149 HydrophobicContact CG-SD 3.56Å; R19-M149 VanDerWaalsContact CG-SD 3.56Å; R19-M149 PolarHBondContact NE-O 2.98Å; R19-M149 PolarHBondContact NH2-O 3.2Å; I146-M149 HydrophobicContact CG2-CE 4.31Å; I146-M149 WeakPolarHBondContact O-CB 3.4Å; I146-M149 WeakPolarHBondContact O-CG 3.47Å; I146-M149 PolarHBondContact O-N 3.24Å; S147-M149 PolarHBondContact O-N 3.34Å; M149-P151 VanDerWaalsContact C-CD 3.5Å; M149-P151 WeakPolarHBondContact O-CD 3.28Å; M149-M214 HydrophobicContact CE-CE 3.1Å; M149-M214 HydrophobicContact CE-SD 3.91Å; M149-M214 WeakPolarHBondContact CG-O 3.15Å; M149-F217 HydrophobicContact CG-CB 4.29Å; M149-F217 HydrophobicContact SD-CB 4.22Å; M149-F217 HydrophobicContact SD-CD2 4.28Å; M149-A218 WeakPolarHBondContact O-CB 3.35Å
150F90.2Very high91.7Very high17 Ų1722.2 Ų22.28%0.07511%0.109CC..  trans-124.968.9-175-63.8-87.2000111.4R19 L23 I146 S147 S148 H152 F153 R154R19-F150 HydrophobicContact CB-CE1 4.3Å; R19-F150 HydrophobicContact CB-CE2 4.16Å; R19-F150 HydrophobicContact CB-CZ 3.68Å; R19-F150 WeakPolarHBondContact O-CZ 3.38Å; L23-F150 HydrophobicContact CB-CE2 4.04Å; L23-F150 HydrophobicContact CB-CZ 4.28Å; L23-F150 HydrophobicContact CD2-CE2 4.17Å; L23-F150 HydrophobicContact CD2-CZ 4.2Å; I146-F150 HydrophobicContact CG2-CE2 4.42Å; S147-F150 CarbonylContact O-C 3.43Å; S147-F150 PolarHBondContact O-N 2.97Å; S148-F150 VanDerWaalsContact C-N 3.28Å; F150-H152 VanDerWaalsContact C-N 3.26Å; F150-H152 PolarHBondContact O-N 3.14Å; F150-F153 CarbonylContact O-C 3.48Å; F150-F153 PolarHBondContact O-N 2.98Å; F150-R154 VanDerWaalsContact O-CA 3.24Å; F150-R154 WeakPolarHBondContact O-CA 3.38Å; F150-R154 WeakPolarHBondContact O-CB 3.24Å; F150-R154 PolarHBondContact O-N 3.32Å
151P83.5Confident91.7Very high67 Ų6721.6 Ų21.644%0.43511%0.106SC..G310 helixtrans-60.5-30.1-17421-31.7000114.4M149 A218M149-P151 VanDerWaalsContact C-CD 3.5Å; M149-P151 WeakPolarHBondContact O-CD 3.28Å; P151-A218 HydrophobicContact CG-CB 3.86Å
152H84Confident91.7Very high111 Ų11121.5 Ų21.551%0.51411%0.106SC..G310 helixtrans-81.6-23.8179.9-65.2-35.5000115F150 R335F150-H152 VanDerWaalsContact C-N 3.26Å; F150-H152 PolarHBondContact O-N 3.14Å; H152-R335 PolarHBondContact CE1-NH1 3.25Å; H152-R335 PolarHBondContact ND1-NH1 3.48Å
153F88.3Confident91.5Very high124 Ų12421.5 Ų21.554%0.54411%0.106SC..G310 helixtrans-125.933.8-178.4-56.6-67.3000110.9F150 I156 C157 D328F150-F153 CarbonylContact O-C 3.48Å; F150-F153 PolarHBondContact O-N 2.98Å; F153-I156 HydrophobicContact CB-CB 4.49Å; F153-I156 HydrophobicContact CD1-CD1 4.16Å; F153-I156 PolarHBondContact O-N 3.13Å; F153-C157 PolarHBondContact O-N 3.39Å; F153-C157 PolarHBondContact O-SG 3.46Å; F153-C157 VanDerWaalsContact O-SG 3.36Å; F153-D328 VanDerWaalsContact CA-OD2 3.25Å; F153-D328 WeakPolarHBondContact CA-OD2 3.24Å
154R90.2Very high91.5Very high46 Ų4621.5 Ų21.517%0.17411%0.106CC..Hα-helixtrans-66.1-42.9-168.9-169.4-179.7-168.9179.27.6111.1F150 C157 I158 D328 L411F150-R154 VanDerWaalsContact O-CA 3.24Å; F150-R154 WeakPolarHBondContact O-CA 3.38Å; F150-R154 WeakPolarHBondContact O-CB 3.24Å; F150-R154 PolarHBondContact O-N 3.32Å; R154-C157 PolarHBondContact O-N 3.36Å; R154-I158 HydrophobicContact CG-CD1 3.93Å; R154-I158 WeakPolarHBondContact O-CD1 3.39Å; R154-I158 VanDerWaalsContact O-CG1 3.23Å; R154-I158 WeakPolarHBondContact O-CG1 3.44Å; R154-I158 PolarHBondContact O-N 3.32Å; R154-D328 PolarHBondContact N-OD1 3.38Å; R154-L411 PolarHBondContact NH1-O 2.98Å; R154-L411 VanDerWaalsContact NH2-CB 3.34Å
155G90Very high91.5Very high1 Ų121.7 Ų21.71%0.0111%0.106CC..Hα-helixtrans-61.2-44.7176.200000111.6I158 S159 D328G155-I158 PolarHBondContact O-N 3.34Å; G155-S159 VanDerWaalsContact O-CB 3.28Å; G155-S159 WeakPolarHBondContact O-CB 3.47Å; G155-S159 PolarHBondContact O-N 3.13Å; G155-S159 PolarHBondContact O-OG 3.06Å; G155-D328 VanDerWaalsContact CA-OD1 3.27Å; G155-D328 WeakPolarHBondContact CA-OD1 3.42Å; G155-D328 PolarHBondContact N-OD1 3.29Å; G155-D328 PolarHBondContact N-OD2 2.66Å
156I94.3Very high91.2Very high41 Ų4121.9 Ų21.921%0.2111%0.107CC..Hα-helixtrans-58.8-50.3173-68.7166.4000110.9F153 I158 S159 L160 V325 D328F153-I156 HydrophobicContact CB-CB 4.49Å; F153-I156 HydrophobicContact CD1-CD1 4.16Å; F153-I156 PolarHBondContact O-N 3.13Å; I156-I158 PolarHBondContact O-N 3.48Å; I156-S159 WeakPolarHBondContact CA-OG 3.3Å; I156-S159 PolarHBondContact O-N 2.81Å; I156-S159 PolarHBondContact O-OG 3.23Å; I156-L160 HydrophobicContact CG2-CD1 3.76Å; I156-L160 HydrophobicContact CG2-CG 4.27Å; I156-L160 WeakPolarHBondContact O-CB 3.47Å; I156-L160 WeakPolarHBondContact O-CG 3.47Å; I156-L160 PolarHBondContact O-N 2.79Å; I156-V325 HydrophobicContact CD1-CG2 3.76Å; I156-V325 HydrophobicContact CG1-CG2 4.02Å; I156-D328 VanDerWaalsContact CG1-OD2 3.27Å; I156-D328 WeakPolarHBondContact CG1-OD2 3.38Å; I156-D328 PolarHBondContact N-OD2 3.38Å
157C94.1Very high91.1Very high4 Ų422 Ų223%0.02711%0.108CC..Hα-helixtrans-58.7-45.4177.9-67.90000112.4L23 F153 R154 I161L23-C157 HydrophobicContact CD1-CB 4.12Å; F153-C157 PolarHBondContact O-N 3.39Å; F153-C157 PolarHBondContact O-SG 3.46Å; F153-C157 VanDerWaalsContact O-SG 3.36Å; R154-C157 PolarHBondContact O-N 3.36Å; C157-I161 WeakPolarHBondContact O-CB 3.29Å; C157-I161 WeakPolarHBondContact O-CD1 3.37Å; C157-I161 WeakPolarHBondContact O-CG1 3.39Å; C157-I161 PolarHBondContact O-N 3.43Å; C157-I161 VanDerWaalsContact O-N 3.09Å
158I93.1Very high91.2Very high0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-60.9-48177.3-69.7163.5000110.4R154 G155 I156 I161 S162 V407 S408 L411R154-I158 HydrophobicContact CG-CD1 3.93Å; R154-I158 WeakPolarHBondContact O-CD1 3.39Å; R154-I158 VanDerWaalsContact O-CG1 3.23Å; R154-I158 WeakPolarHBondContact O-CG1 3.44Å; R154-I158 PolarHBondContact O-N 3.32Å; G155-I158 PolarHBondContact O-N 3.34Å; I156-I158 PolarHBondContact O-N 3.48Å; I158-I161 PolarHBondContact O-N 2.94Å; I158-S162 PolarHBondContact O-N 3.01Å; I158-S162 PolarHBondContact O-OG 3.46Å; I158-V407 HydrophobicContact CD1-CG1 4.22Å; I158-V407 HydrophobicContact CG1-CG1 4.3Å; I158-V407 HydrophobicContact CG2-CB 3.84Å; I158-V407 HydrophobicContact CG2-CG1 3.72Å; I158-S408 WeakPolarHBondContact CD1-OG 3.45Å; I158-L411 HydrophobicContact CD1-CD1 3.7Å; I158-L411 HydrophobicContact CG1-CD1 4.33Å
159S94.1Very high91.2Very high0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-62.9-43.2-178.368.90000112.2G155 I156 I161 S162 G163 A320 G324G155-S159 VanDerWaalsContact O-CB 3.28Å; G155-S159 WeakPolarHBondContact O-CB 3.47Å; G155-S159 PolarHBondContact O-N 3.13Å; G155-S159 PolarHBondContact O-OG 3.06Å; I156-S159 WeakPolarHBondContact CA-OG 3.3Å; I156-S159 PolarHBondContact O-N 2.81Å; I156-S159 PolarHBondContact O-OG 3.23Å; S159-I161 PolarHBondContact O-N 2.61Å; S159-S162 PolarHBondContact O-N 3.4Å; S159-G163 PolarHBondContact O-N 2.82Å; S159-A320 WeakPolarHBondContact CB-O 3.42Å; S159-A320 WeakPolarHBondContact O-CB 3.48Å; S159-A320 PolarHBondContact OG-O 3.32Å; S159-G324 VanDerWaalsContact OG-CA 3.28Å; S159-G324 WeakPolarHBondContact OG-CA 3.41Å; S159-G324 PolarHBondContact OG-N 2.97Å
160L94.9Very high91.1Very high29 Ų2923.6 Ų23.615%0.15212%0.117CC..Hα-helixtrans-62.6-42.9176.8-77.1172.1000111.7I27 I156 G163 A164 F317 P321I27-L160 HydrophobicContact CD1-CB 4.1Å; I27-L160 HydrophobicContact CD1-CD1 4.3Å; I27-L160 HydrophobicContact CG1-CB 4.44Å; I156-L160 HydrophobicContact CG2-CD1 3.76Å; I156-L160 HydrophobicContact CG2-CG 4.27Å; I156-L160 WeakPolarHBondContact O-CB 3.47Å; I156-L160 WeakPolarHBondContact O-CG 3.47Å; I156-L160 PolarHBondContact O-N 2.79Å; L160-G163 PolarHBondContact O-N 3.32Å; L160-A164 VanDerWaalsContact O-CB 3.28Å; L160-A164 WeakPolarHBondContact O-CB 3.13Å; L160-A164 PolarHBondContact O-N 3.44Å; L160-F317 HydrophobicContact CD2-CE2 4.18Å; L160-F317 HydrophobicContact CD2-CZ 4.31Å; L160-P321 HydrophobicContact CD2-CG 3.86Å
161I94.8Very high91.2Very high0 Ų023.3 Ų23.30%012%0.117CC..Hα-helixtrans-63.4-47.2177-73.4172.6000110.6L23 L30 L140 N143 I146 C157 I158 S159 A164 F165L23-I161 HydrophobicContact CD1-CD1 4.19Å; L23-I161 HydrophobicContact CD1-CG1 4.39Å; L30-I161 HydrophobicContact CD1-CB 4.25Å; L30-I161 HydrophobicContact CD1-CG2 3.32Å; L30-I161 WeakPolarHBondContact CD1-O 3.46Å; L140-I161 HydrophobicContact CD1-CG2 3.9Å; N143-I161 HydrophobicContact CB-CG2 3.98Å; N143-I161 WeakPolarHBondContact O-CD1 3.46Å; I146-I161 HydrophobicContact CB-CD1 4.33Å; C157-I161 WeakPolarHBondContact O-CB 3.29Å; C157-I161 WeakPolarHBondContact O-CD1 3.37Å; C157-I161 WeakPolarHBondContact O-CG1 3.39Å; C157-I161 PolarHBondContact O-N 3.43Å; C157-I161 VanDerWaalsContact O-N 3.09Å; I158-I161 PolarHBondContact O-N 2.94Å; S159-I161 PolarHBondContact O-N 2.61Å; I161-A164 PolarHBondContact O-N 2.9Å; I161-F165 PolarHBondContact O-N 3.22Å; I161-F165 VanDerWaalsContact O-N 3.14Å
162S92.5Very high91.5Very high2 Ų220.1 Ų20.11%0.01410%0.096CC..Hα-helixtrans-63.9-42.9174.4-66.20000112.3H144 I158 S159 A164 F165 D166H144-S162 PolarHBondContact CE1-OG 2.94Å; I158-S162 PolarHBondContact O-N 3.01Å; I158-S162 PolarHBondContact O-OG 3.46Å; S159-S162 PolarHBondContact O-N 3.4Å; S162-A164 VanDerWaalsContact C-N 3.33Å; S162-A164 PolarHBondContact O-N 2.82Å; S162-F165 WeakPolarHBondContact O-CB 3.47Å; S162-F165 PolarHBondContact O-N 2.98Å; S162-D166 PolarHBondContact O-N 3.44Å
163G92.7Very high91.7Very high0 Ų019 Ų190%09%0.088CC..Hα-helixtrans-64.7-37.2179.200000112.5S159 L160 D166 S167S159-G163 PolarHBondContact O-N 2.82Å; L160-G163 PolarHBondContact O-N 3.32Å; G163-D166 PolarHBondContact O-N 2.96Å; G163-S167 VanDerWaalsContact O-CB 3.31Å; G163-S167 WeakPolarHBondContact O-CB 3.45Å; G163-S167 PolarHBondContact O-N 3.18Å; G163-S167 PolarHBondContact O-OG 3.47Å
164A94.1Very high91.8Very high0 Ų016.2 Ų16.20%08%0.081CC..Hα-helixtrans-63.4-45.8173.200000111.1I27 L30 F31 L160 I161 S162 D166 S167 S168 F317I27-A164 HydrophobicContact CG2-CB 4.08Å; L30-A164 HydrophobicContact CB-CB 4.16Å; F31-A164 HydrophobicContact CB-CB 4.22Å; L160-A164 VanDerWaalsContact O-CB 3.28Å; L160-A164 WeakPolarHBondContact O-CB 3.13Å; L160-A164 PolarHBondContact O-N 3.44Å; I161-A164 PolarHBondContact O-N 2.9Å; S162-A164 VanDerWaalsContact C-N 3.33Å; S162-A164 PolarHBondContact O-N 2.82Å; A164-D166 PolarHBondContact O-N 2.83Å; A164-S167 PolarHBondContact O-N 2.84Å; A164-S168 PolarHBondContact O-N 3.46Å; A164-S168 VanDerWaalsContact O-N 3.12Å; A164-F317 HydrophobicContact CB-CD2 4.16Å; A164-F317 HydrophobicContact CB-CE2 4.31Å
165F93.6Very high91.9Very high7 Ų714.6 Ų14.63%0.0318%0.076CC..Hα-helixtrans-60.5-42.1175178.3-89.6000112.8L30 G35 Y38 S136 L140 I161 S162 S167 S168L30-F165 HydrophobicContact CB-CB 4.32Å; L30-F165 HydrophobicContact CD1-CB 4.45Å; L30-F165 HydrophobicContact CD2-CD2 4.26Å; G35-F165 VanDerWaalsContact N-CE2 3.34Å; Y38-F165 HydrophobicContact CD2-CE1 4.24Å; Y38-F165 AromaticContact CE2-CE1 3.8Å; Y38-F165 HydrophobicContact CE2-CE1 3.8Å; Y38-F165 HydrophobicContact CE2-CZ 4.04Å; S136-F165 WeakPolarHBondContact O-CE2 3.42Å; L140-F165 HydrophobicContact CB-CD2 4.05Å; L140-F165 HydrophobicContact CB-CE2 4.22Å; L140-F165 HydrophobicContact CD1-CB 3.86Å; L140-F165 HydrophobicContact CD1-CD2 4.29Å; L140-F165 HydrophobicContact CD1-CG 4.11Å; L140-F165 HydrophobicContact CD2-CB 4.49Å; L140-F165 HydrophobicContact CD2-CD1 3.99Å; L140-F165 HydrophobicContact CD2-CD2 4.2Å; L140-F165 HydrophobicContact CD2-CE1 4.24Å; L140-F165 HydrophobicContact CD2-CE2 4.41Å; L140-F165 HydrophobicContact CD2-CG 3.97Å; L140-F165 HydrophobicContact CD2-CZ 4.44Å; L140-F165 HydrophobicContact CG-CD2 4.4Å; L140-F165 HydrophobicContact CG-CG 4.44Å; I161-F165 PolarHBondContact O-N 3.22Å; I161-F165 VanDerWaalsContact O-N 3.14Å; S162-F165 WeakPolarHBondContact O-CB 3.47Å; S162-F165 PolarHBondContact O-N 2.98Å; F165-S167 VanDerWaalsContact C-N 3.3Å; F165-S167 PolarHBondContact O-N 3.31Å; F165-S168 PolarHBondContact O-N 3.43Å; F165-S168 PolarHBondContact O-OG 2.86Å
166D88Confident91.8Very high4 Ų416.2 Ų16.22%0.0219%0.087CC..Hα-helixtrans-66.9-35.2178.2-72.7-21000112.2S162 G163 A164 S168 T169 R399S162-D166 PolarHBondContact O-N 3.44Å; G163-D166 PolarHBondContact O-N 2.96Å; A164-D166 PolarHBondContact O-N 2.83Å; D166-S168 VanDerWaalsContact C-N 3.31Å; D166-S168 PolarHBondContact O-N 3.01Å; D166-T169 PolarHBondContact O-OG1 3.16Å; D166-R399 IonicContact OD1-CZ 2.67Å; D166-R399 IonicContact OD1-NE 3.15Å; D166-R399 PolarHBondContact OD1-NE 2.88Å; D166-R399 IonicContact OD1-NH2 2.7Å; D166-R399 PolarHBondContact OD1-NH2 2.85Å; D166-R399 IonicContact OD2-NE 3.17Å; D166-R399 PolarHBondContact OD2-NE 3.31Å; D166-R399 VanDerWaalsContact OD2-NE 3.15Å
167S91.3Very high91.6Very high1 Ų120 Ų201%0.00710%0.102CC..Hα-helixtrans-80.8-12.2-177.5-530000113.4G163 A164 F165 T169 V170 M314 F317G163-S167 VanDerWaalsContact O-CB 3.31Å; G163-S167 WeakPolarHBondContact O-CB 3.45Å; G163-S167 PolarHBondContact O-N 3.18Å; G163-S167 PolarHBondContact O-OG 3.47Å; A164-S167 PolarHBondContact O-N 2.84Å; F165-S167 VanDerWaalsContact C-N 3.3Å; F165-S167 PolarHBondContact O-N 3.31Å; S167-T169 PolarHBondContact O-N 3.46Å; S167-V170 WeakPolarHBondContact O-CB 3.28Å; S167-V170 WeakPolarHBondContact O-CG1 3.23Å; S167-V170 PolarHBondContact O-N 2.89Å; S167-M314 WeakPolarHBondContact CB-O 3.4Å; S167-M314 PolarHBondContact OG-O 3.29Å; S167-M314 VanDerWaalsContact OG-O 3.06Å; S167-F317 VanDerWaalsContact OG-CB 3.22Å; S167-F317 WeakPolarHBondContact OG-CB 3.49Å; S167-F317 PolarHBondContact OG-N 2.83Å
168S92.5Very high91.5Very high0 Ų026.1 Ų26.10%013%0.126CC..THydrogen-bonded Turntrans-63.2-11.717882.40000113.5L30 F31 G34 G35 Y36 A164 F165 D166 V170 V171L30-S168 VanDerWaalsContact O-CB 3.3Å; L30-S168 WeakPolarHBondContact O-CB 3.36Å; F31-S168 WeakPolarHBondContact O-CA 3.18Å; F31-S168 WeakPolarHBondContact O-CB 2.93Å; G34-S168 VanDerWaalsContact C-OG 3.29Å; G35-S168 WeakPolarHBondContact CA-OG 3.4Å; G35-S168 PolarHBondContact N-OG 3.34Å; Y36-S168 WeakPolarHBondContact CB-O 3.11Å; Y36-S168 PolarHBondContact N-OG 2.61Å; Y36-S168 VanDerWaalsContact N-OG 3.09Å; A164-S168 PolarHBondContact O-N 3.46Å; A164-S168 VanDerWaalsContact O-N 3.12Å; F165-S168 PolarHBondContact O-N 3.43Å; F165-S168 PolarHBondContact O-OG 2.86Å; D166-S168 VanDerWaalsContact C-N 3.31Å; D166-S168 PolarHBondContact O-N 3.01Å; S168-V170 PolarHBondContact O-N 2.81Å; S168-V171 WeakPolarHBondContact O-CB 2.99Å; S168-V171 WeakPolarHBondContact O-CG2 3.1Å; S168-V171 PolarHBondContact O-N 2.9Å
169T88.5Confident91.4Very high8 Ų828.4 Ų28.45%0.04914%0.136CC..Hα-helixtrans-55.1-25.2167.954.40000112.6D166 S167 V171 A172 Y173D166-T169 PolarHBondContact O-OG1 3.16Å; S167-T169 PolarHBondContact O-N 3.46Å; T169-V171 PolarHBondContact O-N 2.94Å; T169-A172 PolarHBondContact O-N 3.42Å; T169-Y173 PolarHBondContact O-N 3.37Å
170V89.7Confident91.1Very high33 Ų3333.4 Ų33.420%0.217%0.168CC..Hα-helixtrans-54.4-33.5171.572.80000112.7F31 S167 S168 A172 Y173 V174 M314F31-V170 HydrophobicContact CE1-CG1 4.01Å; F31-V170 HydrophobicContact CZ-CG1 4.02Å; S167-V170 WeakPolarHBondContact O-CB 3.28Å; S167-V170 WeakPolarHBondContact O-CG1 3.23Å; S167-V170 PolarHBondContact O-N 2.89Å; S168-V170 PolarHBondContact O-N 2.81Å; V170-A172 PolarHBondContact O-N 3.21Å; V170-Y173 WeakPolarHBondContact O-CB 3.35Å; V170-Y173 PolarHBondContact O-N 3.22Å; V170-V174 HydrophobicContact CG2-CG2 4.11Å; V170-V174 WeakPolarHBondContact O-CB 3.43Å; V170-V174 VanDerWaalsContact O-CG2 3.27Å; V170-V174 WeakPolarHBondContact O-CG2 3.47Å; V170-V174 PolarHBondContact O-N 3.13Å; V170-M314 HydrophobicContact CB-CE 4.41Å; V170-M314 HydrophobicContact CB-CG 3.95Å; V170-M314 HydrophobicContact CB-SD 3.76Å; V170-M314 HydrophobicContact CG2-CE 4.46Å; V170-M314 HydrophobicContact CG2-CG 4.44Å; V170-M314 HydrophobicContact CG2-SD 3.64Å
171V92.2Very high91Very high12 Ų1241.7 Ų41.77%0.07320%0.199CC..Hα-helixtrans-62.5-46.2-179.5176.40000110.4S168 T169 Y173 V174 I175 L191S168-V171 WeakPolarHBondContact O-CB 2.99Å; S168-V171 WeakPolarHBondContact O-CG2 3.1Å; S168-V171 PolarHBondContact O-N 2.9Å; T169-V171 PolarHBondContact O-N 2.94Å; V171-Y173 VanDerWaalsContact C-N 3.3Å; V171-Y173 PolarHBondContact O-N 3.19Å; V171-V174 PolarHBondContact O-N 3.02Å; V171-I175 HydrophobicContact CG1-CD1 4.15Å; V171-I175 VanDerWaalsContact O-CG1 3.23Å; V171-I175 WeakPolarHBondContact O-CG1 3.37Å; V171-I175 PolarHBondContact O-N 2.84Å; V171-L191 HydrophobicContact CG1-CD1 3.66Å; V171-L191 HydrophobicContact CG1-CD2 3.81Å; V171-L191 HydrophobicContact CG1-CG 4.4Å
172A89.6Confident90.7Very high0 Ų046.3 Ų46.30%022%0.22CC..Hα-helixtrans-63.9-35.8176.700000112.3G39 S42 L43 T169 V170 S176G39-A172 WeakPolarHBondContact O-CB 3.35Å; S42-A172 PolarHBondContact OG-O 3.17Å; L43-A172 HydrophobicContact CD1-CB 3.99Å; L43-A172 WeakPolarHBondContact CD2-O 3.32Å; L43-A172 HydrophobicContact CG-CB 4.18Å; T169-A172 PolarHBondContact O-N 3.42Å; V170-A172 PolarHBondContact O-N 3.21Å; A172-S176 WeakPolarHBondContact O-CB 3.49Å; A172-S176 PolarHBondContact O-N 2.84Å
173Y87.3Confident90.8Very high87 Ų8748.6 Ų48.634%0.34124%0.235SC..Hα-helixtrans-67.3-44.2174.7176.2-97.6000112.2S42 T169 V170 V171 S176 K177 M314S42-Y173 PolarHBondContact OG-N 3.35Å; T169-Y173 PolarHBondContact O-N 3.37Å; V170-Y173 WeakPolarHBondContact O-CB 3.35Å; V170-Y173 PolarHBondContact O-N 3.22Å; V171-Y173 VanDerWaalsContact C-N 3.3Å; V171-Y173 PolarHBondContact O-N 3.19Å; Y173-S176 WeakPolarHBondContact O-CB 3.33Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 VanDerWaalsContact O-N 3.16Å; Y173-K177 HydrophobicContact CE1-CD 4.23Å; Y173-K177 PolarHBondContact O-N 2.82Å; Y173-M314 HydrophobicContact CD1-CE 3.99Å; Y173-M314 HydrophobicContact CD2-CE 4.18Å; Y173-M314 HydrophobicContact CG-CE 3.59Å
174V90.9Very high90.8Very high66 Ų6648.8 Ų48.840%0.424%0.236SC..Hα-helixtrans-62.5-46.7177.3169.80000110.6V170 V171 S176 K177 Y178V170-V174 HydrophobicContact CG2-CG2 4.11Å; V170-V174 WeakPolarHBondContact O-CB 3.43Å; V170-V174 VanDerWaalsContact O-CG2 3.27Å; V170-V174 WeakPolarHBondContact O-CG2 3.47Å; V170-V174 PolarHBondContact O-N 3.13Å; V171-V174 PolarHBondContact O-N 3.02Å; V174-S176 PolarHBondContact O-N 3.11Å; V174-K177 PolarHBondContact O-N 3.41Å; V174-Y178 HydrophobicContact CG1-CD2 3.78Å; V174-Y178 HydrophobicContact CG1-CE2 4.14Å; V174-Y178 VanDerWaalsContact O-CD2 3.31Å; V174-Y178 WeakPolarHBondContact O-CD2 3.45Å; V174-Y178 PolarHBondContact O-N 3.31Å
175I92.2Very high90.8Very high12 Ų1252.9 Ų52.96%0.06226%0.255CS..Hα-helixtrans-55.5-45173.7-65.1169.3000110.1L43 V171 H179 L184 F188 L191L43-I175 HydrophobicContact CD2-CB 4.01Å; L43-I175 HydrophobicContact CD2-CG2 3.7Å; V171-I175 HydrophobicContact CG1-CD1 4.15Å; V171-I175 VanDerWaalsContact O-CG1 3.23Å; V171-I175 WeakPolarHBondContact O-CG1 3.37Å; V171-I175 PolarHBondContact O-N 2.84Å; I175-H179 WeakPolarHBondContact O-CB 3.4Å; I175-H179 PolarHBondContact O-N 3.31Å; I175-L184 HydrophobicContact CG2-CD1 3.55Å; I175-F188 HydrophobicContact CD1-CD1 4.44Å; I175-F188 HydrophobicContact CD1-CE1 3.99Å; I175-F188 HydrophobicContact CD1-CZ 4.19Å; I175-L191 HydrophobicContact CD1-CD1 3.52Å; I175-L191 HydrophobicContact CG1-CD1 4.37Å
176S88.3Confident90.8Very high35 Ų3560 Ų6025%0.24528%0.282CS..Hα-helixtrans-60.9-48.1-179.4-1750000112.7S42 A172 Y173 V174 H179S42-S176 WeakPolarHBondContact O-CB 3.36Å; S42-S176 PolarHBondContact O-OG 3.02Å; A172-S176 WeakPolarHBondContact O-CB 3.49Å; A172-S176 PolarHBondContact O-N 2.84Å; Y173-S176 WeakPolarHBondContact O-CB 3.33Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 VanDerWaalsContact O-N 3.16Å; V174-S176 PolarHBondContact O-N 3.11Å; S176-H179 WeakPolarHBondContact O-CB 3.23Å
177K89.2Confident91.2Very high121 Ų12160.2 Ų60.253%0.52628%0.284SS..Hα-helixtrans-66.2-39.2-178.2-173.7171.4-175.7171.70113.4Y173 V174Y173-K177 HydrophobicContact CE1-CD 4.23Å; Y173-K177 PolarHBondContact O-N 2.82Å; V174-K177 PolarHBondContact O-N 3.41Å
178Y92.1Very high91.4Very high132 Ų13260.2 Ų60.252%0.51828%0.284SS..Hα-helixtrans-94.4-2.2-176.2-71.1-78.1000114.1V174 P180 Y181 F182V174-Y178 HydrophobicContact CG1-CD2 3.78Å; V174-Y178 HydrophobicContact CG1-CE2 4.14Å; V174-Y178 VanDerWaalsContact O-CD2 3.31Å; V174-Y178 WeakPolarHBondContact O-CD2 3.45Å; V174-Y178 PolarHBondContact O-N 3.31Å; Y178-P180 VanDerWaalsContact C-N 3.29Å; Y178-Y181 HydrophobicContact CD1-CD2 4.38Å; Y178-Y181 PolarHBondContact O-N 3.31Å; Y178-F182 PolarHBondContact O-N 3.47Å
179H90.2Very high91.6Very high48 Ų4861.8 Ų61.822%0.22229%0.292CS..THydrogen-bonded Turntrans-48.6-39.9177.4-179.4-96.2000115I46 I175 S176 Y181 F182 L184I46-H179 HydrophobicContact CD1-CB 3.51Å; I46-H179 HydrophobicContact CG1-CB 4.26Å; I46-H179 WeakPolarHBondContact CG2-NE2 3.33Å; I175-H179 WeakPolarHBondContact O-CB 3.4Å; I175-H179 PolarHBondContact O-N 3.31Å; S176-H179 WeakPolarHBondContact O-CB 3.23Å; H179-Y181 PolarHBondContact O-N 3.29Å; H179-F182 WeakPolarHBondContact CA-O 3.39Å; H179-F182 CarbonylContact O-C 3.52Å; H179-F182 PolarHBondContact O-N 3.46Å; H179-F182 VanDerWaalsContact O-O 3.09Å; H179-L184 PolarHBondContact CD2-N 2.83Å
180P89.3Confident91.9Very high104 Ų10464.5 Ų64.568%0.67531%0.311SS*.THydrogen-bonded Turntrans-61.9-25.5177.6-24.235.7000114.3Y178Y178-P180 VanDerWaalsContact C-N 3.29Å
181Y91.1Very high92.2Very high203 Ų20364 Ų6480%0.79631%0.307SS*.THydrogen-bonded Turntrans-101.2-28.2-178.6-55.2-77.9000112.6Y178 H179Y178-Y181 HydrophobicContact CD1-CD2 4.38Å; Y178-Y181 PolarHBondContact O-N 3.31Å; H179-Y181 PolarHBondContact O-N 3.29Å
182F90.4Very high92.5Very high98 Ų9864 Ų6443%0.4331%0.308SS..SBendtrans-134.6117.2-176.5-165.8-110.6000110Y178 H179 W186 S187Y178-F182 PolarHBondContact O-N 3.47Å; H179-F182 WeakPolarHBondContact CA-O 3.39Å; H179-F182 CarbonylContact O-C 3.52Å; H179-F182 PolarHBondContact O-N 3.46Å; H179-F182 VanDerWaalsContact O-O 3.09Å; F182-W186 HydrophobicContact CD1-CB 4.36Å; F182-W186 HydrophobicContact CE1-CB 3.62Å; F182-W186 HydrophobicContact CE2-CB 3.99Å; F182-W186 HydrophobicContact CZ-CB 3.41Å; F182-W186 VanDerWaalsContact CZ-CB 3.41Å; F182-W186 HydrophobicContact CZ-CG 4.46Å; F182-S187 VanDerWaalsContact CD1-OG 3.26Å; F182-S187 WeakPolarHBondContact CD1-OG 3.15Å; F182-S187 VanDerWaalsContact CE1-N 3.31Å
183S92.8Very high92.8Very high50 Ų5068.5 Ų68.535%0.3533%0.331SS..  trans-53.2142.1-175.9173.60000112.4Q185 W186 S187S183-Q185 PolarHBondContact O-N 2.85Å; S183-Q185 VanDerWaalsContact O-N 3.17Å; S183-Q185 PolarHBondContact OG-N 3.38Å; S183-W186 PolarHBondContact O-N 3.46Å; S183-S187 PolarHBondContact O-N 3.17Å; S183-S187 VanDerWaalsContact O-N 3.07Å; S183-S187 PolarHBondContact O-OG 2.64Å; S183-S187 VanDerWaalsContact O-OG 3.07Å
184L92.7Very high93.3Very high3 Ų365.4 Ų65.42%0.01633%0.326CS..Hα-helixtrans-51.3-39.8174.8-167.468.7000111.9L43 I46 Y47 L50 I175 H179 S187 F188L43-L184 HydrophobicContact CD2-CD1 4.45Å; I46-L184 HydrophobicContact CG2-CB 4.47Å; I46-L184 HydrophobicContact CG2-CD1 4.08Å; I46-L184 HydrophobicContact CG2-CD2 3.88Å; I46-L184 HydrophobicContact CG2-CG 4.36Å; Y47-L184 HydrophobicContact CD1-CD2 4.34Å; Y47-L184 HydrophobicContact CE1-CD2 3.79Å; L50-L184 HydrophobicContact CD1-CD2 3.5Å; L50-L184 VanDerWaalsContact CD1-CD2 3.5Å; I175-L184 HydrophobicContact CG2-CD1 3.55Å; H179-L184 PolarHBondContact CD2-N 2.83Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 2.99Å; L184-F188 HydrophobicContact CD1-CD2 4.04Å; L184-F188 HydrophobicContact CD1-CE2 3.51Å; L184-F188 HydrophobicContact CD1-CZ 4.46Å; L184-F188 HydrophobicContact CD2-CE2 4.16Å; L184-F188 HydrophobicContact CG-CD2 3.81Å; L184-F188 HydrophobicContact CG-CE2 3.66Å; L184-F188 WeakPolarHBondContact O-CD2 3.5Å; L184-F188 PolarHBondContact O-N 3.42Å; L184-F188 VanDerWaalsContact O-N 3.09Å
185Q94Very high93.5Very high86 Ų8662.5 Ų62.540%0.40231%0.308SS..Hα-helixtrans-62-49.9-176.8-54.1-169.9-38.500110.9A115 S183 S187 F188 I189A115-Q185 WeakPolarHBondContact O-CG 3.39Å; S183-Q185 PolarHBondContact O-N 2.85Å; S183-Q185 VanDerWaalsContact O-N 3.17Å; S183-Q185 PolarHBondContact OG-N 3.38Å; Q185-S187 VanDerWaalsContact C-N 3.3Å; Q185-S187 PolarHBondContact O-N 3.29Å; Q185-F188 PolarHBondContact O-N 3.21Å; Q185-I189 WeakPolarHBondContact O-CB 3.18Å; Q185-I189 WeakPolarHBondContact O-CD1 3.29Å; Q185-I189 VanDerWaalsContact O-CG1 3.22Å; Q185-I189 WeakPolarHBondContact O-CG1 3.33Å; Q185-I189 PolarHBondContact O-N 3.46Å
186W94.9Very high93.8Very high156 Ų15665.7 Ų65.759%0.59132%0.322SS*.Hα-helixtrans-67.7-31178.9-72.1113.5000112.5F182 S183 I189 S190F182-W186 HydrophobicContact CD1-CB 4.36Å; F182-W186 HydrophobicContact CE1-CB 3.62Å; F182-W186 HydrophobicContact CE2-CB 3.99Å; F182-W186 HydrophobicContact CZ-CB 3.41Å; F182-W186 VanDerWaalsContact CZ-CB 3.41Å; F182-W186 HydrophobicContact CZ-CG 4.46Å; S183-W186 PolarHBondContact O-N 3.46Å; W186-I189 HydrophobicContact CE3-CD1 4.33Å; W186-I189 HydrophobicContact CE3-CG2 4.4Å; W186-S190 WeakPolarHBondContact O-CB 3.27Å; W186-S190 PolarHBondContact O-N 3.1Å; W186-S190 PolarHBondContact O-OG 3.24Å
187S95.2Very high94.2Very high10 Ų1069.2 Ų69.27%0.0734%0.337CS..Hα-helixtrans-58.9-50.5172.6-57.60000111.3F182 S183 L184 Q185 S190 L191F182-S187 VanDerWaalsContact CD1-OG 3.26Å; F182-S187 WeakPolarHBondContact CD1-OG 3.15Å; F182-S187 VanDerWaalsContact CE1-N 3.31Å; S183-S187 PolarHBondContact O-N 3.17Å; S183-S187 VanDerWaalsContact O-N 3.07Å; S183-S187 PolarHBondContact O-OG 2.64Å; S183-S187 VanDerWaalsContact O-OG 3.07Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 2.99Å; Q185-S187 VanDerWaalsContact C-N 3.3Å; Q185-S187 PolarHBondContact O-N 3.29Å; S187-S190 PolarHBondContact O-OG 3.14Å; S187-L191 WeakPolarHBondContact O-CG 3.49Å; S187-L191 PolarHBondContact O-N 3.18Å; S187-L191 VanDerWaalsContact O-N 3.12Å
188F96.1Very high94.5Very high0 Ų064.9 Ų64.90%032%0.319CS..Hα-helixtrans-74.9-33.5179.9-76.5-61.8000113.6Y36 L43 Y47 T111 F114 A115 I175 L184 Q185 L191 S192Y36-F188 AromaticContact CE2-CE1 3.85Å; Y36-F188 HydrophobicContact CE2-CE1 3.85Å; L43-F188 HydrophobicContact CD1-CZ 3.92Å; Y47-F188 WeakPolarHBondContact OH-CE2 3.1Å; T111-F188 HydrophobicContact CG2-CB 4.32Å; T111-F188 HydrophobicContact CG2-CD1 3.8Å; T111-F188 WeakPolarHBondContact CG2-O 3.4Å; F114-F188 HydrophobicContact CB-CD1 4.03Å; F114-F188 HydrophobicContact CB-CD2 4.11Å; F114-F188 HydrophobicContact CB-CE1 4.04Å; F114-F188 HydrophobicContact CB-CE2 4.12Å; F114-F188 HydrophobicContact CB-CG 4.06Å; F114-F188 HydrophobicContact CB-CZ 4.08Å; A115-F188 HydrophobicContact CB-CB 3.6Å; I175-F188 HydrophobicContact CD1-CD1 4.44Å; I175-F188 HydrophobicContact CD1-CE1 3.99Å; I175-F188 HydrophobicContact CD1-CZ 4.19Å; L184-F188 HydrophobicContact CD1-CD2 4.04Å; L184-F188 HydrophobicContact CD1-CE2 3.51Å; L184-F188 HydrophobicContact CD1-CZ 4.46Å; L184-F188 HydrophobicContact CD2-CE2 4.16Å; L184-F188 HydrophobicContact CG-CD2 3.81Å; L184-F188 HydrophobicContact CG-CE2 3.66Å; L184-F188 WeakPolarHBondContact O-CD2 3.5Å; L184-F188 PolarHBondContact O-N 3.42Å; L184-F188 VanDerWaalsContact O-N 3.09Å; Q185-F188 PolarHBondContact O-N 3.21Å; F188-L191 HydrophobicContact CD1-CD1 4.28Å; F188-L191 PolarHBondContact O-N 3.1Å; F188-S192 WeakPolarHBondContact O-CB 3.45Å; F188-S192 PolarHBondContact O-N 3.31Å
189I96.9Very high94.6Very high34 Ų3458.6 Ų58.617%0.17429%0.294CS..Hα-helixtrans-62.4-47174.2-70.3164.9000110.5L112 A115 F116 Q185 W186 L191 S192 I193L112-I189 HydrophobicContact CD1-CG1 3.93Å; A115-I189 HydrophobicContact CB-CG1 4.06Å; F116-I189 HydrophobicContact CZ-CD1 4.4Å; Q185-I189 WeakPolarHBondContact O-CB 3.18Å; Q185-I189 WeakPolarHBondContact O-CD1 3.29Å; Q185-I189 VanDerWaalsContact O-CG1 3.22Å; Q185-I189 WeakPolarHBondContact O-CG1 3.33Å; Q185-I189 PolarHBondContact O-N 3.46Å; W186-I189 HydrophobicContact CE3-CD1 4.33Å; W186-I189 HydrophobicContact CE3-CG2 4.4Å; I189-L191 PolarHBondContact O-N 3.3Å; I189-S192 WeakPolarHBondContact O-CB 3.49Å; I189-S192 PolarHBondContact O-N 2.67Å; I189-I193 HydrophobicContact CG2-CD1 3.94Å; I189-I193 WeakPolarHBondContact O-CG1 3.33Å; I189-I193 PolarHBondContact O-N 2.99Å
190S95.6Very high94.9Very high64 Ų6459.5 Ų59.545%0.44830%0.3SS..Hα-helixtrans-63.5-41177.958.80000112.1W186 S187 I193 G194W186-S190 WeakPolarHBondContact O-CB 3.27Å; W186-S190 PolarHBondContact O-N 3.1Å; W186-S190 PolarHBondContact O-OG 3.24Å; S187-S190 PolarHBondContact O-OG 3.14Å; S190-I193 PolarHBondContact O-N 3.24Å; S190-G194 PolarHBondContact O-N 3.46Å
191L95.8Very high95.1Very high22 Ų2258 Ų5812%0.11528%0.283CS..Hα-helixtrans-62-42172.9-76.6171.6000112.8F33 T111 V171 I175 S187 F188 I189 G194 S195F33-L191 HydrophobicContact CD1-CD2 4.29Å; F33-L191 HydrophobicContact CE1-CD2 4.03Å; T111-L191 HydrophobicContact CG2-CB 3.86Å; V171-L191 HydrophobicContact CG1-CD1 3.66Å; V171-L191 HydrophobicContact CG1-CD2 3.81Å; V171-L191 HydrophobicContact CG1-CG 4.4Å; I175-L191 HydrophobicContact CD1-CD1 3.52Å; I175-L191 HydrophobicContact CG1-CD1 4.37Å; S187-L191 WeakPolarHBondContact O-CG 3.49Å; S187-L191 PolarHBondContact O-N 3.18Å; S187-L191 VanDerWaalsContact O-N 3.12Å; F188-L191 HydrophobicContact CD1-CD1 4.28Å; F188-L191 PolarHBondContact O-N 3.1Å; I189-L191 PolarHBondContact O-N 3.3Å; L191-G194 PolarHBondContact O-N 2.97Å; L191-S195 VanDerWaalsContact O-CB 3.24Å; L191-S195 WeakPolarHBondContact O-CB 3.33Å; L191-S195 PolarHBondContact O-N 3.21Å; L191-S195 PolarHBondContact O-OG 2.92Å
192S97Very high95.2Very high12 Ų1248.4 Ų48.48%0.08425%0.245CC..Hα-helixtrans-59.8-50176.5174.90000111A108 F188 I189 S195 F196A108-S192 PolarHBondContact O-OG 3.13Å; F188-S192 WeakPolarHBondContact O-CB 3.45Å; F188-S192 PolarHBondContact O-N 3.31Å; I189-S192 WeakPolarHBondContact O-CB 3.49Å; I189-S192 PolarHBondContact O-N 2.67Å; S192-S195 PolarHBondContact O-N 3.45Å; S192-S195 PolarHBondContact O-OG 2.93Å; S192-F196 WeakPolarHBondContact O-CB 3.35Å; S192-F196 PolarHBondContact O-N 2.9Å
193I97.4Very high95.4Very high96 Ų9643.7 Ų43.749%0.49223%0.225SC..Hα-helixtrans-63.3-46.8178.9-64.8167.8000110.9I189 S190 S195 F196 I197I189-I193 HydrophobicContact CG2-CD1 3.94Å; I189-I193 WeakPolarHBondContact O-CG1 3.33Å; I189-I193 PolarHBondContact O-N 2.99Å; S190-I193 PolarHBondContact O-N 3.24Å; I193-S195 PolarHBondContact O-N 2.96Å; I193-F196 PolarHBondContact O-N 3.35Å; I193-I197 HydrophobicContact CG2-CD1 3.75Å; I193-I197 HydrophobicContact CG2-CG1 4.45Å; I193-I197 WeakPolarHBondContact O-CG1 3.39Å; I193-I197 PolarHBondContact O-N 3.05Å
194G96.7Very high95.3Very high22 Ų2244 Ų4423%0.22722%0.222CC..Hα-helixtrans-59.9-46.217900000112.5S190 L191 F196 I197 M198S190-G194 PolarHBondContact O-N 3.46Å; L191-G194 PolarHBondContact O-N 2.97Å; G194-F196 VanDerWaalsContact C-N 3.3Å; G194-F196 PolarHBondContact O-N 3.38Å; G194-I197 PolarHBondContact O-N 3.48Å; G194-M198 VanDerWaalsContact O-CB 3.31Å; G194-M198 WeakPolarHBondContact O-CB 3.15Å; G194-M198 PolarHBondContact O-N 3.19Å
195S96.3Very high95.1Very high4 Ų447.3 Ų47.33%0.02824%0.236CC..Hα-helixtrans-62.4-38177.271.40000112.2F33 Y107 L191 S192 I193 G199F33-S195 VanDerWaalsContact CE1-N 3.35Å; Y107-S195 VanDerWaalsContact CD1-CB 3.46Å; Y107-S195 WeakPolarHBondContact CD1-OG 3.49Å; L191-S195 VanDerWaalsContact O-CB 3.24Å; L191-S195 WeakPolarHBondContact O-CB 3.33Å; L191-S195 PolarHBondContact O-N 3.21Å; L191-S195 PolarHBondContact O-OG 2.92Å; S192-S195 PolarHBondContact O-N 3.45Å; S192-S195 PolarHBondContact O-OG 2.93Å; I193-S195 PolarHBondContact O-N 2.96Å; S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.19Å
196F97Very high95Very high80 Ų8043.2 Ų43.235%0.35122%0.217SC..Hα-helixtrans-65.8-49.1178.3-176.6-103000111.6T104 L105 A108 S192 I193 G194 L200T104-F196 HydrophobicContact CG2-CD2 4.06Å; L105-F196 HydrophobicContact CD2-CD2 4.24Å; L105-F196 HydrophobicContact CD2-CE2 3.56Å; L105-F196 HydrophobicContact CG-CE2 4.33Å; A108-F196 HydrophobicContact CB-CB 4.19Å; S192-F196 WeakPolarHBondContact O-CB 3.35Å; S192-F196 PolarHBondContact O-N 2.9Å; I193-F196 PolarHBondContact O-N 3.35Å; G194-F196 VanDerWaalsContact C-N 3.3Å; G194-F196 PolarHBondContact O-N 3.38Å; F196-L200 HydrophobicContact CE1-CD2 4.15Å; F196-L200 HydrophobicContact CZ-CD2 4.31Å; F196-L200 WeakPolarHBondContact O-CB 3.47Å; F196-L200 PolarHBondContact O-N 2.89Å
197I96.9Very high94.8Very high108 Ų10835.8 Ų35.855%0.55419%0.189SC*.Hα-helixtrans-62.7-51-179.9-65.8168.9000110.5I193 G194 L200 F201I193-I197 HydrophobicContact CG2-CD1 3.75Å; I193-I197 HydrophobicContact CG2-CG1 4.45Å; I193-I197 WeakPolarHBondContact O-CG1 3.39Å; I193-I197 PolarHBondContact O-N 3.05Å; G194-I197 PolarHBondContact O-N 3.48Å; I197-L200 PolarHBondContact O-N 2.75Å; I197-F201 WeakPolarHBondContact O-CB 3.34Å; I197-F201 PolarHBondContact O-N 3.49Å
198M95.8Very high94.5Very high31 Ų3135.4 Ų35.415%0.15319%0.186CC..Hα-helixtrans-63.4-46.8-178.7-17364.3175.100111.5L25 L28 D29 F33 G194 L200 F201 M202L25-M198 HydrophobicContact CB-CE 3.61Å; L25-M198 HydrophobicContact CD2-CE 3.66Å; L25-M198 HydrophobicContact CD2-SD 4.35Å; L25-M198 HydrophobicContact CG-CE 4.18Å; L25-M198 WeakPolarHBondContact O-CE 3.22Å; L28-M198 HydrophobicContact CB-CE 4.03Å; D29-M198 HydrophobicContact CB-CE 3.96Å; D29-M198 HydrophobicContact CB-CG 3.99Å; F33-M198 HydrophobicContact CD2-CB 4.01Å; F33-M198 HydrophobicContact CD2-CG 4.17Å; F33-M198 HydrophobicContact CE2-CB 3.71Å; F33-M198 HydrophobicContact CE2-CG 4.05Å; G194-M198 VanDerWaalsContact O-CB 3.31Å; G194-M198 WeakPolarHBondContact O-CB 3.15Å; G194-M198 PolarHBondContact O-N 3.19Å; M198-L200 PolarHBondContact O-N 3.37Å; M198-F201 PolarHBondContact O-N 3.27Å; M198-M202 WeakPolarHBondContact O-CB 3.48Å; M198-M202 WeakPolarHBondContact O-CG 3.28Å; M198-M202 PolarHBondContact O-N 3.14Å
199G95.1Very high94.2Very high0 Ų037.6 Ų37.60%020%0.197CC..Hα-helixtrans-66-36.5179.800000113.1T104 S195 A203T104-G199 WeakPolarHBondContact OG1-CA 3.35Å; S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.19Å; G199-A203 WeakPolarHBondContact O-CB 3.49Å; G199-A203 PolarHBondContact O-N 3.09Å
200L95.5Very high93.8Very high67 Ų6741.9 Ų41.935%0.35121%0.214SC..Hα-helixtrans-67-44.4174.8-178.762.8000111.1L101 F196 I197 M198 A203 M204L101-L200 HydrophobicContact CD2-CD1 3.59Å; F196-L200 HydrophobicContact CE1-CD2 4.15Å; F196-L200 HydrophobicContact CZ-CD2 4.31Å; F196-L200 WeakPolarHBondContact O-CB 3.47Å; F196-L200 PolarHBondContact O-N 2.89Å; I197-L200 PolarHBondContact O-N 2.75Å; M198-L200 PolarHBondContact O-N 3.37Å; L200-A203 PolarHBondContact O-N 2.91Å; L200-M204 HydrophobicContact CD1-CG 4.05Å; L200-M204 WeakPolarHBondContact O-CB 3.23Å; L200-M204 WeakPolarHBondContact O-CG 3.5Å; L200-M204 PolarHBondContact O-N 3.08Å
201F94Very high93.3Very high73 Ų7339.1 Ų39.132%0.3220%0.195SC..Hα-helixtrans-59.4-49.4175.8-174.9-87.8000111.4L25 I197 M198 A203 M204 F205 I206L25-F201 HydrophobicContact CD1-CD1 3.83Å; L25-F201 HydrophobicContact CD1-CE1 3.42Å; L25-F201 VanDerWaalsContact CD1-CE1 3.42Å; I197-F201 WeakPolarHBondContact O-CB 3.34Å; I197-F201 PolarHBondContact O-N 3.49Å; M198-F201 PolarHBondContact O-N 3.27Å; F201-A203 VanDerWaalsContact C-N 3.35Å; F201-A203 PolarHBondContact O-N 3.39Å; F201-M204 PolarHBondContact O-N 3.31Å; F201-F205 HydrophobicContact CD1-CD2 4.44Å; F201-F205 AromaticContact CD2-CD2 3.43Å; F201-F205 HydrophobicContact CD2-CD2 3.43Å; F201-F205 VanDerWaalsContact CD2-CD2 3.43Å; F201-F205 AromaticContact CD2-CE2 3.76Å; F201-F205 HydrophobicContact CD2-CE2 3.76Å; F201-F205 HydrophobicContact CD2-CG 4.46Å; F201-F205 HydrophobicContact CE1-CB 4.36Å; F201-F205 HydrophobicContact CE1-CD2 4.49Å; F201-F205 AromaticContact CE2-CD2 3.53Å; F201-F205 HydrophobicContact CE2-CD2 3.53Å; F201-F205 AromaticContact CE2-CE2 3.94Å; F201-F205 HydrophobicContact CE2-CE2 3.94Å; F201-F205 HydrophobicContact CE2-CG 4.2Å; F201-F205 AromaticContact CG-CD2 3.92Å; F201-F205 HydrophobicContact CG-CD2 3.92Å; F201-F205 HydrophobicContact CZ-CB 4.3Å; F201-F205 HydrophobicContact CZ-CD2 4.08Å; F201-F205 HydrophobicContact CZ-CG 4.38Å; F201-F205 WeakPolarHBondContact O-CD2 3.34Å; F201-F205 PolarHBondContact O-N 2.91Å; F201-I206 HydrophobicContact CE1-CG1 4.47Å
202M93.7Very high92.8Very high0 Ų041.4 Ų41.40%021%0.21CC..Iπ-helixtrans-57.9-45.5176.7-74.3-66.6-73.300112.1L25 N143 I146 M198 M204 I206 F207L25-M202 HydrophobicContact CB-CE 4.47Å; L25-M202 HydrophobicContact CB-SD 3.44Å; L25-M202 WeakPolarHBondContact CB-SD 3.48Å; L25-M202 HydrophobicContact CD1-SD 4.31Å; N143-M202 WeakPolarHBondContact OD1-CE 3.38Å; I146-M202 HydrophobicContact CD1-CE 3.75Å; M198-M202 WeakPolarHBondContact O-CB 3.48Å; M198-M202 WeakPolarHBondContact O-CG 3.28Å; M198-M202 PolarHBondContact O-N 3.14Å; M202-M204 PolarHBondContact O-N 3.24Å; M202-I206 HydrophobicContact CE-CB 4.32Å; M202-I206 HydrophobicContact CE-CG2 4.04Å; M202-I206 WeakPolarHBondContact O-CB 3.31Å; M202-I206 PolarHBondContact O-N 3.33Å; M202-I206 VanDerWaalsContact O-N 3.12Å; M202-I206 HydrophobicContact SD-CB 4.01Å; M202-I206 HydrophobicContact SD-CG1 3.7Å; M202-I206 HydrophobicContact SD-CG2 4.26Å; M202-F207 HydrophobicContact CB-CD2 4.35Å; M202-F207 HydrophobicContact CB-CE2 4.08Å; M202-F207 HydrophobicContact CE-CE2 4.09Å; M202-F207 HydrophobicContact CE-CZ 4.06Å; M202-F207 WeakPolarHBondContact O-CD2 3.45Å; M202-F207 PolarHBondContact O-N 3.38Å
203A93.3Very high92.3Very high0 Ų042.8 Ų42.80%022%0.216CC..Iπ-helixtrans-61.8-43.917900000112.9R97 K100 L101 G199 L200 F201R97-A203 WeakPolarHBondContact CD-O 3.23Å; R97-A203 VanDerWaalsContact CG-O 3.32Å; R97-A203 WeakPolarHBondContact CG-O 3.06Å; R97-A203 PolarHBondContact NE-O 3.11Å; K100-A203 HydrophobicContact CB-CB 4.16Å; K100-A203 HydrophobicContact CG-CB 3.82Å; L101-A203 HydrophobicContact CD2-CB 3.47Å; L101-A203 VanDerWaalsContact CD2-CB 3.47Å; L101-A203 HydrophobicContact CG-CB 3.72Å; G199-A203 WeakPolarHBondContact O-CB 3.49Å; G199-A203 PolarHBondContact O-N 3.09Å; L200-A203 PolarHBondContact O-N 2.91Å; F201-A203 VanDerWaalsContact C-N 3.35Å; F201-A203 PolarHBondContact O-N 3.39Å
204M90.5Very high91.9Very high57 Ų5738.2 Ų38.228%0.28119%0.193SC..Iπ-helixtrans-81.4-40.6-172.4-67.7-60-69.900113.1L9 R97 L200 F201 M202L9-M204 HydrophobicContact CD1-CE 3.98Å; L9-M204 HydrophobicContact CD2-CE 4.35Å; R97-M204 PolarHBondContact NH2-O 3.12Å; L200-M204 HydrophobicContact CD1-CG 4.05Å; L200-M204 WeakPolarHBondContact O-CB 3.23Å; L200-M204 WeakPolarHBondContact O-CG 3.5Å; L200-M204 PolarHBondContact O-N 3.08Å; F201-M204 PolarHBondContact O-N 3.31Å; M202-M204 PolarHBondContact O-N 3.24Å
205F89.3Confident91.3Very high71 Ų7138.9 Ų38.931%0.31120%0.196SC..Iπ-helixtrans-107.7-27.5-169.4-60.9-71.3000114.5F13 F201F13-F205 HydrophobicContact CD2-CB 4.47Å; F13-F205 HydrophobicContact CE2-CB 4.01Å; F13-F205 HydrophobicContact CE2-CD1 4.14Å; F13-F205 HydrophobicContact CE2-CG 4.29Å; F201-F205 HydrophobicContact CD1-CD2 4.44Å; F201-F205 AromaticContact CD2-CD2 3.43Å; F201-F205 HydrophobicContact CD2-CD2 3.43Å; F201-F205 VanDerWaalsContact CD2-CD2 3.43Å; F201-F205 AromaticContact CD2-CE2 3.76Å; F201-F205 HydrophobicContact CD2-CE2 3.76Å; F201-F205 HydrophobicContact CD2-CG 4.46Å; F201-F205 HydrophobicContact CE1-CB 4.36Å; F201-F205 HydrophobicContact CE1-CD2 4.49Å; F201-F205 AromaticContact CE2-CD2 3.53Å; F201-F205 HydrophobicContact CE2-CD2 3.53Å; F201-F205 AromaticContact CE2-CE2 3.94Å; F201-F205 HydrophobicContact CE2-CE2 3.94Å; F201-F205 HydrophobicContact CE2-CG 4.2Å; F201-F205 AromaticContact CG-CD2 3.92Å; F201-F205 HydrophobicContact CG-CD2 3.92Å; F201-F205 HydrophobicContact CZ-CB 4.3Å; F201-F205 HydrophobicContact CZ-CD2 4.08Å; F201-F205 HydrophobicContact CZ-CG 4.38Å; F201-F205 WeakPolarHBondContact O-CD2 3.34Å; F201-F205 PolarHBondContact O-N 2.91Å
206I91Very high90.7Very high1 Ų144.2 Ų44.21%0.00522%0.218CC..Iπ-helixtrans-102.2-41.9-175-57.8-56.2000112.4R18 V21 L25 F201 M202R18-I206 VanDerWaalsContact CZ-O 3.25Å; R18-I206 PolarHBondContact NE-O 2.62Å; R18-I206 PolarHBondContact NH2-O 3.46Å; V21-I206 HydrophobicContact CG1-CD1 4.46Å; L25-I206 HydrophobicContact CD1-CD1 4.47Å; L25-I206 HydrophobicContact CD1-CG1 4.4Å; F201-I206 HydrophobicContact CE1-CG1 4.47Å; M202-I206 HydrophobicContact CE-CB 4.32Å; M202-I206 HydrophobicContact CE-CG2 4.04Å; M202-I206 WeakPolarHBondContact O-CB 3.31Å; M202-I206 PolarHBondContact O-N 3.33Å; M202-I206 VanDerWaalsContact O-N 3.12Å; M202-I206 HydrophobicContact SD-CB 4.01Å; M202-I206 HydrophobicContact SD-CG1 3.7Å; M202-I206 HydrophobicContact SD-CG2 4.26Å
207F91.4Very high90Very high0 Ų041 Ų410%020%0.204CC..  trans-87.3138.5-179.3-68.4-56.1000112.8L96 R97 K100 C142 I146 M202 M214L96-F207 HydrophobicContact CD2-CB 4.16Å; L96-F207 HydrophobicContact CD2-CD1 3.61Å; L96-F207 HydrophobicContact CD2-CE1 4.36Å; L96-F207 HydrophobicContact CD2-CG 4.16Å; L96-F207 HydrophobicContact CG-CB 4.22Å; L96-F207 HydrophobicContact CG-CD1 4.06Å; L96-F207 HydrophobicContact CG-CG 4.22Å; R97-F207 PolarHBondContact NE-O 3.2Å; R97-F207 PolarHBondContact NH2-O 3.22Å; K100-F207 HydrophobicContact CB-CD2 4.13Å; K100-F207 HydrophobicContact CB-CE2 4.39Å; K100-F207 HydrophobicContact CD-CE2 4Å; K100-F207 HydrophobicContact CG-CD2 3.83Å; K100-F207 HydrophobicContact CG-CE2 3.83Å; C142-F207 HydrophobicContact CB-CE2 4.34Å; C142-F207 HydrophobicContact CB-CZ 4.15Å; C142-F207 WeakPolarHBondContact O-CE1 3.02Å; I146-F207 HydrophobicContact CD1-CE1 4.01Å; I146-F207 HydrophobicContact CD1-CZ 4.04Å; I146-F207 HydrophobicContact CG1-CE1 3.69Å; I146-F207 HydrophobicContact CG1-CZ 4.24Å; M202-F207 HydrophobicContact CB-CD2 4.35Å; M202-F207 HydrophobicContact CB-CE2 4.08Å; M202-F207 HydrophobicContact CE-CE2 4.09Å; M202-F207 HydrophobicContact CE-CZ 4.06Å; M202-F207 WeakPolarHBondContact O-CD2 3.45Å; M202-F207 PolarHBondContact O-N 3.38Å; F207-M214 HydrophobicContact CD1-CE 3.62Å; F207-M214 HydrophobicContact CD1-SD 4.33Å; F207-M214 HydrophobicContact CE1-CE 4.05Å
208T89.3Confident89.1Confident2 Ų236.4 Ų36.41%0.01218%0.182CC..  trans-79.5170.1168.652.20000111.4R18 R97 K210 D213 M214 F217R18-T208 VanDerWaalsContact NH2-CG2 3.29Å; R97-T208 PolarHBondContact N-O 2.95Å; T208-K210 VanDerWaalsContact C-N 3.35Å; T208-K210 PolarHBondContact O-N 3.29Å; T208-K210 PolarHBondContact OG1-O 3.4Å; T208-D213 HydrophobicContact CG2-CB 4.03Å; T208-M214 HydrophobicContact CG2-SD 3.99Å; T208-M214 WeakPolarHBondContact OG1-CG 3.31Å; T208-M214 PolarHBondContact OG1-SD 2.98Å; T208-M214 VanDerWaalsContact OG1-SD 3.35Å; T208-F217 HydrophobicContact CG2-CE2 3.56Å; T208-F217 HydrophobicContact CG2-CZ 3.99Å
209M88.8Confident87.8Confident45 Ų4541.7 Ų41.722%0.22221%0.205CC..SBendtrans-60.6-42.2174.8-169.870.3-168.100112.5V94 G95 L96 P98V94-M209 WeakPolarHBondContact O-CE 3.48Å; G95-M209 CarbonylContact C-O 3.34Å; G95-M209 WeakPolarHBondContact CA-O 3.16Å; L96-M209 PolarHBondContact N-O 2.87Å; P98-M209 HydrophobicContact CG-CE 3.59Å; P98-M209 HydrophobicContact CG-SD 4.2Å
210K88.9Confident86.2Confident125 Ų12545.7 Ų45.754%0.54322%0.224SC..SBendtrans-120.1144.4179.6-66.4-171.4173.4-170.10111.5T208 V212 D213T208-K210 VanDerWaalsContact C-N 3.35Å; T208-K210 PolarHBondContact O-N 3.29Å; T208-K210 PolarHBondContact OG1-O 3.4Å; K210-V212 VanDerWaalsContact C-N 3.28Å; K210-V212 PolarHBondContact O-N 3.48Å; K210-D213 WeakPolarHBondContact O-CB 3.42Å; K210-D213 PolarHBondContact O-N 2.99Å; K210-D213 VanDerWaalsContact O-N 3.1Å
211S85Confident84.5Confident6 Ų645.3 Ų45.34%0.04222%0.221CC..Hα-helixtrans-55.5-39.717751.90000113.2D213 M214S211-D213 PolarHBondContact O-N 3.04Å; S211-M214 VanDerWaalsContact O-CB 3.31Å; S211-M214 WeakPolarHBondContact O-CB 3.3Å; S211-M214 PolarHBondContact O-N 3.48Å; S211-M214 VanDerWaalsContact O-N 3.1Å
212V85.4Confident82.9Confident70 Ų7045.7 Ų45.742%0.42423%0.229SC..Hα-helixtrans-58.7-31.1179.4-172.40000112.4K210 M214 I416 R417K210-V212 VanDerWaalsContact C-N 3.28Å; K210-V212 PolarHBondContact O-N 3.48Å; V212-M214 VanDerWaalsContact C-N 3.3Å; V212-M214 PolarHBondContact O-N 2.83Å; V212-I416 HydrophobicContact CG2-CG2 4.1Å; V212-R417 HydrophobicContact CG2-CB 4.29Å
213D87.6Confident81.1Confident41 Ų4153.1 Ų53.122%0.21926%0.261CS..Hα-helixtrans-75.1-20.7-177.9-64.5-41.7000112.7T208 K210 S211 A215 K216T208-D213 HydrophobicContact CG2-CB 4.03Å; K210-D213 WeakPolarHBondContact O-CB 3.42Å; K210-D213 PolarHBondContact O-N 2.99Å; K210-D213 VanDerWaalsContact O-N 3.1Å; S211-D213 PolarHBondContact O-N 3.04Å; D213-A215 VanDerWaalsContact C-N 3.28Å; D213-A215 PolarHBondContact O-N 3.37Å; D213-K216 HydrophobicContact CB-CD 4.37Å; D213-K216 VanDerWaalsContact O-CB 3.29Å; D213-K216 WeakPolarHBondContact O-CB 3.41Å; D213-K216 PolarHBondContact O-N 3.4Å; D213-K216 VanDerWaalsContact O-N 3.13Å; D213-K216 VanDerWaalsContact OD1-CE 3.28Å; D213-K216 WeakPolarHBondContact OD1-CE 3.36Å; D213-K216 IonicContact OD1-NZ 3.97Å; D213-K216 PolarHBondContact OD1-NZ 2.93Å
214M87.5Confident79.4Confident0 Ų057.8 Ų57.80%028%0.283CS..Hα-helixtrans-63-36.4177.8-63.2-73.4-79.500111.5L96 Q145 I146 S148 M149 F207 T208 S211 V212 K216 F217L96-M214 HydrophobicContact CD2-CE 4.41Å; L96-M214 HydrophobicContact CD2-CG 3.89Å; L96-M214 HydrophobicContact CD2-SD 4.17Å; Q145-M214 HydrophobicContact CB-CE 4.37Å; Q145-M214 HydrophobicContact CB-CG 4.31Å; I146-M214 HydrophobicContact CG1-CE 4.16Å; S148-M214 WeakPolarHBondContact OG-CB 3.09Å; M149-M214 HydrophobicContact CE-CE 3.1Å; M149-M214 HydrophobicContact CE-SD 3.91Å; M149-M214 WeakPolarHBondContact CG-O 3.15Å; F207-M214 HydrophobicContact CD1-CE 3.62Å; F207-M214 HydrophobicContact CD1-SD 4.33Å; F207-M214 HydrophobicContact CE1-CE 4.05Å; T208-M214 HydrophobicContact CG2-SD 3.99Å; T208-M214 WeakPolarHBondContact OG1-CG 3.31Å; T208-M214 PolarHBondContact OG1-SD 2.98Å; T208-M214 VanDerWaalsContact OG1-SD 3.35Å; S211-M214 VanDerWaalsContact O-CB 3.31Å; S211-M214 WeakPolarHBondContact O-CB 3.3Å; S211-M214 PolarHBondContact O-N 3.48Å; S211-M214 VanDerWaalsContact O-N 3.1Å; V212-M214 VanDerWaalsContact C-N 3.3Å; V212-M214 PolarHBondContact O-N 2.83Å; M214-K216 PolarHBondContact O-N 3.21Å; M214-K216 VanDerWaalsContact O-N 3.13Å; M214-F217 WeakPolarHBondContact O-CD2 3.17Å; M214-F217 PolarHBondContact O-N 3.14Å
215A84.3Confident77.8Confident36 Ų3657.8 Ų57.830%0.29829%0.288SS..THydrogen-bonded Turntrans-65.6-15.6178.200000113.6S148 D213 F217 A218S148-A215 PolarHBondContact OG-N 3.01Å; D213-A215 VanDerWaalsContact C-N 3.28Å; D213-A215 PolarHBondContact O-N 3.37Å; A215-F217 VanDerWaalsContact C-N 3.31Å; A215-F217 PolarHBondContact O-N 3.26Å; A215-A218 WeakPolarHBondContact O-CB 3.4Å; A215-A218 PolarHBondContact O-N 3.34Å
216K83.9Confident76.2Confident115 Ų11557.1 Ų57.150%0.529%0.29SS..Hα-helixtrans-68.7-30.1179.2-64.9174.5174.3169.30112.4D213 M214 A218 K219 M220D213-K216 HydrophobicContact CB-CD 4.37Å; D213-K216 VanDerWaalsContact O-CB 3.29Å; D213-K216 WeakPolarHBondContact O-CB 3.41Å; D213-K216 PolarHBondContact O-N 3.4Å; D213-K216 VanDerWaalsContact O-N 3.13Å; D213-K216 VanDerWaalsContact OD1-CE 3.28Å; D213-K216 WeakPolarHBondContact OD1-CE 3.36Å; D213-K216 IonicContact OD1-NZ 3.97Å; D213-K216 PolarHBondContact OD1-NZ 2.93Å; M214-K216 PolarHBondContact O-N 3.21Å; M214-K216 VanDerWaalsContact O-N 3.13Å; K216-A218 PolarHBondContact O-N 3.2Å; K216-K219 PolarHBondContact O-N 2.97Å; K216-K219 VanDerWaalsContact O-N 3.14Å; K216-M220 PolarHBondContact O-N 3.5Å
217F82.3Confident74.4Confident13 Ų1364.8 Ų64.86%0.05732%0.324CS..Hα-helixtrans-70.1-20.2179.5-59-68.9000113.2R18 R19 M149 T208 M214 A215 M220R18-F217 VanDerWaalsContact CZ-CZ 3.47Å; R19-F217 WeakPolarHBondContact CD-O 3.47Å; R19-F217 HydrophobicContact CG-CB 4.14Å; R19-F217 PolarHBondContact NH1-O 2.93Å; M149-F217 HydrophobicContact CG-CB 4.29Å; M149-F217 HydrophobicContact SD-CB 4.22Å; M149-F217 HydrophobicContact SD-CD2 4.28Å; T208-F217 HydrophobicContact CG2-CE2 3.56Å; T208-F217 HydrophobicContact CG2-CZ 3.99Å; M214-F217 WeakPolarHBondContact O-CD2 3.17Å; M214-F217 PolarHBondContact O-N 3.14Å; A215-F217 VanDerWaalsContact C-N 3.31Å; A215-F217 PolarHBondContact O-N 3.26Å; F217-M220 HydrophobicContact CD1-SD 4.14Å; F217-M220 HydrophobicContact CE1-SD 4.48Å
218A79.4Confident72.6Confident11 Ų1172.2 Ų72.29%0.09136%0.359CS..Hα-helixtrans-66.5-42.3169.900000111.5M149 P151 A215 K216M149-A218 WeakPolarHBondContact O-CB 3.35Å; P151-A218 HydrophobicContact CG-CB 3.86Å; A215-A218 WeakPolarHBondContact O-CB 3.4Å; A215-A218 PolarHBondContact O-N 3.34Å; K216-A218 PolarHBondContact O-N 3.2Å
219K68.4Low70.8Confident143 Ų14375 Ų7562%0.62238%0.378SS*.Hα-helixtrans-74-27-175.8-62.3-173.4178.8-172.30113.4K216 K223K216-K219 PolarHBondContact O-N 2.97Å; K216-K219 VanDerWaalsContact O-N 3.14Å; K219-K223 WeakPolarHBondContact O-CG 3.49Å; K219-K223 PolarHBondContact O-N 3.42Å
220M61.5Low68.9Low83 Ų8380 Ų8041%0.40939%0.394SS..Hα-helixtrans-68-42.2179.4-74.5175.5170.300111.8K216 F217 K223 E224K216-M220 PolarHBondContact O-N 3.5Å; F217-M220 HydrophobicContact CD1-SD 4.14Å; F217-M220 HydrophobicContact CE1-SD 4.48Å; M220-K223 PolarHBondContact O-N 3.13Å; M220-E224 WeakPolarHBondContact O-CG 3.43Å; M220-E224 PolarHBondContact O-N 3.33Å
221E59.2Low67.1Low59 Ų5982.3 Ų82.328%0.27641%0.407SS..Hα-helixtrans-64.7-42.3176.8-173.6178.3-121.800111.6R19 K223 E224 S225R19-E221 IonicContact CZ-OE2 3.14Å; R19-E221 VanDerWaalsContact NH1-CD 3.28Å; R19-E221 IonicContact NH1-OE1 2.61Å; R19-E221 IonicContact NH1-OE2 2.81Å; R19-E221 PolarHBondContact NH1-OE2 3.32Å; R19-E221 IonicContact NH2-OE2 3.06Å; R19-E221 PolarHBondContact NH2-OE2 3.25Å; E221-K223 VanDerWaalsContact C-N 3.27Å; E221-K223 PolarHBondContact O-N 3.25Å; E221-E224 PolarHBondContact O-N 3.37Å; E221-S225 WeakPolarHBondContact O-CB 3.49Å; E221-S225 PolarHBondContact O-N 2.84Å; E221-S225 PolarHBondContact O-OG 2.85Å; E221-S225 VanDerWaalsContact O-OG 3.12Å
222V59.6Low65Low81 Ų8186.5 Ų86.549%0.49144%0.436SS..Hα-helixtrans-61-39.8174.9178.90000110.6S225 V226V222-S225 WeakPolarHBondContact CA-OG 3.25Å; V222-S225 PolarHBondContact O-OG 3.02Å; V222-S225 VanDerWaalsContact O-OG 3.07Å; V222-V226 HydrophobicContact CG1-CG2 4.12Å; V222-V226 WeakPolarHBondContact O-CB 3.49Å; V222-V226 WeakPolarHBondContact O-CG2 3.31Å; V222-V226 PolarHBondContact O-N 3.16Å
223K56.9Low62.6Low156 Ų15687.9 Ų87.968%0.67845%0.448SS*.Hα-helixtrans-67.1-43.1175.1-77.5-174.5177.9-169.80112.1K219 M220 E221 V226 F227K219-K223 WeakPolarHBondContact O-CG 3.49Å; K219-K223 PolarHBondContact O-N 3.42Å; M220-K223 PolarHBondContact O-N 3.13Å; E221-K223 VanDerWaalsContact C-N 3.27Å; E221-K223 PolarHBondContact O-N 3.25Å; K223-V226 PolarHBondContact O-N 3.44Å; K223-F227 VanDerWaalsContact O-CB 3.26Å; K223-F227 WeakPolarHBondContact O-CB 3.12Å; K223-F227 PolarHBondContact O-N 3.43Å
224E57.2Low60Low98 Ų9894.4 Ų94.446%0.45848%0.482SS..Hα-helixtrans-63-44.9177.2-77.5170-169.100111.2M220 E221 F227 Q228M220-E224 WeakPolarHBondContact O-CG 3.43Å; M220-E224 PolarHBondContact O-N 3.33Å; E221-E224 PolarHBondContact O-N 3.37Å; E224-F227 PolarHBondContact O-N 2.92Å; E224-Q228 WeakPolarHBondContact O-CB 3.35Å; E224-Q228 WeakPolarHBondContact O-CG 3.11Å; E224-Q228 PolarHBondContact O-N 3.2Å
225S56.6Low57.6Low57 Ų57102.7 Ų102.740%0.39952%0.521SS..Hα-helixtrans-68.3-37.7177.367.50000112.4E221 V222 S229E221-S225 WeakPolarHBondContact O-CB 3.49Å; E221-S225 PolarHBondContact O-N 2.84Å; E221-S225 PolarHBondContact O-OG 2.85Å; E221-S225 VanDerWaalsContact O-OG 3.12Å; V222-S225 WeakPolarHBondContact CA-OG 3.25Å; V222-S225 PolarHBondContact O-OG 3.02Å; V222-S225 VanDerWaalsContact O-OG 3.07Å; S225-S229 WeakPolarHBondContact O-CB 3.43Å; S225-S229 PolarHBondContact O-N 3.49Å; S225-S229 PolarHBondContact O-OG 2.87Å
226V55.8Low55.2Low58 Ų58109.1 Ų109.135%0.35255%0.545SS..Hα-helixtrans-70.5-36.8174.7170.60000110.9V222 K223 S229 R230V222-V226 HydrophobicContact CG1-CG2 4.12Å; V222-V226 WeakPolarHBondContact O-CB 3.49Å; V222-V226 WeakPolarHBondContact O-CG2 3.31Å; V222-V226 PolarHBondContact O-N 3.16Å; K223-V226 PolarHBondContact O-N 3.44Å; V226-S229 WeakPolarHBondContact CA-OG 3.39Å; V226-S229 PolarHBondContact O-N 2.95Å; V226-S229 PolarHBondContact O-OG 3.47Å; V226-R230 HydrophobicContact CG1-CG 4.02Å; V226-R230 WeakPolarHBondContact O-CA 3.29Å; V226-R230 WeakPolarHBondContact O-CB 3.34Å; V226-R230 WeakPolarHBondContact O-CG 3.24Å; V226-R230 PolarHBondContact O-N 2.81Å
227F53.2Low53.1Low161 Ų161108.3 Ų108.371%0.70655%0.553SS**Hα-helixtrans-69-39.5176.7-140-92.1000111.2K223 E224 S229K223-F227 VanDerWaalsContact O-CB 3.26Å; K223-F227 WeakPolarHBondContact O-CB 3.12Å; K223-F227 PolarHBondContact O-N 3.43Å; E224-F227 PolarHBondContact O-N 2.92Å; F227-S229 VanDerWaalsContact C-N 3.35Å
228Q54.1Low51.2Low157 Ų157113.5 Ų113.573%0.73459%0.592SS**Hα-helixtrans-67.9-30.8174-76.7176.7-16.900113.2E224E224-Q228 WeakPolarHBondContact O-CB 3.35Å; E224-Q228 WeakPolarHBondContact O-CG 3.11Å; E224-Q228 PolarHBondContact O-N 3.2Å
229S51.2Low50.2Low61 Ų61118 Ų11843%0.42762%0.622SS.*Hα-helixtrans-88.4-27.1176.449.40000113.7S225 V226 F227 E231 S232S225-S229 WeakPolarHBondContact O-CB 3.43Å; S225-S229 PolarHBondContact O-N 3.49Å; S225-S229 PolarHBondContact O-OG 2.87Å; V226-S229 WeakPolarHBondContact CA-OG 3.39Å; V226-S229 PolarHBondContact O-N 2.95Å; V226-S229 PolarHBondContact O-OG 3.47Å; F227-S229 VanDerWaalsContact C-N 3.35Å; S229-E231 PolarHBondContact O-N 3.43Å; S229-S232 PolarHBondContact O-N 2.92Å; S229-S232 PolarHBondContact O-OG 2.89Å
230R49.7Very low50.4Low148 Ų148113.9 Ų113.956%0.55861%0.609SS**Hα-helixtrans-68-13.5177.9-94.1-175.5153.9-178.4-12.2114.4V226 S232 E236V226-R230 HydrophobicContact CG1-CG 4.02Å; V226-R230 WeakPolarHBondContact O-CA 3.29Å; V226-R230 WeakPolarHBondContact O-CB 3.34Å; V226-R230 WeakPolarHBondContact O-CG 3.24Å; V226-R230 PolarHBondContact O-N 2.81Å; R230-S232 PolarHBondContact O-N 3.47Å; R230-E236 IonicContact NH2-OE1 3.66Å; R230-E236 PolarHBondContact NH2-OE1 3.38Å; R230-E236 VanDerWaalsContact NH2-OE1 3.14Å
231E50.6Low51.4Low175 Ų175114.1 Ų114.182%0.81861%0.612SS**THydrogen-bonded Turntrans-71.5-6.5166.1-79.2-176.516300113.1S229S229-E231 PolarHBondContact O-N 3.43Å
232S40.4Very low52.6Low93 Ų93112.2 Ų112.265%0.6560%0.604SS**THydrogen-bonded Turntrans-123.6-14.3-174.366.10000117.3S229 R230S229-S232 PolarHBondContact O-N 2.92Å; S229-S232 PolarHBondContact O-OG 2.89Å; R230-S232 PolarHBondContact O-N 3.47Å
233C34.7Very low53.8Low100 Ų100111.4 Ų111.468%0.67660%0.597SS**  trans-153.2115.6176.8-79.50000112.7E235C233-E235 PolarHBondContact O-N 3.3Å
234L32.6Very low55.1Low177 Ų177110 Ų11093%0.92759%0.591SS**  trans-85.485.8166.1-80.3163.2000109.7
235E38.4Very low56.6Low175 Ų175108.7 Ų108.782%0.81859%0.585SS**  trans-135.899.1157-77.2-167.516900109.5C233 S237C233-E235 PolarHBondContact O-N 3.3Å; E235-S237 PolarHBondContact O-N 3.46Å
236E33.6Very low58.2Low171 Ų171106.3 Ų106.380%0.79957%0.568SS**  trans-70.180.1166.3-98.417817400109.6R230 S238R230-E236 IonicContact NH2-OE1 3.66Å; R230-E236 PolarHBondContact NH2-OE1 3.38Å; R230-E236 VanDerWaalsContact NH2-OE1 3.14Å; E236-S238 PolarHBondContact O-N 3.09Å
237S38.8Very low59.8Low97 Ų97106.4 Ų106.468%0.67857%0.571SS**  trans-76.4120.1158.945.80000108.1E235 S239E235-S237 PolarHBondContact O-N 3.46Å; S237-S239 PolarHBondContact O-N 3.48Å
238S43.6Very low61.5Low123 Ų123102.2 Ų102.286%0.8656%0.556SS**  trans-67.164.3177.144.60000111.4E236 V240E236-S238 PolarHBondContact O-N 3.09Å; S238-V240 PolarHBondContact O-N 3.46Å; S238-V240 VanDerWaalsContact O-N 3.13Å
239S59.1Low63.4Low104 Ų10494.9 Ų94.973%0.72752%0.522SS*.  trans-64.1114.9175.463.10000109S237 D241S237-S239 PolarHBondContact O-N 3.48Å; S239-D241 PolarHBondContact O-N 2.92Å
240V70.9Confident65.4Low57 Ų5792.7 Ų92.735%0.34551%0.505SS..  trans-58.1119.6172.6177.20000108.1S238 V242 L342S238-V240 PolarHBondContact O-N 3.46Å; S238-V240 VanDerWaalsContact O-N 3.13Å; V240-V242 VanDerWaalsContact C-N 3.26Å; V240-V242 PolarHBondContact O-N 2.98Å; V240-L342 HydrophobicContact CG1-CB 4.37Å; V240-L342 HydrophobicContact CG1-CD1 3.99Å
241D82.9Confident67.4Low88 Ų8888.6 Ų88.647%0.47149%0.494SS..  trans-73.884.2174.3-174.6-11.1000108.9S239 D243 K244 E245S239-D241 PolarHBondContact O-N 2.92Å; D241-D243 PolarHBondContact O-N 3.38Å; D241-D243 PolarHBondContact OD1-N 3.01Å; D241-K244 HydrophobicContact CB-CB 4.02Å; D241-K244 VanDerWaalsContact CG-CB 3.48Å; D241-K244 PolarHBondContact O-N 2.61Å; D241-K244 VanDerWaalsContact O-N 3.16Å; D241-K244 PolarHBondContact OD1-N 2.92Å; D241-K244 VanDerWaalsContact OD1-N 3.11Å; D241-K244 WeakPolarHBondContact OD2-CB 3.34Å; D241-E245 PolarHBondContact O-N 3.19Å; D241-E245 VanDerWaalsContact O-N 3.09Å
242V85.3Confident69.4Low19 Ų1986.6 Ų86.612%0.11549%0.485CS..Hα-helixtrans-56.8-36.7-177.5-177.30000111.1V240 E245 L246 R335 V338 A339 L342V240-V242 VanDerWaalsContact C-N 3.26Å; V240-V242 PolarHBondContact O-N 2.98Å; V242-E245 PolarHBondContact O-N 3.01Å; V242-L246 WeakPolarHBondContact O-CB 3.37Å; V242-L246 PolarHBondContact O-N 3.09Å; V242-R335 HydrophobicContact CG1-CG 3.95Å; V242-V338 HydrophobicContact CG1-CB 4.49Å; V242-V338 HydrophobicContact CG1-CG1 4.16Å; V242-A339 HydrophobicContact CG2-CB 3.67Å; V242-L342 HydrophobicContact CG1-CD1 4.44Å; V242-L342 HydrophobicContact CG2-CD1 4.46Å
243D84Confident72Confident65 Ų6585.7 Ų85.735%0.34847%0.467SS..Hα-helixtrans-67.9-38.7-178.6-65.8-31.5000111D241 S247D241-D243 PolarHBondContact O-N 3.38Å; D241-D243 PolarHBondContact OD1-N 3.01Å; D243-S247 WeakPolarHBondContact O-CB 3.31Å; D243-S247 PolarHBondContact O-N 3.36Å
244K85.4Confident74.9Confident126 Ų12681.2 Ų81.255%0.54844%0.436SS..Hα-helixtrans-66-45.5173.8-175.4-177.3178.3-171.50111.9D241 L246 S247 N248D241-K244 HydrophobicContact CB-CB 4.02Å; D241-K244 VanDerWaalsContact CG-CB 3.48Å; D241-K244 PolarHBondContact O-N 2.61Å; D241-K244 VanDerWaalsContact O-N 3.16Å; D241-K244 PolarHBondContact OD1-N 2.92Å; D241-K244 VanDerWaalsContact OD1-N 3.11Å; D241-K244 WeakPolarHBondContact OD2-CB 3.34Å; K244-L246 VanDerWaalsContact C-N 3.34Å; K244-L246 PolarHBondContact O-N 3.29Å; K244-S247 WeakPolarHBondContact O-CB 3.33Å; K244-S247 PolarHBondContact O-N 2.81Å; K244-N248 VanDerWaalsContact O-CG 3.27Å; K244-N248 PolarHBondContact O-N 3.3Å; K244-N248 PolarHBondContact O-ND2 2.87Å
245E88.1Confident77.8Confident71 Ų7175.3 Ų75.333%0.33241%0.409SS..Hα-helixtrans-62.6-44.3-179.5-167.656.9-152.400111.2D241 V242 S247 N248 V249 L342D241-E245 PolarHBondContact O-N 3.19Å; D241-E245 VanDerWaalsContact O-N 3.09Å; V242-E245 PolarHBondContact O-N 3.01Å; E245-S247 VanDerWaalsContact C-N 3.35Å; E245-S247 PolarHBondContact O-N 3.5Å; E245-N248 WeakPolarHBondContact O-CB 3.29Å; E245-N248 PolarHBondContact O-N 2.77Å; E245-N248 VanDerWaalsContact O-N 3.13Å; E245-V249 WeakPolarHBondContact O-CG2 3.28Å; E245-V249 PolarHBondContact O-N 2.8Å; E245-L342 HydrophobicContact CB-CD1 4.24Å; E245-L342 HydrophobicContact CG-CD1 4.1Å; E245-L342 HydrophobicContact CG-CD2 4.15Å
246L89.7Confident80.5Confident7 Ų770.1 Ų70.14%0.03739%0.389CS..Hα-helixtrans-65.4-37.7177.9-168.860.1000112.7V242 K244 N248 V249 I250 Y358V242-L246 WeakPolarHBondContact O-CB 3.37Å; V242-L246 PolarHBondContact O-N 3.09Å; K244-L246 VanDerWaalsContact C-N 3.34Å; K244-L246 PolarHBondContact O-N 3.29Å; L246-N248 VanDerWaalsContact C-N 3.34Å; L246-V249 PolarHBondContact O-N 3.13Å; L246-I250 HydrophobicContact CG-CD1 4.28Å; L246-I250 WeakPolarHBondContact O-CD1 3.24Å; L246-I250 VanDerWaalsContact O-CG1 3.23Å; L246-I250 WeakPolarHBondContact O-CG1 3.48Å; L246-I250 PolarHBondContact O-N 3.07Å; L246-Y358 HydrophobicContact CD1-CD1 3.76Å; L246-Y358 HydrophobicContact CD1-CE1 4.4Å; L246-Y358 HydrophobicContact CD1-CG 3.92Å; L246-Y358 HydrophobicContact CD2-CD1 3.31Å; L246-Y358 HydrophobicContact CD2-CD2 3.67Å; L246-Y358 HydrophobicContact CD2-CE1 3.16Å; L246-Y358 HydrophobicContact CD2-CE2 3.6Å; L246-Y358 HydrophobicContact CD2-CG 3.53Å; L246-Y358 HydrophobicContact CG-CD1 3.76Å; L246-Y358 HydrophobicContact CG-CE1 3.89Å; L246-Y358 HydrophobicContact CG-CG 4.21Å
247S88.8Confident83.3Confident59 Ų5964.4 Ų64.441%0.41336%0.364SS..Hα-helixtrans-60.8-43171.4-170.40000111.6D243 K244 E245 I250 D251D243-S247 WeakPolarHBondContact O-CB 3.31Å; D243-S247 PolarHBondContact O-N 3.36Å; K244-S247 WeakPolarHBondContact O-CB 3.33Å; K244-S247 PolarHBondContact O-N 2.81Å; E245-S247 VanDerWaalsContact C-N 3.35Å; E245-S247 PolarHBondContact O-N 3.5Å; S247-I250 PolarHBondContact O-N 3.47Å; S247-D251 WeakPolarHBondContact O-CB 3.27Å; S247-D251 PolarHBondContact O-N 3.29Å
248N90.5Very high86.1Confident74 Ų7468.7 Ų68.740%0.39637%0.365SS..Hα-helixtrans-63-45.2177.1-64.9-23.5000111.2K244 E245 L246 I250 D251 E252K244-N248 VanDerWaalsContact O-CG 3.27Å; K244-N248 PolarHBondContact O-N 3.3Å; K244-N248 PolarHBondContact O-ND2 2.87Å; E245-N248 WeakPolarHBondContact O-CB 3.29Å; E245-N248 PolarHBondContact O-N 2.77Å; E245-N248 VanDerWaalsContact O-N 3.13Å; L246-N248 VanDerWaalsContact C-N 3.34Å; N248-I250 VanDerWaalsContact C-N 3.3Å; N248-I250 PolarHBondContact O-N 3.39Å; N248-D251 PolarHBondContact O-N 3.25Å; N248-E252 WeakPolarHBondContact O-CB 3.46Å; N248-E252 PolarHBondContact O-N 2.94Å
249V92.5Very high88.5Confident2 Ų268.6 Ų68.61%0.01235%0.349CS..Hα-helixtrans-57.9-42.9176.4170.40000111.4E245 L246 R253 N351 M354E245-V249 WeakPolarHBondContact O-CG2 3.28Å; E245-V249 PolarHBondContact O-N 2.8Å; L246-V249 PolarHBondContact O-N 3.13Å; V249-R253 WeakPolarHBondContact O-CB 3.49Å; V249-R253 PolarHBondContact O-N 3.46Å; V249-N351 HydrophobicContact CG1-CB 4.16Å; V249-N351 VanDerWaalsContact CG1-O 3.32Å; V249-N351 WeakPolarHBondContact CG1-O 3.5Å; V249-M354 HydrophobicContact CG2-CE 3.59Å; V249-M354 HydrophobicContact CG2-SD 4.34Å
250I93.6Very high90.3Very high15 Ų1563.6 Ų63.68%0.07731%0.314CS..Hα-helixtrans-67.3-44.3178.3-68.3161.8000111L246 S247 N248 R253 F254 Y355 T412 P415L246-I250 HydrophobicContact CG-CD1 4.28Å; L246-I250 WeakPolarHBondContact O-CD1 3.24Å; L246-I250 VanDerWaalsContact O-CG1 3.23Å; L246-I250 WeakPolarHBondContact O-CG1 3.48Å; L246-I250 PolarHBondContact O-N 3.07Å; S247-I250 PolarHBondContact O-N 3.47Å; N248-I250 VanDerWaalsContact C-N 3.3Å; N248-I250 PolarHBondContact O-N 3.39Å; I250-R253 PolarHBondContact O-N 3.36Å; I250-F254 HydrophobicContact CG2-CD2 4.36Å; I250-F254 WeakPolarHBondContact O-CB 3.35Å; I250-F254 WeakPolarHBondContact O-CD2 3.27Å; I250-F254 PolarHBondContact O-N 3.15Å; I250-Y355 HydrophobicContact CG1-CD2 4.21Å; I250-Y355 HydrophobicContact CG1-CE2 4.37Å; I250-T412 WeakPolarHBondContact CD1-O 3.28Å; I250-P415 HydrophobicContact CG2-CG 4Å
251D92.3Very high91.5Very high62 Ų6263.4 Ų63.433%0.33231%0.311SS..Hα-helixtrans-67.6-38.4179.9-81.6-31.8000112.5S247 N248 F254 P415S247-D251 WeakPolarHBondContact O-CB 3.27Å; S247-D251 PolarHBondContact O-N 3.29Å; N248-D251 PolarHBondContact O-N 3.25Å; D251-F254 CarbonylContact O-C 3.35Å; D251-F254 VanDerWaalsContact O-C 3.28Å; D251-F254 PolarHBondContact O-N 3.16Å; D251-P415 WeakPolarHBondContact OD1-CB 3.29Å; D251-P415 WeakPolarHBondContact OD1-CG 3.2Å
252E93.3Very high92.1Very high134 Ų13467 Ų6763%0.62632%0.323SS*.Hα-helixtrans-68.4-39.8175.6-167.9-169.5148.300111.5N248 F254 P255 N351N248-E252 WeakPolarHBondContact O-CB 3.46Å; N248-E252 PolarHBondContact O-N 2.94Å; E252-F254 VanDerWaalsContact C-N 3.32Å; E252-F254 PolarHBondContact O-N 3.15Å; E252-P255 WeakPolarHBondContact O-CD 3.41Å; E252-N351 PolarHBondContact OE1-ND2 2.99Å; E252-N351 PolarHBondContact OE2-ND2 2.98Å
253R93.6Very high92.5Very high74 Ų7466.9 Ų66.928%0.27932%0.322SS..Hα-helixtrans-66.7-35.9176-168.7169.3-156.4-115.7-0.3111.9V249 I250 P255 Y355 Y356V249-R253 WeakPolarHBondContact O-CB 3.49Å; V249-R253 PolarHBondContact O-N 3.46Å; I250-R253 PolarHBondContact O-N 3.36Å; R253-P255 VanDerWaalsContact C-CD 3.43Å; R253-P255 WeakPolarHBondContact O-CD 3.23Å; R253-Y355 VanDerWaalsContact NH1-CD1 3.27Å; R253-Y356 VanDerWaalsContact NH2-CE2 3.31Å; R253-Y356 PolarHBondContact NH2-OH 2.63Å
254F95.7Very high93Very high5 Ų566.3 Ų66.32%0.02233%0.326CS..  trans-126.466.6-173.7-59.4-62.1000113.3I250 D251 E252 T256 K259 Y355 G413 F414 P415 R417I250-F254 HydrophobicContact CG2-CD2 4.36Å; I250-F254 WeakPolarHBondContact O-CB 3.35Å; I250-F254 WeakPolarHBondContact O-CD2 3.27Å; I250-F254 PolarHBondContact O-N 3.15Å; D251-F254 CarbonylContact O-C 3.35Å; D251-F254 VanDerWaalsContact O-C 3.28Å; D251-F254 PolarHBondContact O-N 3.16Å; E252-F254 VanDerWaalsContact C-N 3.32Å; E252-F254 PolarHBondContact O-N 3.15Å; F254-T256 VanDerWaalsContact C-N 3.26Å; F254-T256 PolarHBondContact O-N 2.87Å; F254-K259 HydrophobicContact CD1-CB 4.45Å; F254-Y355 AromaticContact CE2-CE2 3.7Å; F254-Y355 HydrophobicContact CE2-CE2 3.7Å; F254-Y355 AromaticContact CE2-CZ 3.83Å; F254-Y355 HydrophobicContact CZ-CE2 4.48Å; F254-G413 WeakPolarHBondContact CE2-O 3.46Å; F254-F414 HydrophobicContact CD1-CD1 4.5Å; F254-F414 HydrophobicContact CD2-CD1 4.03Å; F254-F414 HydrophobicContact CD2-CE1 4.48Å; F254-F414 HydrophobicContact CE1-CD1 4.42Å; F254-F414 HydrophobicContact CE1-CE1 4.08Å; F254-F414 AromaticContact CE2-CD1 3.92Å; F254-F414 HydrophobicContact CE2-CD1 3.92Å; F254-F414 AromaticContact CE2-CE1 3.96Å; F254-F414 HydrophobicContact CE2-CE1 3.96Å; F254-F414 HydrophobicContact CG-CD1 4.31Å; F254-F414 HydrophobicContact CZ-CD1 4.12Å; F254-F414 AromaticContact CZ-CE1 3.73Å; F254-F414 HydrophobicContact CZ-CE1 3.73Å; F254-P415 HydrophobicContact CB-CG 3.96Å; F254-R417 PolarHBondContact O-NH2 2.7Å
255P93.4Very high93.5Very high54 Ų5460.3 Ų60.335%0.35130%0.3SS..SBendtrans-70.8-23.4-179.528.6-36.3000112.6E252 R253 K259 R417 Y418E252-P255 WeakPolarHBondContact O-CD 3.41Å; R253-P255 VanDerWaalsContact C-CD 3.43Å; R253-P255 WeakPolarHBondContact O-CD 3.23Å; P255-K259 HydrophobicContact CG-CD 3.85Å; P255-R417 PolarHBondContact O-NH2 3.36Å; P255-Y418 PolarHBondContact O-OH 3.28Å
256T95.4Very high93.9Very high66 Ų6657.1 Ų57.141%0.40529%0.286SS..SBendtrans-133149-177.864.90000111.4F254 R258 K259 C260F254-T256 VanDerWaalsContact C-N 3.26Å; F254-T256 PolarHBondContact O-N 2.87Å; T256-R258 PolarHBondContact O-N 3.21Å; T256-K259 PolarHBondContact O-N 3.02Å; T256-C260 PolarHBondContact O-N 3.35Å
257L93.5Very high94.2Very high50 Ų5059.5 Ų59.526%0.26231%0.306SS..Hα-helixtrans-55.6-37.2176.5178.966.4000112.4K259 C260 I261 Y418 T421 L422L257-K259 VanDerWaalsContact C-N 3.31Å; L257-K259 PolarHBondContact O-N 3.05Å; L257-C260 VanDerWaalsContact O-CB 3.3Å; L257-C260 WeakPolarHBondContact O-CB 3.28Å; L257-C260 PolarHBondContact O-N 2.9Å; L257-I261 HydrophobicContact CD1-CD1 4.18Å; L257-I261 HydrophobicContact CD1-CG1 4.32Å; L257-I261 HydrophobicContact CD2-CD1 4.27Å; L257-I261 HydrophobicContact CG-CD1 3.83Å; L257-I261 HydrophobicContact CG-CG1 4.36Å; L257-I261 WeakPolarHBondContact O-CG1 3.2Å; L257-I261 PolarHBondContact O-N 2.92Å; L257-Y418 HydrophobicContact CB-CD1 4.15Å; L257-Y418 HydrophobicContact CB-CE1 4.07Å; L257-Y418 HydrophobicContact CD1-CD1 4.14Å; L257-Y418 HydrophobicContact CD1-CG 4.06Å; L257-T421 HydrophobicContact CD1-CG2 4.19Å; L257-T421 HydrophobicContact CD2-CG2 3.78Å; L257-L422 HydrophobicContact CD1-CD2 3.97Å; L257-L422 HydrophobicContact CD1-CG 4.22Å
258R95.9Very high94.6Very high187 Ų18757.9 Ų57.971%0.70629%0.293SS*.Hα-helixtrans-58.8-42.7177.5-173.1178.1178.9-176.7-0.1111.4T256 C260 I261 F262T256-R258 PolarHBondContact O-N 3.21Å; R258-C260 VanDerWaalsContact C-N 3.3Å; R258-C260 PolarHBondContact O-N 3.33Å; R258-I261 PolarHBondContact O-N 3.35Å; R258-F262 HydrophobicContact CG-CD2 3.7Å; R258-F262 HydrophobicContact CG-CE2 3.95Å; R258-F262 WeakPolarHBondContact O-CD2 3.45Å; R258-F262 PolarHBondContact O-N 2.73Å
259K95.6Very high94.8Very high121 Ų12154.4 Ų54.453%0.52627%0.274SS..Hα-helixtrans-66.1-32.1176-76.7-173.7174.4-173.60112.2F254 P255 T256 L257 S263F254-K259 HydrophobicContact CD1-CB 4.45Å; P255-K259 HydrophobicContact CG-CD 3.85Å; T256-K259 PolarHBondContact O-N 3.02Å; L257-K259 VanDerWaalsContact C-N 3.31Å; L257-K259 PolarHBondContact O-N 3.05Å; K259-S263 WeakPolarHBondContact O-CB 3.42Å; K259-S263 PolarHBondContact O-N 3.35Å
260C95.7Very high95Very high0 Ų054.5 Ų54.50%028%0.275CS..Hα-helixtrans-63.5-53.5172.4-55.40000111.1T256 L257 R258 F262 S263 Y266 F414 L422T256-C260 PolarHBondContact O-N 3.35Å; L257-C260 VanDerWaalsContact O-CB 3.3Å; L257-C260 WeakPolarHBondContact O-CB 3.28Å; L257-C260 PolarHBondContact O-N 2.9Å; R258-C260 VanDerWaalsContact C-N 3.3Å; R258-C260 PolarHBondContact O-N 3.33Å; C260-F262 PolarHBondContact O-N 3.46Å; C260-S263 WeakPolarHBondContact O-CB 3.2Å; C260-S263 PolarHBondContact O-N 3.31Å; C260-S263 VanDerWaalsContact O-N 3.16Å; C260-S263 PolarHBondContact O-OG 3.43Å; C260-Y266 WeakPolarHBondContact O-CB 3.4Å; C260-F414 HydrophobicContact CB-CD1 4Å; C260-F414 HydrophobicContact CB-CE1 4.33Å; C260-L422 HydrophobicContact CB-CD1 4.1Å; C260-L422 HydrophobicContact CB-CD2 3.83Å
261I95.7Very high95.2Very high53 Ų5357 Ų5727%0.27229%0.288SS..Hα-helixtrans-62.9-42.5-173.7-66.6170.3000111.6L257 R258 S263 Y266 L422 I425L257-I261 HydrophobicContact CD1-CD1 4.18Å; L257-I261 HydrophobicContact CD1-CG1 4.32Å; L257-I261 HydrophobicContact CD2-CD1 4.27Å; L257-I261 HydrophobicContact CG-CD1 3.83Å; L257-I261 HydrophobicContact CG-CG1 4.36Å; L257-I261 WeakPolarHBondContact O-CG1 3.2Å; L257-I261 PolarHBondContact O-N 2.92Å; R258-I261 PolarHBondContact O-N 3.35Å; I261-S263 VanDerWaalsContact C-N 3.25Å; I261-S263 PolarHBondContact O-N 3.16Å; I261-Y266 HydrophobicContact CG1-CE1 4.41Å; I261-Y266 HydrophobicContact CG2-CE1 4.48Å; I261-Y266 WeakPolarHBondContact O-CD1 3.27Å; I261-L422 HydrophobicContact CG1-CD2 4.04Å; I261-I425 HydrophobicContact CD1-CD1 3.76Å; I261-I425 HydrophobicContact CG1-CD1 4.38Å
262F95.4Very high95.4Very high164 Ų16454 Ų5472%0.71927%0.272SS*.THydrogen-bonded Turntrans-87.615.9179.7-70.5-76.9000113.7R258 C260R258-F262 HydrophobicContact CG-CD2 3.7Å; R258-F262 HydrophobicContact CG-CE2 3.95Å; R258-F262 WeakPolarHBondContact O-CD2 3.45Å; R258-F262 PolarHBondContact O-N 2.73Å; C260-F262 PolarHBondContact O-N 3.46Å
263S95.2Very high95.5Very high15 Ų1547.9 Ų47.911%0.10524%0.243CC..  trans-85.6144177.573.70000112.4K259 C260 I261 S265 Y266 A267K259-S263 WeakPolarHBondContact O-CB 3.42Å; K259-S263 PolarHBondContact O-N 3.35Å; C260-S263 WeakPolarHBondContact O-CB 3.2Å; C260-S263 PolarHBondContact O-N 3.31Å; C260-S263 VanDerWaalsContact O-N 3.16Å; C260-S263 PolarHBondContact O-OG 3.43Å; I261-S263 VanDerWaalsContact C-N 3.25Å; I261-S263 PolarHBondContact O-N 3.16Å; S263-S265 PolarHBondContact O-N 3.08Å; S263-Y266 PolarHBondContact O-N 3.32Å; S263-Y266 VanDerWaalsContact O-N 3.17Å; S263-Y266 VanDerWaalsContact OG-CB 3.23Å; S263-Y266 WeakPolarHBondContact OG-CB 3.44Å; S263-Y266 PolarHBondContact OG-N 3.25Å; S263-Y266 VanDerWaalsContact OG-N 3.11Å; S263-A267 PolarHBondContact O-N 3.34Å
264A94.6Very high95.6Very high53 Ų5345.7 Ų45.744%0.43824%0.237SC..Hα-helixtrans-58.4-37173.200000112.1Y266 A267 L268 L469A264-Y266 PolarHBondContact O-N 2.95Å; A264-A267 PolarHBondContact O-N 3.42Å; A264-L268 WeakPolarHBondContact O-CB 3.37Å; A264-L268 VanDerWaalsContact O-CG 3.23Å; A264-L268 WeakPolarHBondContact O-CG 3.49Å; A264-L268 PolarHBondContact O-N 3.46Å; A264-L469 HydrophobicContact CB-CD1 4.45Å
265S94.2Very high95.5Very high0 Ų046.5 Ų46.50%024%0.241CC..Hα-helixtrans-59.3-45.7176.5-176.60000111.7S263 I269 Y355 Y409S263-S265 PolarHBondContact O-N 3.08Å; S265-I269 WeakPolarHBondContact O-CG2 3.33Å; S265-I269 PolarHBondContact O-N 2.9Å; S265-Y355 WeakPolarHBondContact CB-OH 3.28Å; S265-Y355 PolarHBondContact OG-OH 2.68Å; S265-Y409 PolarHBondContact O-OH 2.98Å; S265-Y409 PolarHBondContact OG-OH 2.84Å
266Y96.7Very high95.6Very high5 Ų544 Ų442%0.0223%0.225CC..Hα-helixtrans-69.9-41.6178.7-172.6-112.8000111.6C260 I261 S263 A264 L268 I269 N270 L410 F414 L422 S426C260-Y266 WeakPolarHBondContact O-CB 3.4Å; I261-Y266 HydrophobicContact CG1-CE1 4.41Å; I261-Y266 HydrophobicContact CG2-CE1 4.48Å; I261-Y266 WeakPolarHBondContact O-CD1 3.27Å; S263-Y266 PolarHBondContact O-N 3.32Å; S263-Y266 VanDerWaalsContact O-N 3.17Å; S263-Y266 VanDerWaalsContact OG-CB 3.23Å; S263-Y266 WeakPolarHBondContact OG-CB 3.44Å; S263-Y266 PolarHBondContact OG-N 3.25Å; S263-Y266 VanDerWaalsContact OG-N 3.11Å; A264-Y266 PolarHBondContact O-N 2.95Å; Y266-L268 VanDerWaalsContact C-N 3.34Å; Y266-L268 PolarHBondContact O-N 3.48Å; Y266-I269 HydrophobicContact CD2-CG2 4.43Å; Y266-I269 VanDerWaalsContact O-CG2 3.28Å; Y266-I269 WeakPolarHBondContact O-CG2 3.38Å; Y266-I269 PolarHBondContact O-N 2.85Å; Y266-N270 WeakPolarHBondContact CD1-ND2 3.3Å; Y266-N270 VanDerWaalsContact CD2-ND2 3.28Å; Y266-N270 WeakPolarHBondContact CD2-ND2 3.31Å; Y266-N270 VanDerWaalsContact CE1-ND2 3.28Å; Y266-N270 WeakPolarHBondContact CE1-ND2 3.29Å; Y266-N270 WeakPolarHBondContact CE2-ND2 3.35Å; Y266-N270 VanDerWaalsContact O-CB 3.3Å; Y266-N270 WeakPolarHBondContact O-CB 3.07Å; Y266-N270 PolarHBondContact O-N 3.41Å; Y266-N270 PolarHBondContact O-ND2 3.24Å; Y266-L410 HydrophobicContact CD2-CD2 4.19Å; Y266-L410 HydrophobicContact CE2-CD2 4Å; Y266-F414 HydrophobicContact CD2-CE2 4.12Å; Y266-F414 HydrophobicContact CD2-CZ 4.05Å; Y266-F414 HydrophobicContact CG-CZ 4.31Å; Y266-L422 HydrophobicContact CD2-CD2 4.07Å; Y266-L422 HydrophobicContact CE1-CD2 4.24Å; Y266-L422 HydrophobicContact CE2-CB 3.9Å; Y266-L422 HydrophobicContact CE2-CD2 3.59Å; Y266-L422 HydrophobicContact CE2-CG 4.23Å; Y266-L422 PolarHBondContact OH-O 3.14Å; Y266-S426 WeakPolarHBondContact CE2-OG 3.43Å; Y266-S426 PolarHBondContact OH-OG 3.46Å
267A96.7Very high95.4Very high57 Ų5741.1 Ų41.147%0.47121%0.207SC..Hα-helixtrans-59.7-43.2176.500000112.3S263 A264 N270 L271S263-A267 PolarHBondContact O-N 3.34Å; A264-A267 PolarHBondContact O-N 3.42Å; A267-N270 PolarHBondContact O-N 3.04Å; A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.24Å
268L96.5Very high95.3Very high25 Ų2539.3 Ų39.313%0.13120%0.198CC..Hα-helixtrans-65.8-44.8-179.9-74.7174.7000113A264 Y266 N270 L271 W272 T462 A465 L466 L469A264-L268 WeakPolarHBondContact O-CB 3.37Å; A264-L268 VanDerWaalsContact O-CG 3.23Å; A264-L268 WeakPolarHBondContact O-CG 3.49Å; A264-L268 PolarHBondContact O-N 3.46Å; Y266-L268 VanDerWaalsContact C-N 3.34Å; Y266-L268 PolarHBondContact O-N 3.48Å; L268-N270 VanDerWaalsContact C-N 3.33Å; L268-L271 PolarHBondContact O-N 3.06Å; L268-W272 PolarHBondContact O-N 3.47Å; L268-W272 VanDerWaalsContact O-N 3.12Å; L268-T462 HydrophobicContact CB-CG2 4.09Å; L268-T462 VanDerWaalsContact O-CG2 3.28Å; L268-T462 WeakPolarHBondContact O-CG2 3.41Å; L268-T462 PolarHBondContact O-OG1 3.17Å; L268-A465 HydrophobicContact CD1-CB 3.79Å; L268-A465 HydrophobicContact CD2-CB 3.58Å; L268-A465 HydrophobicContact CG-CB 4.35Å; L268-L466 HydrophobicContact CD1-CD2 3.88Å; L268-L466 HydrophobicContact CD1-CG 4.2Å; L268-L469 HydrophobicContact CD1-CD1 3.58Å
269I96.6Very high95.1Very high0 Ų030.9 Ų30.90%017%0.166CC..Hα-helixtrans-70.2-33.1177.6-169.962.4000111.8S265 Y266 W272 L273 L366 F406 Y409S265-I269 WeakPolarHBondContact O-CG2 3.33Å; S265-I269 PolarHBondContact O-N 2.9Å; Y266-I269 HydrophobicContact CD2-CG2 4.43Å; Y266-I269 VanDerWaalsContact O-CG2 3.28Å; Y266-I269 WeakPolarHBondContact O-CG2 3.38Å; Y266-I269 PolarHBondContact O-N 2.85Å; I269-W272 HydrophobicContact CD1-CD2 4.46Å; I269-W272 HydrophobicContact CD1-CE3 3.89Å; I269-W272 HydrophobicContact CD1-CZ3 4.42Å; I269-W272 PolarHBondContact O-N 2.96Å; I269-L273 PolarHBondContact O-N 3.46Å; I269-L366 HydrophobicContact CD1-CD2 4.12Å; I269-F406 HydrophobicContact CD1-CD2 4.3Å; I269-F406 HydrophobicContact CG1-CD2 3.74Å; I269-F406 HydrophobicContact CG1-CE2 4.02Å; I269-Y409 HydrophobicContact CB-CD1 3.74Å; I269-Y409 HydrophobicContact CB-CE1 3.7Å; I269-Y409 HydrophobicContact CB-CE2 4.45Å; I269-Y409 HydrophobicContact CB-CG 4.17Å; I269-Y409 HydrophobicContact CD1-CD1 4.24Å; I269-Y409 HydrophobicContact CD1-CD2 3.86Å; I269-Y409 HydrophobicContact CD1-CE2 4.39Å; I269-Y409 HydrophobicContact CD1-CG 3.77Å; I269-Y409 HydrophobicContact CG1-CD1 3.64Å; I269-Y409 HydrophobicContact CG1-CD2 4.18Å; I269-Y409 HydrophobicContact CG1-CE1 4.14Å; I269-Y409 HydrophobicContact CG1-CG 3.68Å; I269-Y409 HydrophobicContact CG2-CD1 3.78Å; I269-Y409 HydrophobicContact CG2-CE1 3.7Å
270N96.3Very high94.6Very high5 Ų525.4 Ų25.43%0.02714%0.142CC..Hα-helixtrans-65.8-44.9173.7-88.1-85.5000112Y266 A267 L268 W272 L273 I274 S426 M429Y266-N270 WeakPolarHBondContact CD1-ND2 3.3Å; Y266-N270 VanDerWaalsContact CD2-ND2 3.28Å; Y266-N270 WeakPolarHBondContact CD2-ND2 3.31Å; Y266-N270 VanDerWaalsContact CE1-ND2 3.28Å; Y266-N270 WeakPolarHBondContact CE1-ND2 3.29Å; Y266-N270 WeakPolarHBondContact CE2-ND2 3.35Å; Y266-N270 VanDerWaalsContact O-CB 3.3Å; Y266-N270 WeakPolarHBondContact O-CB 3.07Å; Y266-N270 PolarHBondContact O-N 3.41Å; Y266-N270 PolarHBondContact O-ND2 3.24Å; A267-N270 PolarHBondContact O-N 3.04Å; L268-N270 VanDerWaalsContact C-N 3.33Å; N270-W272 VanDerWaalsContact C-N 3.26Å; N270-W272 PolarHBondContact O-N 3.31Å; N270-L273 PolarHBondContact O-N 2.7Å; N270-I274 WeakPolarHBondContact O-CB 3.26Å; N270-I274 WeakPolarHBondContact O-CD1 3.25Å; N270-I274 WeakPolarHBondContact O-CG1 3.37Å; N270-I274 PolarHBondContact O-N 3.33Å; N270-S426 PolarHBondContact ND2-OG 2.85Å; N270-S426 WeakPolarHBondContact OD1-CA 3.38Å; N270-S426 WeakPolarHBondContact OD1-CB 3.26Å; N270-S426 PolarHBondContact OD1-OG 3Å; N270-M429 HydrophobicContact CB-CE 4.07Å; N270-M429 WeakPolarHBondContact OD1-CE 3.37Å
271L96.2Very high94.1Very high67 Ų6725.7 Ų25.735%0.35114%0.144SC..Hα-helixtrans-56.1-44.6174.5178.663.1000111A267 L268 I274 L275 I461A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.24Å; L268-L271 PolarHBondContact O-N 3.06Å; L271-I274 PolarHBondContact O-N 2.88Å; L271-L275 HydrophobicContact CD1-CD1 3.99Å; L271-L275 HydrophobicContact CD1-CG 4.23Å; L271-L275 HydrophobicContact CG-CD1 4.02Å; L271-L275 WeakPolarHBondContact O-CB 3.32Å; L271-L275 VanDerWaalsContact O-CG 3.28Å; L271-L275 WeakPolarHBondContact O-CG 3.29Å; L271-L275 PolarHBondContact O-N 3.26Å; L271-I461 HydrophobicContact CD2-CG2 4.31Å
272W96.9Very high93.5Very high0 Ų023.2 Ų23.20%013%0.131CC..Hα-helixtrans-62.6-45.3177.1-17886.3000112.6L268 I269 N270 G276 L366 M369 M402 A405 F406 L459 T462L268-W272 PolarHBondContact O-N 3.47Å; L268-W272 VanDerWaalsContact O-N 3.12Å; I269-W272 HydrophobicContact CD1-CD2 4.46Å; I269-W272 HydrophobicContact CD1-CE3 3.89Å; I269-W272 HydrophobicContact CD1-CZ3 4.42Å; I269-W272 PolarHBondContact O-N 2.96Å; N270-W272 VanDerWaalsContact C-N 3.26Å; N270-W272 PolarHBondContact O-N 3.31Å; W272-G276 PolarHBondContact O-N 2.84Å; W272-L366 HydrophobicContact CD2-CD2 3.78Å; W272-L366 HydrophobicContact CE3-CD2 4Å; W272-L366 HydrophobicContact CG-CD2 4.44Å; W272-L366 HydrophobicContact CH2-CD2 3.59Å; W272-L366 HydrophobicContact CZ2-CB 4.42Å; W272-L366 HydrophobicContact CZ2-CD2 3.43Å; W272-L366 VanDerWaalsContact CZ2-CD2 3.43Å; W272-L366 HydrophobicContact CZ3-CD2 3.91Å; W272-M369 HydrophobicContact CH2-CE 4.08Å; W272-M369 HydrophobicContact CH2-CG 4.42Å; W272-M369 HydrophobicContact CZ2-CB 3.97Å; W272-M369 HydrophobicContact CZ2-CE 3.58Å; W272-M369 HydrophobicContact CZ2-CG 3.74Å; W272-M369 HydrophobicContact CZ2-SD 3.64Å; W272-M402 HydrophobicContact CH2-CB 4.38Å; W272-M402 HydrophobicContact CH2-CG 4.31Å; W272-M402 WeakPolarHBondContact CH2-O 3.22Å; W272-M402 HydrophobicContact CZ3-CG 4.26Å; W272-M402 WeakPolarHBondContact CZ3-O 3.28Å; W272-A405 HydrophobicContact CH2-CB 4.01Å; W272-F406 HydrophobicContact CZ3-CB 4.07Å; W272-L459 HydrophobicContact CG-CD2 4.29Å; W272-L459 WeakPolarHBondContact O-CD2 3.42Å; W272-T462 HydrophobicContact CB-CG2 3.91Å; W272-T462 HydrophobicContact CG-CG2 4.43Å
273L96Very high93Very high4 Ų415.5 Ų15.52%0.02110%0.098CC..Hα-helixtrans-63.7-44.7176.5-179.868.9000111.7I269 N270 G276 L277 M402 F406 A430I269-L273 PolarHBondContact O-N 3.46Å; N270-L273 PolarHBondContact O-N 2.7Å; L273-G276 PolarHBondContact O-N 3.35Å; L273-L277 VanDerWaalsContact O-CB 3.23Å; L273-L277 WeakPolarHBondContact O-CB 3.32Å; L273-L277 PolarHBondContact O-N 2.65Å; L273-M402 HydrophobicContact CD1-CG 4.34Å; L273-F406 HydrophobicContact CB-CD2 3.93Å; L273-F406 HydrophobicContact CB-CE2 4.14Å; L273-F406 HydrophobicContact CD1-CB 4.3Å; L273-F406 HydrophobicContact CD1-CD1 4.3Å; L273-F406 HydrophobicContact CD1-CD2 4.22Å; L273-F406 HydrophobicContact CD1-CG 3.99Å; L273-F406 HydrophobicContact CD2-CD1 4.03Å; L273-F406 HydrophobicContact CD2-CD2 3.9Å; L273-F406 HydrophobicContact CD2-CE1 3.77Å; L273-F406 HydrophobicContact CD2-CE2 3.66Å; L273-F406 HydrophobicContact CD2-CG 4.11Å; L273-F406 HydrophobicContact CD2-CZ 3.6Å; L273-F406 HydrophobicContact CG-CD2 4.23Å; L273-F406 HydrophobicContact CG-CE2 4.39Å; L273-F406 HydrophobicContact CG-CG 4.44Å; L273-A430 HydrophobicContact CD2-CB 4.07Å; L273-A430 HydrophobicContact CG-CB 4.01Å
274I95.1Very high92.3Very high28 Ų2817.6 Ų17.614%0.14411%0.107CC..Hα-helixtrans-58.4-50.2179.5-72.3162.6000110.1N270 L271 F278 M429 A430 F433N270-I274 WeakPolarHBondContact O-CB 3.26Å; N270-I274 WeakPolarHBondContact O-CD1 3.25Å; N270-I274 WeakPolarHBondContact O-CG1 3.37Å; N270-I274 PolarHBondContact O-N 3.33Å; L271-I274 PolarHBondContact O-N 2.88Å; I274-F278 WeakPolarHBondContact O-CB 3.49Å; I274-F278 PolarHBondContact O-N 3.43Å; I274-M429 HydrophobicContact CD1-CB 4.22Å; I274-A430 HydrophobicContact CG1-CB 4.03Å; I274-F433 HydrophobicContact CG2-CB 3.68Å; I274-F433 HydrophobicContact CG2-CD1 3.4Å; I274-F433 VanDerWaalsContact CG2-CD1 3.4Å; I274-F433 HydrophobicContact CG2-CD2 4.01Å; I274-F433 HydrophobicContact CG2-CE1 3.99Å; I274-F433 HydrophobicContact CG2-CG 3.41Å; I274-F433 VanDerWaalsContact CG2-CG 3.41Å
275L95.1Very high91.4Very high22 Ų2217.1 Ų17.112%0.11510%0.101CC..Hα-helixtrans-65-42179.1-69.5171.2000112L271 R279 L459L271-L275 HydrophobicContact CD1-CD1 3.99Å; L271-L275 HydrophobicContact CD1-CG 4.23Å; L271-L275 HydrophobicContact CG-CD1 4.02Å; L271-L275 WeakPolarHBondContact O-CB 3.32Å; L271-L275 VanDerWaalsContact O-CG 3.28Å; L271-L275 WeakPolarHBondContact O-CG 3.29Å; L271-L275 PolarHBondContact O-N 3.26Å; L275-R279 WeakPolarHBondContact O-CB 3.41Å; L275-R279 PolarHBondContact O-N 3.1Å; L275-L459 HydrophobicContact CB-CD2 3.7Å; L275-L459 HydrophobicContact CB-CG 4.42Å
276G94.2Very high90.7Very high2 Ų217.3 Ų17.32%0.02110%0.102CC..Hα-helixtrans-65-47.2179.300000112.1W272 L273 R279 F280W272-G276 PolarHBondContact O-N 2.84Å; L273-G276 PolarHBondContact O-N 3.35Å; G276-R279 PolarHBondContact O-N 3.3Å; G276-F280 WeakPolarHBondContact O-CB 3.24Å; G276-F280 PolarHBondContact O-N 2.82Å
277L91.2Very high90Very high5 Ų517.5 Ų17.53%0.02610%0.103CC..Hα-helixtrans-68.9-38.3179.1-166.869000111.4F77 L273 F280 A281 M402 F403 A430F77-L277 HydrophobicContact CZ-CD1 4.45Å; F77-L277 HydrophobicContact CZ-CD2 4.32Å; L273-L277 VanDerWaalsContact O-CB 3.23Å; L273-L277 WeakPolarHBondContact O-CB 3.32Å; L273-L277 PolarHBondContact O-N 2.65Å; L277-F280 HydrophobicContact CD1-CD1 4.18Å; L277-F280 PolarHBondContact O-N 3.36Å; L277-A281 VanDerWaalsContact O-CB 3.23Å; L277-A281 WeakPolarHBondContact O-CB 3.46Å; L277-A281 PolarHBondContact O-N 2.9Å; L277-M402 HydrophobicContact CD1-CE 3.94Å; L277-F403 HydrophobicContact CD1-CE1 4.43Å; L277-F403 HydrophobicContact CD1-CZ 4.09Å; L277-A430 HydrophobicContact CB-CB 4.19Å; L277-A430 HydrophobicContact CD2-CB 3.5Å; L277-A430 VanDerWaalsContact CD2-CB 3.5Å; L277-A430 HydrophobicContact CG-CB 4.48Å
278F91.1Very high89.3Confident13 Ų1321.5 Ų21.56%0.05711%0.107CC..Hα-helixtrans-59.7-48.4173.8175.3-111000111.9I274 F280 A281 I282 F433 L436 F440 V451 A455I274-F278 WeakPolarHBondContact O-CB 3.49Å; I274-F278 PolarHBondContact O-N 3.43Å; F278-F280 PolarHBondContact O-N 3.29Å; F278-A281 PolarHBondContact O-N 3.33Å; F278-I282 HydrophobicContact CD1-CD1 4.02Å; F278-I282 HydrophobicContact CD2-CD1 4.33Å; F278-I282 HydrophobicContact CE1-CD1 3.51Å; F278-I282 HydrophobicContact CE2-CD1 3.85Å; F278-I282 HydrophobicContact CE2-CG1 4.36Å; F278-I282 HydrophobicContact CG-CD1 4.42Å; F278-I282 HydrophobicContact CZ-CD1 3.43Å; F278-I282 VanDerWaalsContact CZ-CD1 3.43Å; F278-I282 HydrophobicContact CZ-CG1 4.4Å; F278-I282 WeakPolarHBondContact O-CG1 3.23Å; F278-I282 PolarHBondContact O-N 3.14Å; F278-F433 HydrophobicContact CB-CD1 3.99Å; F278-F433 HydrophobicContact CB-CE1 4.17Å; F278-F433 HydrophobicContact CD1-CE1 4.24Å; F278-F433 AromaticContact CD2-CD1 3.99Å; F278-F433 HydrophobicContact CD2-CD1 3.99Å; F278-F433 AromaticContact CD2-CE1 3.98Å; F278-F433 HydrophobicContact CD2-CE1 3.98Å; F278-F433 HydrophobicContact CE2-CE1 4.42Å; F278-F433 HydrophobicContact CG-CD1 4.04Å; F278-F433 AromaticContact CG-CE1 3.87Å; F278-F433 HydrophobicContact CG-CE1 3.87Å; F278-L436 HydrophobicContact CE2-CB 4.03Å; F278-F440 HydrophobicContact CE2-CE2 4.4Å; F278-F440 HydrophobicContact CZ-CD2 4.37Å; F278-F440 AromaticContact CZ-CE2 3.84Å; F278-F440 HydrophobicContact CZ-CE2 3.84Å; F278-V451 HydrophobicContact CE1-CG1 3.79Å; F278-V451 HydrophobicContact CZ-CG1 4.01Å; F278-A455 HydrophobicContact CD1-CB 4.14Å; F278-A455 HydrophobicContact CE1-CB 4.48Å
279R91.3Very high88.5Confident10 Ų1025.2 Ų25.24%0.03812%0.119CC..Hα-helixtrans-57.3-53.1173.3-165.5-39-173.9156.7-30.3109.4L275 G276 A281 I282 F283 L376 S377L275-R279 WeakPolarHBondContact O-CB 3.41Å; L275-R279 PolarHBondContact O-N 3.1Å; G276-R279 PolarHBondContact O-N 3.3Å; R279-A281 VanDerWaalsContact C-N 3.25Å; R279-A281 PolarHBondContact O-N 3.02Å; R279-I282 PolarHBondContact O-N 3.14Å; R279-F283 VanDerWaalsContact NH1-CB 3.29Å; R279-F283 PolarHBondContact O-N 2.85Å; R279-F283 VanDerWaalsContact O-N 3.09Å; R279-L376 VanDerWaalsContact CZ-CG 3.42Å; R279-L376 VanDerWaalsContact NH1-CG 3.33Å; R279-L376 VanDerWaalsContact NH2-CG 3.31Å; R279-S377 PolarHBondContact NE-OG 3.47Å
280F87.1Confident87.9Confident6 Ų625.5 Ų25.53%0.02612%0.12CC..Hα-helixtrans-55.1-43.1-178177.1-104.7000112.1G276 L277 F278 F283 L284 L395 R399G276-F280 WeakPolarHBondContact O-CB 3.24Å; G276-F280 PolarHBondContact O-N 2.82Å; L277-F280 HydrophobicContact CD1-CD1 4.18Å; L277-F280 PolarHBondContact O-N 3.36Å; F278-F280 PolarHBondContact O-N 3.29Å; F280-F283 PolarHBondContact O-N 3.39Å; F280-L284 HydrophobicContact CD1-CD1 4.24Å; F280-L284 HydrophobicContact CE1-CD1 3.46Å; F280-L284 VanDerWaalsContact CE1-CD1 3.46Å; F280-L284 HydrophobicContact CE1-CG 4.33Å; F280-L284 HydrophobicContact CE2-CD1 4.14Å; F280-L284 HydrophobicContact CE2-CG 4.34Å; F280-L284 HydrophobicContact CZ-CD1 3.4Å; F280-L284 VanDerWaalsContact CZ-CD1 3.4Å; F280-L284 HydrophobicContact CZ-CG 4.08Å; F280-L284 PolarHBondContact O-N 3.33Å; F280-L284 VanDerWaalsContact O-N 3.15Å; F280-L395 HydrophobicContact CD2-CD1 3.79Å; F280-L395 HydrophobicContact CE2-CD1 4Å; F280-L395 HydrophobicContact CE2-CG 4.41Å; F280-R399 HydrophobicContact CE2-CB 4.12Å; F280-R399 HydrophobicContact CE2-CG 3.92Å; F280-R399 HydrophobicContact CZ-CG 4.17Å
281A84.1Confident87.5Confident6 Ų625.2 Ų25.25%0.0512%0.119CC..Hα-helixtrans-65.2-45.4178.400000111.7L277 F278 R279 F283 L284 S285 Q437L277-A281 VanDerWaalsContact O-CB 3.23Å; L277-A281 WeakPolarHBondContact O-CB 3.46Å; L277-A281 PolarHBondContact O-N 2.9Å; F278-A281 PolarHBondContact O-N 3.33Å; R279-A281 VanDerWaalsContact C-N 3.25Å; R279-A281 PolarHBondContact O-N 3.02Å; A281-F283 PolarHBondContact O-N 3.46Å; A281-L284 PolarHBondContact O-N 3.44Å; A281-S285 WeakPolarHBondContact O-CB 3.33Å; A281-S285 PolarHBondContact O-N 3.28Å; A281-S285 PolarHBondContact O-OG 3.43Å; A281-Q437 PolarHBondContact O-OE1 2.95Å
282I84.2Confident87Confident0 Ų026.2 Ų26.20%012%0.121CC..Hα-helixtrans-56.2-43.4176.3-72.2169.3000110.5F278 R279 S285 Q286 Q437 A448 V451 S452F278-I282 HydrophobicContact CD1-CD1 4.02Å; F278-I282 HydrophobicContact CD2-CD1 4.33Å; F278-I282 HydrophobicContact CE1-CD1 3.51Å; F278-I282 HydrophobicContact CE2-CD1 3.85Å; F278-I282 HydrophobicContact CE2-CG1 4.36Å; F278-I282 HydrophobicContact CG-CD1 4.42Å; F278-I282 HydrophobicContact CZ-CD1 3.43Å; F278-I282 VanDerWaalsContact CZ-CD1 3.43Å; F278-I282 HydrophobicContact CZ-CG1 4.4Å; F278-I282 WeakPolarHBondContact O-CG1 3.23Å; F278-I282 PolarHBondContact O-N 3.14Å; R279-I282 PolarHBondContact O-N 3.14Å; I282-S285 WeakPolarHBondContact CA-OG 3.08Å; I282-S285 PolarHBondContact O-OG 3.32Å; I282-Q286 HydrophobicContact CG2-CG 4.38Å; I282-Q286 VanDerWaalsContact O-CB 3.28Å; I282-Q286 WeakPolarHBondContact O-CB 3.45Å; I282-Q286 WeakPolarHBondContact O-CG 3.2Å; I282-Q286 PolarHBondContact O-N 3.11Å; I282-Q437 HydrophobicContact CG1-CB 3.85Å; I282-Q437 VanDerWaalsContact N-OE1 3.13Å; I282-A448 HydrophobicContact CG2-CB 4.49Å; I282-V451 HydrophobicContact CD1-CG1 4.32Å; I282-S452 WeakPolarHBondContact CG2-OG 3.36Å
283F84.8Confident86.5Confident2 Ų231.3 Ų31.31%0.00914%0.144CC..Hα-helixtrans-61.5-51179.5-176.9-87.3000112.1R279 F280 A281 S285 Q286 L287 L376 M380 F392 L395R279-F283 VanDerWaalsContact NH1-CB 3.29Å; R279-F283 PolarHBondContact O-N 2.85Å; R279-F283 VanDerWaalsContact O-N 3.09Å; F280-F283 PolarHBondContact O-N 3.39Å; A281-F283 PolarHBondContact O-N 3.46Å; F283-S285 PolarHBondContact O-N 3.22Å; F283-Q286 PolarHBondContact O-N 2.99Å; F283-L287 HydrophobicContact CE1-CD1 4.25Å; F283-L287 HydrophobicContact CE1-CD2 4.31Å; F283-L287 HydrophobicContact CE2-CD1 4.47Å; F283-L287 HydrophobicContact CZ-CD1 3.95Å; F283-L287 WeakPolarHBondContact O-CB 3.42Å; F283-L287 PolarHBondContact O-N 3.12Å; F283-L376 HydrophobicContact CD2-CD1 4.3Å; F283-L376 HydrophobicContact CE2-CD1 3.96Å; F283-M380 HydrophobicContact CD2-CG 4.48Å; F283-M380 HydrophobicContact CE2-CE 4.23Å; F283-M380 HydrophobicContact CE2-CG 4.24Å; F283-M380 HydrophobicContact CE2-SD 3.8Å; F283-F392 HydrophobicContact CE1-CD1 4.47Å; F283-F392 HydrophobicContact CE1-CE1 4.5Å; F283-F392 AromaticContact CZ-CD1 3.92Å; F283-F392 HydrophobicContact CZ-CD1 3.92Å; F283-F392 AromaticContact CZ-CE1 3.94Å; F283-F392 HydrophobicContact CZ-CE1 3.94Å; F283-L395 HydrophobicContact CB-CD1 4.42Å; F283-L395 HydrophobicContact CD1-CD1 3.58Å; F283-L395 HydrophobicContact CD1-CD2 3.63Å; F283-L395 HydrophobicContact CD1-CG 4.19Å; F283-L395 HydrophobicContact CE1-CD1 3.99Å; F283-L395 HydrophobicContact CE1-CD2 3.29Å; F283-L395 HydrophobicContact CE1-CG 4.13Å; F283-L395 HydrophobicContact CG-CD1 3.95Å; F283-L395 HydrophobicContact CZ-CD2 4.1Å
284L79Confident86.1Confident60 Ų6032.5 Ų32.531%0.31415%0.151SC..Hα-helixtrans-65.3-40.4-179.4-72.9-176.3000112.6F280 A281 Q286F280-L284 HydrophobicContact CD1-CD1 4.24Å; F280-L284 HydrophobicContact CE1-CD1 3.46Å; F280-L284 VanDerWaalsContact CE1-CD1 3.46Å; F280-L284 HydrophobicContact CE1-CG 4.33Å; F280-L284 HydrophobicContact CE2-CD1 4.14Å; F280-L284 HydrophobicContact CE2-CG 4.34Å; F280-L284 HydrophobicContact CZ-CD1 3.4Å; F280-L284 VanDerWaalsContact CZ-CD1 3.4Å; F280-L284 HydrophobicContact CZ-CG 4.08Å; F280-L284 PolarHBondContact O-N 3.33Å; F280-L284 VanDerWaalsContact O-N 3.15Å; A281-L284 PolarHBondContact O-N 3.44Å; L284-Q286 VanDerWaalsContact C-N 3.35Å
285S75.7Confident85.9Confident43 Ų4332.5 Ų32.530%0.30115%0.15SC..Hα-helixtrans-72.4-27.4-177.759.70000113.3A281 I282 F283 Q437A281-S285 WeakPolarHBondContact O-CB 3.33Å; A281-S285 PolarHBondContact O-N 3.28Å; A281-S285 PolarHBondContact O-OG 3.43Å; I282-S285 WeakPolarHBondContact CA-OG 3.08Å; I282-S285 PolarHBondContact O-OG 3.32Å; F283-S285 PolarHBondContact O-N 3.22Å; S285-Q437 PolarHBondContact OG-OE1 3.33Å; S285-Q437 VanDerWaalsContact OG-OE1 3.11Å
286Q79.5Confident85.5Confident3 Ų335.1 Ų35.11%0.01417%0.168CC..Hα-helixtrans-109.2-4.2-175.2-59.6-168.63.400114.7I282 F283 L284 Y288 R289 Q290 F440 L441I282-Q286 HydrophobicContact CG2-CG 4.38Å; I282-Q286 VanDerWaalsContact O-CB 3.28Å; I282-Q286 WeakPolarHBondContact O-CB 3.45Å; I282-Q286 WeakPolarHBondContact O-CG 3.2Å; I282-Q286 PolarHBondContact O-N 3.11Å; F283-Q286 PolarHBondContact O-N 2.99Å; L284-Q286 VanDerWaalsContact C-N 3.35Å; Q286-Y288 VanDerWaalsContact C-N 3.31Å; Q286-Y288 PolarHBondContact O-N 2.98Å; Q286-R289 PolarHBondContact O-N 3Å; Q286-Q290 HydrophobicContact CB-CG 4.09Å; Q286-Q290 WeakPolarHBondContact O-CG 3.35Å; Q286-Q290 PolarHBondContact O-N 2.95Å; Q286-F440 PolarHBondContact NE2-O 3.28Å; Q286-L441 HydrophobicContact CG-CD2 4.3Å
287L83.1Confident85.2Confident9 Ų941.6 Ų41.65%0.04721%0.207CC..Hα-helixtrans-50.2-50.4-173.4-179.959.7000112.5F283 R289 Q290 L291 L306 S309 F392F283-L287 HydrophobicContact CE1-CD1 4.25Å; F283-L287 HydrophobicContact CE1-CD2 4.31Å; F283-L287 HydrophobicContact CE2-CD1 4.47Å; F283-L287 HydrophobicContact CZ-CD1 3.95Å; F283-L287 WeakPolarHBondContact O-CB 3.42Å; F283-L287 PolarHBondContact O-N 3.12Å; L287-R289 VanDerWaalsContact C-N 3.35Å; L287-R289 PolarHBondContact O-N 3.05Å; L287-Q290 PolarHBondContact O-N 3.35Å; L287-L291 HydrophobicContact CD1-CD1 3.95Å; L287-L291 HydrophobicContact CD1-CD2 4.44Å; L287-L291 HydrophobicContact CD1-CG 3.98Å; L287-L291 HydrophobicContact CG-CD1 3.99Å; L287-L291 HydrophobicContact CG-CG 4.4Å; L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 VanDerWaalsContact O-CG 3.27Å; L287-L291 WeakPolarHBondContact O-CG 3.33Å; L287-L291 PolarHBondContact O-N 2.62Å; L287-L306 HydrophobicContact CD2-CD2 4.1Å; L287-L306 HydrophobicContact CG-CD2 4.04Å; L287-S309 WeakPolarHBondContact CD2-OG 3.07Å; L287-F392 HydrophobicContact CD1-CE1 3.82Å; L287-F392 HydrophobicContact CD1-CZ 4.3Å; L287-F392 HydrophobicContact CD2-CE1 4.04Å; L287-F392 HydrophobicContact CD2-CZ 4.45Å
288Y81.4Confident85.2Confident141 Ų14144.7 Ų44.755%0.55322%0.224SC*.Hα-helixtrans-53-51176.9178.4-87.4000112.1Q286 Q290 L291 F292 V302 L306Q286-Y288 VanDerWaalsContact C-N 3.31Å; Q286-Y288 PolarHBondContact O-N 2.98Å; Y288-Q290 PolarHBondContact O-N 3.27Å; Y288-L291 PolarHBondContact O-N 2.9Å; Y288-F292 PolarHBondContact O-N 3.41Å; Y288-V302 HydrophobicContact CE2-CG1 4.48Å; Y288-L306 HydrophobicContact CD2-CD1 3.46Å; Y288-L306 VanDerWaalsContact CD2-CD1 3.46Å; Y288-L306 HydrophobicContact CE2-CD1 4.05Å; Y288-L306 HydrophobicContact CG-CD1 4.47Å
289R80.1Confident85Confident104 Ų10450.5 Ų50.539%0.39225%0.251SS..Hα-helixtrans-65.9-39.8-178.6-176.2-176.1-64.5-163.43.4112.1Q286 L287 F292 H293 L441Q286-R289 PolarHBondContact O-N 3Å; L287-R289 VanDerWaalsContact C-N 3.35Å; L287-R289 PolarHBondContact O-N 3.05Å; R289-F292 PolarHBondContact O-N 3.48Å; R289-H293 WeakPolarHBondContact O-CB 3.48Å; R289-H293 PolarHBondContact O-N 3.04Å; R289-L441 PolarHBondContact NH1-O 3.21Å; R289-L441 PolarHBondContact NH2-O 3.28Å
290Q83.3Confident84.9Confident5 Ų558.2 Ų58.22%0.02329%0.285CS..Hα-helixtrans-65.8-41.8179.2-70.4-177.2-5.200110.7Q286 L287 Y288 H293 L294 M380 N449Q286-Q290 HydrophobicContact CB-CG 4.09Å; Q286-Q290 WeakPolarHBondContact O-CG 3.35Å; Q286-Q290 PolarHBondContact O-N 2.95Å; L287-Q290 PolarHBondContact O-N 3.35Å; Y288-Q290 PolarHBondContact O-N 3.27Å; Q290-H293 PolarHBondContact O-N 3Å; Q290-L294 VanDerWaalsContact O-CG 3.28Å; Q290-L294 WeakPolarHBondContact O-CG 3.37Å; Q290-L294 PolarHBondContact O-N 2.86Å; Q290-M380 HydrophobicContact CB-CE 3.93Å; Q290-N449 PolarHBondContact NE2-OD1 3.25Å
291L88Confident85.1Confident0 Ų059.4 Ų59.40%029%0.291CS..Hα-helixtrans-63-44.9174.5-67.7176.2000111.6L287 Y288 H293 L294 F295 V302 L305 L306 I388L287-L291 HydrophobicContact CD1-CD1 3.95Å; L287-L291 HydrophobicContact CD1-CD2 4.44Å; L287-L291 HydrophobicContact CD1-CG 3.98Å; L287-L291 HydrophobicContact CG-CD1 3.99Å; L287-L291 HydrophobicContact CG-CG 4.4Å; L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 VanDerWaalsContact O-CG 3.27Å; L287-L291 WeakPolarHBondContact O-CG 3.33Å; L287-L291 PolarHBondContact O-N 2.62Å; Y288-L291 PolarHBondContact O-N 2.9Å; L291-H293 VanDerWaalsContact C-N 3.3Å; L291-H293 PolarHBondContact O-N 3.11Å; L291-L294 PolarHBondContact O-N 3.18Å; L291-F295 PolarHBondContact O-N 2.88Å; L291-V302 HydrophobicContact CB-CG1 3.93Å; L291-V302 HydrophobicContact CB-CG2 4.22Å; L291-L305 HydrophobicContact CD1-CB 3.75Å; L291-L305 HydrophobicContact CD2-CB 4.18Å; L291-L305 HydrophobicContact CD2-CD1 3.77Å; L291-L306 HydrophobicContact CD1-CD2 3.91Å; L291-L306 HydrophobicContact CD1-CG 3.87Å; L291-I388 HydrophobicContact CD2-CD1 4.17Å; L291-I388 HydrophobicContact CD2-CG1 4.16Å; L291-I388 HydrophobicContact CD2-CG2 3.9Å
292F86.1Confident85.2Confident87 Ų8759.2 Ų59.238%0.38229%0.29SS..Hα-helixtrans-63.5-34.7175.9-167.9-93.5000112.6Y288 R289 F295 P296Y288-F292 PolarHBondContact O-N 3.41Å; R289-F292 PolarHBondContact O-N 3.48Å; F292-F295 CarbonylContact O-C 3.28Å; F292-P296 WeakPolarHBondContact O-CA 3.28Å; F292-P296 WeakPolarHBondContact O-CB 3.39Å; F292-P296 VanDerWaalsContact O-N 3.12Å
293H86.1Confident85.1Confident107 Ų10765.1 Ų65.150%0.49532%0.317SS..Hα-helixtrans-70.2-36.7176-17559.7000112.9R289 Q290 L291R289-H293 WeakPolarHBondContact O-CB 3.48Å; R289-H293 PolarHBondContact O-N 3.04Å; Q290-H293 PolarHBondContact O-N 3Å; L291-H293 VanDerWaalsContact C-N 3.3Å; L291-H293 PolarHBondContact O-N 3.11Å
294L88.4Confident85.2Confident30 Ų3069 Ų6916%0.15734%0.335CS..Hα-helixtrans-79.3-30.6178.8-66.3170.1000112.4Q290 L291 A383 I388Q290-L294 VanDerWaalsContact O-CG 3.28Å; Q290-L294 WeakPolarHBondContact O-CG 3.37Å; Q290-L294 PolarHBondContact O-N 2.86Å; L291-L294 PolarHBondContact O-N 3.18Å; L294-A383 HydrophobicContact CB-CB 4.3Å; L294-A383 HydrophobicContact CD2-CB 3.83Å; L294-I388 HydrophobicContact CD1-CD1 3.82Å
295F90.6Very high85.6Confident28 Ų2866.1 Ų66.112%0.12332%0.32CS..  trans-131.261.6-177.7-53.7-74.6000111.9L291 F292 T297 D298 L301 V302 L305 I388L291-F295 PolarHBondContact O-N 2.88Å; F292-F295 CarbonylContact O-C 3.28Å; F295-T297 PolarHBondContact O-N 3.01Å; F295-T297 VanDerWaalsContact O-N 3.09Å; F295-D298 PolarHBondContact O-N 2.9Å; F295-L301 HydrophobicContact CB-CD2 4.43Å; F295-L301 HydrophobicContact CD1-CD2 3.7Å; F295-L301 HydrophobicContact CD2-CD2 4.31Å; F295-L301 HydrophobicContact CE1-CD2 3.97Å; F295-L301 HydrophobicContact CG-CD2 3.89Å; F295-L301 HydrophobicContact CZ-CD2 4.38Å; F295-V302 HydrophobicContact CB-CG2 4.17Å; F295-L305 HydrophobicContact CD2-CD1 4.23Å; F295-L305 HydrophobicContact CE2-CD1 3.97Å; F295-I388 HydrophobicContact CE2-CG1 4.15Å
296P86Confident85.9Confident76 Ų7666.2 Ų66.249%0.49432%0.317SS..THydrogen-bonded Turntrans-65-18.4-171.925.9-35.3000114.4F292F292-P296 WeakPolarHBondContact O-CA 3.28Å; F292-P296 WeakPolarHBondContact O-CB 3.39Å; F292-P296 VanDerWaalsContact O-N 3.12Å
297T88.5Confident85.9Confident139 Ų13972.1 Ų72.185%0.85335%0.345SS*.THydrogen-bonded Turntrans-103.4-4.8-175.655.80000114.1F295F295-T297 PolarHBondContact O-N 3.01Å; F295-T297 VanDerWaalsContact O-N 3.09Å
298D90.1Very high86Confident69 Ų6972.9 Ų72.937%0.36935%0.349SS..  trans-125.974.5-172.1-164.8-13.7000111.5F295 K300 L301 V302F295-D298 PolarHBondContact O-N 2.9Å; D298-K300 PolarHBondContact O-N 3.3Å; D298-L301 HydrophobicContact CB-CB 3.92Å; D298-L301 PolarHBondContact O-N 2.95Å; D298-L301 WeakPolarHBondContact OD1-CB 3.5Å; D298-L301 PolarHBondContact OD1-N 3.48Å; D298-L301 WeakPolarHBondContact OD2-CB 3.4Å; D298-V302 WeakPolarHBondContact O-CG2 3.36Å; D298-V302 PolarHBondContact O-N 2.84Å; D298-V302 VanDerWaalsContact O-N 3.08Å
299E87.3Confident86Confident135 Ų13566.9 Ų66.963%0.63133%0.328SS*.Hα-helixtrans-57.9-36.7179.4-66.5-177.6166.900112.2L301 V302 E303E299-L301 PolarHBondContact O-N 3.01Å; E299-V302 PolarHBondContact O-N 3.34Å; E299-E303 WeakPolarHBondContact O-CG 3.21Å; E299-E303 PolarHBondContact O-N 3.25Å
300K89.6Confident85.8Confident172 Ų17263.5 Ų63.575%0.74832%0.32SS*.Hα-helixtrans-64.1-41.6178.1-69.1-175.1179.8179.50111.6D298 H304D298-K300 PolarHBondContact O-N 3.3Å; K300-H304 VanDerWaalsContact O-CB 3.31Å; K300-H304 WeakPolarHBondContact O-CB 3.17Å; K300-H304 PolarHBondContact O-N 3.5Å
301L90.5Very high85.6Confident31 Ų3166.2 Ų66.216%0.16234%0.337CS..Hα-helixtrans-65.2-40.7174.7-18063.5000111.5F295 D298 E299 H304 L305 T385F295-L301 HydrophobicContact CB-CD2 4.43Å; F295-L301 HydrophobicContact CD1-CD2 3.7Å; F295-L301 HydrophobicContact CD2-CD2 4.31Å; F295-L301 HydrophobicContact CE1-CD2 3.97Å; F295-L301 HydrophobicContact CG-CD2 3.89Å; F295-L301 HydrophobicContact CZ-CD2 4.38Å; D298-L301 HydrophobicContact CB-CB 3.92Å; D298-L301 PolarHBondContact O-N 2.95Å; D298-L301 WeakPolarHBondContact OD1-CB 3.5Å; D298-L301 PolarHBondContact OD1-N 3.48Å; D298-L301 WeakPolarHBondContact OD2-CB 3.4Å; E299-L301 PolarHBondContact O-N 3.01Å; L301-H304 PolarHBondContact O-N 3.2Å; L301-L305 HydrophobicContact CD1-CD1 4.11Å; L301-L305 HydrophobicContact CD1-CG 4.13Å; L301-L305 HydrophobicContact CG-CD1 3.91Å; L301-L305 HydrophobicContact CG-CG 4.35Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 VanDerWaalsContact O-CG 3.24Å; L301-L305 WeakPolarHBondContact O-CG 3.39Å; L301-L305 PolarHBondContact O-N 2.84Å; L301-T385 HydrophobicContact CD1-CG2 4.17Å
302V86.3Confident85.5Confident3 Ų369 Ų692%0.01835%0.349CS..Hα-helixtrans-61.6-48.4177173.50000111Y288 L291 F295 D298 E299 H304 L305 L306Y288-V302 HydrophobicContact CE2-CG1 4.48Å; L291-V302 HydrophobicContact CB-CG1 3.93Å; L291-V302 HydrophobicContact CB-CG2 4.22Å; F295-V302 HydrophobicContact CB-CG2 4.17Å; D298-V302 WeakPolarHBondContact O-CG2 3.36Å; D298-V302 PolarHBondContact O-N 2.84Å; D298-V302 VanDerWaalsContact O-N 3.08Å; E299-V302 PolarHBondContact O-N 3.34Å; V302-H304 PolarHBondContact O-N 2.97Å; V302-L305 PolarHBondContact O-N 3.29Å; V302-L306 HydrophobicContact CG1-CD1 4.02Å; V302-L306 WeakPolarHBondContact O-CD1 3.13Å; V302-L306 VanDerWaalsContact O-CG 3.29Å; V302-L306 WeakPolarHBondContact O-CG 3.49Å; V302-L306 PolarHBondContact O-N 2.87Å
303E83.1Confident85Confident123 Ų12365.7 Ų65.758%0.57534%0.338SS*.Hα-helixtrans-58.2-47.9175.4-73.1-178.9168.200111.5E299 L305 L306 E307E299-E303 WeakPolarHBondContact O-CG 3.21Å; E299-E303 PolarHBondContact O-N 3.25Å; E303-L305 PolarHBondContact O-N 3.17Å; E303-L306 WeakPolarHBondContact O-CB 3.45Å; E303-L306 PolarHBondContact O-N 3.37Å; E303-E307 PolarHBondContact O-N 3.38Å
304H87.2Confident84.7Confident84 Ų8462.1 Ų62.139%0.38932%0.321SS..Hα-helixtrans-58.7-45.3176.917864.2000112.3K300 L301 V302 L306 E307 V308 Y389K300-H304 VanDerWaalsContact O-CB 3.31Å; K300-H304 WeakPolarHBondContact O-CB 3.17Å; K300-H304 PolarHBondContact O-N 3.5Å; L301-H304 PolarHBondContact O-N 3.2Å; V302-H304 PolarHBondContact O-N 2.97Å; H304-L306 VanDerWaalsContact C-N 3.29Å; H304-L306 PolarHBondContact O-N 2.84Å; H304-E307 PolarHBondContact O-N 3.48Å; H304-V308 VanDerWaalsContact CE1-CG2 3.46Å; H304-V308 WeakPolarHBondContact CE1-CG2 3.29Å; H304-V308 WeakPolarHBondContact O-CB 3.3Å; H304-V308 WeakPolarHBondContact O-CG2 3.3Å; H304-V308 PolarHBondContact O-N 3.26Å; H304-Y389 PolarHBondContact NE2-OH 3.19Å
305L87.8Confident84.5Confident0 Ų063.1 Ų63.10%033%0.33CS..Hα-helixtrans-65.2-31.9179.4-73.1172.9000112.4L291 F295 L301 V302 E303 S309 T385 I388 Y389 F392L291-L305 HydrophobicContact CD1-CB 3.75Å; L291-L305 HydrophobicContact CD2-CB 4.18Å; L291-L305 HydrophobicContact CD2-CD1 3.77Å; F295-L305 HydrophobicContact CD2-CD1 4.23Å; F295-L305 HydrophobicContact CE2-CD1 3.97Å; L301-L305 HydrophobicContact CD1-CD1 4.11Å; L301-L305 HydrophobicContact CD1-CG 4.13Å; L301-L305 HydrophobicContact CG-CD1 3.91Å; L301-L305 HydrophobicContact CG-CG 4.35Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 VanDerWaalsContact O-CG 3.24Å; L301-L305 WeakPolarHBondContact O-CG 3.39Å; L301-L305 PolarHBondContact O-N 2.84Å; V302-L305 PolarHBondContact O-N 3.29Å; E303-L305 PolarHBondContact O-N 3.17Å; L305-S309 WeakPolarHBondContact O-CB 3.37Å; L305-S309 PolarHBondContact O-N 3.29Å; L305-T385 HydrophobicContact CD2-CG2 4.02Å; L305-I388 HydrophobicContact CD1-CG2 4.28Å; L305-I388 HydrophobicContact CD2-CG2 3.96Å; L305-Y389 HydrophobicContact CD2-CD1 4.31Å; L305-Y389 HydrophobicContact CD2-CE1 3.66Å; L305-F392 HydrophobicContact CD2-CE2 4.31Å; L305-F392 WeakPolarHBondContact O-CE2 3.09Å; L305-F392 WeakPolarHBondContact O-CZ 3.02Å
306L81.6Confident84.1Confident44 Ų4462 Ų6223%0.2333%0.326CS..Hα-helixtrans-70.3-44.7174.4-70.2162000112.2L287 Y288 L291 V302 E303 H304 V308 S309 S310L287-L306 HydrophobicContact CD2-CD2 4.1Å; L287-L306 HydrophobicContact CG-CD2 4.04Å; Y288-L306 HydrophobicContact CD2-CD1 3.46Å; Y288-L306 VanDerWaalsContact CD2-CD1 3.46Å; Y288-L306 HydrophobicContact CE2-CD1 4.05Å; Y288-L306 HydrophobicContact CG-CD1 4.47Å; L291-L306 HydrophobicContact CD1-CD2 3.91Å; L291-L306 HydrophobicContact CD1-CG 3.87Å; V302-L306 HydrophobicContact CG1-CD1 4.02Å; V302-L306 WeakPolarHBondContact O-CD1 3.13Å; V302-L306 VanDerWaalsContact O-CG 3.29Å; V302-L306 WeakPolarHBondContact O-CG 3.49Å; V302-L306 PolarHBondContact O-N 2.87Å; E303-L306 WeakPolarHBondContact O-CB 3.45Å; E303-L306 PolarHBondContact O-N 3.37Å; H304-L306 VanDerWaalsContact C-N 3.29Å; H304-L306 PolarHBondContact O-N 2.84Å; L306-V308 VanDerWaalsContact C-N 3.32Å; L306-V308 PolarHBondContact O-N 2.97Å; L306-S309 PolarHBondContact O-N 2.89Å; L306-S309 PolarHBondContact O-OG 3.26Å; L306-S310 PolarHBondContact O-N 2.99Å; L306-S310 PolarHBondContact O-OG 3.39Å
307E78.7Confident84.1Confident128 Ų12861 Ų6160%0.59831%0.314SS*.Hα-helixtrans-58.7-47.7173.5-70.8-174.416900110.7E303 H304 S309 S310 V311E303-E307 PolarHBondContact O-N 3.38Å; H304-E307 PolarHBondContact O-N 3.48Å; E307-S309 VanDerWaalsContact C-N 3.33Å; E307-S309 PolarHBondContact O-N 3.41Å; E307-S310 WeakPolarHBondContact O-CB 3.27Å; E307-S310 PolarHBondContact O-N 3.37Å; E307-S310 VanDerWaalsContact O-N 3.14Å; E307-V311 PolarHBondContact O-N 3.24Å
308V85Confident84.1Confident24 Ų2461.8 Ų61.815%0.14531%0.306CS..Hα-helixtrans-62.1-40.6178.8173.70000111.1H304 L306 S310 V311 F312 Y389 F392H304-V308 VanDerWaalsContact CE1-CG2 3.46Å; H304-V308 WeakPolarHBondContact CE1-CG2 3.29Å; H304-V308 WeakPolarHBondContact O-CB 3.3Å; H304-V308 WeakPolarHBondContact O-CG2 3.3Å; H304-V308 PolarHBondContact O-N 3.26Å; L306-V308 VanDerWaalsContact C-N 3.32Å; L306-V308 PolarHBondContact O-N 2.97Å; V308-S310 PolarHBondContact O-N 2.92Å; V308-V311 WeakPolarHBondContact O-CA 3.48Å; V308-V311 WeakPolarHBondContact O-CB 3.11Å; V308-V311 PolarHBondContact O-N 2.85Å; V308-F312 HydrophobicContact CG1-CD2 3.34Å; V308-F312 HydrophobicContact CG1-CE2 3.28Å; V308-F312 WeakPolarHBondContact O-CD2 3.16Å; V308-F312 PolarHBondContact O-N 2.98Å; V308-Y389 HydrophobicContact CB-CE1 4.44Å; V308-Y389 HydrophobicContact CG1-CD1 4.12Å; V308-Y389 HydrophobicContact CG1-CE1 3.75Å; V308-F392 HydrophobicContact CG1-CD2 4.32Å; V308-F392 HydrophobicContact CG1-CE2 4.42Å
309S81.4Confident84.1Confident16 Ų1659.2 Ų59.211%0.11229%0.294CS..Hα-helixtrans-57.4-35.2176.679.50000113.4L287 L305 L306 E307 S313L287-S309 WeakPolarHBondContact CD2-OG 3.07Å; L305-S309 WeakPolarHBondContact O-CB 3.37Å; L305-S309 PolarHBondContact O-N 3.29Å; L306-S309 PolarHBondContact O-N 2.89Å; L306-S309 PolarHBondContact O-OG 3.26Å; E307-S309 VanDerWaalsContact C-N 3.33Å; E307-S309 PolarHBondContact O-N 3.41Å; S309-S313 PolarHBondContact O-N 3.48Å; S309-S313 VanDerWaalsContact O-N 3.08Å; S309-S313 PolarHBondContact O-OG 2.98Å
310S75.9Confident84.3Confident32 Ų3252.8 Ų52.822%0.22426%0.264CS..Hα-helixtrans-69.4-41.3176.1-59.10000110.7L306 E307 V308 S313 M314L306-S310 PolarHBondContact O-N 2.99Å; L306-S310 PolarHBondContact O-OG 3.39Å; E307-S310 WeakPolarHBondContact O-CB 3.27Å; E307-S310 PolarHBondContact O-N 3.37Å; E307-S310 VanDerWaalsContact O-N 3.14Å; V308-S310 PolarHBondContact O-N 2.92Å; S310-S313 WeakPolarHBondContact O-CB 3.5Å; S310-S313 PolarHBondContact O-N 3.5Å; S310-M314 WeakPolarHBondContact O-CG 3.35Å; S310-M314 PolarHBondContact O-N 3.47Å
311V80.4Confident84.5Confident63 Ų6347 Ų4738%0.38224%0.244SC..Hα-helixtrans-63.8-44.9174.9178.40000111.4E307 V308 S313 M314E307-V311 PolarHBondContact O-N 3.24Å; V308-V311 WeakPolarHBondContact O-CA 3.48Å; V308-V311 WeakPolarHBondContact O-CB 3.11Å; V308-V311 PolarHBondContact O-N 2.85Å; V311-S313 VanDerWaalsContact C-N 3.26Å; V311-S313 PolarHBondContact O-N 3.23Å; V311-M314 VanDerWaalsContact O-CB 3.26Å; V311-M314 WeakPolarHBondContact O-CB 3.42Å; V311-M314 PolarHBondContact O-N 3.37Å
312F84.1Confident84.6Confident57 Ų5750.8 Ų50.825%0.2526%0.264CS..Hα-helixtrans-60.4-37.2176.3-89.7-93.1000111.8V308 M314 C315 Y389 F392 V393 V396V308-F312 HydrophobicContact CG1-CD2 3.34Å; V308-F312 HydrophobicContact CG1-CE2 3.28Å; V308-F312 WeakPolarHBondContact O-CD2 3.16Å; V308-F312 PolarHBondContact O-N 2.98Å; F312-M314 PolarHBondContact O-N 3.2Å; F312-C315 VanDerWaalsContact O-CB 3.3Å; F312-C315 WeakPolarHBondContact O-CB 3.14Å; F312-C315 PolarHBondContact O-N 2.99Å; F312-Y389 HydrophobicContact CE2-CD1 4.28Å; F312-F392 HydrophobicContact CB-CB 3.9Å; F312-F392 HydrophobicContact CD1-CB 3.87Å; F312-F392 HydrophobicContact CD2-CB 4.13Å; F312-F392 HydrophobicContact CD2-CD2 4.14Å; F312-F392 HydrophobicContact CE1-CB 4.45Å; F312-F392 HydrophobicContact CG-CB 3.69Å; F312-F392 HydrophobicContact CG-CG 4.5Å; F312-V393 HydrophobicContact CD1-CG2 4.12Å; F312-V393 HydrophobicContact CE1-CG2 3.53Å; F312-V396 HydrophobicContact CB-CG2 4.33Å; F312-V396 WeakPolarHBondContact O-CG2 3.34Å
313S76Confident84.9Confident19 Ų1950.8 Ų50.813%0.13326%0.264CS..Hα-helixtrans-60.3-30.2175.2-61.70000112.7S309 S310 V311 C315 G316S309-S313 PolarHBondContact O-N 3.48Å; S309-S313 VanDerWaalsContact O-N 3.08Å; S309-S313 PolarHBondContact O-OG 2.98Å; S310-S313 WeakPolarHBondContact O-CB 3.5Å; S310-S313 PolarHBondContact O-N 3.5Å; V311-S313 VanDerWaalsContact C-N 3.26Å; V311-S313 PolarHBondContact O-N 3.23Å; S313-C315 VanDerWaalsContact C-N 3.26Å; S313-C315 PolarHBondContact O-N 2.79Å; S313-G316 PolarHBondContact O-N 3.04Å
314M79.6Confident85.4Confident31 Ų3144.9 Ų44.915%0.15324%0.236CC..Hα-helixtrans-70.6-21.6174.5-53.8171.2-164.500112.8S167 V170 Y173 S310 V311 F312 G316S167-M314 WeakPolarHBondContact CB-O 3.4Å; S167-M314 PolarHBondContact OG-O 3.29Å; S167-M314 VanDerWaalsContact OG-O 3.06Å; V170-M314 HydrophobicContact CB-CE 4.41Å; V170-M314 HydrophobicContact CB-CG 3.95Å; V170-M314 HydrophobicContact CB-SD 3.76Å; V170-M314 HydrophobicContact CG2-CE 4.46Å; V170-M314 HydrophobicContact CG2-CG 4.44Å; V170-M314 HydrophobicContact CG2-SD 3.64Å; Y173-M314 HydrophobicContact CD1-CE 3.99Å; Y173-M314 HydrophobicContact CD2-CE 4.18Å; Y173-M314 HydrophobicContact CG-CE 3.59Å; S310-M314 WeakPolarHBondContact O-CG 3.35Å; S310-M314 PolarHBondContact O-N 3.47Å; V311-M314 VanDerWaalsContact O-CB 3.26Å; V311-M314 WeakPolarHBondContact O-CB 3.42Å; V311-M314 PolarHBondContact O-N 3.37Å; F312-M314 PolarHBondContact O-N 3.2Å; M314-G316 PolarHBondContact O-N 3.45Å
315C84.1Confident85.8Confident52 Ų5243.8 Ų43.835%0.35124%0.235SC..THydrogen-bonded Turntrans-74.6-2.2176.8-58.30000113.1F312 S313 F317 F318 A319F312-C315 VanDerWaalsContact O-CB 3.3Å; F312-C315 WeakPolarHBondContact O-CB 3.14Å; F312-C315 PolarHBondContact O-N 2.99Å; S313-C315 VanDerWaalsContact C-N 3.26Å; S313-C315 PolarHBondContact O-N 2.79Å; C315-F317 PolarHBondContact O-N 3.18Å; C315-F318 PolarHBondContact O-N 3.45Å; C315-A319 PolarHBondContact O-N 3.01Å
316G82.4Confident86.1Confident3 Ų345.9 Ų45.93%0.03125%0.246CC..Hα-helixtrans-54.2-33.9176.200000113.8S313 M314 F318 A319 A320S313-G316 PolarHBondContact O-N 3.04Å; M314-G316 PolarHBondContact O-N 3.45Å; G316-F318 VanDerWaalsContact C-N 3.3Å; G316-F318 PolarHBondContact O-N 3.31Å; G316-A319 PolarHBondContact O-N 3.09Å; G316-A320 WeakPolarHBondContact O-CB 3.42Å; G316-A320 PolarHBondContact O-N 2.95Å
317F86.9Confident86.7Confident56 Ų5643.8 Ų43.825%0.24624%0.235CC..Hα-helixtrans-62.8-34.6175.1-174-103.5000112.7I27 L160 A164 S167 C315 P321I27-F317 HydrophobicContact CG2-CE2 3.75Å; I27-F317 HydrophobicContact CG2-CZ 4.17Å; L160-F317 HydrophobicContact CD2-CE2 4.18Å; L160-F317 HydrophobicContact CD2-CZ 4.31Å; A164-F317 HydrophobicContact CB-CD2 4.16Å; A164-F317 HydrophobicContact CB-CE2 4.31Å; S167-F317 VanDerWaalsContact OG-CB 3.22Å; S167-F317 WeakPolarHBondContact OG-CB 3.49Å; S167-F317 PolarHBondContact OG-N 2.83Å; C315-F317 PolarHBondContact O-N 3.18Å; F317-P321 WeakPolarHBondContact O-CD 3.47Å
318F88.7Confident87.5Confident155 Ų15538.5 Ų38.568%0.6821%0.211SC*.Hα-helixtrans-79.6-28.9177.9-61.6-70.4000112.6C315 G316C315-F318 PolarHBondContact O-N 3.45Å; G316-F318 VanDerWaalsContact C-N 3.3Å; G316-F318 PolarHBondContact O-N 3.31Å
319A89.7Confident87.9Confident15 Ų1541.6 Ų41.612%0.12423%0.226CC..Hα-helixtrans-75.5-25.3173.500000112.8C315 G316 I322 S323 V396C315-A319 PolarHBondContact O-N 3.01Å; G316-A319 PolarHBondContact O-N 3.09Å; A319-I322 WeakPolarHBondContact O-CB 3.43Å; A319-I322 PolarHBondContact O-N 2.85Å; A319-S323 PolarHBondContact O-N 3.43Å; A319-V396 HydrophobicContact CB-CG1 3.79Å
320A91.3Very high88.5Confident0 Ų041.3 Ų41.30%022%0.224CC..Hα-helixtrans-56.4-51.4-178.200000114.8S159 G316 I322 S323 G324 S400S159-A320 WeakPolarHBondContact CB-O 3.42Å; S159-A320 WeakPolarHBondContact O-CB 3.48Å; S159-A320 PolarHBondContact OG-O 3.32Å; G316-A320 WeakPolarHBondContact O-CB 3.42Å; G316-A320 PolarHBondContact O-N 2.95Å; A320-I322 PolarHBondContact O-N 2.84Å; A320-I322 VanDerWaalsContact O-N 3.13Å; A320-S323 PolarHBondContact O-N 3.08Å; A320-S323 VanDerWaalsContact O-N 3.11Å; A320-S323 PolarHBondContact O-OG 3.03Å; A320-G324 PolarHBondContact O-N 3.21Å; A320-S400 WeakPolarHBondContact CA-OG 3.44Å
321P93.1Very high89.4Confident50 Ų5040.6 Ų40.633%0.32522%0.218SC..Hα-helixtrans-53.4-37.7176.6-26.431000113.4L160 F317 G324 V325L160-P321 HydrophobicContact CD2-CG 3.86Å; F317-P321 WeakPolarHBondContact O-CD 3.47Å; P321-G324 PolarHBondContact O-N 3.22Å; P321-V325 WeakPolarHBondContact O-CB 3.44Å; P321-V325 WeakPolarHBondContact O-CG2 3.32Å; P321-V325 PolarHBondContact O-N 3.08Å
322I93.4Very high89.9Confident111 Ų11144.9 Ų44.957%0.56923%0.227SC*.Hα-helixtrans-65.5-47.9-179.9-56.6173.1000110A319 A320 G324 V325 I326A319-I322 WeakPolarHBondContact O-CB 3.43Å; A319-I322 PolarHBondContact O-N 2.85Å; A320-I322 PolarHBondContact O-N 2.84Å; A320-I322 VanDerWaalsContact O-N 3.13Å; I322-G324 VanDerWaalsContact C-N 3.33Å; I322-G324 PolarHBondContact O-N 3.12Å; I322-V325 PolarHBondContact O-N 2.91Å; I322-I326 HydrophobicContact CG2-CD1 4.07Å; I322-I326 WeakPolarHBondContact O-CD1 3.08Å; I322-I326 VanDerWaalsContact O-CG1 3.26Å; I322-I326 WeakPolarHBondContact O-CG1 3.44Å; I322-I326 PolarHBondContact O-N 2.99Å
323S92.6Very high90.3Very high3 Ų350.6 Ų50.62%0.02125%0.247CC..Hα-helixtrans-63.3-40.5177.562.20000111.8A319 A320 I326 I327 S400A319-S323 PolarHBondContact O-N 3.43Å; A320-S323 PolarHBondContact O-N 3.08Å; A320-S323 VanDerWaalsContact O-N 3.11Å; A320-S323 PolarHBondContact O-OG 3.03Å; S323-I326 PolarHBondContact O-N 2.87Å; S323-I327 WeakPolarHBondContact O-CG1 3.34Å; S323-I327 PolarHBondContact O-N 3.3Å; S323-I327 VanDerWaalsContact O-N 3.12Å; S323-S400 PolarHBondContact OG-OG 3.2Å
324G93.4Very high91.1Very high0 Ų050.1 Ų50.10%024%0.244CC..Hα-helixtrans-61.7-46.117500000114.1S159 A320 P321 I322 I326 I327 D328S159-G324 VanDerWaalsContact OG-CA 3.28Å; S159-G324 WeakPolarHBondContact OG-CA 3.41Å; S159-G324 PolarHBondContact OG-N 2.97Å; A320-G324 PolarHBondContact O-N 3.21Å; P321-G324 PolarHBondContact O-N 3.22Å; I322-G324 VanDerWaalsContact C-N 3.33Å; I322-G324 PolarHBondContact O-N 3.12Å; G324-I326 PolarHBondContact O-N 3.41Å; G324-I327 PolarHBondContact O-N 3.39Å; G324-D328 PolarHBondContact O-N 3.41Å
325V95.3Very high91.6Very high61 Ų6151.3 Ų51.337%0.3725%0.247SC..Hα-helixtrans-62.9-42177.4168.60000111I156 P321 I322 I327 D328 L329I156-V325 HydrophobicContact CD1-CG2 3.76Å; I156-V325 HydrophobicContact CG1-CG2 4.02Å; P321-V325 WeakPolarHBondContact O-CB 3.44Å; P321-V325 WeakPolarHBondContact O-CG2 3.32Å; P321-V325 PolarHBondContact O-N 3.08Å; I322-V325 PolarHBondContact O-N 2.91Å; V325-I327 VanDerWaalsContact C-N 3.3Å; V325-I327 PolarHBondContact O-N 3.3Å; V325-D328 PolarHBondContact O-N 3.48Å; V325-L329 HydrophobicContact CG1-CD1 3.56Å; V325-L329 HydrophobicContact CG1-CG 4.02Å; V325-L329 VanDerWaalsContact O-CB 3.3Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 VanDerWaalsContact O-CG 3.23Å; V325-L329 WeakPolarHBondContact O-CG 3.41Å; V325-L329 PolarHBondContact O-N 3.2Å
326I94.5Very high91.9Very high44 Ų4451.9 Ų51.923%0.22625%0.246CC..Hα-helixtrans-57.4-45.8175.3-69.6165000110.3I322 S323 G324 S330 A365 I368I322-I326 HydrophobicContact CG2-CD1 4.07Å; I322-I326 WeakPolarHBondContact O-CD1 3.08Å; I322-I326 VanDerWaalsContact O-CG1 3.26Å; I322-I326 WeakPolarHBondContact O-CG1 3.44Å; I322-I326 PolarHBondContact O-N 2.99Å; S323-I326 PolarHBondContact O-N 2.87Å; G324-I326 PolarHBondContact O-N 3.41Å; I326-S330 VanDerWaalsContact O-CB 3.25Å; I326-S330 WeakPolarHBondContact O-CB 3.21Å; I326-S330 PolarHBondContact O-N 3.05Å; I326-S330 PolarHBondContact O-OG 2.91Å; I326-A365 HydrophobicContact CG2-CB 4.24Å; I326-I368 HydrophobicContact CD1-CD1 4.3Å; I326-I368 HydrophobicContact CG2-CD1 3.82Å
327I94.5Very high92.3Very high0 Ų056.8 Ų56.80%027%0.267CS..Hα-helixtrans-65.3-50.1179-69.4165000111.1S323 G324 V325 S330 L331 L362 A365 A405S323-I327 WeakPolarHBondContact O-CG1 3.34Å; S323-I327 PolarHBondContact O-N 3.3Å; S323-I327 VanDerWaalsContact O-N 3.12Å; G324-I327 PolarHBondContact O-N 3.39Å; V325-I327 VanDerWaalsContact C-N 3.3Å; V325-I327 PolarHBondContact O-N 3.3Å; I327-S330 PolarHBondContact O-N 2.89Å; I327-S330 PolarHBondContact O-OG 3.39Å; I327-L331 HydrophobicContact CG2-CD1 3.8Å; I327-L331 HydrophobicContact CG2-CG 4.42Å; I327-L331 WeakPolarHBondContact O-CB 3.39Å; I327-L331 WeakPolarHBondContact O-CG 3.33Å; I327-L331 PolarHBondContact O-N 3.21Å; I327-L362 HydrophobicContact CG2-CD2 3.77Å; I327-A365 HydrophobicContact CG1-CB 3.84Å; I327-A405 HydrophobicContact CD1-CB 4.14Å
328D94.4Very high92.4Very high17 Ų1754.1 Ų54.19%0.09126%0.255CS..Hα-helixtrans-67.6-40.5-175.5-77.9-27000112.3F153 R154 G155 I156 G324 V325 S330 R332F153-D328 VanDerWaalsContact CA-OD2 3.25Å; F153-D328 WeakPolarHBondContact CA-OD2 3.24Å; R154-D328 PolarHBondContact N-OD1 3.38Å; G155-D328 VanDerWaalsContact CA-OD1 3.27Å; G155-D328 WeakPolarHBondContact CA-OD1 3.42Å; G155-D328 PolarHBondContact N-OD1 3.29Å; G155-D328 PolarHBondContact N-OD2 2.66Å; I156-D328 VanDerWaalsContact CG1-OD2 3.27Å; I156-D328 WeakPolarHBondContact CG1-OD2 3.38Å; I156-D328 PolarHBondContact N-OD2 3.38Å; G324-D328 PolarHBondContact O-N 3.41Å; V325-D328 PolarHBondContact O-N 3.48Å; D328-S330 VanDerWaalsContact C-N 3.34Å; D328-S330 PolarHBondContact O-N 3.33Å; D328-R332 WeakPolarHBondContact O-CB 3.43Å; D328-R332 PolarHBondContact O-N 2.95Å
329L94.9Very high92.4Very high88 Ų8847.7 Ų47.746%0.46123%0.23SC..Hα-helixtrans-64.7-39.5176.4-70.2177.3000112.1V325 R333V325-L329 HydrophobicContact CG1-CD1 3.56Å; V325-L329 HydrophobicContact CG1-CG 4.02Å; V325-L329 VanDerWaalsContact O-CB 3.3Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 VanDerWaalsContact O-CG 3.23Å; V325-L329 WeakPolarHBondContact O-CG 3.41Å; V325-L329 PolarHBondContact O-N 3.2Å; L329-R333 VanDerWaalsContact O-CG 3.31Å; L329-R333 WeakPolarHBondContact O-CG 3.39Å; L329-R333 PolarHBondContact O-N 3.24Å; L329-R333 VanDerWaalsContact O-N 3.1Å
330S94.1Very high92.3Very high11 Ų1151.8 Ų51.88%0.07725%0.25CS..Hα-helixtrans-75-36.6-178.459.50000112.6I326 I327 D328 S334 G361I326-S330 VanDerWaalsContact O-CB 3.25Å; I326-S330 WeakPolarHBondContact O-CB 3.21Å; I326-S330 PolarHBondContact O-N 3.05Å; I326-S330 PolarHBondContact O-OG 2.91Å; I327-S330 PolarHBondContact O-N 2.89Å; I327-S330 PolarHBondContact O-OG 3.39Å; D328-S330 VanDerWaalsContact C-N 3.34Å; D328-S330 PolarHBondContact O-N 3.33Å; S330-S334 PolarHBondContact O-N 3.01Å; S330-S334 PolarHBondContact O-OG 3.49Å; S330-G361 CarbonylContact C-O 3.6Å; S330-G361 WeakPolarHBondContact CB-O 3.31Å; S330-G361 PolarHBondContact OG-O 2.9Å
331L93.3Very high92.1Very high16 Ų1653.3 Ų53.38%0.08426%0.258CS..Hα-helixtrans-66.8-43.8169.4-77.5176.9000112.3I327 R333 S334 R335 Y358 L362 T412I327-L331 HydrophobicContact CG2-CD1 3.8Å; I327-L331 HydrophobicContact CG2-CG 4.42Å; I327-L331 WeakPolarHBondContact O-CB 3.39Å; I327-L331 WeakPolarHBondContact O-CG 3.33Å; I327-L331 PolarHBondContact O-N 3.21Å; L331-R333 PolarHBondContact O-N 3.14Å; L331-S334 CarbonylContact O-C 3.57Å; L331-S334 PolarHBondContact O-N 2.97Å; L331-R335 WeakPolarHBondContact O-CB 3.43Å; L331-R335 PolarHBondContact O-N 3.45Å; L331-Y358 HydrophobicContact CD2-CE2 4.18Å; L331-L362 HydrophobicContact CD1-CD2 4.05Å; L331-L362 HydrophobicContact CD2-CD1 4.47Å; L331-L362 HydrophobicContact CD2-CD2 4.15Å; L331-L362 HydrophobicContact CD2-CG 3.88Å; L331-L362 HydrophobicContact CG-CD2 4.04Å; L331-L362 HydrophobicContact CG-CG 4.32Å; L331-T412 HydrophobicContact CD2-CG2 3.86Å
332R92.4Very high91.8Very high154 Ų15451.7 Ų51.758%0.58125%0.246SC*.Hα-helixtrans-57.5-48.6176.8-178.3176.6176.41791.6111.3D328 S334 R335 D336D328-R332 WeakPolarHBondContact O-CB 3.43Å; D328-R332 PolarHBondContact O-N 2.95Å; R332-S334 PolarHBondContact O-N 3.09Å; R332-R335 WeakPolarHBondContact O-CB 3.2Å; R332-R335 PolarHBondContact O-N 3.12Å; R332-D336 PolarHBondContact O-N 2.99Å
333R92.9Very high91.3Very high176 Ų17652.2 Ų52.266%0.66425%0.249SC*.Hα-helixtrans-57.6-35.5175.2-74.8174.4-178.7175.31.8112.8L329 L331 K337L329-R333 VanDerWaalsContact O-CG 3.31Å; L329-R333 WeakPolarHBondContact O-CG 3.39Å; L329-R333 PolarHBondContact O-N 3.24Å; L329-R333 VanDerWaalsContact O-N 3.1Å; L331-R333 PolarHBondContact O-N 3.14Å; R333-K337 WeakPolarHBondContact O-CG 3.12Å; R333-K337 PolarHBondContact O-N 2.76Å
334S91.9Very high90.9Very high10 Ų1056.4 Ų56.47%0.0728%0.278CS..Hα-helixtrans-78.1-36.7-179.3-57.10000111.8S330 L331 R332 K337 V338 G361S330-S334 PolarHBondContact O-N 3.01Å; S330-S334 PolarHBondContact O-OG 3.49Å; L331-S334 CarbonylContact O-C 3.57Å; L331-S334 PolarHBondContact O-N 2.97Å; R332-S334 PolarHBondContact O-N 3.09Å; S334-K337 WeakPolarHBondContact O-CB 3.08Å; S334-K337 PolarHBondContact O-N 3.33Å; S334-V338 WeakPolarHBondContact O-CG2 3.42Å; S334-V338 PolarHBondContact O-N 2.85Å; S334-V338 VanDerWaalsContact O-N 3.07Å; S334-G361 WeakPolarHBondContact OG-CA 3.48Å; S334-G361 PolarHBondContact OG-N 3.28Å
335R90.5Very high89.9Confident55 Ų5560.7 Ų60.721%0.20830%0.301CS..Hα-helixtrans-61.9-44.7170.8-172.1-169.165.7170.51.4111.4H152 V242 L331 R332 K337 V338 A339 Y358H152-R335 PolarHBondContact CE1-NH1 3.25Å; H152-R335 PolarHBondContact ND1-NH1 3.48Å; V242-R335 HydrophobicContact CG1-CG 3.95Å; L331-R335 WeakPolarHBondContact O-CB 3.43Å; L331-R335 PolarHBondContact O-N 3.45Å; R332-R335 WeakPolarHBondContact O-CB 3.2Å; R332-R335 PolarHBondContact O-N 3.12Å; R335-K337 VanDerWaalsContact C-N 3.27Å; R335-K337 PolarHBondContact O-N 3.35Å; R335-V338 PolarHBondContact O-N 2.95Å; R335-A339 PolarHBondContact O-N 2.66Å; R335-Y358 HydrophobicContact CB-CE2 4.31Å
336D90.2Very high88.6Confident64 Ų6465 Ų6534%0.34232%0.315SS..Hα-helixtrans-63.8-34.8178.7-60.8-15.1000111.1R332 A339 N340R332-D336 PolarHBondContact O-N 2.99Å; D336-A339 WeakPolarHBondContact O-CB 3.3Å; D336-A339 PolarHBondContact O-N 2.99Å; D336-N340 VanDerWaalsContact O-CG 3.23Å; D336-N340 PolarHBondContact O-N 3.12Å; D336-N340 PolarHBondContact O-ND2 2.84Å
337K89.9Confident87.2Confident106 Ų10672.2 Ų72.246%0.46135%0.345SS..Hα-helixtrans-62.9-43.7170.1-72.8172.2-177.3177.90112.4R333 S334 R335 N340 M341R333-K337 WeakPolarHBondContact O-CG 3.12Å; R333-K337 PolarHBondContact O-N 2.76Å; S334-K337 WeakPolarHBondContact O-CB 3.08Å; S334-K337 PolarHBondContact O-N 3.33Å; R335-K337 VanDerWaalsContact C-N 3.27Å; R335-K337 PolarHBondContact O-N 3.35Å; K337-N340 PolarHBondContact O-N 3.49Å; K337-M341 WeakPolarHBondContact O-CG 3.37Å; K337-M341 PolarHBondContact O-N 3.29Å
338V90Very high86.1Confident1 Ų178.5 Ų78.51%0.00638%0.379CS..Hα-helixtrans-64.7-40.8176.2176.80000111.4V242 S334 R335 N340 M341 L342 M354 N357V242-V338 HydrophobicContact CG1-CB 4.49Å; V242-V338 HydrophobicContact CG1-CG1 4.16Å; S334-V338 WeakPolarHBondContact O-CG2 3.42Å; S334-V338 PolarHBondContact O-N 2.85Å; S334-V338 VanDerWaalsContact O-N 3.07Å; R335-V338 PolarHBondContact O-N 2.95Å; V338-N340 VanDerWaalsContact C-N 3.32Å; V338-N340 PolarHBondContact O-N 2.73Å; V338-M341 HydrophobicContact CB-CE 4.1Å; V338-M341 HydrophobicContact CG2-CE 3.67Å; V338-M341 PolarHBondContact O-N 2.7Å; V338-L342 HydrophobicContact CG1-CD1 4.21Å; V338-L342 WeakPolarHBondContact O-CG 3.23Å; V338-L342 PolarHBondContact O-N 3.48Å; V338-M354 HydrophobicContact CG1-CG 4.39Å; V338-M354 HydrophobicContact CG1-SD 4.45Å; V338-N357 HydrophobicContact CG2-CB 4.23Å
339A88.9Confident85.5Confident19 Ų1978.9 Ų78.916%0.15738%0.382CS..Hα-helixtrans-56.3-47.5173.700000111.4V242 R335 D336 M341 L342 I343V242-A339 HydrophobicContact CG2-CB 3.67Å; R335-A339 PolarHBondContact O-N 2.66Å; D336-A339 WeakPolarHBondContact O-CB 3.3Å; D336-A339 PolarHBondContact O-N 2.99Å; A339-M341 VanDerWaalsContact C-N 3.34Å; A339-M341 PolarHBondContact O-N 3.3Å; A339-L342 PolarHBondContact O-N 3.42Å; A339-I343 VanDerWaalsContact O-CG1 3.28Å; A339-I343 WeakPolarHBondContact O-CG1 3.34Å; A339-I343 PolarHBondContact O-N 3.22Å
340N87.9Confident85.1Confident102 Ų10277.9 Ų77.955%0.54538%0.382SS..Hα-helixtrans-63.9-36.7177.7-68.4-19.2000112.6D336 K337 V338 I343 S344D336-N340 VanDerWaalsContact O-CG 3.23Å; D336-N340 PolarHBondContact O-N 3.12Å; D336-N340 PolarHBondContact O-ND2 2.84Å; K337-N340 PolarHBondContact O-N 3.49Å; V338-N340 VanDerWaalsContact C-N 3.32Å; V338-N340 PolarHBondContact O-N 2.73Å; N340-I343 PolarHBondContact O-N 3.41Å; N340-S344 VanDerWaalsContact O-CB 3.29Å; N340-S344 WeakPolarHBondContact O-CB 3.45Å; N340-S344 PolarHBondContact O-N 3.24Å; N340-S344 PolarHBondContact O-OG 3.48Å
341M86.5Confident84.9Confident31 Ų3180 Ų8015%0.15339%0.392CS..Hα-helixtrans-64.5-42.2174.5-70.6-174-65.300111.7K337 V338 A339 S344 N345 V349 E353 N357K337-M341 WeakPolarHBondContact O-CG 3.37Å; K337-M341 PolarHBondContact O-N 3.29Å; V338-M341 HydrophobicContact CB-CE 4.1Å; V338-M341 HydrophobicContact CG2-CE 3.67Å; V338-M341 PolarHBondContact O-N 2.7Å; A339-M341 VanDerWaalsContact C-N 3.34Å; A339-M341 PolarHBondContact O-N 3.3Å; M341-S344 PolarHBondContact O-OG 3.13Å; M341-N345 PolarHBondContact O-N 3.23Å; M341-V349 HydrophobicContact CB-CG1 4.4Å; M341-V349 HydrophobicContact CB-CG2 4.06Å; M341-E353 HydrophobicContact SD-CG 4.44Å; M341-N357 HydrophobicContact CE-CB 3.78Å
342L86.1Confident84.7Confident17 Ų1785.4 Ų85.49%0.08941%0.412CS..Hα-helixtrans-67.1-35.8177.6-72171.1000112.8V240 V242 E245 V338 A339 K346 M354V240-L342 HydrophobicContact CG1-CB 4.37Å; V240-L342 HydrophobicContact CG1-CD1 3.99Å; V242-L342 HydrophobicContact CG1-CD1 4.44Å; V242-L342 HydrophobicContact CG2-CD1 4.46Å; E245-L342 HydrophobicContact CB-CD1 4.24Å; E245-L342 HydrophobicContact CG-CD1 4.1Å; E245-L342 HydrophobicContact CG-CD2 4.15Å; V338-L342 HydrophobicContact CG1-CD1 4.21Å; V338-L342 WeakPolarHBondContact O-CG 3.23Å; V338-L342 PolarHBondContact O-N 3.48Å; A339-L342 PolarHBondContact O-N 3.42Å; L342-K346 WeakPolarHBondContact O-CA 3.45Å; L342-K346 WeakPolarHBondContact O-CB 3.47Å; L342-M354 HydrophobicContact CD2-SD 3.73Å; L342-M354 HydrophobicContact CG-SD 4.3Å
343I84Confident84.6Confident122 Ų12282.3 Ų82.363%0.62640%0.404SS*.Hα-helixtrans-73.7-45.1177.6-66.1164.5000110.9A339 N340A339-I343 VanDerWaalsContact O-CG1 3.28Å; A339-I343 WeakPolarHBondContact O-CG1 3.34Å; A339-I343 PolarHBondContact O-N 3.22Å; N340-I343 PolarHBondContact O-N 3.41Å
344S82.9Confident84.4Confident91 Ų9174.2 Ų74.264%0.63637%0.374SS*.Hα-helixtrans-77.3-34.3-174.557.30000114N340 M341N340-S344 VanDerWaalsContact O-CB 3.29Å; N340-S344 WeakPolarHBondContact O-CB 3.45Å; N340-S344 PolarHBondContact O-N 3.24Å; N340-S344 PolarHBondContact O-OG 3.48Å; M341-S344 PolarHBondContact O-OG 3.13Å
345N73.9Confident84.5Confident89 Ų8973.8 Ų73.848%0.47637%0.37SS..  trans-137.442.1-164.5-126.9-4.7000112.3M341 F347 N348 V349M341-N345 PolarHBondContact O-N 3.23Å; N345-F347 PolarHBondContact O-N 3.05Å; N345-N348 PolarHBondContact O-N 3.02Å; N345-V349 HydrophobicContact CB-CG2 3.99Å
346K66.1Low84.7Confident152 Ų15271.6 Ų71.666%0.66136%0.362SS*.THydrogen-bonded Turntrans-46.1-24-166.5-156.1175.4-176.1178.80116.5L342L342-K346 WeakPolarHBondContact O-CA 3.45Å; L342-K346 WeakPolarHBondContact O-CB 3.47Å
347F65.7Low84.8Confident196 Ų19669.1 Ų69.186%0.8635%0.349SS*.THydrogen-bonded Turntrans-107-12.4-178.9-66.4-76.4000115.8N345N345-F347 PolarHBondContact O-N 3.05Å
348N72.7Confident84.9Confident132 Ų13265.6 Ų65.671%0.70633%0.333SS*.THydrogen-bonded Turntrans-116-1.4-170.1-83.1-10.7000115.3N345 S350N345-N348 PolarHBondContact O-N 3.02Å; N348-S350 PolarHBondContact O-N 3.2Å
349V79.8Confident85.1Confident25 Ų2565.6 Ų65.615%0.15233%0.333CS..  trans-79.4120.5179.9-167.90000110.1M341 N345 E353 M354M341-V349 HydrophobicContact CB-CG1 4.4Å; M341-V349 HydrophobicContact CB-CG2 4.06Å; N345-V349 HydrophobicContact CB-CG2 3.99Å; V349-E353 HydrophobicContact CG1-CB 4.46Å; V349-M354 HydrophobicContact CB-CG 4.45Å; V349-M354 HydrophobicContact CG1-CG 3.49Å; V349-M354 VanDerWaalsContact CG1-CG 3.49Å; V349-M354 HydrophobicContact CG1-SD 4.29Å
350S87.1Confident85.4Confident67 Ų6765.2 Ų65.247%0.46933%0.329SS..  trans-69.4138.9176.2-176.50000111.4N348 R352 E353 M354N348-S350 PolarHBondContact O-N 3.2Å; S350-R352 PolarHBondContact O-N 3.34Å; S350-R352 VanDerWaalsContact O-N 3.09Å; S350-R352 PolarHBondContact OG-N 2.82Å; S350-E353 WeakPolarHBondContact O-CA 3.45Å; S350-E353 WeakPolarHBondContact O-CB 3.48Å; S350-E353 PolarHBondContact O-N 3.38Å; S350-M354 PolarHBondContact O-N 3.15Å; S350-M354 VanDerWaalsContact O-N 3.08Å
351N89.7Confident85.7Confident54 Ų5460.4 Ų60.429%0.28930%0.304SS..Hα-helixtrans-50.6-34.5170.4-73.9-6.2000112.6V249 E252 M354 Y355V249-N351 HydrophobicContact CG1-CB 4.16Å; V249-N351 VanDerWaalsContact CG1-O 3.32Å; V249-N351 WeakPolarHBondContact CG1-O 3.5Å; E252-N351 PolarHBondContact OE1-ND2 2.99Å; E252-N351 PolarHBondContact OE2-ND2 2.98Å; N351-M354 VanDerWaalsContact OD1-CE 3.3Å; N351-M354 WeakPolarHBondContact OD1-CE 3.2Å; N351-Y355 WeakPolarHBondContact O-CB 3.46Å; N351-Y355 PolarHBondContact O-N 2.83Å; N351-Y355 VanDerWaalsContact O-N 3.13Å
352R89.8Confident86.1Confident131 Ų13159 Ų5949%0.49430%0.296SS..Hα-helixtrans-64.3-44.5175.6178.2178.3170.7-177.7-8.2111.7S350 Y355 Y356S350-R352 PolarHBondContact O-N 3.34Å; S350-R352 VanDerWaalsContact O-N 3.09Å; S350-R352 PolarHBondContact OG-N 2.82Å; R352-Y355 PolarHBondContact O-N 2.78Å; R352-Y356 HydrophobicContact CG-CD2 3.77Å; R352-Y356 HydrophobicContact CG-CE2 3.88Å; R352-Y356 WeakPolarHBondContact O-CD2 3.39Å; R352-Y356 PolarHBondContact O-N 3.47Å; R352-Y356 VanDerWaalsContact O-N 3.1Å
353E89.4Confident86.5Confident89 Ų8958.6 Ų58.642%0.41630%0.295SS..Hα-helixtrans-66.1-43.9-178.3-176.7174.6-170.700110.8M341 V349 S350 Y355 N357M341-E353 HydrophobicContact SD-CG 4.44Å; V349-E353 HydrophobicContact CG1-CB 4.46Å; S350-E353 WeakPolarHBondContact O-CA 3.45Å; S350-E353 WeakPolarHBondContact O-CB 3.48Å; S350-E353 PolarHBondContact O-N 3.38Å; E353-Y355 PolarHBondContact O-N 2.97Å; E353-N357 WeakPolarHBondContact CG-ND2 3.44Å; E353-N357 VanDerWaalsContact O-CB 3.31Å; E353-N357 WeakPolarHBondContact O-CB 3.19Å; E353-N357 PolarHBondContact O-N 2.76Å; E353-N357 PolarHBondContact O-ND2 3.22Å
354M89.9Confident87.1Confident6 Ų655.2 Ų55.23%0.0328%0.281CS..Hα-helixtrans-58.7-47.7175-68-167.1-84.500111.9V249 V338 L342 V349 S350 N351 N357 Y358V249-M354 HydrophobicContact CG2-CE 3.59Å; V249-M354 HydrophobicContact CG2-SD 4.34Å; V338-M354 HydrophobicContact CG1-CG 4.39Å; V338-M354 HydrophobicContact CG1-SD 4.45Å; L342-M354 HydrophobicContact CD2-SD 3.73Å; L342-M354 HydrophobicContact CG-SD 4.3Å; V349-M354 HydrophobicContact CB-CG 4.45Å; V349-M354 HydrophobicContact CG1-CG 3.49Å; V349-M354 VanDerWaalsContact CG1-CG 3.49Å; V349-M354 HydrophobicContact CG1-SD 4.29Å; S350-M354 PolarHBondContact O-N 3.15Å; S350-M354 VanDerWaalsContact O-N 3.08Å; N351-M354 VanDerWaalsContact OD1-CE 3.3Å; N351-M354 WeakPolarHBondContact OD1-CE 3.2Å; M354-N357 PolarHBondContact O-N 3.05Å; M354-Y358 WeakPolarHBondContact O-CB 3.37Å; M354-Y358 PolarHBondContact O-N 3.48Å
355Y93.7Very high87.7Confident0 Ų050.9 Ų50.90%025%0.251CS..Hα-helixtrans-58.3-52.8-179.9177.6-93.2000112.6I250 R253 F254 S265 N351 R352 E353 Y358 I359 G413I250-Y355 HydrophobicContact CG1-CD2 4.21Å; I250-Y355 HydrophobicContact CG1-CE2 4.37Å; R253-Y355 VanDerWaalsContact NH1-CD1 3.27Å; F254-Y355 AromaticContact CE2-CE2 3.7Å; F254-Y355 HydrophobicContact CE2-CE2 3.7Å; F254-Y355 AromaticContact CE2-CZ 3.83Å; F254-Y355 HydrophobicContact CZ-CE2 4.48Å; S265-Y355 WeakPolarHBondContact CB-OH 3.28Å; S265-Y355 PolarHBondContact OG-OH 2.68Å; N351-Y355 WeakPolarHBondContact O-CB 3.46Å; N351-Y355 PolarHBondContact O-N 2.83Å; N351-Y355 VanDerWaalsContact O-N 3.13Å; R352-Y355 PolarHBondContact O-N 2.78Å; E353-Y355 PolarHBondContact O-N 2.97Å; Y355-Y358 PolarHBondContact O-N 3.28Å; Y355-I359 HydrophobicContact CD1-CG1 4.38Å; Y355-I359 HydrophobicContact CD2-CG1 4.43Å; Y355-I359 HydrophobicContact CE1-CG1 3.91Å; Y355-I359 HydrophobicContact CE2-CG1 3.99Å; Y355-I359 WeakPolarHBondContact O-CG1 3.32Å; Y355-I359 PolarHBondContact O-N 2.94Å; Y355-G413 VanDerWaalsContact CE2-O 3.29Å; Y355-G413 WeakPolarHBondContact CE2-O 3.27Å; Y355-G413 PolarHBondContact OH-O 3.06Å; Y355-G413 VanDerWaalsContact OH-O 3.04Å
356Y93.7Very high88.8Confident9 Ų946.7 Ų46.74%0.03523%0.228CC..Hα-helixtrans-72.8-32-176.5-77.3-70.5000112.7R253 R352 Y358 C360 L469R253-Y356 VanDerWaalsContact NH2-CE2 3.31Å; R253-Y356 PolarHBondContact NH2-OH 2.63Å; R352-Y356 HydrophobicContact CG-CD2 3.77Å; R352-Y356 HydrophobicContact CG-CE2 3.88Å; R352-Y356 WeakPolarHBondContact O-CD2 3.39Å; R352-Y356 PolarHBondContact O-N 3.47Å; R352-Y356 VanDerWaalsContact O-N 3.1Å; Y356-Y358 VanDerWaalsContact C-N 3.3Å; Y356-Y358 PolarHBondContact O-N 3.37Å; Y356-C360 WeakPolarHBondContact O-CB 3.17Å; Y356-C360 PolarHBondContact O-N 3.37Å; Y356-C360 PolarHBondContact O-SG 3.24Å; Y356-L469 HydrophobicContact CD1-CB 3.8Å; Y356-L469 WeakPolarHBondContact CD2-O 3.21Å; Y356-L469 HydrophobicContact CE1-CB 3.5Å; Y356-L469 HydrophobicContact CE1-CD1 3.76Å; Y356-L469 HydrophobicContact CE1-CG 4.21Å; Y356-L469 HydrophobicContact CE2-CB 4.4Å; Y356-L469 HydrophobicContact CG-CB 4.37Å
357N92.6Very high90.2Very high13 Ų1341.3 Ų41.37%0.0721%0.208CC..Hα-helixtrans-62.5-39.8171.8-84-69.7000111.5V338 M341 E353 M354 R470V338-N357 HydrophobicContact CG2-CB 4.23Å; M341-N357 HydrophobicContact CE-CB 3.78Å; E353-N357 WeakPolarHBondContact CG-ND2 3.44Å; E353-N357 VanDerWaalsContact O-CB 3.31Å; E353-N357 WeakPolarHBondContact O-CB 3.19Å; E353-N357 PolarHBondContact O-N 2.76Å; E353-N357 PolarHBondContact O-ND2 3.22Å; M354-N357 PolarHBondContact O-N 3.05Å; N357-R470 PolarHBondContact OD1-NE 2.76Å; N357-R470 PolarHBondContact OD1-NH2 3.32Å
358Y93.4Very high91.7Very high32 Ų3234.4 Ų34.413%0.12518%0.18CC..Hα-helixtrans-69.1-47.9177.2-174.9-130.3000112.6L246 L331 R335 M354 Y355 Y356 C360 G361 T412L246-Y358 HydrophobicContact CD1-CD1 3.76Å; L246-Y358 HydrophobicContact CD1-CE1 4.4Å; L246-Y358 HydrophobicContact CD1-CG 3.92Å; L246-Y358 HydrophobicContact CD2-CD1 3.31Å; L246-Y358 HydrophobicContact CD2-CD2 3.67Å; L246-Y358 HydrophobicContact CD2-CE1 3.16Å; L246-Y358 HydrophobicContact CD2-CE2 3.6Å; L246-Y358 HydrophobicContact CD2-CG 3.53Å; L246-Y358 HydrophobicContact CG-CD1 3.76Å; L246-Y358 HydrophobicContact CG-CE1 3.89Å; L246-Y358 HydrophobicContact CG-CG 4.21Å; L331-Y358 HydrophobicContact CD2-CE2 4.18Å; R335-Y358 HydrophobicContact CB-CE2 4.31Å; M354-Y358 WeakPolarHBondContact O-CB 3.37Å; M354-Y358 PolarHBondContact O-N 3.48Å; Y355-Y358 PolarHBondContact O-N 3.28Å; Y356-Y358 VanDerWaalsContact C-N 3.3Å; Y356-Y358 PolarHBondContact O-N 3.37Å; Y358-C360 VanDerWaalsContact C-N 3.3Å; Y358-C360 PolarHBondContact O-N 3.28Å; Y358-G361 PolarHBondContact O-N 2.97Å; Y358-T412 HydrophobicContact CD1-CG2 3.63Å; Y358-T412 HydrophobicContact CE1-CG2 3.09Å; Y358-T412 HydrophobicContact CE2-CG2 4.43Å
359I94Very high92.8Very high0 Ų028.1 Ų28.10%015%0.146CC..Hα-helixtrans-66.2-32.4-179.6-70.8-68.8000112.6Y355 G361 L362 Y409 T412 L466Y355-I359 HydrophobicContact CD1-CG1 4.38Å; Y355-I359 HydrophobicContact CD2-CG1 4.43Å; Y355-I359 HydrophobicContact CE1-CG1 3.91Å; Y355-I359 HydrophobicContact CE2-CG1 3.99Å; Y355-I359 WeakPolarHBondContact O-CG1 3.32Å; Y355-I359 PolarHBondContact O-N 2.94Å; I359-G361 PolarHBondContact O-N 3.45Å; I359-L362 PolarHBondContact O-N 3.4Å; I359-Y409 HydrophobicContact CG2-CD2 4.36Å; I359-Y409 HydrophobicContact CG2-CE2 3.43Å; I359-Y409 VanDerWaalsContact CG2-CE2 3.43Å; I359-Y409 WeakPolarHBondContact CG2-OH 2.98Å; I359-T412 HydrophobicContact CD1-CG2 4.07Å; I359-L466 HydrophobicContact CG2-CD2 4.29Å
360C94.3Very high93.6Very high12 Ų1226.9 Ų26.98%0.08114%0.139CC..G310 helixtrans-60.8-14.9171.8-77.10000113.3Y356 Y358 L362 V363Y356-C360 WeakPolarHBondContact O-CB 3.17Å; Y356-C360 PolarHBondContact O-N 3.37Å; Y356-C360 PolarHBondContact O-SG 3.24Å; Y358-C360 VanDerWaalsContact C-N 3.3Å; Y358-C360 PolarHBondContact O-N 3.28Å; C360-L362 PolarHBondContact O-N 3.4Å; C360-V363 HydrophobicContact CB-CG2 4.4Å; C360-V363 WeakPolarHBondContact O-CB 3.09Å; C360-V363 PolarHBondContact O-N 3.43Å
361G93.8Very high94.1Very high1 Ų127.6 Ų27.61%0.0114%0.136CC..G310 helixtrans-59.2-24.9168.200000113.9S330 S334 Y358 I359 P364S330-G361 CarbonylContact C-O 3.6Å; S330-G361 WeakPolarHBondContact CB-O 3.31Å; S330-G361 PolarHBondContact OG-O 2.9Å; S334-G361 WeakPolarHBondContact OG-CA 3.48Å; S334-G361 PolarHBondContact OG-N 3.28Å; Y358-G361 PolarHBondContact O-N 2.97Å; I359-G361 PolarHBondContact O-N 3.45Å; G361-P364 WeakPolarHBondContact O-CD 3.31Å
362L95.1Very high94.4Very high0 Ų027.9 Ų27.90%014%0.135CC..G310 helixtrans-87.9-13.9178.2-68.6165.9000113.7I327 L331 I359 C360 P364 A365 L366 Y409 T412I327-L362 HydrophobicContact CG2-CD2 3.77Å; L331-L362 HydrophobicContact CD1-CD2 4.05Å; L331-L362 HydrophobicContact CD2-CD1 4.47Å; L331-L362 HydrophobicContact CD2-CD2 4.15Å; L331-L362 HydrophobicContact CD2-CG 3.88Å; L331-L362 HydrophobicContact CG-CD2 4.04Å; L331-L362 HydrophobicContact CG-CG 4.32Å; I359-L362 PolarHBondContact O-N 3.4Å; C360-L362 PolarHBondContact O-N 3.4Å; L362-P364 VanDerWaalsContact C-CD 3.47Å; L362-P364 VanDerWaalsContact C-N 3.34Å; L362-A365 PolarHBondContact O-N 2.88Å; L362-A365 VanDerWaalsContact O-N 3.09Å; L362-L366 WeakPolarHBondContact O-CG 3.38Å; L362-L366 PolarHBondContact O-N 2.95Å; L362-Y409 HydrophobicContact CB-CD2 4.28Å; L362-Y409 HydrophobicContact CD1-CD2 3.6Å; L362-Y409 HydrophobicContact CD1-CG 3.97Å; L362-T412 HydrophobicContact CD1-CG2 4.39Å
363V95.9Very high94.7Very high10 Ų1021.7 Ų21.76%0.06111%0.112CC..Hα-helixtrans-53.3-43.8-178.8167.90000112.6C360 A365 L366 T367 P463 L466 L467C360-V363 HydrophobicContact CB-CG2 4.4Å; C360-V363 WeakPolarHBondContact O-CB 3.09Å; C360-V363 PolarHBondContact O-N 3.43Å; V363-A365 VanDerWaalsContact C-N 3.34Å; V363-A365 PolarHBondContact O-N 3.18Å; V363-L366 PolarHBondContact O-N 3.45Å; V363-L366 VanDerWaalsContact O-N 3.16Å; V363-T367 HydrophobicContact CG1-CG2 4.05Å; V363-T367 WeakPolarHBondContact O-CG2 3.45Å; V363-T367 PolarHBondContact O-N 2.9Å; V363-T367 PolarHBondContact O-OG1 3.28Å; V363-P463 HydrophobicContact CG1-CB 3.77Å; V363-L466 HydrophobicContact CG2-CB 3.99Å; V363-L466 HydrophobicContact CG2-CD1 4.22Å; V363-L467 HydrophobicContact CG1-CD1 4.09Å; V363-L467 HydrophobicContact CG1-CD2 4.26Å; V363-L467 HydrophobicContact CG1-CG 4.07Å; V363-L467 HydrophobicContact CG2-CD2 4.46Å; V363-L467 HydrophobicContact CG2-CG 4.44Å
364P95.7Very high95.1Very high51 Ų5119.4 Ų19.433%0.33110%0.104SC..Hα-helixtrans-53.9-46.6175.8-28.437.4000113.3G361 L362 L366 T367 I368G361-P364 WeakPolarHBondContact O-CD 3.31Å; L362-P364 VanDerWaalsContact C-CD 3.47Å; L362-P364 VanDerWaalsContact C-N 3.34Å; P364-L366 PolarHBondContact O-N 3.42Å; P364-T367 WeakPolarHBondContact CA-OG1 3.39Å; P364-T367 PolarHBondContact O-N 3.01Å; P364-T367 PolarHBondContact O-OG1 2.82Å; P364-I368 WeakPolarHBondContact O-CB 3.49Å; P364-I368 WeakPolarHBondContact O-CD1 3.24Å; P364-I368 WeakPolarHBondContact O-CG1 3.21Å; P364-I368 PolarHBondContact O-N 2.94Å
365A95.5Very high95.4Very high0 Ų022 Ų220%012%0.117CC..Hα-helixtrans-62.6-43.6178.200000111.8I326 I327 L362 V363 T367 I368 M369 I401 A405I326-A365 HydrophobicContact CG2-CB 4.24Å; I327-A365 HydrophobicContact CG1-CB 3.84Å; L362-A365 PolarHBondContact O-N 2.88Å; L362-A365 VanDerWaalsContact O-N 3.09Å; V363-A365 VanDerWaalsContact C-N 3.34Å; V363-A365 PolarHBondContact O-N 3.18Å; A365-T367 VanDerWaalsContact C-N 3.34Å; A365-T367 PolarHBondContact O-N 2.99Å; A365-I368 PolarHBondContact O-N 3.49Å; A365-M369 WeakPolarHBondContact O-CB 3.24Å; A365-M369 PolarHBondContact O-N 3.11Å; A365-I401 HydrophobicContact CB-CG2 4.19Å; A365-I401 WeakPolarHBondContact O-CG2 3.49Å; A365-A405 HydrophobicContact CB-CB 4.12Å
366L96.6Very high95.4Very high0 Ų022 Ų220%012%0.117CC..Hα-helixtrans-62.1-41176.9-55.8-179.8000111.9I269 W272 L362 V363 P364 G370 A405 T462 P463 L466I269-L366 HydrophobicContact CD1-CD2 4.12Å; W272-L366 HydrophobicContact CD2-CD2 3.78Å; W272-L366 HydrophobicContact CE3-CD2 4Å; W272-L366 HydrophobicContact CG-CD2 4.44Å; W272-L366 HydrophobicContact CH2-CD2 3.59Å; W272-L366 HydrophobicContact CZ2-CB 4.42Å; W272-L366 HydrophobicContact CZ2-CD2 3.43Å; W272-L366 VanDerWaalsContact CZ2-CD2 3.43Å; W272-L366 HydrophobicContact CZ3-CD2 3.91Å; L362-L366 WeakPolarHBondContact O-CG 3.38Å; L362-L366 PolarHBondContact O-N 2.95Å; V363-L366 PolarHBondContact O-N 3.45Å; V363-L366 VanDerWaalsContact O-N 3.16Å; P364-L366 PolarHBondContact O-N 3.42Å; L366-G370 PolarHBondContact O-N 3.27Å; L366-G370 VanDerWaalsContact O-N 3.11Å; L366-A405 HydrophobicContact CD2-CB 4.09Å; L366-T462 HydrophobicContact CD1-CG2 4.09Å; L366-P463 HydrophobicContact CB-CB 4.34Å; L366-P463 HydrophobicContact CB-CG 4.49Å; L366-L466 HydrophobicContact CD1-CD1 3.91Å
367T96.5Very high95.5Very high40 Ų4021.6 Ų21.625%0.24512%0.116CC..Hα-helixtrans-69.8-42.4178.155.20000112.8V363 P364 A365 M369 G370 I371 P463V363-T367 HydrophobicContact CG1-CG2 4.05Å; V363-T367 WeakPolarHBondContact O-CG2 3.45Å; V363-T367 PolarHBondContact O-N 2.9Å; V363-T367 PolarHBondContact O-OG1 3.28Å; P364-T367 WeakPolarHBondContact CA-OG1 3.39Å; P364-T367 PolarHBondContact O-N 3.01Å; P364-T367 PolarHBondContact O-OG1 2.82Å; A365-T367 VanDerWaalsContact C-N 3.34Å; A365-T367 PolarHBondContact O-N 2.99Å; T367-M369 VanDerWaalsContact C-N 3.33Å; T367-M369 PolarHBondContact O-N 2.9Å; T367-G370 PolarHBondContact O-N 3.23Å; T367-G370 VanDerWaalsContact O-N 3.17Å; T367-I371 WeakPolarHBondContact O-CG1 3.11Å; T367-I371 PolarHBondContact O-N 3.21Å; T367-P463 HydrophobicContact CG2-CB 3.49Å; T367-P463 VanDerWaalsContact CG2-CB 3.49Å; T367-P463 HydrophobicContact CG2-CG 3.78Å
368I96.4Very high95.6Very high50 Ų5022.6 Ų22.626%0.25613%0.126SC..Hα-helixtrans-62.1-44.7178.4-70.6165.1000109.7I326 P364 A365 G370 I371 F372 I401I326-I368 HydrophobicContact CD1-CD1 4.3Å; I326-I368 HydrophobicContact CG2-CD1 3.82Å; P364-I368 WeakPolarHBondContact O-CB 3.49Å; P364-I368 WeakPolarHBondContact O-CD1 3.24Å; P364-I368 WeakPolarHBondContact O-CG1 3.21Å; P364-I368 PolarHBondContact O-N 2.94Å; A365-I368 PolarHBondContact O-N 3.49Å; I368-G370 VanDerWaalsContact C-N 3.33Å; I368-G370 PolarHBondContact O-N 2.83Å; I368-I371 PolarHBondContact O-N 3.07Å; I368-F372 HydrophobicContact CG2-CD2 3.77Å; I368-F372 HydrophobicContact CG2-CE2 3.77Å; I368-F372 WeakPolarHBondContact O-CD2 3.29Å; I368-F372 PolarHBondContact O-N 2.88Å; I368-I401 HydrophobicContact CG2-CD1 3.78Å
369M95.7Very high95.6Very high0 Ų023.2 Ų23.20%013%0.131CC..Hα-helixtrans-58.2-44.7174.1-178.8-82.6-149.900111.7W272 A365 T367 I371 F372 A373 V398 I401 M402 L459W272-M369 HydrophobicContact CH2-CE 4.08Å; W272-M369 HydrophobicContact CH2-CG 4.42Å; W272-M369 HydrophobicContact CZ2-CB 3.97Å; W272-M369 HydrophobicContact CZ2-CE 3.58Å; W272-M369 HydrophobicContact CZ2-CG 3.74Å; W272-M369 HydrophobicContact CZ2-SD 3.64Å; A365-M369 WeakPolarHBondContact O-CB 3.24Å; A365-M369 PolarHBondContact O-N 3.11Å; T367-M369 VanDerWaalsContact C-N 3.33Å; T367-M369 PolarHBondContact O-N 2.9Å; M369-I371 VanDerWaalsContact C-N 3.34Å; M369-I371 PolarHBondContact O-N 2.78Å; M369-F372 PolarHBondContact O-N 3.4Å; M369-A373 WeakPolarHBondContact O-CB 3.44Å; M369-A373 PolarHBondContact O-N 3.46Å; M369-V398 HydrophobicContact CE-CG1 4.28Å; M369-V398 HydrophobicContact CG-CG1 4.28Å; M369-V398 HydrophobicContact SD-CG1 4.43Å; M369-I401 HydrophobicContact CB-CB 4.06Å; M369-I401 HydrophobicContact CB-CG2 3.71Å; M369-I401 HydrophobicContact CG-CB 4.34Å; M369-I401 HydrophobicContact CG-CG2 4.35Å; M369-M402 HydrophobicContact CE-CB 3.75Å; M369-M402 HydrophobicContact CE-CG 3.71Å; M369-M402 HydrophobicContact CE-SD 4.09Å; M369-L459 HydrophobicContact CE-CD1 4.17Å; M369-L459 HydrophobicContact CE-CD2 4.27Å; M369-L459 HydrophobicContact SD-CD1 3.72Å; M369-L459 HydrophobicContact SD-CD2 4.47Å
370G96.7Very high95.4Very high0 Ų023.2 Ų23.20%013%0.131CC..Hα-helixtrans-58.4-42.1174.800000113.2L366 T367 I368 A373 V374 F460L366-G370 PolarHBondContact O-N 3.27Å; L366-G370 VanDerWaalsContact O-N 3.11Å; T367-G370 PolarHBondContact O-N 3.23Å; T367-G370 VanDerWaalsContact O-N 3.17Å; I368-G370 VanDerWaalsContact C-N 3.33Å; I368-G370 PolarHBondContact O-N 2.83Å; G370-A373 PolarHBondContact O-N 3.35Å; G370-V374 WeakPolarHBondContact O-CG2 3.44Å; G370-V374 PolarHBondContact O-N 2.98Å; G370-F460 VanDerWaalsContact C-CZ 3.44Å
371I97.3Very high95.3Very high82 Ų8227.1 Ų27.142%0.42115%0.146SC..Hα-helixtrans-61.6-51.2176.5-66.5165000110.5T367 I368 M369 A373 V374 I375 F460T367-I371 WeakPolarHBondContact O-CG1 3.11Å; T367-I371 PolarHBondContact O-N 3.21Å; I368-I371 PolarHBondContact O-N 3.07Å; M369-I371 VanDerWaalsContact C-N 3.34Å; M369-I371 PolarHBondContact O-N 2.78Å; I371-A373 VanDerWaalsContact C-N 3.28Å; I371-A373 PolarHBondContact O-N 3.15Å; I371-V374 PolarHBondContact O-N 3.11Å; I371-I375 HydrophobicContact CG2-CD1 3.95Å; I371-I375 WeakPolarHBondContact O-CG1 3.39Å; I371-I375 PolarHBondContact O-N 2.91Å; I371-F460 HydrophobicContact CG1-CE1 4.06Å; I371-F460 HydrophobicContact CG1-CZ 3.85Å
372F96.4Very high95.2Very high59 Ų5930.8 Ų30.826%0.25917%0.165SC..Hα-helixtrans-64.5-32.6178.5-80.9-79.3000112.4I368 M369 I375 L376 C394 I397 V398I368-F372 HydrophobicContact CG2-CD2 3.77Å; I368-F372 HydrophobicContact CG2-CE2 3.77Å; I368-F372 WeakPolarHBondContact O-CD2 3.29Å; I368-F372 PolarHBondContact O-N 2.88Å; M369-F372 PolarHBondContact O-N 3.4Å; F372-I375 PolarHBondContact O-N 3.37Å; F372-L376 WeakPolarHBondContact O-CB 3.45Å; F372-L376 PolarHBondContact O-N 3.26Å; F372-C394 HydrophobicContact CD1-CB 4.26Å; F372-I397 HydrophobicContact CB-CG2 4.46Å; F372-I397 HydrophobicContact CD1-CB 4.42Å; F372-I397 HydrophobicContact CD1-CD1 4.06Å; F372-I397 HydrophobicContact CD1-CG2 4.21Å; F372-I397 HydrophobicContact CD2-CG2 3.72Å; F372-I397 HydrophobicContact CE1-CD1 3.58Å; F372-I397 HydrophobicContact CE1-CG2 4.4Å; F372-I397 HydrophobicContact CE2-CG2 3.93Å; F372-I397 HydrophobicContact CG-CB 4.45Å; F372-I397 HydrophobicContact CG-CG2 3.88Å; F372-I397 HydrophobicContact CZ-CD1 3.9Å; F372-I397 HydrophobicContact CZ-CG2 4.26Å; F372-V398 HydrophobicContact CB-CG2 3.59Å
373A96.4Very high94.9Very high1 Ų133.9 Ų33.91%0.00819%0.19CC..Hα-helixtrans-66.9-37.5175.100000112.5M369 G370 I371 S377 V398 S456 L459M369-A373 WeakPolarHBondContact O-CB 3.44Å; M369-A373 PolarHBondContact O-N 3.46Å; G370-A373 PolarHBondContact O-N 3.35Å; I371-A373 VanDerWaalsContact C-N 3.28Å; I371-A373 PolarHBondContact O-N 3.15Å; A373-S377 WeakPolarHBondContact O-CB 3.46Å; A373-S377 PolarHBondContact O-N 3.48Å; A373-S377 PolarHBondContact O-OG 3.33Å; A373-V398 HydrophobicContact CB-CG1 4.46Å; A373-V398 HydrophobicContact CB-CG2 4.1Å; A373-S456 PolarHBondContact O-OG 3.19Å; A373-L459 HydrophobicContact CB-CD1 3.66Å
374V97Very high94.7Very high41 Ų4137 Ų3725%0.24821%0.207CC..Hα-helixtrans-67.1-47.1173.3170.20000111G370 I371 L376 S377 A378 M453 V457 F460G370-V374 WeakPolarHBondContact O-CG2 3.44Å; G370-V374 PolarHBondContact O-N 2.98Å; I371-V374 PolarHBondContact O-N 3.11Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 2.71Å; V374-S377 PolarHBondContact O-N 2.85Å; V374-A378 WeakPolarHBondContact O-CB 3.29Å; V374-A378 PolarHBondContact O-N 3.31Å; V374-M453 HydrophobicContact CG1-SD 4.12Å; V374-V457 HydrophobicContact CG2-CG2 4.19Å; V374-F460 HydrophobicContact CG2-CE2 3.88Å
375I96.7Very high94.5Very high61 Ų6136.5 Ų36.531%0.31320%0.203SC..Hα-helixtrans-57.5-49.6176.3-65.3167.9000109.8I371 F372 S377 A378 M379I371-I375 HydrophobicContact CG2-CD1 3.95Å; I371-I375 WeakPolarHBondContact O-CG1 3.39Å; I371-I375 PolarHBondContact O-N 2.91Å; F372-I375 PolarHBondContact O-N 3.37Å; I375-S377 VanDerWaalsContact C-N 3.31Å; I375-S377 PolarHBondContact O-N 2.93Å; I375-A378 WeakPolarHBondContact O-CB 3.26Å; I375-A378 PolarHBondContact O-N 2.98Å; I375-A378 VanDerWaalsContact O-N 3.11Å; I375-M379 HydrophobicContact CG2-CE 4.27Å; I375-M379 HydrophobicContact CG2-CG 4.27Å; I375-M379 VanDerWaalsContact O-CG 3.31Å; I375-M379 WeakPolarHBondContact O-CG 3.36Å; I375-M379 PolarHBondContact O-N 3.01Å
376L94.9Very high94.4Very high0 Ų041 Ų410%023%0.23CC..Hα-helixtrans-55.6-43.5176.917252.2000112.4R279 F283 F372 V374 M380 A391 C394 L395 V398R279-L376 VanDerWaalsContact CZ-CG 3.42Å; R279-L376 VanDerWaalsContact NH1-CG 3.33Å; R279-L376 VanDerWaalsContact NH2-CG 3.31Å; F283-L376 HydrophobicContact CD2-CD1 4.3Å; F283-L376 HydrophobicContact CE2-CD1 3.96Å; F372-L376 WeakPolarHBondContact O-CB 3.45Å; F372-L376 PolarHBondContact O-N 3.26Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 2.71Å; L376-M380 WeakPolarHBondContact O-CG 3.17Å; L376-A391 HydrophobicContact CD1-CB 3.67Å; L376-A391 WeakPolarHBondContact CD1-O 3.33Å; L376-C394 HydrophobicContact CB-CB 3.74Å; L376-C394 HydrophobicContact CD1-CB 4.37Å; L376-C394 HydrophobicContact CG-CB 4.42Å; L376-L395 HydrophobicContact CD1-CB 4.3Å; L376-L395 HydrophobicContact CD2-CB 4.08Å; L376-L395 HydrophobicContact CD2-CD1 4Å; L376-V398 HydrophobicContact CD2-CB 4.4Å; L376-V398 HydrophobicContact CD2-CG2 4.11Å
377S94.3Very high94.3Very high1 Ų141.4 Ų41.41%0.00723%0.233CC..Hα-helixtrans-71.4-34176.8-62.20000112.6R279 A373 V374 I375 F381 S452 S456R279-S377 PolarHBondContact NE-OG 3.47Å; A373-S377 WeakPolarHBondContact O-CB 3.46Å; A373-S377 PolarHBondContact O-N 3.48Å; A373-S377 PolarHBondContact O-OG 3.33Å; V374-S377 PolarHBondContact O-N 2.85Å; I375-S377 VanDerWaalsContact C-N 3.31Å; I375-S377 PolarHBondContact O-N 2.93Å; S377-F381 VanDerWaalsContact O-CD2 3.23Å; S377-F381 WeakPolarHBondContact O-CD2 3.38Å; S377-F381 WeakPolarHBondContact O-CE2 3.17Å; S377-S452 PolarHBondContact OG-O 3.21Å; S377-S456 PolarHBondContact OG-OG 2.94Å
378A94.8Very high94.2Very high34 Ų3439.5 Ų39.528%0.28122%0.221SC..Hα-helixtrans-67-42.6176.300000111.8V374 I375 M380 F381 M453V374-A378 WeakPolarHBondContact O-CB 3.29Å; V374-A378 PolarHBondContact O-N 3.31Å; I375-A378 WeakPolarHBondContact O-CB 3.26Å; I375-A378 PolarHBondContact O-N 2.98Å; I375-A378 VanDerWaalsContact O-N 3.11Å; A378-M380 PolarHBondContact O-N 3.46Å; A378-F381 PolarHBondContact O-N 3.43Å; A378-F381 VanDerWaalsContact O-N 3.12Å; A378-M453 HydrophobicContact CB-CE 3.84Å
379M93.7Very high94Very high45 Ų4540.5 Ų40.522%0.22222%0.222CC..Hα-helixtrans-61.5-29.9-179.5-69.1-55.3122.300112.8I375 F381 I382 A387 T390 A391I375-M379 HydrophobicContact CG2-CE 4.27Å; I375-M379 HydrophobicContact CG2-CG 4.27Å; I375-M379 VanDerWaalsContact O-CG 3.31Å; I375-M379 WeakPolarHBondContact O-CG 3.36Å; I375-M379 PolarHBondContact O-N 3.01Å; M379-F381 PolarHBondContact O-N 3.27Å; M379-I382 HydrophobicContact CE-CD1 4.49Å; M379-I382 PolarHBondContact O-N 3.48Å; M379-I382 VanDerWaalsContact O-N 3.13Å; M379-I382 HydrophobicContact SD-CD1 4.31Å; M379-A387 HydrophobicContact CB-CB 4.36Å; M379-A387 WeakPolarHBondContact CB-O 3.47Å; M379-A387 HydrophobicContact SD-CB 4.05Å; M379-T390 HydrophobicContact CG-CG2 4.07Å; M379-T390 HydrophobicContact SD-CG2 4.29Å; M379-A391 HydrophobicContact CB-CB 4.07Å
380M90.7Very high94Very high0 Ų043 Ų430%024%0.238CC..THydrogen-bonded Turntrans-71.8-7.2178.6-64.4-49-69.900114.5F283 Q290 L376 A378 I388 A391 N449F283-M380 HydrophobicContact CD2-CG 4.48Å; F283-M380 HydrophobicContact CE2-CE 4.23Å; F283-M380 HydrophobicContact CE2-CG 4.24Å; F283-M380 HydrophobicContact CE2-SD 3.8Å; Q290-M380 HydrophobicContact CB-CE 3.93Å; L376-M380 WeakPolarHBondContact O-CG 3.17Å; A378-M380 PolarHBondContact O-N 3.46Å; M380-I388 HydrophobicContact CE-CD1 4.02Å; M380-I388 HydrophobicContact SD-CD1 3.9Å; M380-A391 HydrophobicContact SD-CB 3.8Å; M380-N449 PolarHBondContact O-ND2 3Å
381F91.2Very high93.8Very high93 Ų9343 Ų4341%0.40824%0.238SC..THydrogen-bonded Turntrans-87.6-11170.9-71.1-84.4000113.4S377 A378 M379 N449 M453S377-F381 VanDerWaalsContact O-CD2 3.23Å; S377-F381 WeakPolarHBondContact O-CD2 3.38Å; S377-F381 WeakPolarHBondContact O-CE2 3.17Å; A378-F381 PolarHBondContact O-N 3.43Å; A378-F381 VanDerWaalsContact O-N 3.12Å; M379-F381 PolarHBondContact O-N 3.27Å; F381-N449 HydrophobicContact CD1-CB 4.23Å; F381-N449 HydrophobicContact CD2-CB 4.36Å; F381-N449 HydrophobicContact CE1-CB 3.65Å; F381-N449 HydrophobicContact CE2-CB 3.79Å; F381-N449 HydrophobicContact CZ-CB 3.42Å; F381-N449 VanDerWaalsContact CZ-CB 3.42Å; F381-M453 HydrophobicContact CE2-CB 4.49Å; F381-M453 HydrophobicContact CE2-CE 4.22Å
382I91.7Very high93.6Very high79 Ų7939.2 Ų39.241%0.40522%0.219SC..SBendtrans-103.6116.8-172.4-53.1175.5000108.7M379 N384 A387M379-I382 HydrophobicContact CE-CD1 4.49Å; M379-I382 PolarHBondContact O-N 3.48Å; M379-I382 VanDerWaalsContact O-N 3.13Å; M379-I382 HydrophobicContact SD-CD1 4.31Å; I382-N384 HydrophobicContact CG2-CB 3.82Å; I382-N384 PolarHBondContact O-N 3Å; I382-A387 HydrophobicContact CB-CB 3.89Å; I382-A387 HydrophobicContact CG2-CB 4.09Å
383A88.6Confident93.4Very high64 Ų6439.7 Ų39.753%0.52923%0.226SC..  trans-7567.1174.800000111.4L294L294-A383 HydrophobicContact CB-CB 4.3Å; L294-A383 HydrophobicContact CD2-CB 3.83Å
384N91.8Very high93.3Very high76 Ų7639.9 Ų39.941%0.40623%0.227SC..  trans-142.8131.3180-174.5-33.8000110.3I382 V386 A387 I388I382-N384 HydrophobicContact CG2-CB 3.82Å; I382-N384 PolarHBondContact O-N 3Å; N384-V386 PolarHBondContact O-N 3.17Å; N384-V386 WeakPolarHBondContact OD1-CB 3.43Å; N384-V386 PolarHBondContact OD1-N 2.91Å; N384-A387 HydrophobicContact CB-CB 4.19Å; N384-A387 WeakPolarHBondContact O-CA 3.29Å; N384-A387 WeakPolarHBondContact O-CB 3.47Å; N384-A387 PolarHBondContact O-N 2.96Å; N384-I388 PolarHBondContact O-N 3.3Å; N384-I388 VanDerWaalsContact O-N 3.13Å
385T91.3Very high93.1Very high40 Ų4038.2 Ų38.225%0.24522%0.217CC..Hα-helixtrans-56-38.1179.9-39.30000112.6L301 L305 A387 I388 Y389L301-T385 HydrophobicContact CD1-CG2 4.17Å; L305-T385 HydrophobicContact CD2-CG2 4.02Å; T385-A387 VanDerWaalsContact C-N 3.32Å; T385-A387 PolarHBondContact O-N 3.02Å; T385-I388 PolarHBondContact O-N 3.2Å; T385-Y389 HydrophobicContact CG2-CD2 4.1Å; T385-Y389 HydrophobicContact CG2-CE2 3.45Å; T385-Y389 VanDerWaalsContact CG2-CE2 3.45Å; T385-Y389 VanDerWaalsContact O-CD2 3.23Å; T385-Y389 WeakPolarHBondContact O-CD2 3.42Å; T385-Y389 PolarHBondContact O-N 2.98Å
386V94.2Very high92.9Very high96 Ų9636 Ų3658%0.58221%0.206SC*.Hα-helixtrans-65.4-37177.1-1780000111.3N384 I388 Y389 T390N384-V386 PolarHBondContact O-N 3.17Å; N384-V386 WeakPolarHBondContact OD1-CB 3.43Å; N384-V386 PolarHBondContact OD1-N 2.91Å; V386-I388 VanDerWaalsContact C-N 3.33Å; V386-Y389 PolarHBondContact O-N 3.14Å; V386-T390 WeakPolarHBondContact O-CB 3.37Å; V386-T390 PolarHBondContact O-N 3.5Å; V386-T390 PolarHBondContact O-OG1 3.45Å
387A94.5Very high92.8Very high7 Ų738 Ų386%0.05822%0.216CC..Hα-helixtrans-65.3-39.6175.400000110.9M379 I382 N384 T385 T390 A391M379-A387 HydrophobicContact CB-CB 4.36Å; M379-A387 WeakPolarHBondContact CB-O 3.47Å; M379-A387 HydrophobicContact SD-CB 4.05Å; I382-A387 HydrophobicContact CB-CB 3.89Å; I382-A387 HydrophobicContact CG2-CB 4.09Å; N384-A387 HydrophobicContact CB-CB 4.19Å; N384-A387 WeakPolarHBondContact O-CA 3.29Å; N384-A387 WeakPolarHBondContact O-CB 3.47Å; N384-A387 PolarHBondContact O-N 2.96Å; T385-A387 VanDerWaalsContact C-N 3.32Å; T385-A387 PolarHBondContact O-N 3.02Å; A387-T390 WeakPolarHBondContact O-CB 3.31Å; A387-T390 PolarHBondContact O-N 3.33Å; A387-A391 WeakPolarHBondContact O-CB 3.43Å; A387-A391 PolarHBondContact O-N 3.18Å
388I93.2Very high92.7Very high0 Ų038.3 Ų38.30%022%0.218CC..Hα-helixtrans-65.7-45175.9-60.1-54.3000112.1L291 L294 F295 L305 M380 N384 T385 V386 T390 A391 F392L291-I388 HydrophobicContact CD2-CD1 4.17Å; L291-I388 HydrophobicContact CD2-CG1 4.16Å; L291-I388 HydrophobicContact CD2-CG2 3.9Å; L294-I388 HydrophobicContact CD1-CD1 3.82Å; F295-I388 HydrophobicContact CE2-CG1 4.15Å; L305-I388 HydrophobicContact CD1-CG2 4.28Å; L305-I388 HydrophobicContact CD2-CG2 3.96Å; M380-I388 HydrophobicContact CE-CD1 4.02Å; M380-I388 HydrophobicContact SD-CD1 3.9Å; N384-I388 PolarHBondContact O-N 3.3Å; N384-I388 VanDerWaalsContact O-N 3.13Å; T385-I388 PolarHBondContact O-N 3.2Å; V386-I388 VanDerWaalsContact C-N 3.33Å; I388-T390 VanDerWaalsContact C-N 3.27Å; I388-T390 PolarHBondContact O-N 2.94Å; I388-A391 WeakPolarHBondContact O-CA 3.46Å; I388-A391 WeakPolarHBondContact O-CB 3.46Å; I388-A391 PolarHBondContact O-N 2.99Å; I388-A391 VanDerWaalsContact O-N 3.11Å; I388-F392 HydrophobicContact CG2-CD2 4.31Å; I388-F392 HydrophobicContact CG2-CE1 3.96Å; I388-F392 HydrophobicContact CG2-CE2 3.62Å; I388-F392 HydrophobicContact CG2-CZ 3.41Å; I388-F392 VanDerWaalsContact CG2-CZ 3.41Å; I388-F392 WeakPolarHBondContact O-CG 3.49Å; I388-F392 PolarHBondContact O-N 2.89Å
389Y93.7Very high92.6Very high71 Ų7137.3 Ų37.328%0.27821%0.207SC..Hα-helixtrans-61.4-39.1174.4-66.6-48.6000111.8H304 L305 V308 F312 T385 V386 A391 F392 V393H304-Y389 PolarHBondContact NE2-OH 3.19Å; L305-Y389 HydrophobicContact CD2-CD1 4.31Å; L305-Y389 HydrophobicContact CD2-CE1 3.66Å; V308-Y389 HydrophobicContact CB-CE1 4.44Å; V308-Y389 HydrophobicContact CG1-CD1 4.12Å; V308-Y389 HydrophobicContact CG1-CE1 3.75Å; F312-Y389 HydrophobicContact CE2-CD1 4.28Å; T385-Y389 HydrophobicContact CG2-CD2 4.1Å; T385-Y389 HydrophobicContact CG2-CE2 3.45Å; T385-Y389 VanDerWaalsContact CG2-CE2 3.45Å; T385-Y389 VanDerWaalsContact O-CD2 3.23Å; T385-Y389 WeakPolarHBondContact O-CD2 3.42Å; T385-Y389 PolarHBondContact O-N 2.98Å; V386-Y389 PolarHBondContact O-N 3.14Å; Y389-A391 VanDerWaalsContact C-N 3.32Å; Y389-A391 PolarHBondContact O-N 3.41Å; Y389-F392 HydrophobicContact CD1-CD2 4.19Å; Y389-F392 HydrophobicContact CD1-CE2 4.48Å; Y389-F392 PolarHBondContact O-N 3.47Å; Y389-V393 WeakPolarHBondContact O-CG2 3.4Å; Y389-V393 PolarHBondContact O-N 3.03Å
390T94.4Very high92.5Very high54 Ų5435.2 Ų35.233%0.33120%0.197SC..Hα-helixtrans-62.6-40.3174-55.60000111.3M379 V386 A387 I388 V393 C394M379-T390 HydrophobicContact CG-CG2 4.07Å; M379-T390 HydrophobicContact SD-CG2 4.29Å; V386-T390 WeakPolarHBondContact O-CB 3.37Å; V386-T390 PolarHBondContact O-N 3.5Å; V386-T390 PolarHBondContact O-OG1 3.45Å; A387-T390 WeakPolarHBondContact O-CB 3.31Å; A387-T390 PolarHBondContact O-N 3.33Å; I388-T390 VanDerWaalsContact C-N 3.27Å; I388-T390 PolarHBondContact O-N 2.94Å; T390-V393 PolarHBondContact O-N 3.3Å; T390-C394 WeakPolarHBondContact O-CB 3.2Å; T390-C394 PolarHBondContact O-N 3.27Å; T390-C394 PolarHBondContact O-SG 3.33Å
391A93.7Very high92.6Very high0 Ų035.4 Ų35.40%020%0.198CC..Hα-helixtrans-61.1-42.7173.200000111.4L376 M379 M380 A387 I388 Y389 V393 C394 L395L376-A391 HydrophobicContact CD1-CB 3.67Å; L376-A391 WeakPolarHBondContact CD1-O 3.33Å; M379-A391 HydrophobicContact CB-CB 4.07Å; M380-A391 HydrophobicContact SD-CB 3.8Å; A387-A391 WeakPolarHBondContact O-CB 3.43Å; A387-A391 PolarHBondContact O-N 3.18Å; I388-A391 WeakPolarHBondContact O-CA 3.46Å; I388-A391 WeakPolarHBondContact O-CB 3.46Å; I388-A391 PolarHBondContact O-N 2.99Å; I388-A391 VanDerWaalsContact O-N 3.11Å; Y389-A391 VanDerWaalsContact C-N 3.32Å; Y389-A391 PolarHBondContact O-N 3.41Å; A391-V393 PolarHBondContact O-N 3.33Å; A391-C394 PolarHBondContact O-N 3.42Å; A391-L395 WeakPolarHBondContact O-CB 3.24Å; A391-L395 PolarHBondContact O-N 2.96Å
392F92.2Very high92.8Very high2 Ų231 Ų311%0.00918%0.179CC..Hα-helixtrans-61.9-44175.8-61.7-26.8000112.6F283 L287 L305 V308 F312 I388 Y389 C394 L395 V396F283-F392 HydrophobicContact CE1-CD1 4.47Å; F283-F392 HydrophobicContact CE1-CE1 4.5Å; F283-F392 AromaticContact CZ-CD1 3.92Å; F283-F392 HydrophobicContact CZ-CD1 3.92Å; F283-F392 AromaticContact CZ-CE1 3.94Å; F283-F392 HydrophobicContact CZ-CE1 3.94Å; L287-F392 HydrophobicContact CD1-CE1 3.82Å; L287-F392 HydrophobicContact CD1-CZ 4.3Å; L287-F392 HydrophobicContact CD2-CE1 4.04Å; L287-F392 HydrophobicContact CD2-CZ 4.45Å; L305-F392 HydrophobicContact CD2-CE2 4.31Å; L305-F392 WeakPolarHBondContact O-CE2 3.09Å; L305-F392 WeakPolarHBondContact O-CZ 3.02Å; V308-F392 HydrophobicContact CG1-CD2 4.32Å; V308-F392 HydrophobicContact CG1-CE2 4.42Å; F312-F392 HydrophobicContact CB-CB 3.9Å; F312-F392 HydrophobicContact CD1-CB 3.87Å; F312-F392 HydrophobicContact CD2-CB 4.13Å; F312-F392 HydrophobicContact CD2-CD2 4.14Å; F312-F392 HydrophobicContact CE1-CB 4.45Å; F312-F392 HydrophobicContact CG-CB 3.69Å; F312-F392 HydrophobicContact CG-CG 4.5Å; I388-F392 HydrophobicContact CG2-CD2 4.31Å; I388-F392 HydrophobicContact CG2-CE1 3.96Å; I388-F392 HydrophobicContact CG2-CE2 3.62Å; I388-F392 HydrophobicContact CG2-CZ 3.41Å; I388-F392 VanDerWaalsContact CG2-CZ 3.41Å; I388-F392 WeakPolarHBondContact O-CG 3.49Å; I388-F392 PolarHBondContact O-N 2.89Å; Y389-F392 HydrophobicContact CD1-CD2 4.19Å; Y389-F392 HydrophobicContact CD1-CE2 4.48Å; Y389-F392 PolarHBondContact O-N 3.47Å; F392-C394 PolarHBondContact O-N 3.4Å; F392-L395 WeakPolarHBondContact O-CB 3.42Å; F392-L395 PolarHBondContact O-N 2.97Å; F392-V396 VanDerWaalsContact O-CG2 3.31Å; F392-V396 WeakPolarHBondContact O-CG2 3.22Å; F392-V396 PolarHBondContact O-N 3.31Å; F392-V396 VanDerWaalsContact O-N 3.14Å
393V93.3Very high92.8Very high68 Ų6829.4 Ų29.441%0.41217%0.169SC..Hα-helixtrans-59.3-48.2174.3175.50000111.1F312 Y389 T390 A391 L395 V396 I397F312-V393 HydrophobicContact CD1-CG2 4.12Å; F312-V393 HydrophobicContact CE1-CG2 3.53Å; Y389-V393 WeakPolarHBondContact O-CG2 3.4Å; Y389-V393 PolarHBondContact O-N 3.03Å; T390-V393 PolarHBondContact O-N 3.3Å; A391-V393 PolarHBondContact O-N 3.33Å; V393-L395 VanDerWaalsContact C-N 3.31Å; V393-L395 PolarHBondContact O-N 2.89Å; V393-V396 PolarHBondContact O-N 3Å; V393-I397 HydrophobicContact CG1-CD1 4.06Å; V393-I397 WeakPolarHBondContact O-CG1 3.48Å; V393-I397 PolarHBondContact O-N 3.19Å
394C94Very high93Very high5 Ų526.3 Ų26.33%0.03414%0.143CC..Hα-helixtrans-64.3-37.2-179.7-64.30000111.8F372 L376 T390 A391 F392 V396 I397 V398F372-C394 HydrophobicContact CD1-CB 4.26Å; L376-C394 HydrophobicContact CB-CB 3.74Å; L376-C394 HydrophobicContact CD1-CB 4.37Å; L376-C394 HydrophobicContact CG-CB 4.42Å; T390-C394 WeakPolarHBondContact O-CB 3.2Å; T390-C394 PolarHBondContact O-N 3.27Å; T390-C394 PolarHBondContact O-SG 3.33Å; A391-C394 PolarHBondContact O-N 3.42Å; F392-C394 PolarHBondContact O-N 3.4Å; C394-V396 VanDerWaalsContact C-N 3.34Å; C394-V396 PolarHBondContact O-N 2.83Å; C394-I397 PolarHBondContact O-N 3.47Å; C394-V398 WeakPolarHBondContact O-CB 3.2Å; C394-V398 WeakPolarHBondContact O-CG2 3.48Å; C394-V398 PolarHBondContact O-N 2.93Å
395L91.9Very high93.2Very high7 Ų722.7 Ų22.74%0.03712%0.124CC..Hα-helixtrans-59.3-45.4175.8-178.577.2000111.5F280 F283 L376 A391 F392 V393 I397 V398 R399F280-L395 HydrophobicContact CD2-CD1 3.79Å; F280-L395 HydrophobicContact CE2-CD1 4Å; F280-L395 HydrophobicContact CE2-CG 4.41Å; F283-L395 HydrophobicContact CB-CD1 4.42Å; F283-L395 HydrophobicContact CD1-CD1 3.58Å; F283-L395 HydrophobicContact CD1-CD2 3.63Å; F283-L395 HydrophobicContact CD1-CG 4.19Å; F283-L395 HydrophobicContact CE1-CD1 3.99Å; F283-L395 HydrophobicContact CE1-CD2 3.29Å; F283-L395 HydrophobicContact CE1-CG 4.13Å; F283-L395 HydrophobicContact CG-CD1 3.95Å; F283-L395 HydrophobicContact CZ-CD2 4.1Å; L376-L395 HydrophobicContact CD1-CB 4.3Å; L376-L395 HydrophobicContact CD2-CB 4.08Å; L376-L395 HydrophobicContact CD2-CD1 4Å; A391-L395 WeakPolarHBondContact O-CB 3.24Å; A391-L395 PolarHBondContact O-N 2.96Å; F392-L395 WeakPolarHBondContact O-CB 3.42Å; F392-L395 PolarHBondContact O-N 2.97Å; V393-L395 VanDerWaalsContact C-N 3.31Å; V393-L395 PolarHBondContact O-N 2.89Å; L395-I397 VanDerWaalsContact C-N 3.32Å; L395-I397 PolarHBondContact O-N 3.3Å; L395-V398 PolarHBondContact O-N 3.28Å; L395-R399 WeakPolarHBondContact O-CB 3.27Å; L395-R399 PolarHBondContact O-N 3.48Å
396V91.9Very high93.4Very high13 Ų1321 Ų218%0.07911%0.113CC..Hα-helixtrans-61.1-44179.4175.70000110.6F312 A319 F392 V393 C394 S400F312-V396 HydrophobicContact CB-CG2 4.33Å; F312-V396 WeakPolarHBondContact O-CG2 3.34Å; A319-V396 HydrophobicContact CB-CG1 3.79Å; F392-V396 VanDerWaalsContact O-CG2 3.31Å; F392-V396 WeakPolarHBondContact O-CG2 3.22Å; F392-V396 PolarHBondContact O-N 3.31Å; F392-V396 VanDerWaalsContact O-N 3.14Å; V393-V396 PolarHBondContact O-N 3Å; C394-V396 VanDerWaalsContact C-N 3.34Å; C394-V396 PolarHBondContact O-N 2.83Å; V396-S400 VanDerWaalsContact O-CB 3.3Å; V396-S400 WeakPolarHBondContact O-CB 3.46Å; V396-S400 PolarHBondContact O-N 3.01Å
397I92.7Very high93.4Very high42 Ų4216.7 Ų16.722%0.2159%0.087CC..Hα-helixtrans-66.2-48.1177.6-63.9169.5000111F372 V393 C394 L395 R399 S400 I401F372-I397 HydrophobicContact CB-CG2 4.46Å; F372-I397 HydrophobicContact CD1-CB 4.42Å; F372-I397 HydrophobicContact CD1-CD1 4.06Å; F372-I397 HydrophobicContact CD1-CG2 4.21Å; F372-I397 HydrophobicContact CD2-CG2 3.72Å; F372-I397 HydrophobicContact CE1-CD1 3.58Å; F372-I397 HydrophobicContact CE1-CG2 4.4Å; F372-I397 HydrophobicContact CE2-CG2 3.93Å; F372-I397 HydrophobicContact CG-CB 4.45Å; F372-I397 HydrophobicContact CG-CG2 3.88Å; F372-I397 HydrophobicContact CZ-CD1 3.9Å; F372-I397 HydrophobicContact CZ-CG2 4.26Å; V393-I397 HydrophobicContact CG1-CD1 4.06Å; V393-I397 WeakPolarHBondContact O-CG1 3.48Å; V393-I397 PolarHBondContact O-N 3.19Å; C394-I397 PolarHBondContact O-N 3.47Å; L395-I397 VanDerWaalsContact C-N 3.32Å; L395-I397 PolarHBondContact O-N 3.3Å; I397-R399 VanDerWaalsContact C-N 3.35Å; I397-R399 PolarHBondContact O-N 3.19Å; I397-S400 PolarHBondContact O-N 3.43Å; I397-I401 HydrophobicContact CG2-CD1 3.66Å; I397-I401 HydrophobicContact CG2-CG1 4.37Å; I397-I401 WeakPolarHBondContact O-CG1 3.33Å; I397-I401 PolarHBondContact O-N 2.87Å
398V93.6Very high93.4Very high8 Ų816.4 Ų16.45%0.0489%0.085CC..Hα-helixtrans-57.7-48.6178.2168.40000110.3M369 F372 A373 L376 C394 L395 M402M369-V398 HydrophobicContact CE-CG1 4.28Å; M369-V398 HydrophobicContact CG-CG1 4.28Å; M369-V398 HydrophobicContact SD-CG1 4.43Å; F372-V398 HydrophobicContact CB-CG2 3.59Å; A373-V398 HydrophobicContact CB-CG1 4.46Å; A373-V398 HydrophobicContact CB-CG2 4.1Å; L376-V398 HydrophobicContact CD2-CB 4.4Å; L376-V398 HydrophobicContact CD2-CG2 4.11Å; C394-V398 WeakPolarHBondContact O-CB 3.2Å; C394-V398 WeakPolarHBondContact O-CG2 3.48Å; C394-V398 PolarHBondContact O-N 2.93Å; L395-V398 PolarHBondContact O-N 3.28Å; V398-M402 WeakPolarHBondContact O-CB 3.46Å; V398-M402 PolarHBondContact O-N 3.34Å
399R91.4Very high93.5Very high14 Ų1416.4 Ų16.45%0.0539%0.085CC..Hα-helixtrans-60.3-48.7179.5-175.3-176.1175.5157.9-3.4111.4D166 F280 L395 I397 M402 F403D166-R399 IonicContact OD1-CZ 2.67Å; D166-R399 IonicContact OD1-NE 3.15Å; D166-R399 PolarHBondContact OD1-NE 2.88Å; D166-R399 IonicContact OD1-NH2 2.7Å; D166-R399 PolarHBondContact OD1-NH2 2.85Å; D166-R399 IonicContact OD2-NE 3.17Å; D166-R399 PolarHBondContact OD2-NE 3.31Å; D166-R399 VanDerWaalsContact OD2-NE 3.15Å; F280-R399 HydrophobicContact CE2-CB 4.12Å; F280-R399 HydrophobicContact CE2-CG 3.92Å; F280-R399 HydrophobicContact CZ-CG 4.17Å; L395-R399 WeakPolarHBondContact O-CB 3.27Å; L395-R399 PolarHBondContact O-N 3.48Å; I397-R399 VanDerWaalsContact C-N 3.35Å; I397-R399 PolarHBondContact O-N 3.19Å; R399-M402 PolarHBondContact O-N 3.28Å; R399-F403 HydrophobicContact CG-CD2 4.01Å; R399-F403 HydrophobicContact CG-CE2 3.86Å; R399-F403 WeakPolarHBondContact O-CD2 3.31Å; R399-F403 PolarHBondContact O-N 3.48Å
400S92.1Very high93.6Very high1 Ų113.2 Ų13.21%0.0077%0.072CC..Hα-helixtrans-60.3-49.5-179.9-176.70000112A320 S323 V396 I397 S404A320-S400 WeakPolarHBondContact CA-OG 3.44Å; S323-S400 PolarHBondContact OG-OG 3.2Å; V396-S400 VanDerWaalsContact O-CB 3.3Å; V396-S400 WeakPolarHBondContact O-CB 3.46Å; V396-S400 PolarHBondContact O-N 3.01Å; I397-S400 PolarHBondContact O-N 3.43Å; S400-S404 VanDerWaalsContact O-CB 3.28Å; S400-S404 WeakPolarHBondContact O-CB 3.29Å; S400-S404 PolarHBondContact O-N 2.68Å; S400-S404 PolarHBondContact O-OG 3.32Å
401I93.7Very high93.4Very high4 Ų411 Ų112%0.0216%0.059CC..Hα-helixtrans-69.2-37.5179.2-59.2170.5000110.8A365 I368 M369 I397 F403 S404 A405A365-I401 HydrophobicContact CB-CG2 4.19Å; A365-I401 WeakPolarHBondContact O-CG2 3.49Å; I368-I401 HydrophobicContact CG2-CD1 3.78Å; M369-I401 HydrophobicContact CB-CB 4.06Å; M369-I401 HydrophobicContact CB-CG2 3.71Å; M369-I401 HydrophobicContact CG-CB 4.34Å; M369-I401 HydrophobicContact CG-CG2 4.35Å; I397-I401 HydrophobicContact CG2-CD1 3.66Å; I397-I401 HydrophobicContact CG2-CG1 4.37Å; I397-I401 WeakPolarHBondContact O-CG1 3.33Å; I397-I401 PolarHBondContact O-N 2.87Å; I401-F403 PolarHBondContact O-N 3.24Å; I401-S404 WeakPolarHBondContact CA-OG 3.42Å; I401-S404 PolarHBondContact O-OG 3.39Å; I401-A405 HydrophobicContact CG2-CB 4.19Å; I401-A405 WeakPolarHBondContact O-CB 3.31Å; I401-A405 PolarHBondContact O-N 3.07Å
402M94.4Very high93.4Very high0 Ų011.2 Ų11.20%06%0.06CC..Hα-helixtrans-55.1-57.4-179.2-176.5179.77300111.7W272 L273 L277 M369 V398 R399 F406W272-M402 HydrophobicContact CH2-CB 4.38Å; W272-M402 HydrophobicContact CH2-CG 4.31Å; W272-M402 WeakPolarHBondContact CH2-O 3.22Å; W272-M402 HydrophobicContact CZ3-CG 4.26Å; W272-M402 WeakPolarHBondContact CZ3-O 3.28Å; L273-M402 HydrophobicContact CD1-CG 4.34Å; L277-M402 HydrophobicContact CD1-CE 3.94Å; M369-M402 HydrophobicContact CE-CB 3.75Å; M369-M402 HydrophobicContact CE-CG 3.71Å; M369-M402 HydrophobicContact CE-SD 4.09Å; V398-M402 WeakPolarHBondContact O-CB 3.46Å; V398-M402 PolarHBondContact O-N 3.34Å; R399-M402 PolarHBondContact O-N 3.28Å; M402-F406 WeakPolarHBondContact O-CB 3.42Å; M402-F406 PolarHBondContact O-N 3.01Å; M402-F406 VanDerWaalsContact O-N 3.07Å
403F92.1Very high93.4Very high45 Ų4511.1 Ų11.120%0.1976%0.06CC..Hα-helixtrans-71.7-42-177.2-68.9-63.3000112.1L277 R399 I401 F406 V407L277-F403 HydrophobicContact CD1-CE1 4.43Å; L277-F403 HydrophobicContact CD1-CZ 4.09Å; R399-F403 HydrophobicContact CG-CD2 4.01Å; R399-F403 HydrophobicContact CG-CE2 3.86Å; R399-F403 WeakPolarHBondContact O-CD2 3.31Å; R399-F403 PolarHBondContact O-N 3.48Å; I401-F403 PolarHBondContact O-N 3.24Å; F403-F406 PolarHBondContact O-N 2.62Å; F403-V407 WeakPolarHBondContact O-CB 3.31Å; F403-V407 WeakPolarHBondContact O-CG2 3.38Å; F403-V407 PolarHBondContact O-N 2.85Å
404S93.4Very high93.5Very high0 Ų08.1 Ų8.10%04%0.041CC..Hα-helixtrans-66.7-43.4-179.360.60000112.7S400 I401 S408S400-S404 VanDerWaalsContact O-CB 3.28Å; S400-S404 WeakPolarHBondContact O-CB 3.29Å; S400-S404 PolarHBondContact O-N 2.68Å; S400-S404 PolarHBondContact O-OG 3.32Å; I401-S404 WeakPolarHBondContact CA-OG 3.42Å; I401-S404 PolarHBondContact O-OG 3.39Å; S404-S408 WeakPolarHBondContact O-CB 3.21Å; S404-S408 PolarHBondContact O-N 2.97Å; S404-S408 PolarHBondContact O-OG 3.49Å
405A95.4Very high93.4Very high0 Ų08.2 Ų8.20%04%0.041CC..Hα-helixtrans-70.5-38.4178.200000111.5W272 I327 A365 L366 I401 S408 Y409W272-A405 HydrophobicContact CH2-CB 4.01Å; I327-A405 HydrophobicContact CD1-CB 4.14Å; A365-A405 HydrophobicContact CB-CB 4.12Å; L366-A405 HydrophobicContact CD2-CB 4.09Å; I401-A405 HydrophobicContact CG2-CB 4.19Å; I401-A405 WeakPolarHBondContact O-CB 3.31Å; I401-A405 PolarHBondContact O-N 3.07Å; A405-S408 PolarHBondContact O-N 3.1Å; A405-Y409 VanDerWaalsContact O-CB 3.26Å; A405-Y409 WeakPolarHBondContact O-CB 3.42Å; A405-Y409 PolarHBondContact O-N 3.42Å
406F95.6Very high93.3Very high4 Ų49.6 Ų9.62%0.0185%0.048CC..Hα-helixtrans-59.8-52.8174.9177.4-109.1000112I269 W272 L273 M402 F403 S408 Y409 L410 N423 S426I269-F406 HydrophobicContact CD1-CD2 4.3Å; I269-F406 HydrophobicContact CG1-CD2 3.74Å; I269-F406 HydrophobicContact CG1-CE2 4.02Å; W272-F406 HydrophobicContact CZ3-CB 4.07Å; L273-F406 HydrophobicContact CB-CD2 3.93Å; L273-F406 HydrophobicContact CB-CE2 4.14Å; L273-F406 HydrophobicContact CD1-CB 4.3Å; L273-F406 HydrophobicContact CD1-CD1 4.3Å; L273-F406 HydrophobicContact CD1-CD2 4.22Å; L273-F406 HydrophobicContact CD1-CG 3.99Å; L273-F406 HydrophobicContact CD2-CD1 4.03Å; L273-F406 HydrophobicContact CD2-CD2 3.9Å; L273-F406 HydrophobicContact CD2-CE1 3.77Å; L273-F406 HydrophobicContact CD2-CE2 3.66Å; L273-F406 HydrophobicContact CD2-CG 4.11Å; L273-F406 HydrophobicContact CD2-CZ 3.6Å; L273-F406 HydrophobicContact CG-CD2 4.23Å; L273-F406 HydrophobicContact CG-CE2 4.39Å; L273-F406 HydrophobicContact CG-CG 4.44Å; M402-F406 WeakPolarHBondContact O-CB 3.42Å; M402-F406 PolarHBondContact O-N 3.01Å; M402-F406 VanDerWaalsContact O-N 3.07Å; F403-F406 PolarHBondContact O-N 2.62Å; F406-S408 VanDerWaalsContact C-N 3.34Å; F406-S408 PolarHBondContact O-N 2.99Å; F406-Y409 WeakPolarHBondContact O-CB 3.46Å; F406-Y409 PolarHBondContact O-N 2.88Å; F406-L410 HydrophobicContact CD1-CD1 4.42Å; F406-L410 HydrophobicContact CE1-CD1 3.56Å; F406-L410 HydrophobicContact CE1-CG 4.2Å; F406-L410 HydrophobicContact CE2-CD1 4.22Å; F406-L410 HydrophobicContact CE2-CD2 4.34Å; F406-L410 HydrophobicContact CE2-CG 4.13Å; F406-L410 HydrophobicContact CZ-CD1 3.4Å; F406-L410 VanDerWaalsContact CZ-CD1 3.4Å; F406-L410 HydrophobicContact CZ-CD2 4.22Å; F406-L410 HydrophobicContact CZ-CG 3.81Å; F406-L410 PolarHBondContact O-N 2.89Å; F406-N423 WeakPolarHBondContact CE1-OD1 3.36Å; F406-S426 WeakPolarHBondContact CZ-OG 3.2Å
407V94.2Very high93.2Very high5 Ų513.7 Ų13.73%0.036%0.063CC..Hα-helixtrans-64.1-42.5180171.90000110.5H144 I158 F403 Y409 L410 L411 F419H144-V407 HydrophobicContact CB-CG1 4.28Å; I158-V407 HydrophobicContact CD1-CG1 4.22Å; I158-V407 HydrophobicContact CG1-CG1 4.3Å; I158-V407 HydrophobicContact CG2-CB 3.84Å; I158-V407 HydrophobicContact CG2-CG1 3.72Å; F403-V407 WeakPolarHBondContact O-CB 3.31Å; F403-V407 WeakPolarHBondContact O-CG2 3.38Å; F403-V407 PolarHBondContact O-N 2.85Å; V407-Y409 VanDerWaalsContact C-N 3.3Å; V407-Y409 PolarHBondContact O-N 2.79Å; V407-L410 PolarHBondContact O-N 3.33Å; V407-L411 HydrophobicContact CG1-CD1 3.83Å; V407-L411 HydrophobicContact CG1-CG 4.38Å; V407-L411 VanDerWaalsContact O-CB 3.3Å; V407-L411 WeakPolarHBondContact O-CB 3.24Å; V407-L411 WeakPolarHBondContact O-CG 3.46Å; V407-L411 PolarHBondContact O-N 3.4Å; V407-F419 HydrophobicContact CG1-CE2 4.04Å; V407-F419 HydrophobicContact CG1-CZ 3.98Å
408S94.3Very high93.2Very high2 Ų213.8 Ų13.81%0.0146%0.06CC..Hα-helixtrans-60.3-40.1175.1-61.20000111.5I158 S404 A405 F406 L411 T412I158-S408 WeakPolarHBondContact CD1-OG 3.45Å; S404-S408 WeakPolarHBondContact O-CB 3.21Å; S404-S408 PolarHBondContact O-N 2.97Å; S404-S408 PolarHBondContact O-OG 3.49Å; A405-S408 PolarHBondContact O-N 3.1Å; F406-S408 VanDerWaalsContact C-N 3.34Å; F406-S408 PolarHBondContact O-N 2.99Å; S408-L411 PolarHBondContact O-N 3.18Å; S408-T412 WeakPolarHBondContact O-CB 3.37Å; S408-T412 PolarHBondContact O-N 3.45Å; S408-T412 PolarHBondContact O-OG1 3.41Å
409Y96Very high93.2Very high0 Ų013.5 Ų13.50%06%0.058CC..Hα-helixtrans-62.3-47.6175.8-166-75.9000112S265 I269 I359 L362 A405 F406 V407 L411 T412 G413 F414 L466S265-Y409 PolarHBondContact O-OH 2.98Å; S265-Y409 PolarHBondContact OG-OH 2.84Å; I269-Y409 HydrophobicContact CB-CD1 3.74Å; I269-Y409 HydrophobicContact CB-CE1 3.7Å; I269-Y409 HydrophobicContact CB-CE2 4.45Å; I269-Y409 HydrophobicContact CB-CG 4.17Å; I269-Y409 HydrophobicContact CD1-CD1 4.24Å; I269-Y409 HydrophobicContact CD1-CD2 3.86Å; I269-Y409 HydrophobicContact CD1-CE2 4.39Å; I269-Y409 HydrophobicContact CD1-CG 3.77Å; I269-Y409 HydrophobicContact CG1-CD1 3.64Å; I269-Y409 HydrophobicContact CG1-CD2 4.18Å; I269-Y409 HydrophobicContact CG1-CE1 4.14Å; I269-Y409 HydrophobicContact CG1-CG 3.68Å; I269-Y409 HydrophobicContact CG2-CD1 3.78Å; I269-Y409 HydrophobicContact CG2-CE1 3.7Å; I359-Y409 HydrophobicContact CG2-CD2 4.36Å; I359-Y409 HydrophobicContact CG2-CE2 3.43Å; I359-Y409 VanDerWaalsContact CG2-CE2 3.43Å; I359-Y409 WeakPolarHBondContact CG2-OH 2.98Å; L362-Y409 HydrophobicContact CB-CD2 4.28Å; L362-Y409 HydrophobicContact CD1-CD2 3.6Å; L362-Y409 HydrophobicContact CD1-CG 3.97Å; A405-Y409 VanDerWaalsContact O-CB 3.26Å; A405-Y409 WeakPolarHBondContact O-CB 3.42Å; A405-Y409 PolarHBondContact O-N 3.42Å; F406-Y409 WeakPolarHBondContact O-CB 3.46Å; F406-Y409 PolarHBondContact O-N 2.88Å; V407-Y409 VanDerWaalsContact C-N 3.3Å; V407-Y409 PolarHBondContact O-N 2.79Å; Y409-L411 VanDerWaalsContact C-N 3.31Å; Y409-L411 PolarHBondContact O-N 3.48Å; Y409-T412 PolarHBondContact O-N 3.42Å; Y409-G413 WeakPolarHBondContact O-CA 3.21Å; Y409-G413 PolarHBondContact O-N 3.36Å; Y409-F414 HydrophobicContact CD1-CE2 4.15Å; Y409-F414 AromaticContact CE1-CE2 3.93Å; Y409-F414 HydrophobicContact CE1-CE2 3.93Å; Y409-L466 HydrophobicContact CE2-CD1 3.83Å; Y409-L466 WeakPolarHBondContact OH-CD2 3.48Å
410L95Very high93.1Very high3 Ų312.8 Ų12.82%0.0166%0.056CC..Hα-helixtrans-60.9-43.4178.4-71.6-172.5000112.1Y266 F406 V407 T412 F414 F419 L422 N423Y266-L410 HydrophobicContact CD2-CD2 4.19Å; Y266-L410 HydrophobicContact CE2-CD2 4Å; F406-L410 HydrophobicContact CD1-CD1 4.42Å; F406-L410 HydrophobicContact CE1-CD1 3.56Å; F406-L410 HydrophobicContact CE1-CG 4.2Å; F406-L410 HydrophobicContact CE2-CD1 4.22Å; F406-L410 HydrophobicContact CE2-CD2 4.34Å; F406-L410 HydrophobicContact CE2-CG 4.13Å; F406-L410 HydrophobicContact CZ-CD1 3.4Å; F406-L410 VanDerWaalsContact CZ-CD1 3.4Å; F406-L410 HydrophobicContact CZ-CD2 4.22Å; F406-L410 HydrophobicContact CZ-CG 3.81Å; F406-L410 PolarHBondContact O-N 2.89Å; V407-L410 PolarHBondContact O-N 3.33Å; L410-T412 VanDerWaalsContact C-N 3.32Å; L410-T412 PolarHBondContact O-N 3.47Å; L410-F414 HydrophobicContact CD2-CD2 4.01Å; L410-F414 HydrophobicContact CD2-CE2 4.13Å; L410-F414 PolarHBondContact O-N 2.65Å; L410-F419 HydrophobicContact CB-CD2 3.95Å; L410-F419 HydrophobicContact CB-CE2 4.02Å; L410-F419 HydrophobicContact CD1-CD2 4.45Å; L410-F419 HydrophobicContact CD1-CE2 4.26Å; L410-L422 HydrophobicContact CD1-CB 4.49Å; L410-L422 HydrophobicContact CD2-CB 4.31Å; L410-N423 HydrophobicContact CD1-CB 3.74Å
411L91.7Very high93.2Very high8 Ų813.3 Ų13.34%0.0426%0.059CC..Hα-helixtrans-74.3-20.4-177.9-79.4-177.5000114.4R154 I158 V407 S408 Y409 I416 F419R154-L411 PolarHBondContact NH1-O 2.98Å; R154-L411 VanDerWaalsContact NH2-CB 3.34Å; I158-L411 HydrophobicContact CD1-CD1 3.7Å; I158-L411 HydrophobicContact CG1-CD1 4.33Å; V407-L411 HydrophobicContact CG1-CD1 3.83Å; V407-L411 HydrophobicContact CG1-CG 4.38Å; V407-L411 VanDerWaalsContact O-CB 3.3Å; V407-L411 WeakPolarHBondContact O-CB 3.24Å; V407-L411 WeakPolarHBondContact O-CG 3.46Å; V407-L411 PolarHBondContact O-N 3.4Å; S408-L411 PolarHBondContact O-N 3.18Å; Y409-L411 VanDerWaalsContact C-N 3.31Å; Y409-L411 PolarHBondContact O-N 3.48Å; L411-I416 HydrophobicContact CD2-CD1 4.41Å; L411-I416 HydrophobicContact CD2-CG1 4.14Å; L411-F419 HydrophobicContact CD1-CE2 4.25Å; L411-F419 HydrophobicContact CD2-CB 4.18Å; L411-F419 HydrophobicContact CD2-CD1 4.37Å; L411-F419 HydrophobicContact CD2-CD2 3.28Å; L411-F419 HydrophobicContact CD2-CE2 3.68Å; L411-F419 HydrophobicContact CD2-CG 3.67Å; L411-F419 HydrophobicContact CD2-CZ 4.37Å; L411-F419 HydrophobicContact CG-CD2 3.66Å; L411-F419 HydrophobicContact CG-CE2 3.6Å; L411-F419 HydrophobicContact CG-CG 4.5Å; L411-F419 HydrophobicContact CG-CZ 4.4Å
412T92.3Very high93.3Very high5 Ų513.1 Ų13.13%0.0316%0.058CC..Hα-helixtrans-97.2-36.3179.7-60.90000111.4I250 L331 Y358 I359 L362 S408 Y409 L410I250-T412 WeakPolarHBondContact CD1-O 3.28Å; L331-T412 HydrophobicContact CD2-CG2 3.86Å; Y358-T412 HydrophobicContact CD1-CG2 3.63Å; Y358-T412 HydrophobicContact CE1-CG2 3.09Å; Y358-T412 HydrophobicContact CE2-CG2 4.43Å; I359-T412 HydrophobicContact CD1-CG2 4.07Å; L362-T412 HydrophobicContact CD1-CG2 4.39Å; S408-T412 WeakPolarHBondContact O-CB 3.37Å; S408-T412 PolarHBondContact O-N 3.45Å; S408-T412 PolarHBondContact O-OG1 3.41Å; Y409-T412 PolarHBondContact O-N 3.42Å; L410-T412 VanDerWaalsContact C-N 3.32Å; L410-T412 PolarHBondContact O-N 3.47Å
413G93.4Very high93.3Very high0 Ų013.5 Ų13.50%06%0.06CC..Hα-helixtrans-99.5-8.8-17100000116F254 Y355 Y409F254-G413 WeakPolarHBondContact CE2-O 3.46Å; Y355-G413 VanDerWaalsContact CE2-O 3.29Å; Y355-G413 WeakPolarHBondContact CE2-O 3.27Å; Y355-G413 PolarHBondContact OH-O 3.06Å; Y355-G413 VanDerWaalsContact OH-O 3.04Å; Y409-G413 WeakPolarHBondContact O-CA 3.21Å; Y409-G413 PolarHBondContact O-N 3.36Å
414F95.2Very high93.3Very high5 Ų511.4 Ų11.42%0.0225%0.051CC..SBendtrans-139.4154.9-178.5-57.7-81.2000111.7F254 C260 Y266 Y409 L410 I416 L422F254-F414 HydrophobicContact CD1-CD1 4.5Å; F254-F414 HydrophobicContact CD2-CD1 4.03Å; F254-F414 HydrophobicContact CD2-CE1 4.48Å; F254-F414 HydrophobicContact CE1-CD1 4.42Å; F254-F414 HydrophobicContact CE1-CE1 4.08Å; F254-F414 AromaticContact CE2-CD1 3.92Å; F254-F414 HydrophobicContact CE2-CD1 3.92Å; F254-F414 AromaticContact CE2-CE1 3.96Å; F254-F414 HydrophobicContact CE2-CE1 3.96Å; F254-F414 HydrophobicContact CG-CD1 4.31Å; F254-F414 HydrophobicContact CZ-CD1 4.12Å; F254-F414 AromaticContact CZ-CE1 3.73Å; F254-F414 HydrophobicContact CZ-CE1 3.73Å; C260-F414 HydrophobicContact CB-CD1 4Å; C260-F414 HydrophobicContact CB-CE1 4.33Å; Y266-F414 HydrophobicContact CD2-CE2 4.12Å; Y266-F414 HydrophobicContact CD2-CZ 4.05Å; Y266-F414 HydrophobicContact CG-CZ 4.31Å; Y409-F414 HydrophobicContact CD1-CE2 4.15Å; Y409-F414 AromaticContact CE1-CE2 3.93Å; Y409-F414 HydrophobicContact CE1-CE2 3.93Å; L410-F414 HydrophobicContact CD2-CD2 4.01Å; L410-F414 HydrophobicContact CD2-CE2 4.13Å; L410-F414 PolarHBondContact O-N 2.65Å; F414-I416 PolarHBondContact O-N 3.41Å; F414-L422 HydrophobicContact CB-CD1 3.65Å; F414-L422 HydrophobicContact CD1-CD1 4.16Å; F414-L422 HydrophobicContact CD2-CD1 4.24Å; F414-L422 HydrophobicContact CG-CD1 3.74Å
415P92.2Very high93.4Very high6 Ų613.1 Ų13.14%0.0396%0.06CC..  trans-56.5130175.6-26.234.9000112.1I250 D251 F254 R417 Y418I250-P415 HydrophobicContact CG2-CG 4Å; D251-P415 WeakPolarHBondContact OD1-CB 3.29Å; D251-P415 WeakPolarHBondContact OD1-CG 3.2Å; F254-P415 HydrophobicContact CB-CG 3.96Å; P415-R417 HydrophobicContact CB-CG 3.84Å; P415-R417 PolarHBondContact O-N 3.3Å; P415-Y418 HydrophobicContact CB-CD2 4.05Å; P415-Y418 HydrophobicContact CB-CE2 4.45Å; P415-Y418 HydrophobicContact CG-CD2 4.23Å; P415-Y418 HydrophobicContact CG-CE2 4.45Å; P415-Y418 PolarHBondContact O-N 2.91Å
416I88.8Confident93.4Very high36 Ų3613.1 Ų13.119%0.1856%0.06CC..G310 helixtrans-57.8-25-177-164.7167.8000113.4V212 L411 F414 Y418 F419V212-I416 HydrophobicContact CG2-CG2 4.1Å; L411-I416 HydrophobicContact CD2-CD1 4.41Å; L411-I416 HydrophobicContact CD2-CG1 4.14Å; F414-I416 PolarHBondContact O-N 3.41Å; I416-Y418 PolarHBondContact O-N 3.2Å; I416-F419 VanDerWaalsContact O-CB 3.29Å; I416-F419 WeakPolarHBondContact O-CB 3.45Å; I416-F419 PolarHBondContact O-N 3Å; I416-F419 VanDerWaalsContact O-N 3.16Å
417R90.2Very high93.2Very high100 Ų10013.7 Ų13.738%0.3776%0.064SC..G310 helixtrans-62.8-17.9175.764.8179.1175.9-164.8-4.7114.7V212 F254 P255 P415V212-R417 HydrophobicContact CG2-CB 4.29Å; F254-R417 PolarHBondContact O-NH2 2.7Å; P255-R417 PolarHBondContact O-NH2 3.36Å; P415-R417 HydrophobicContact CB-CG 3.84Å; P415-R417 PolarHBondContact O-N 3.3Å
418Y92.8Very high93.1Very high43 Ų4314 Ų1417%0.1697%0.068CC..G310 helixtrans-110.34.8178.7-59.4-45.4000112.5P255 L257 P415 I416 G420 T421 L422P255-Y418 PolarHBondContact O-OH 3.28Å; L257-Y418 HydrophobicContact CB-CD1 4.15Å; L257-Y418 HydrophobicContact CB-CE1 4.07Å; L257-Y418 HydrophobicContact CD1-CD1 4.14Å; L257-Y418 HydrophobicContact CD1-CG 4.06Å; P415-Y418 HydrophobicContact CB-CD2 4.05Å; P415-Y418 HydrophobicContact CB-CE2 4.45Å; P415-Y418 HydrophobicContact CG-CD2 4.23Å; P415-Y418 HydrophobicContact CG-CE2 4.45Å; P415-Y418 PolarHBondContact O-N 2.91Å; I416-Y418 PolarHBondContact O-N 3.2Å; Y418-G420 VanDerWaalsContact C-N 3.34Å; Y418-G420 PolarHBondContact O-N 2.79Å; Y418-T421 PolarHBondContact O-N 3.14Å; Y418-L422 WeakPolarHBondContact O-CB 3.43Å; Y418-L422 VanDerWaalsContact O-CG 3.27Å; Y418-L422 WeakPolarHBondContact O-CG 3.41Å; Y418-L422 PolarHBondContact O-N 3.04Å
419F92.4Very high93.1Very high2 Ų217.5 Ų17.51%0.0098%0.084CC..Hα-helixtrans-58.7-44.8-173.4171.7-97.5000112M91 H144 V407 L410 L411 I416 L422 N423M91-F419 HydrophobicContact CE-CD1 3.75Å; M91-F419 HydrophobicContact CE-CE1 4.42Å; H144-F419 HydrophobicContact CB-CZ 4.44Å; V407-F419 HydrophobicContact CG1-CE2 4.04Å; V407-F419 HydrophobicContact CG1-CZ 3.98Å; L410-F419 HydrophobicContact CB-CD2 3.95Å; L410-F419 HydrophobicContact CB-CE2 4.02Å; L410-F419 HydrophobicContact CD1-CD2 4.45Å; L410-F419 HydrophobicContact CD1-CE2 4.26Å; L411-F419 HydrophobicContact CD1-CE2 4.25Å; L411-F419 HydrophobicContact CD2-CB 4.18Å; L411-F419 HydrophobicContact CD2-CD1 4.37Å; L411-F419 HydrophobicContact CD2-CD2 3.28Å; L411-F419 HydrophobicContact CD2-CE2 3.68Å; L411-F419 HydrophobicContact CD2-CG 3.67Å; L411-F419 HydrophobicContact CD2-CZ 4.37Å; L411-F419 HydrophobicContact CG-CD2 3.66Å; L411-F419 HydrophobicContact CG-CE2 3.6Å; L411-F419 HydrophobicContact CG-CG 4.5Å; L411-F419 HydrophobicContact CG-CZ 4.4Å; I416-F419 VanDerWaalsContact O-CB 3.29Å; I416-F419 WeakPolarHBondContact O-CB 3.45Å; I416-F419 PolarHBondContact O-N 3Å; I416-F419 VanDerWaalsContact O-N 3.16Å; F419-L422 PolarHBondContact O-N 3.33Å; F419-N423 HydrophobicContact CE1-CB 4.48Å; F419-N423 HydrophobicContact CE2-CB 4.39Å; F419-N423 HydrophobicContact CZ-CB 4.27Å; F419-N423 WeakPolarHBondContact O-CB 3.45Å; F419-N423 PolarHBondContact O-N 2.93Å
420G89.8Confident92.9Very high0 Ų017.5 Ų17.50%08%0.084CC..Hα-helixtrans-59.9-51.7-178.400000111.8G88 D92 Y418 G424G88-G420 VanDerWaalsContact CA-O 3.27Å; G88-G420 WeakPolarHBondContact CA-O 3.24Å; D92-G420 WeakPolarHBondContact OD1-CA 3.33Å; D92-G420 PolarHBondContact OD1-N 2.88Å; D92-G420 VanDerWaalsContact OD1-N 3.13Å; Y418-G420 VanDerWaalsContact C-N 3.34Å; Y418-G420 PolarHBondContact O-N 2.79Å; G420-G424 PolarHBondContact O-N 3.29Å
421T94.2Very high92.6Very high12 Ų1217.4 Ų17.47%0.0748%0.084CC..Hα-helixtrans-64.2-45-179.4-54.60000111.6I89 D92 L257 Y418 G424 I425I89-T421 HydrophobicContact CG1-CG2 4.08Å; D92-T421 VanDerWaalsContact OD2-CB 3.27Å; D92-T421 WeakPolarHBondContact OD2-CB 3.44Å; D92-T421 PolarHBondContact OD2-N 3.28Å; D92-T421 PolarHBondContact OD2-OG1 3.16Å; L257-T421 HydrophobicContact CD1-CG2 4.19Å; L257-T421 HydrophobicContact CD2-CG2 3.78Å; Y418-T421 PolarHBondContact O-N 3.14Å; T421-G424 PolarHBondContact O-N 2.92Å; T421-I425 HydrophobicContact CG2-CD1 3.73Å; T421-I425 HydrophobicContact CG2-CG1 4.35Å; T421-I425 WeakPolarHBondContact O-CB 3.23Å; T421-I425 VanDerWaalsContact O-CG1 3.28Å; T421-I425 WeakPolarHBondContact O-CG1 3.33Å; T421-I425 PolarHBondContact O-N 2.86Å
422L96Very high92.4Very high0 Ų021.4 Ų21.40%011%0.105CC..Hα-helixtrans-65.6-43.5179.3-69.2175.3000112L257 C260 I261 Y266 L410 F414 Y418 F419 G424 S426L257-L422 HydrophobicContact CD1-CD2 3.97Å; L257-L422 HydrophobicContact CD1-CG 4.22Å; C260-L422 HydrophobicContact CB-CD1 4.1Å; C260-L422 HydrophobicContact CB-CD2 3.83Å; I261-L422 HydrophobicContact CG1-CD2 4.04Å; Y266-L422 HydrophobicContact CD2-CD2 4.07Å; Y266-L422 HydrophobicContact CE1-CD2 4.24Å; Y266-L422 HydrophobicContact CE2-CB 3.9Å; Y266-L422 HydrophobicContact CE2-CD2 3.59Å; Y266-L422 HydrophobicContact CE2-CG 4.23Å; Y266-L422 PolarHBondContact OH-O 3.14Å; L410-L422 HydrophobicContact CD1-CB 4.49Å; L410-L422 HydrophobicContact CD2-CB 4.31Å; F414-L422 HydrophobicContact CB-CD1 3.65Å; F414-L422 HydrophobicContact CD1-CD1 4.16Å; F414-L422 HydrophobicContact CD2-CD1 4.24Å; F414-L422 HydrophobicContact CG-CD1 3.74Å; Y418-L422 WeakPolarHBondContact O-CB 3.43Å; Y418-L422 VanDerWaalsContact O-CG 3.27Å; Y418-L422 WeakPolarHBondContact O-CG 3.41Å; Y418-L422 PolarHBondContact O-N 3.04Å; F419-L422 PolarHBondContact O-N 3.33Å; L422-G424 VanDerWaalsContact C-N 3.34Å; L422-S426 WeakPolarHBondContact O-CB 3.11Å; L422-S426 PolarHBondContact O-N 3.46Å; L422-S426 VanDerWaalsContact O-N 3.09Å; L422-S426 PolarHBondContact O-OG 3.39Å
423N94Very high92.3Very high8 Ų825 Ų254%0.04312%0.121CC..Hα-helixtrans-63.3-43.4175.8-175.579.9000111.1I141 F406 L410 F419 S426 S427I141-N423 VanDerWaalsContact CG2-ND2 3.27Å; I141-N423 WeakPolarHBondContact CG2-ND2 3.41Å; F406-N423 WeakPolarHBondContact CE1-OD1 3.36Å; L410-N423 HydrophobicContact CD1-CB 3.74Å; F419-N423 HydrophobicContact CE1-CB 4.48Å; F419-N423 HydrophobicContact CE2-CB 4.39Å; F419-N423 HydrophobicContact CZ-CB 4.27Å; F419-N423 WeakPolarHBondContact O-CB 3.45Å; F419-N423 PolarHBondContact O-N 2.93Å; N423-S426 PolarHBondContact O-N 2.89Å; N423-S427 WeakPolarHBondContact O-CB 3.3Å; N423-S427 PolarHBondContact O-N 3.01Å; N423-S427 PolarHBondContact O-OG 3.22Å
424G93.4Very high91.9Very high0 Ų025.1 Ų25.10%012%0.121CC..Hα-helixtrans-60.7-53.7178.600000112.7T85 G420 T421 L422 S426 S427 A428T85-G424 PolarHBondContact OG1-O 3.32Å; T85-G424 VanDerWaalsContact OG1-O 3.04Å; G420-G424 PolarHBondContact O-N 3.29Å; T421-G424 PolarHBondContact O-N 2.92Å; L422-G424 VanDerWaalsContact C-N 3.34Å; G424-S426 VanDerWaalsContact C-N 3.31Å; G424-S426 PolarHBondContact O-N 3.03Å; G424-S427 PolarHBondContact O-N 3.4Å; G424-A428 WeakPolarHBondContact O-CB 3.28Å; G424-A428 PolarHBondContact O-N 3.27Å
425I94.9Very high91.3Very high37 Ų3727.5 Ų27.519%0.1913%0.134CC..Hα-helixtrans-58.3-44.7178.2-68.7169.3000110.7T85 I261 T421 S427 A428 M429T85-I425 HydrophobicContact CG2-CG1 3.92Å; T85-I425 PolarHBondContact OG1-N 3.48Å; I261-I425 HydrophobicContact CD1-CD1 3.76Å; I261-I425 HydrophobicContact CG1-CD1 4.38Å; T421-I425 HydrophobicContact CG2-CD1 3.73Å; T421-I425 HydrophobicContact CG2-CG1 4.35Å; T421-I425 WeakPolarHBondContact O-CB 3.23Å; T421-I425 VanDerWaalsContact O-CG1 3.28Å; T421-I425 WeakPolarHBondContact O-CG1 3.33Å; T421-I425 PolarHBondContact O-N 2.86Å; I425-S427 PolarHBondContact O-N 3.47Å; I425-A428 PolarHBondContact O-N 3.12Å; I425-M429 HydrophobicContact CG2-CE 3.91Å; I425-M429 HydrophobicContact CG2-CG 4.45Å; I425-M429 HydrophobicContact CG2-SD 4.2Å; I425-M429 WeakPolarHBondContact O-CG 3.4Å; I425-M429 PolarHBondContact O-N 2.67Å
426S94.9Very high91Very high0 Ų030.7 Ų30.70%015%0.15CC..Hα-helixtrans-63.5-43.7-179.8-47.70000112.1Y266 N270 F406 L422 N423 G424 A428 M429 A430Y266-S426 WeakPolarHBondContact CE2-OG 3.43Å; Y266-S426 PolarHBondContact OH-OG 3.46Å; N270-S426 PolarHBondContact ND2-OG 2.85Å; N270-S426 WeakPolarHBondContact OD1-CA 3.38Å; N270-S426 WeakPolarHBondContact OD1-CB 3.26Å; N270-S426 PolarHBondContact OD1-OG 3Å; F406-S426 WeakPolarHBondContact CZ-OG 3.2Å; L422-S426 WeakPolarHBondContact O-CB 3.11Å; L422-S426 PolarHBondContact O-N 3.46Å; L422-S426 VanDerWaalsContact O-N 3.09Å; L422-S426 PolarHBondContact O-OG 3.39Å; N423-S426 PolarHBondContact O-N 2.89Å; G424-S426 VanDerWaalsContact C-N 3.31Å; G424-S426 PolarHBondContact O-N 3.03Å; S426-A428 VanDerWaalsContact C-N 3.34Å; S426-M429 PolarHBondContact O-N 3.34Å; S426-A430 VanDerWaalsContact O-CB 3.29Å; S426-A430 WeakPolarHBondContact O-CB 3.31Å; S426-A430 PolarHBondContact O-N 2.68Å
427S91.8Very high90.6Very high16 Ų1629.4 Ų29.411%0.11214%0.143CC..Hα-helixtrans-65.9-38177.9-56.30000111.3N423 G424 I425 A430 G431N423-S427 WeakPolarHBondContact O-CB 3.3Å; N423-S427 PolarHBondContact O-N 3.01Å; N423-S427 PolarHBondContact O-OG 3.22Å; G424-S427 PolarHBondContact O-N 3.4Å; I425-S427 PolarHBondContact O-N 3.47Å; S427-A430 PolarHBondContact O-N 3.04Å; S427-G431 PolarHBondContact O-N 3.19Å
428A92.7Very high89.9Confident12 Ų1227.6 Ų27.610%0.09914%0.139CC..Hα-helixtrans-65.5-46.1175.200000112.4M81 T85 G424 I425 S426 G431 L432M81-A428 WeakPolarHBondContact O-CA 3.35Å; M81-A428 WeakPolarHBondContact O-CB 3.29Å; M81-A428 PolarHBondContact O-N 2.99Å; T85-A428 WeakPolarHBondContact OG1-CB 3.35Å; G424-A428 WeakPolarHBondContact O-CB 3.28Å; G424-A428 PolarHBondContact O-N 3.27Å; I425-A428 PolarHBondContact O-N 3.12Å; S426-A428 VanDerWaalsContact C-N 3.34Å; A428-G431 PolarHBondContact O-N 3.45Å; A428-L432 VanDerWaalsContact O-CB 3.31Å; A428-L432 WeakPolarHBondContact O-CB 3.43Å; A428-L432 VanDerWaalsContact O-CG 3.24Å; A428-L432 WeakPolarHBondContact O-CG 3.16Å; A428-L432 PolarHBondContact O-N 3.03Å
429M93.1Very high89.4Confident74 Ų7430.6 Ų30.637%0.36516%0.157SC..Hα-helixtrans-62.2-44.5175.8-68.8-173-54.500111.4N270 I274 I425 S426 F433N270-M429 HydrophobicContact CB-CE 4.07Å; N270-M429 WeakPolarHBondContact OD1-CE 3.37Å; I274-M429 HydrophobicContact CD1-CB 4.22Å; I425-M429 HydrophobicContact CG2-CE 3.91Å; I425-M429 HydrophobicContact CG2-CG 4.45Å; I425-M429 HydrophobicContact CG2-SD 4.2Å; I425-M429 WeakPolarHBondContact O-CG 3.4Å; I425-M429 PolarHBondContact O-N 2.67Å; S426-M429 PolarHBondContact O-N 3.34Å; M429-F433 WeakPolarHBondContact O-CB 3.44Å; M429-F433 PolarHBondContact O-N 3.36Å
430A92.3Very high88.5Confident0 Ų032.4 Ų32.40%017%0.165CC..Hα-helixtrans-64.5-43.5177.700000112.3L273 I274 L277 S426 S427 F433 S434L273-A430 HydrophobicContact CD2-CB 4.07Å; L273-A430 HydrophobicContact CG-CB 4.01Å; I274-A430 HydrophobicContact CG1-CB 4.03Å; L277-A430 HydrophobicContact CB-CB 4.19Å; L277-A430 HydrophobicContact CD2-CB 3.5Å; L277-A430 VanDerWaalsContact CD2-CB 3.5Å; L277-A430 HydrophobicContact CG-CB 4.48Å; S426-A430 VanDerWaalsContact O-CB 3.29Å; S426-A430 WeakPolarHBondContact O-CB 3.31Å; S426-A430 PolarHBondContact O-N 2.68Å; S427-A430 PolarHBondContact O-N 3.04Å; A430-F433 PolarHBondContact O-N 3.45Å; A430-S434 WeakPolarHBondContact O-CB 3.35Å; A430-S434 PolarHBondContact O-N 3.27Å
431G87.7Confident87.4Confident1 Ų134.3 Ų34.31%0.0118%0.175CC..Hα-helixtrans-65.8-44.4176.900000113S427 A428 F433 S434 L435S427-G431 PolarHBondContact O-N 3.19Å; A428-G431 PolarHBondContact O-N 3.45Å; G431-F433 VanDerWaalsContact C-N 3.34Å; G431-F433 PolarHBondContact O-N 2.84Å; G431-S434 WeakPolarHBondContact CA-OG 3.4Å; G431-S434 PolarHBondContact O-N 3.33Å; G431-S434 PolarHBondContact O-OG 3.18Å; G431-L435 PolarHBondContact O-N 3.13Å
432L88.8Confident86.4Confident93 Ų9342.2 Ų42.249%0.48721%0.21SC..Hα-helixtrans-62.7-41175-73.6170.7000111.8A428 S434 L435A428-L432 VanDerWaalsContact O-CB 3.31Å; A428-L432 WeakPolarHBondContact O-CB 3.43Å; A428-L432 VanDerWaalsContact O-CG 3.24Å; A428-L432 WeakPolarHBondContact O-CG 3.16Å; A428-L432 PolarHBondContact O-N 3.03Å; L432-S434 VanDerWaalsContact C-N 3.33Å; L432-L435 HydrophobicContact CD2-CD1 4.3Å; L432-L435 WeakPolarHBondContact O-CB 3.44Å; L432-L435 PolarHBondContact O-N 3.45Å
433F89.4Confident85.5Confident81 Ų8144.5 Ų44.536%0.35522%0.224SC..Hα-helixtrans-67.8-36.7175.3-167.7-88.6000111.7I274 F278 M429 A430 G431 L435 L436I274-F433 HydrophobicContact CG2-CB 3.68Å; I274-F433 HydrophobicContact CG2-CD1 3.4Å; I274-F433 VanDerWaalsContact CG2-CD1 3.4Å; I274-F433 HydrophobicContact CG2-CD2 4.01Å; I274-F433 HydrophobicContact CG2-CE1 3.99Å; I274-F433 HydrophobicContact CG2-CG 3.41Å; I274-F433 VanDerWaalsContact CG2-CG 3.41Å; F278-F433 HydrophobicContact CB-CD1 3.99Å; F278-F433 HydrophobicContact CB-CE1 4.17Å; F278-F433 HydrophobicContact CD1-CE1 4.24Å; F278-F433 AromaticContact CD2-CD1 3.99Å; F278-F433 HydrophobicContact CD2-CD1 3.99Å; F278-F433 AromaticContact CD2-CE1 3.98Å; F278-F433 HydrophobicContact CD2-CE1 3.98Å; F278-F433 HydrophobicContact CE2-CE1 4.42Å; F278-F433 HydrophobicContact CG-CD1 4.04Å; F278-F433 AromaticContact CG-CE1 3.87Å; F278-F433 HydrophobicContact CG-CE1 3.87Å; M429-F433 WeakPolarHBondContact O-CB 3.44Å; M429-F433 PolarHBondContact O-N 3.36Å; A430-F433 PolarHBondContact O-N 3.45Å; G431-F433 VanDerWaalsContact C-N 3.34Å; G431-F433 PolarHBondContact O-N 2.84Å; F433-L435 PolarHBondContact O-N 3.38Å; F433-L435 VanDerWaalsContact O-N 3.16Å; F433-L436 HydrophobicContact CD1-CD1 4.3Å; F433-L436 HydrophobicContact CD2-CD1 3.77Å; F433-L436 HydrophobicContact CE1-CD1 4.17Å; F433-L436 HydrophobicContact CE2-CD1 3.62Å; F433-L436 HydrophobicContact CG-CD1 4.12Å; F433-L436 HydrophobicContact CZ-CD1 3.83Å; F433-L436 VanDerWaalsContact O-CB 3.24Å; F433-L436 WeakPolarHBondContact O-CB 3.33Å; F433-L436 WeakPolarHBondContact O-CG 3.18Å; F433-L436 PolarHBondContact O-N 2.88Å
434S84.9Confident84.7Confident1 Ų147 Ų471%0.00724%0.243CC..Hα-helixtrans-62-22.5177.777.60000113.4F77 A430 G431 L432 L436 Q437F77-S434 WeakPolarHBondContact CE1-OG 3.43Å; A430-S434 WeakPolarHBondContact O-CB 3.35Å; A430-S434 PolarHBondContact O-N 3.27Å; G431-S434 WeakPolarHBondContact CA-OG 3.4Å; G431-S434 PolarHBondContact O-N 3.33Å; G431-S434 PolarHBondContact O-OG 3.18Å; L432-S434 VanDerWaalsContact C-N 3.33Å; S434-L436 PolarHBondContact O-N 3.37Å; S434-Q437 VanDerWaalsContact O-CB 3.23Å; S434-Q437 WeakPolarHBondContact O-CB 3.35Å; S434-Q437 WeakPolarHBondContact O-CG 3.42Å; S434-Q437 PolarHBondContact O-N 3.25Å
435L84.2Confident84Confident56 Ų5647.4 Ų47.429%0.29325%0.247SC..THydrogen-bonded Turntrans-59.1-27.9172.5-77.5172.1000113.2V78 G431 L432 F433 Q437 H438V78-L435 HydrophobicContact CG1-CD1 4.02Å; V78-L435 HydrophobicContact CG2-CD1 4.03Å; V78-L435 HydrophobicContact CG2-CD2 3.18Å; V78-L435 HydrophobicContact CG2-CG 3.79Å; G431-L435 PolarHBondContact O-N 3.13Å; L432-L435 HydrophobicContact CD2-CD1 4.3Å; L432-L435 WeakPolarHBondContact O-CB 3.44Å; L432-L435 PolarHBondContact O-N 3.45Å; F433-L435 PolarHBondContact O-N 3.38Å; F433-L435 VanDerWaalsContact O-N 3.16Å; L435-Q437 PolarHBondContact O-N 3.47Å; L435-H438 WeakPolarHBondContact O-CB 3.29Å; L435-H438 PolarHBondContact O-N 2.95Å; L435-H438 PolarHBondContact O-ND1 3.21Å
436L84.9Confident83.4Confident73 Ų7348.9 Ų48.938%0.38226%0.258SS..THydrogen-bonded Turntrans-57-19.7175.6-66173.6000112.5F278 F433 S434 H438 I439F278-L436 HydrophobicContact CE2-CB 4.03Å; F433-L436 HydrophobicContact CD1-CD1 4.3Å; F433-L436 HydrophobicContact CD2-CD1 3.77Å; F433-L436 HydrophobicContact CE1-CD1 4.17Å; F433-L436 HydrophobicContact CE2-CD1 3.62Å; F433-L436 HydrophobicContact CG-CD1 4.12Å; F433-L436 HydrophobicContact CZ-CD1 3.83Å; F433-L436 VanDerWaalsContact O-CB 3.24Å; F433-L436 WeakPolarHBondContact O-CB 3.33Å; F433-L436 WeakPolarHBondContact O-CG 3.18Å; F433-L436 PolarHBondContact O-N 2.88Å; S434-L436 PolarHBondContact O-N 3.37Å; L436-H438 PolarHBondContact O-N 3.48Å; L436-H438 VanDerWaalsContact O-N 3.12Å; L436-I439 HydrophobicContact CD2-CD1 3.92Å; L436-I439 WeakPolarHBondContact O-CB 3.46Å; L436-I439 PolarHBondContact O-N 3.12Å; L436-I439 VanDerWaalsContact O-N 3.14Å
437Q80.1Confident83.1Confident9 Ų951.4 Ų51.44%0.04227%0.273CS..Hα-helixtrans-54.8-28.8172.578.4-176.9-14.400113.4A281 I282 S285 S434 L435 I439 F440 L441A281-Q437 PolarHBondContact O-OE1 2.95Å; I282-Q437 HydrophobicContact CG1-CB 3.85Å; I282-Q437 VanDerWaalsContact N-OE1 3.13Å; S285-Q437 PolarHBondContact OG-OE1 3.33Å; S285-Q437 VanDerWaalsContact OG-OE1 3.11Å; S434-Q437 VanDerWaalsContact O-CB 3.23Å; S434-Q437 WeakPolarHBondContact O-CB 3.35Å; S434-Q437 WeakPolarHBondContact O-CG 3.42Å; S434-Q437 PolarHBondContact O-N 3.25Å; L435-Q437 PolarHBondContact O-N 3.47Å; Q437-I439 PolarHBondContact O-N 3.1Å; Q437-F440 WeakPolarHBondContact O-CB 3.36Å; Q437-F440 PolarHBondContact O-N 3.27Å; Q437-L441 PolarHBondContact O-N 2.99Å
438H76.6Confident82.7Confident62 Ų6250.7 Ų50.729%0.28727%0.268SS..Hα-helixtrans-63.3-30.3-178.3-72.271000112N74 L435 L436 F440 L441N74-H438 PolarHBondContact ND2-NE2 3.02Å; L435-H438 WeakPolarHBondContact O-CB 3.29Å; L435-H438 PolarHBondContact O-N 2.95Å; L435-H438 PolarHBondContact O-ND1 3.21Å; L436-H438 PolarHBondContact O-N 3.48Å; L436-H438 VanDerWaalsContact O-N 3.12Å; H438-F440 PolarHBondContact O-N 2.86Å; H438-L441 HydrophobicContact CB-CD1 4.27Å; H438-L441 VanDerWaalsContact O-CB 3.31Å; H438-L441 WeakPolarHBondContact O-CB 3.27Å; H438-L441 PolarHBondContact O-N 3.07Å; H438-L441 VanDerWaalsContact O-N 3.11Å
439I80.5Confident82.5Confident106 Ų10650.6 Ų50.654%0.54427%0.266SS..Hα-helixtrans-60.8-37175.2-58172.9000109.8L436 Q437 L441 T443L436-I439 HydrophobicContact CD2-CD1 3.92Å; L436-I439 WeakPolarHBondContact O-CB 3.46Å; L436-I439 PolarHBondContact O-N 3.12Å; L436-I439 VanDerWaalsContact O-N 3.14Å; Q437-I439 PolarHBondContact O-N 3.1Å; I439-L441 VanDerWaalsContact C-N 3.3Å; I439-L441 PolarHBondContact O-N 3.32Å; I439-T443 PolarHBondContact O-OG1 3.42Å
440F73.8Confident82.4Confident40 Ų4050 Ų5018%0.17527%0.27CS..Hα-helixtrans-79.9-10.2-179.5-57.3-73000113.4F278 Q286 Q437 H438 H442 T443 A448 V451F278-F440 HydrophobicContact CE2-CE2 4.4Å; F278-F440 HydrophobicContact CZ-CD2 4.37Å; F278-F440 AromaticContact CZ-CE2 3.84Å; F278-F440 HydrophobicContact CZ-CE2 3.84Å; Q286-F440 PolarHBondContact NE2-O 3.28Å; Q437-F440 WeakPolarHBondContact O-CB 3.36Å; Q437-F440 PolarHBondContact O-N 3.27Å; H438-F440 PolarHBondContact O-N 2.86Å; F440-H442 PolarHBondContact O-N 3Å; F440-T443 PolarHBondContact O-N 3.07Å; F440-T443 VanDerWaalsContact O-N 3.14Å; F440-A448 HydrophobicContact CB-CB 4.4Å; F440-V451 HydrophobicContact CD1-CG2 4.32Å; F440-V451 HydrophobicContact CE1-CB 4.38Å; F440-V451 HydrophobicContact CE1-CG1 4.3Å; F440-V451 HydrophobicContact CE1-CG2 3.66Å; F440-V451 HydrophobicContact CE2-CG1 4.19Å; F440-V451 HydrophobicContact CZ-CB 4.47Å; F440-V451 HydrophobicContact CZ-CG1 3.91Å; F440-V451 HydrophobicContact CZ-CG2 4.01Å
441L68.2Low82.3Confident39 Ų3951.9 Ų51.920%0.20428%0.281CS..THydrogen-bonded Turntrans-67.4-10.5171.9-66.3172.4000113Q286 R289 Q437 H438 I439Q286-L441 HydrophobicContact CG-CD2 4.3Å; R289-L441 PolarHBondContact NH1-O 3.21Å; R289-L441 PolarHBondContact NH2-O 3.28Å; Q437-L441 PolarHBondContact O-N 2.99Å; H438-L441 HydrophobicContact CB-CD1 4.27Å; H438-L441 VanDerWaalsContact O-CB 3.31Å; H438-L441 WeakPolarHBondContact O-CB 3.27Å; H438-L441 PolarHBondContact O-N 3.07Å; H438-L441 VanDerWaalsContact O-N 3.11Å; I439-L441 VanDerWaalsContact C-N 3.3Å; I439-L441 PolarHBondContact O-N 3.32Å
442H72.7Confident82.5Confident178 Ų17851.9 Ų51.982%0.82428%0.28SS*.THydrogen-bonded Turntrans-108.9-0.8172.6-64.5-72.1000112.9F440F440-H442 PolarHBondContact O-N 3Å
443T76Confident82.8Confident48 Ų4849.7 Ų49.729%0.29427%0.268SS..SBendtrans-94.3163-178.3-41.60000111I439 F440 T447I439-T443 PolarHBondContact O-OG1 3.42Å; F440-T443 PolarHBondContact O-N 3.07Å; F440-T443 VanDerWaalsContact O-N 3.14Å; T443-T447 HydrophobicContact CG2-CG2 3.58Å; T443-T447 WeakPolarHBondContact CG2-OG1 3.49Å
444S78.8Confident83.1Confident61 Ų6148.6 Ų48.643%0.42727%0.274SS..  trans-59.7148.2172.279.40000111.7T446 T447 A448S444-T446 PolarHBondContact O-N 3.43Å; S444-T446 PolarHBondContact OG-OG1 2.92Å; S444-T447 PolarHBondContact O-N 2.86Å; S444-T447 VanDerWaalsContact O-N 3.13Å; S444-T447 PolarHBondContact OG-N 3.32Å; S444-T447 PolarHBondContact OG-OG1 2.87Å; S444-A448 PolarHBondContact O-N 2.88Å
445G77.1Confident83.5Confident9 Ų948.8 Ų48.89%0.09328%0.276CS..Hα-helixtrans-58.9-33.1-179.800000113.2A448 N449G445-A448 PolarHBondContact O-N 3.42Å; G445-N449 PolarHBondContact O-N 3.12Å
446T83.5Confident84.1Confident67 Ų6746.1 Ų46.141%0.41126%0.262SS..Hα-helixtrans-66-38.1177.355.90000112.4S444 N449 S450S444-T446 PolarHBondContact O-N 3.43Å; S444-T446 PolarHBondContact OG-OG1 2.92Å; T446-N449 PolarHBondContact O-N 3.49Å; T446-S450 WeakPolarHBondContact O-CB 3.38Å; T446-S450 PolarHBondContact O-N 2.95Å; T446-S450 PolarHBondContact O-OG 3.34Å
447T87.2Confident84.7Confident54 Ų5446.5 Ų46.533%0.33127%0.267SS..Hα-helixtrans-65.6-43.3175.9-46.70000111.2T443 S444 N449 S450 V451T443-T447 HydrophobicContact CG2-CG2 3.58Å; T443-T447 WeakPolarHBondContact CG2-OG1 3.49Å; S444-T447 PolarHBondContact O-N 2.86Å; S444-T447 VanDerWaalsContact O-N 3.13Å; S444-T447 PolarHBondContact OG-N 3.32Å; S444-T447 PolarHBondContact OG-OG1 2.87Å; T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.09Å; T447-S450 WeakPolarHBondContact O-CB 3.26Å; T447-S450 PolarHBondContact O-N 2.94Å; T447-V451 WeakPolarHBondContact O-CG2 3.35Å; T447-V451 PolarHBondContact O-N 3.2Å
448A84.4Confident85.4Confident0 Ų047.9 Ų47.90%028%0.278CS..Hα-helixtrans-65.8-37177.900000112.6I282 F440 S444 G445 S450 V451 S452I282-A448 HydrophobicContact CG2-CB 4.49Å; F440-A448 HydrophobicContact CB-CB 4.4Å; S444-A448 PolarHBondContact O-N 2.88Å; G445-A448 PolarHBondContact O-N 3.42Å; A448-S450 VanDerWaalsContact C-N 3.35Å; A448-V451 PolarHBondContact O-N 3.22Å; A448-S452 WeakPolarHBondContact O-CB 3.4Å; A448-S452 PolarHBondContact O-N 2.82Å; A448-S452 PolarHBondContact O-OG 3.34Å
449N87.8Confident86.4Confident10 Ų1045 Ų455%0.05327%0.265CS..Hα-helixtrans-64.5-39.3172-73.1-15.1000111.9Q290 M380 F381 G445 T446 T447 S452 M453Q290-N449 PolarHBondContact NE2-OD1 3.25Å; M380-N449 PolarHBondContact O-ND2 3Å; F381-N449 HydrophobicContact CD1-CB 4.23Å; F381-N449 HydrophobicContact CD2-CB 4.36Å; F381-N449 HydrophobicContact CE1-CB 3.65Å; F381-N449 HydrophobicContact CE2-CB 3.79Å; F381-N449 HydrophobicContact CZ-CB 3.42Å; F381-N449 VanDerWaalsContact CZ-CB 3.42Å; G445-N449 PolarHBondContact O-N 3.12Å; T446-N449 PolarHBondContact O-N 3.49Å; T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.09Å; N449-S452 PolarHBondContact O-N 3.13Å; N449-M453 WeakPolarHBondContact O-CB 3.45Å; N449-M453 PolarHBondContact O-N 3.12Å
450S91.1Very high87.1Confident63 Ų6343.6 Ų43.644%0.44126%0.255SS..Hα-helixtrans-65.4-41.6177.2-57.30000111.9T446 T447 A448 M453 A454T446-S450 WeakPolarHBondContact O-CB 3.38Å; T446-S450 PolarHBondContact O-N 2.95Å; T446-S450 PolarHBondContact O-OG 3.34Å; T447-S450 WeakPolarHBondContact O-CB 3.26Å; T447-S450 PolarHBondContact O-N 2.94Å; A448-S450 VanDerWaalsContact C-N 3.35Å; S450-M453 WeakPolarHBondContact O-CB 3.34Å; S450-M453 PolarHBondContact O-N 2.94Å; S450-A454 PolarHBondContact O-N 3.18Å
451V91.7Very high88.2Confident38 Ų3845.8 Ų45.823%0.2327%0.267CS..Hα-helixtrans-66.2-40.8174.3171.90000111.2F278 I282 F440 T447 A448 M453 A454 A455F278-V451 HydrophobicContact CE1-CG1 3.79Å; F278-V451 HydrophobicContact CZ-CG1 4.01Å; I282-V451 HydrophobicContact CD1-CG1 4.32Å; F440-V451 HydrophobicContact CD1-CG2 4.32Å; F440-V451 HydrophobicContact CE1-CB 4.38Å; F440-V451 HydrophobicContact CE1-CG1 4.3Å; F440-V451 HydrophobicContact CE1-CG2 3.66Å; F440-V451 HydrophobicContact CE2-CG1 4.19Å; F440-V451 HydrophobicContact CZ-CB 4.47Å; F440-V451 HydrophobicContact CZ-CG1 3.91Å; F440-V451 HydrophobicContact CZ-CG2 4.01Å; T447-V451 WeakPolarHBondContact O-CG2 3.35Å; T447-V451 PolarHBondContact O-N 3.2Å; A448-V451 PolarHBondContact O-N 3.22Å; V451-M453 VanDerWaalsContact C-N 3.3Å; V451-M453 PolarHBondContact O-N 3.12Å; V451-A454 PolarHBondContact O-N 2.94Å; V451-A455 WeakPolarHBondContact O-CB 3.4Å; V451-A455 PolarHBondContact O-N 3.01Å
452S91.5Very high89.5Confident1 Ų143.9 Ų43.91%0.00726%0.258CS..Hα-helixtrans-62.8-38.2174.8-62.50000112I282 S377 A448 N449 S456I282-S452 WeakPolarHBondContact CG2-OG 3.36Å; S377-S452 PolarHBondContact OG-O 3.21Å; A448-S452 WeakPolarHBondContact O-CB 3.4Å; A448-S452 PolarHBondContact O-N 2.82Å; A448-S452 PolarHBondContact O-OG 3.34Å; N449-S452 PolarHBondContact O-N 3.13Å; S452-S456 WeakPolarHBondContact O-CB 3.13Å; S452-S456 PolarHBondContact O-N 3.35Å; S452-S456 PolarHBondContact O-OG 3.39Å
453M94.4Very high90.6Very high47 Ų4735.6 Ų35.623%0.23222%0.219CC..Hα-helixtrans-64.5-47.8174.1-177.260.377.500111V374 A378 F381 N449 S450 V451 A455 S456 V457V374-M453 HydrophobicContact CG1-SD 4.12Å; A378-M453 HydrophobicContact CB-CE 3.84Å; F381-M453 HydrophobicContact CE2-CB 4.49Å; F381-M453 HydrophobicContact CE2-CE 4.22Å; N449-M453 WeakPolarHBondContact O-CB 3.45Å; N449-M453 PolarHBondContact O-N 3.12Å; S450-M453 WeakPolarHBondContact O-CB 3.34Å; S450-M453 PolarHBondContact O-N 2.94Å; V451-M453 VanDerWaalsContact C-N 3.3Å; V451-M453 PolarHBondContact O-N 3.12Å; M453-A455 VanDerWaalsContact C-N 3.33Å; M453-A455 PolarHBondContact O-N 2.93Å; M453-S456 WeakPolarHBondContact O-CB 3.41Å; M453-S456 PolarHBondContact O-N 3.48Å; M453-S456 VanDerWaalsContact O-N 3.12Å; M453-V457 WeakPolarHBondContact O-CG2 3.49Å; M453-V457 PolarHBondContact O-N 3.27Å; M453-V457 HydrophobicContact SD-CG2 4.35Å
454A95Very high91.5Very high58 Ų5839.4 Ų39.448%0.47923%0.232SC..Hα-helixtrans-60-42.3176.800000112.1S450 V451 S456 V457 S458S450-A454 PolarHBondContact O-N 3.18Å; V451-A454 PolarHBondContact O-N 2.94Å; A454-S456 VanDerWaalsContact C-N 3.35Å; A454-V457 PolarHBondContact O-N 2.69Å; A454-S458 WeakPolarHBondContact O-CB 3.35Å; A454-S458 PolarHBondContact O-N 3.47Å; A454-S458 PolarHBondContact O-OG 3.02Å
455A94.6Very high92.4Very high6 Ų637.6 Ų37.65%0.0522%0.221CC..Hα-helixtrans-61.6-43.2173.900000111.5F278 V451 M453 S458 L459F278-A455 HydrophobicContact CD1-CB 4.14Å; F278-A455 HydrophobicContact CE1-CB 4.48Å; V451-A455 WeakPolarHBondContact O-CB 3.4Å; V451-A455 PolarHBondContact O-N 3.01Å; M453-A455 VanDerWaalsContact C-N 3.33Å; M453-A455 PolarHBondContact O-N 2.93Å; A455-S458 WeakPolarHBondContact O-CB 3.49Å; A455-S458 PolarHBondContact O-N 3.12Å; A455-L459 PolarHBondContact O-N 3.23Å
456S96.1Very high93.2Very high0 Ų037.2 Ų37.20%022%0.217CC..Hα-helixtrans-64.6-41.3179.3-59.10000112.7A373 S377 S452 M453 A454 S458 L459A373-S456 PolarHBondContact O-OG 3.19Å; S377-S456 PolarHBondContact OG-OG 2.94Å; S452-S456 WeakPolarHBondContact O-CB 3.13Å; S452-S456 PolarHBondContact O-N 3.35Å; S452-S456 PolarHBondContact O-OG 3.39Å; M453-S456 WeakPolarHBondContact O-CB 3.41Å; M453-S456 PolarHBondContact O-N 3.48Å; M453-S456 VanDerWaalsContact O-N 3.12Å; A454-S456 VanDerWaalsContact C-N 3.35Å; S456-S458 VanDerWaalsContact C-N 3.32Å; S456-L459 WeakPolarHBondContact O-CB 3.19Å; S456-L459 PolarHBondContact O-N 3.43Å
457V96.8Very high93.6Very high80 Ų8037.6 Ų37.649%0.48522%0.216SC..Hα-helixtrans-67.5-35.3174.4174.40000111.1V374 M453 A454 L459 F460V374-V457 HydrophobicContact CG2-CG2 4.19Å; M453-V457 WeakPolarHBondContact O-CG2 3.49Å; M453-V457 PolarHBondContact O-N 3.27Å; M453-V457 HydrophobicContact SD-CG2 4.35Å; A454-V457 PolarHBondContact O-N 2.69Å; V457-L459 PolarHBondContact O-N 3.26Å; V457-F460 WeakPolarHBondContact O-CD2 3.47Å; V457-F460 PolarHBondContact O-N 3.4Å
458S96.2Very high93.9Very high39 Ų3939 Ų3927%0.27322%0.22SC..Hα-helixtrans-67.4-18.9178.1-590000113.1A454 A455 S456 F460 I461A454-S458 WeakPolarHBondContact O-CB 3.35Å; A454-S458 PolarHBondContact O-N 3.47Å; A454-S458 PolarHBondContact O-OG 3.02Å; A455-S458 WeakPolarHBondContact O-CB 3.49Å; A455-S458 PolarHBondContact O-N 3.12Å; S456-S458 VanDerWaalsContact C-N 3.32Å; S458-F460 PolarHBondContact O-N 2.61Å; S458-F460 VanDerWaalsContact O-N 3.15Å; S458-I461 WeakPolarHBondContact O-CB 3.38Å; S458-I461 VanDerWaalsContact O-CG1 3.28Å; S458-I461 WeakPolarHBondContact O-CG1 3.26Å; S458-I461 PolarHBondContact O-N 3.13Å; S458-I461 VanDerWaalsContact O-N 3.09Å
459L96.4Very high94.2Very high2 Ų241.1 Ų41.11%0.0123%0.231CC..THydrogen-bonded Turntrans-61.1-21.4175.2-67.8167.8000113.2W272 L275 M369 A373 A455 S456 V457 I461 P463W272-L459 HydrophobicContact CG-CD2 4.29Å; W272-L459 WeakPolarHBondContact O-CD2 3.42Å; L275-L459 HydrophobicContact CB-CD2 3.7Å; L275-L459 HydrophobicContact CB-CG 4.42Å; M369-L459 HydrophobicContact CE-CD1 4.17Å; M369-L459 HydrophobicContact CE-CD2 4.27Å; M369-L459 HydrophobicContact SD-CD1 3.72Å; M369-L459 HydrophobicContact SD-CD2 4.47Å; A373-L459 HydrophobicContact CB-CD1 3.66Å; A455-L459 PolarHBondContact O-N 3.23Å; S456-L459 WeakPolarHBondContact O-CB 3.19Å; S456-L459 PolarHBondContact O-N 3.43Å; V457-L459 PolarHBondContact O-N 3.26Å; L459-I461 VanDerWaalsContact C-N 3.3Å; L459-I461 PolarHBondContact O-N 3.45Å; L459-P463 WeakPolarHBondContact O-CD 3.21Å
460F97Very high94.1Very high75 Ų7545.8 Ų45.833%0.32925%0.248SC..THydrogen-bonded Turntrans-76.9-13.4177.6-67.8-84.7000113.8G370 I371 V374 V457 S458 T462 P463 F464G370-F460 VanDerWaalsContact C-CZ 3.44Å; I371-F460 HydrophobicContact CG1-CE1 4.06Å; I371-F460 HydrophobicContact CG1-CZ 3.85Å; V374-F460 HydrophobicContact CG2-CE2 3.88Å; V457-F460 WeakPolarHBondContact O-CD2 3.47Å; V457-F460 PolarHBondContact O-N 3.4Å; S458-F460 PolarHBondContact O-N 2.61Å; S458-F460 VanDerWaalsContact O-N 3.15Å; F460-T462 PolarHBondContact O-N 3.36Å; F460-P463 WeakPolarHBondContact O-CD 3.47Å; F460-P463 WeakPolarHBondContact O-CG 3.42Å; F460-F464 VanDerWaalsContact O-CB 3.28Å; F460-F464 WeakPolarHBondContact O-CB 3.49Å; F460-F464 PolarHBondContact O-N 3.36Å
461I96.3Very high93.5Very high86 Ų8654 Ų5444%0.44127%0.269SS..Hα-helixtrans-60.2-47.1177.9-64.9170.3000110.5L271 S458 L459 F464 A465L271-I461 HydrophobicContact CD2-CG2 4.31Å; S458-I461 WeakPolarHBondContact O-CB 3.38Å; S458-I461 VanDerWaalsContact O-CG1 3.28Å; S458-I461 WeakPolarHBondContact O-CG1 3.26Å; S458-I461 PolarHBondContact O-N 3.13Å; S458-I461 VanDerWaalsContact O-N 3.09Å; L459-I461 VanDerWaalsContact C-N 3.3Å; L459-I461 PolarHBondContact O-N 3.45Å; I461-F464 PolarHBondContact O-N 3.21Å; I461-A465 VanDerWaalsContact O-CB 3.24Å; I461-A465 WeakPolarHBondContact O-CB 3.22Å; I461-A465 PolarHBondContact O-N 2.04Å
462T95.3Very high93.5Very high0 Ų054.8 Ų54.80%027%0.271CS..Hα-helixtrans-61.9-55.5-178.6-650000113.8L268 W272 L366 F460 F464 A465 L466L268-T462 HydrophobicContact CB-CG2 4.09Å; L268-T462 VanDerWaalsContact O-CG2 3.28Å; L268-T462 WeakPolarHBondContact O-CG2 3.41Å; L268-T462 PolarHBondContact O-OG1 3.17Å; W272-T462 HydrophobicContact CB-CG2 3.91Å; W272-T462 HydrophobicContact CG-CG2 4.43Å; L366-T462 HydrophobicContact CD1-CG2 4.09Å; F460-T462 PolarHBondContact O-N 3.36Å; T462-F464 VanDerWaalsContact C-N 3.28Å; T462-F464 PolarHBondContact O-N 3.22Å; T462-A465 PolarHBondContact O-N 3.3Å; T462-L466 HydrophobicContact CG2-CD1 4.03Å; T462-L466 HydrophobicContact CG2-CG 4.49Å; T462-L466 WeakPolarHBondContact O-CG 3.23Å; T462-L466 PolarHBondContact O-N 3.07Å
463P95.7Very high93.7Very high3 Ų357.6 Ų57.62%0.01929%0.285CS..Hα-helixtrans-60.3-37.9177.820.7-30.4000112.3V363 L366 T367 L459 F460 L466 L467V363-P463 HydrophobicContact CG1-CB 3.77Å; L366-P463 HydrophobicContact CB-CB 4.34Å; L366-P463 HydrophobicContact CB-CG 4.49Å; T367-P463 HydrophobicContact CG2-CB 3.49Å; T367-P463 VanDerWaalsContact CG2-CB 3.49Å; T367-P463 HydrophobicContact CG2-CG 3.78Å; L459-P463 WeakPolarHBondContact O-CD 3.21Å; F460-P463 WeakPolarHBondContact O-CD 3.47Å; F460-P463 WeakPolarHBondContact O-CG 3.42Å; P463-L466 PolarHBondContact O-N 3.48Å; P463-L467 WeakPolarHBondContact O-CG 3.08Å; P463-L467 PolarHBondContact O-N 3.46Å; P463-L467 VanDerWaalsContact O-N 3.12Å
464F95.7Very high93.6Very high128 Ų12858.2 Ų58.256%0.56129%0.288SS*.Hα-helixtrans-64.2-47.6175.8-177.7-99.6000112.3F460 I461 T462 L466 L467 M468F460-F464 VanDerWaalsContact O-CB 3.28Å; F460-F464 WeakPolarHBondContact O-CB 3.49Å; F460-F464 PolarHBondContact O-N 3.36Å; I461-F464 PolarHBondContact O-N 3.21Å; T462-F464 VanDerWaalsContact C-N 3.28Å; T462-F464 PolarHBondContact O-N 3.22Å; F464-L466 VanDerWaalsContact C-N 3.33Å; F464-L466 PolarHBondContact O-N 3.05Å; F464-L467 PolarHBondContact O-N 3.43Å; F464-M468 HydrophobicContact CD1-CG 4.37Å; F464-M468 HydrophobicContact CE1-CE 3.77Å; F464-M468 HydrophobicContact CE1-CG 4.09Å; F464-M468 HydrophobicContact CE2-CE 3.64Å; F464-M468 HydrophobicContact CZ-CE 3.17Å; F464-M468 HydrophobicContact CZ-CG 4.38Å; F464-M468 WeakPolarHBondContact O-CG 3.33Å; F464-M468 PolarHBondContact O-N 3.02Å
465A95.8Very high93.5Very high24 Ų2458.2 Ų58.220%0.19828%0.277CS..Hα-helixtrans-62.7-37.7177.900000112.5L268 I461 T462 M468 L469L268-A465 HydrophobicContact CD1-CB 3.79Å; L268-A465 HydrophobicContact CD2-CB 3.58Å; L268-A465 HydrophobicContact CG-CB 4.35Å; I461-A465 VanDerWaalsContact O-CB 3.24Å; I461-A465 WeakPolarHBondContact O-CB 3.22Å; I461-A465 PolarHBondContact O-N 2.04Å; T462-A465 PolarHBondContact O-N 3.3Å; A465-M468 PolarHBondContact O-N 3.42Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.43Å
466L94.4Very high93.5Very high0 Ų061.5 Ų61.50%029%0.291CS..Hα-helixtrans-64.5-40.6175.2-71.5173.4000112.4L268 I359 V363 L366 Y409 T462 P463 F464 M468 L469 R470L268-L466 HydrophobicContact CD1-CD2 3.88Å; L268-L466 HydrophobicContact CD1-CG 4.2Å; I359-L466 HydrophobicContact CG2-CD2 4.29Å; V363-L466 HydrophobicContact CG2-CB 3.99Å; V363-L466 HydrophobicContact CG2-CD1 4.22Å; L366-L466 HydrophobicContact CD1-CD1 3.91Å; Y409-L466 HydrophobicContact CE2-CD1 3.83Å; Y409-L466 WeakPolarHBondContact OH-CD2 3.48Å; T462-L466 HydrophobicContact CG2-CD1 4.03Å; T462-L466 HydrophobicContact CG2-CG 4.49Å; T462-L466 WeakPolarHBondContact O-CG 3.23Å; T462-L466 PolarHBondContact O-N 3.07Å; P463-L466 PolarHBondContact O-N 3.48Å; F464-L466 VanDerWaalsContact C-N 3.33Å; F464-L466 PolarHBondContact O-N 3.05Å; L466-M468 VanDerWaalsContact C-N 3.29Å; L466-M468 PolarHBondContact O-N 3.11Å; L466-L469 PolarHBondContact O-N 3.05Å; L466-R470 PolarHBondContact O-N 3.37Å
467L93.3Very high93.3Very high75 Ų7565.6 Ų65.639%0.39331%0.31SS..Hα-helixtrans-65-33.6174.1-70.2173.3000112.4V363 P463 F464V363-L467 HydrophobicContact CG1-CD1 4.09Å; V363-L467 HydrophobicContact CG1-CD2 4.26Å; V363-L467 HydrophobicContact CG1-CG 4.07Å; V363-L467 HydrophobicContact CG2-CD2 4.46Å; V363-L467 HydrophobicContact CG2-CG 4.44Å; P463-L467 WeakPolarHBondContact O-CG 3.08Å; P463-L467 PolarHBondContact O-N 3.46Å; P463-L467 VanDerWaalsContact O-N 3.12Å; F464-L467 PolarHBondContact O-N 3.43Å
468M92.8Very high93Very high85 Ų8564.6 Ų64.642%0.41930%0.298SS..Hα-helixtrans-71-38.1174.2-70.2-62.1-177.800112.4F464 A465 L466 R470 R471F464-M468 HydrophobicContact CD1-CG 4.37Å; F464-M468 HydrophobicContact CE1-CE 3.77Å; F464-M468 HydrophobicContact CE1-CG 4.09Å; F464-M468 HydrophobicContact CE2-CE 3.64Å; F464-M468 HydrophobicContact CZ-CE 3.17Å; F464-M468 HydrophobicContact CZ-CG 4.38Å; F464-M468 WeakPolarHBondContact O-CG 3.33Å; F464-M468 PolarHBondContact O-N 3.02Å; A465-M468 PolarHBondContact O-N 3.42Å; L466-M468 VanDerWaalsContact C-N 3.29Å; L466-M468 PolarHBondContact O-N 3.11Å; M468-R470 PolarHBondContact O-N 2.88Å; M468-R471 WeakPolarHBondContact O-CB 3.02Å; M468-R471 PolarHBondContact O-N 3.13Å
469L90.4Very high92.8Very high43 Ų4366.5 Ų66.523%0.22530%0.3CS..Hα-helixtrans-70.6-19.8177.8-73.4171000114.2A264 L268 Y356 A465 L466 R471A264-L469 HydrophobicContact CB-CD1 4.45Å; L268-L469 HydrophobicContact CD1-CD1 3.58Å; Y356-L469 HydrophobicContact CD1-CB 3.8Å; Y356-L469 WeakPolarHBondContact CD2-O 3.21Å; Y356-L469 HydrophobicContact CE1-CB 3.5Å; Y356-L469 HydrophobicContact CE1-CD1 3.76Å; Y356-L469 HydrophobicContact CE1-CG 4.21Å; Y356-L469 HydrophobicContact CE2-CB 4.4Å; Y356-L469 HydrophobicContact CG-CB 4.37Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.43Å; L466-L469 PolarHBondContact O-N 3.05Å; L469-R471 VanDerWaalsContact C-N 3.35Å
470R85.9Confident92.5Very high108 Ų10871.9 Ų71.941%0.40832%0.324SS..Hα-helixtrans-71-30.3172.4177.3-176.9170.6-139.8-10.4112.4N357 L466 M468N357-R470 PolarHBondContact OD1-NE 2.76Å; N357-R470 PolarHBondContact OD1-NH2 3.32Å; L466-R470 PolarHBondContact O-N 3.37Å; M468-R470 PolarHBondContact O-N 2.88Å
471R77.6Confident92.1Very high236 Ų23671.6 Ų71.689%0.89132%0.323SS*.  trans-74.40170-61.1-179178-176.6-1.5109.2M468 L469M468-R471 WeakPolarHBondContact O-CB 3.02Å; M468-R471 PolarHBondContact O-N 3.13Å; L469-R471 VanDerWaalsContact C-N 3.35Å

Retrieved 471 of 471 residues in 691.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).