G4VMU1_SCHMA Loading...

Translocation protein SEC62

AlphaFold DB , UniProt , Accession G4VMU1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 374 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53.4Low53.7Low229 Ų229166.3 Ų166.3100%1.12879%0.792SS**  0-16.50-89.3-146-128.400115.2
2S61.5Low52.5Low105 Ų105155.9 Ų155.973%0.73476%0.762SS**Hα-helixtrans-74.3-32-173.8-1570000114.6K5 R6S2-K5 PolarHBondContact O-N 3.24Å; S2-R6 PolarHBondContact O-N 3.35Å
3E59Low51.7Low168 Ų168154.5 Ų154.579%0.78577%0.767SS**Hα-helixtrans-77-34.4-174.2-63.9-173.3133.800114.2K5 R6 K7E3-K5 VanDerWaalsContact C-N 3.27Å; E3-K5 PolarHBondContact O-N 3.41Å; E3-R6 PolarHBondContact O-N 3.42Å; E3-K7 PolarHBondContact O-N 3.15Å; E3-K7 VanDerWaalsContact O-N 3.14Å
4K56Low51.1Low177 Ų177158.5 Ų158.577%0.7778%0.778SS**Hα-helixtrans-64.8-32.1175.3-82-175.1174.6-178.80112.1Q8K4-Q8 PolarHBondContact O-N 3.06Å
5K52.8Low50.5Low157 Ų157158.8 Ų158.868%0.68378%0.783SS**Hα-helixtrans-73.3-29.3176.4-132.5175.2-176-1790112.4S2 E3 R9S2-K5 PolarHBondContact O-N 3.24Å; E3-K5 VanDerWaalsContact C-N 3.27Å; E3-K5 PolarHBondContact O-N 3.41Å; K5-R9 WeakPolarHBondContact O-CG 3.09Å; K5-R9 PolarHBondContact O-N 2.96Å
6R55.3Low50.1Low208 Ų208157.7 Ų157.779%0.78578%0.781SS**Hα-helixtrans-76.6-34.8176.2-151.2176.4-176.3-177.51.1112.2S2 E3 L10S2-R6 PolarHBondContact O-N 3.35Å; E3-R6 PolarHBondContact O-N 3.42Å; R6-L10 PolarHBondContact O-N 2.81Å
7K50.1Low50.4Low168 Ų168157.9 Ų157.973%0.7378%0.78SS**Hα-helixtrans-70.6-34.7172.8-87.9-175.6173-177.40113.4E3 L10 A11E3-K7 PolarHBondContact O-N 3.15Å; E3-K7 VanDerWaalsContact O-N 3.14Å; K7-L10 PolarHBondContact O-N 3.48Å; K7-A11 WeakPolarHBondContact O-CB 3.26Å; K7-A11 PolarHBondContact O-N 3.34Å
8Q52.3Low51Low149 Ų149154.8 Ų154.870%0.69677%0.767SS**Hα-helixtrans-69.9-30.1174.4-82.5176.6-7.900113.5K4 L10 A11 G12K4-Q8 PolarHBondContact O-N 3.06Å; Q8-L10 VanDerWaalsContact C-N 3.27Å; Q8-L10 PolarHBondContact O-N 2.77Å; Q8-A11 PolarHBondContact O-N 3.33Å; Q8-G12 PolarHBondContact O-N 3.28Å
9R48.1Very low51.9Low218 Ų218152.6 Ų152.682%0.82377%0.765SS**Hα-helixtrans-73.8-16.4172.2-66.7179.590.1-178.57.1113.7K5K5-R9 WeakPolarHBondContact O-CG 3.09Å; K5-R9 PolarHBondContact O-N 2.96Å
10L51.1Low52.9Low161 Ų161150.6 Ų150.684%0.84376%0.756SS**Hα-helixtrans-92.1-17.4174.5-13578.6000112.6R6 K7 Q8R6-L10 PolarHBondContact O-N 2.81Å; K7-L10 PolarHBondContact O-N 3.48Å; Q8-L10 VanDerWaalsContact C-N 3.27Å; Q8-L10 PolarHBondContact O-N 2.77Å
11A50.6Low54.4Low89 Ų89150.9 Ų150.974%0.73675%0.753SS**Hα-helixtrans-103.4-9.4-176.300000114.1K7 Q8K7-A11 WeakPolarHBondContact O-CB 3.26Å; K7-A11 PolarHBondContact O-N 3.34Å; Q8-A11 PolarHBondContact O-N 3.33Å
12G40Very low55.8Low42 Ų42141.6 Ų141.643%0.43371%0.71SS.*SBendtrans-101.3130.2173.300000111.3Q8Q8-G12 PolarHBondContact O-N 3.28Å
13V42.2Very low57.2Low137 Ų137138.8 Ų138.883%0.8369%0.688SS**  trans83.867.1163.1-157.60000116.2
14K42.8Very low58.6Low211 Ų211136.9 Ų136.992%0.91768%0.683SS**  trans-119.665.4147.8-84.4-170.8178-177.20108.4
15L42.9Very low60.2Low163 Ų163133.7 Ų133.785%0.85367%0.67SS**  trans-150.263175.8-104.3163.8000107.5
16D43Very low62Low141 Ų141127 Ų12775%0.75464%0.642SS**  trans-149.564155.7-141.1-0.4000105.5N18D16-N18 PolarHBondContact O-N 2.95Å
17E55Low63.7Low161 Ų161119.1 Ų119.175%0.75261%0.614SS**  trans-66.190.5170.4-80.6-161.9122.800106.9P19E17-P19 WeakPolarHBondContact O-CD 3.34Å
18N62.1Low65.6Low102 Ų102115 Ų11555%0.54560%0.6SS.*  trans-46.8116.6165-76.9-77.5000106.6D16 L20 K21D16-N18 PolarHBondContact O-N 2.95Å; N18-L20 PolarHBondContact O-N 3.18Å; N18-K21 PolarHBondContact O-N 3.31Å
19P67.2Low67.5Low114 Ų114107.9 Ų107.974%0.7457%0.567SS**THydrogen-bonded Turntrans-61.3-12.3-170.522-33.6000113.2E17E17-P19 WeakPolarHBondContact O-CD 3.34Å
20L73Confident69.6Low112 Ų11297.5 Ų97.559%0.58653%0.528SS*.THydrogen-bonded Turntrans-83.9-15.8176.3-71.1144.1000113.9N18N18-L20 PolarHBondContact O-N 3.18Å
21K83.8Confident71.4Confident156 Ų15691.2 Ų91.268%0.67850%0.495SS*.SBendtrans-82.6124.9-177.3-166.7168.8-176.3177.80110.1N18N18-K21 PolarHBondContact O-N 3.31Å
22P83.9Confident73.3Confident35 Ų3589 Ų8923%0.22747%0.468CS..PPolyproline II helixtrans-70.9142.7178.529-33.7000111.4E26 I27 K94 M96P22-E26 VanDerWaalsContact CA-OE2 3.25Å; P22-E26 WeakPolarHBondContact CA-OE2 3.44Å; P22-E26 HydrophobicContact CB-CB 4.37Å; P22-I27 HydrophobicContact CB-CD1 4.42Å; P22-I27 HydrophobicContact CB-CG1 3.88Å; P22-I27 HydrophobicContact CG-CD1 4.07Å; P22-I27 HydrophobicContact CG-CG1 3.83Å; P22-K94 HydrophobicContact CB-CD 4.23Å; P22-M96 HydrophobicContact CB-SD 4.28Å
23T89.8Confident75.8Confident46 Ų4687 Ų8728%0.28245%0.448SS..PPolyproline II helixtrans-71.9161.5176.367.60000109.7E25 E26 I27T23-E25 PolarHBondContact O-N 2.73Å; T23-E26 PolarHBondContact N-OE2 3.19Å; T23-E26 PolarHBondContact O-N 2.96Å; T23-E26 WeakPolarHBondContact OG1-CB 3.22Å; T23-E26 VanDerWaalsContact OG1-CD 3.24Å; T23-E26 WeakPolarHBondContact OG1-CG 3.34Å; T23-E26 PolarHBondContact OG1-N 3.27Å; T23-E26 PolarHBondContact OG1-OE2 3.32Å; T23-I27 VanDerWaalsContact O-CG1 3.28Å; T23-I27 WeakPolarHBondContact O-CG1 3.19Å; T23-I27 PolarHBondContact O-N 3.37Å
24L88.9Confident78.1Confident128 Ų12882.3 Ų82.367%0.6742%0.417SS*.Hα-helixtrans-59.6-38.9179.1-175.562.7000111.7I27 D28L24-I27 PolarHBondContact O-N 3.19Å; L24-D28 PolarHBondContact O-N 2.98Å
25E89.1Confident80.2Confident109 Ų10980.2 Ų80.251%0.50941%0.407SS..Hα-helixtrans-64.9-42.5177.3-61-175.6171.200111.9T23 I27 D28 V29T23-E25 PolarHBondContact O-N 2.73Å; E25-I27 VanDerWaalsContact C-N 3.35Å; E25-I27 PolarHBondContact O-N 3.26Å; E25-D28 PolarHBondContact O-N 3.2Å; E25-V29 VanDerWaalsContact O-CG2 3.3Å; E25-V29 WeakPolarHBondContact O-CG2 3.45Å; E25-V29 PolarHBondContact O-N 3.32Å
26E91.2Very high82.5Confident17 Ų1778.3 Ų78.38%0.07939%0.392CS..Hα-helixtrans-64.5-39.5176.1-73.7166.1175.400112.7P22 T23 D28 V29 A30 F87 L91 K94P22-E26 VanDerWaalsContact CA-OE2 3.25Å; P22-E26 WeakPolarHBondContact CA-OE2 3.44Å; P22-E26 HydrophobicContact CB-CB 4.37Å; T23-E26 PolarHBondContact N-OE2 3.19Å; T23-E26 PolarHBondContact O-N 2.96Å; T23-E26 WeakPolarHBondContact OG1-CB 3.22Å; T23-E26 VanDerWaalsContact OG1-CD 3.24Å; T23-E26 WeakPolarHBondContact OG1-CG 3.34Å; T23-E26 PolarHBondContact OG1-N 3.27Å; T23-E26 PolarHBondContact OG1-OE2 3.32Å; E26-D28 VanDerWaalsContact C-N 3.34Å; E26-V29 PolarHBondContact O-N 3.01Å; E26-A30 VanDerWaalsContact O-CB 3.29Å; E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 3.16Å; E26-F87 HydrophobicContact CB-CZ 4.4Å; E26-F87 HydrophobicContact CG-CE2 3.77Å; E26-F87 HydrophobicContact CG-CZ 3.95Å; E26-L91 HydrophobicContact CB-CD2 3.73Å; E26-L91 HydrophobicContact CG-CD2 3.97Å; E26-K94 IonicContact OE1-NZ 3.73Å; E26-K94 PolarHBondContact OE1-NZ 3.04Å; E26-K94 WeakPolarHBondContact OE2-CD 3.44Å; E26-K94 WeakPolarHBondContact OE2-CE 3.31Å; E26-K94 IonicContact OE2-NZ 3.8Å; E26-K94 PolarHBondContact OE2-NZ 2.88Å
27I91.1Very high84.7Confident42 Ų4272 Ų7222%0.21536%0.358CS..Hα-helixtrans-62.5-43.6174.8-68.3166.2000110.2P22 T23 L24 E25 A30 N31 Y202P22-I27 HydrophobicContact CB-CD1 4.42Å; P22-I27 HydrophobicContact CB-CG1 3.88Å; P22-I27 HydrophobicContact CG-CD1 4.07Å; P22-I27 HydrophobicContact CG-CG1 3.83Å; T23-I27 VanDerWaalsContact O-CG1 3.28Å; T23-I27 WeakPolarHBondContact O-CG1 3.19Å; T23-I27 PolarHBondContact O-N 3.37Å; L24-I27 PolarHBondContact O-N 3.19Å; E25-I27 VanDerWaalsContact C-N 3.35Å; E25-I27 PolarHBondContact O-N 3.26Å; I27-A30 PolarHBondContact O-N 3.13Å; I27-N31 WeakPolarHBondContact CG2-ND2 3.09Å; I27-N31 WeakPolarHBondContact O-CB 3.29Å; I27-N31 PolarHBondContact O-N 3.37Å; I27-N31 PolarHBondContact O-ND2 3.48Å; I27-N31 VanDerWaalsContact O-ND2 3.15Å; I27-Y202 WeakPolarHBondContact CG2-OH 3.49Å
28D90.5Very high86.2Confident81 Ų8167.2 Ų67.243%0.43334%0.341SS..Hα-helixtrans-63.6-42.4178.3-75.8-15.2000111.9L24 E25 E26 N31 Y32 W66L24-D28 PolarHBondContact O-N 2.98Å; E25-D28 PolarHBondContact O-N 3.2Å; E26-D28 VanDerWaalsContact C-N 3.34Å; D28-N31 PolarHBondContact O-N 2.66Å; D28-Y32 WeakPolarHBondContact O-CB 3.45Å; D28-Y32 PolarHBondContact O-N 2.94Å; D28-W66 HydrophobicContact CB-CZ2 4.3Å
29V91.2Very high87.3Confident0 Ų064.4 Ų64.40%033%0.33CS..Hα-helixtrans-64.9-43174.6-178.70000111.3E25 E26 N31 Y32 L33 L61 W66 F78 F87E25-V29 VanDerWaalsContact O-CG2 3.3Å; E25-V29 WeakPolarHBondContact O-CG2 3.45Å; E25-V29 PolarHBondContact O-N 3.32Å; E26-V29 PolarHBondContact O-N 3.01Å; V29-N31 PolarHBondContact O-N 2.76Å; V29-Y32 WeakPolarHBondContact O-CB 3.04Å; V29-Y32 PolarHBondContact O-N 2.7Å; V29-L33 HydrophobicContact CG1-CD1 4.16Å; V29-L33 HydrophobicContact CG1-CG 4.47Å; V29-L33 WeakPolarHBondContact O-CG 3.45Å; V29-L33 PolarHBondContact O-N 3.29Å; V29-L61 HydrophobicContact CG1-CD2 3.38Å; V29-W66 VanDerWaalsContact CA-CH2 3.45Å; V29-W66 HydrophobicContact CB-CH2 4.07Å; V29-W66 HydrophobicContact CB-CZ2 4.35Å; V29-W66 HydrophobicContact CB-CZ3 4.15Å; V29-W66 HydrophobicContact CG1-CE3 4.33Å; V29-W66 HydrophobicContact CG1-CH2 4.5Å; V29-W66 HydrophobicContact CG1-CZ3 4.09Å; V29-W66 HydrophobicContact CG2-CD2 3.8Å; V29-W66 HydrophobicContact CG2-CE3 3.87Å; V29-W66 HydrophobicContact CG2-CH2 3.72Å; V29-W66 HydrophobicContact CG2-CZ2 3.56Å; V29-W66 HydrophobicContact CG2-CZ3 3.85Å; V29-F78 HydrophobicContact CG1-CE2 4.5Å; V29-F78 HydrophobicContact CG1-CZ 4.42Å; V29-F87 HydrophobicContact CB-CE1 3.84Å; V29-F87 HydrophobicContact CB-CZ 3.79Å; V29-F87 HydrophobicContact CG1-CD1 4.45Å; V29-F87 HydrophobicContact CG1-CE1 3.45Å; V29-F87 VanDerWaalsContact CG1-CE1 3.45Å; V29-F87 HydrophobicContact CG1-CZ 3.94Å; V29-F87 HydrophobicContact CG2-CE1 4.22Å; V29-F87 HydrophobicContact CG2-CZ 3.86Å
30A91.5Very high88.2Confident0 Ų061.5 Ų61.50%031%0.305CS..Hα-helixtrans-63.9-40.5176.500000112.3E26 I27 Y32 L33 H34 M96 Y202E26-A30 VanDerWaalsContact O-CB 3.29Å; E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 3.16Å; I27-A30 PolarHBondContact O-N 3.13Å; A30-Y32 VanDerWaalsContact C-N 3.31Å; A30-Y32 PolarHBondContact O-N 3.17Å; A30-L33 PolarHBondContact O-N 3.14Å; A30-H34 WeakPolarHBondContact O-CB 3.45Å; A30-H34 PolarHBondContact O-N 3.48Å; A30-M96 HydrophobicContact CB-CE 3.25Å; A30-M96 HydrophobicContact CB-SD 3.83Å; A30-Y202 HydrophobicContact CB-CD1 4.38Å; A30-Y202 HydrophobicContact CB-CE1 4.49Å
31N90.4Very high89Confident29 Ų2961.8 Ų61.816%0.15530%0.304CS..Hα-helixtrans-60.6-41173.7-78-34.3000111.7I27 D28 V29 K35 Y202 P204I27-N31 WeakPolarHBondContact CG2-ND2 3.09Å; I27-N31 WeakPolarHBondContact O-CB 3.29Å; I27-N31 PolarHBondContact O-N 3.37Å; I27-N31 PolarHBondContact O-ND2 3.48Å; I27-N31 VanDerWaalsContact O-ND2 3.15Å; D28-N31 PolarHBondContact O-N 2.66Å; V29-N31 PolarHBondContact O-N 2.76Å; N31-K35 WeakPolarHBondContact O-CG 2.89Å; N31-K35 PolarHBondContact O-N 3.14Å; N31-Y202 WeakPolarHBondContact OD1-CE1 3.37Å; N31-Y202 PolarHBondContact OD1-OH 2.82Å; N31-P204 WeakPolarHBondContact OD1-CB 3.34Å
32Y90.8Very high89.2Confident43 Ų4354.4 Ų54.417%0.16927%0.272CS..Hα-helixtrans-64.5-46.5175.8178.7-94.5000111.8D28 V29 A30 K35 K36 L60 W66D28-Y32 WeakPolarHBondContact O-CB 3.45Å; D28-Y32 PolarHBondContact O-N 2.94Å; V29-Y32 WeakPolarHBondContact O-CB 3.04Å; V29-Y32 PolarHBondContact O-N 2.7Å; A30-Y32 VanDerWaalsContact C-N 3.31Å; A30-Y32 PolarHBondContact O-N 3.17Å; Y32-K35 PolarHBondContact O-N 3.16Å; Y32-K36 HydrophobicContact CD2-CD 4.24Å; Y32-K36 HydrophobicContact CE1-CD 4.14Å; Y32-K36 HydrophobicContact CE2-CD 3.56Å; Y32-K36 HydrophobicContact CE2-CG 4.43Å; Y32-K36 VanDerWaalsContact CE2-NZ 3.29Å; Y32-K36 VanDerWaalsContact CZ-CD 3.48Å; Y32-K36 PolarHBondContact O-N 3.25Å; Y32-K36 VanDerWaalsContact O-N 3.08Å; Y32-K36 WeakPolarHBondContact OH-CD 3.28Å; Y32-K36 PolarHBondContact OH-NZ 3.34Å; Y32-L60 HydrophobicContact CE1-CD2 4.19Å; Y32-L60 HydrophobicContact CE1-CG 4.02Å; Y32-W66 HydrophobicContact CD1-CH2 4.46Å; Y32-W66 AromaticContact CD1-CZ3 3.69Å; Y32-W66 HydrophobicContact CD1-CZ3 3.69Å; Y32-W66 HydrophobicContact CD2-CH2 4.44Å; Y32-W66 HydrophobicContact CD2-CZ3 4.24Å; Y32-W66 HydrophobicContact CE1-CZ3 4.34Å; Y32-W66 AromaticContact CG-CH2 3.97Å; Y32-W66 HydrophobicContact CG-CH2 3.97Å; Y32-W66 AromaticContact CG-CZ3 3.63Å; Y32-W66 HydrophobicContact CG-CZ3 3.63Å
33L92Very high89.4Confident0 Ų058.1 Ų58.10%028%0.281CS..Hα-helixtrans-59-48.9175.9-74.1169.4000111.2V29 A30 K35 K36 L37 A57 L60 L61 M88 L91 W200V29-L33 HydrophobicContact CG1-CD1 4.16Å; V29-L33 HydrophobicContact CG1-CG 4.47Å; V29-L33 WeakPolarHBondContact O-CG 3.45Å; V29-L33 PolarHBondContact O-N 3.29Å; A30-L33 PolarHBondContact O-N 3.14Å; L33-K35 VanDerWaalsContact C-N 3.27Å; L33-K35 PolarHBondContact O-N 3.06Å; L33-K36 PolarHBondContact O-N 3.5Å; L33-L37 HydrophobicContact CB-CD1 3.8Å; L33-L37 HydrophobicContact CD2-CD1 3.67Å; L33-L37 HydrophobicContact CD2-CG 4.24Å; L33-L37 HydrophobicContact CG-CD1 4.32Å; L33-L37 WeakPolarHBondContact O-CB 3.24Å; L33-L37 WeakPolarHBondContact O-CD1 3.43Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.45Å; L33-L37 PolarHBondContact O-N 2.89Å; L33-A57 HydrophobicContact CD2-CB 4.41Å; L33-L60 HydrophobicContact CD2-CD2 4.1Å; L33-L61 HydrophobicContact CD1-CD2 4.13Å; L33-L61 HydrophobicContact CD2-CD2 3.92Å; L33-L61 HydrophobicContact CD2-CG 3.99Å; L33-L61 HydrophobicContact CG-CD2 4.13Å; L33-M88 HydrophobicContact CD1-SD 3.95Å; L33-L91 HydrophobicContact CD1-CD1 4.22Å; L33-W200 HydrophobicContact CB-CH2 3.77Å; L33-W200 HydrophobicContact CB-CZ2 4.08Å; L33-W200 HydrophobicContact CD1-CH2 4.42Å
34H89.5Confident89.3Confident39 Ų3956.9 Ų56.918%0.18127%0.272CS..Hα-helixtrans-61.1-34-179-173.2-81.5000112.9A30A30-H34 WeakPolarHBondContact O-CB 3.45Å; A30-H34 PolarHBondContact O-N 3.48Å
35K88Confident89.1Confident166 Ų16656.1 Ų56.172%0.72228%0.278SS*.Hα-helixtrans-80.7-36.7-179.3-73.4176.2-177.8176.60113.7N31 Y32 L33N31-K35 WeakPolarHBondContact O-CG 2.89Å; N31-K35 PolarHBondContact O-N 3.14Å; Y32-K35 PolarHBondContact O-N 3.16Å; L33-K35 VanDerWaalsContact C-N 3.27Å; L33-K35 PolarHBondContact O-N 3.06Å
36K90.6Very high88.9Confident123 Ų12353 Ų5354%0.53528%0.275SS..Hα-helixtrans-101.6-21.8-170.9-72-160.9-174.4-173.10114.5Y32 L33 L60Y32-K36 HydrophobicContact CD2-CD 4.24Å; Y32-K36 HydrophobicContact CE1-CD 4.14Å; Y32-K36 HydrophobicContact CE2-CD 3.56Å; Y32-K36 HydrophobicContact CE2-CG 4.43Å; Y32-K36 VanDerWaalsContact CE2-NZ 3.29Å; Y32-K36 VanDerWaalsContact CZ-CD 3.48Å; Y32-K36 PolarHBondContact O-N 3.25Å; Y32-K36 VanDerWaalsContact O-N 3.08Å; Y32-K36 WeakPolarHBondContact OH-CD 3.28Å; Y32-K36 PolarHBondContact OH-NZ 3.34Å; L33-K36 PolarHBondContact O-N 3.5Å; K36-L60 HydrophobicContact CB-CD1 4.29Å; K36-L60 HydrophobicContact CB-CD2 3.68Å
37L89.3Confident88.7Confident9 Ų958.7 Ų58.75%0.04730%0.303CS..SBendtrans-69.9139.2179.1-76.4165.4000111.6L33 S39 F52 E56 A57 L60 W200L33-L37 HydrophobicContact CB-CD1 3.8Å; L33-L37 HydrophobicContact CD2-CD1 3.67Å; L33-L37 HydrophobicContact CD2-CG 4.24Å; L33-L37 HydrophobicContact CG-CD1 4.32Å; L33-L37 WeakPolarHBondContact O-CB 3.24Å; L33-L37 WeakPolarHBondContact O-CD1 3.43Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.45Å; L33-L37 PolarHBondContact O-N 2.89Å; L37-S39 PolarHBondContact O-N 3.01Å; L37-F52 HydrophobicContact CD1-CD2 4.29Å; L37-E56 HydrophobicContact CD2-CB 4.21Å; L37-A57 HydrophobicContact CD1-CB 3.97Å; L37-A57 HydrophobicContact CD2-CB 4.27Å; L37-L60 HydrophobicContact CD2-CB 4.15Å; L37-L60 HydrophobicContact CD2-CD2 3.76Å; L37-L60 HydrophobicContact CG-CD2 3.65Å; L37-W200 HydrophobicContact CD1-CZ2 3.76Å
38P86.8Confident88.7Confident60 Ų6062.1 Ų62.139%0.3932%0.321SS..  trans-66.5101.2170.429.7-33.2000108.6E56P38-E56 VanDerWaalsContact CG-OE2 3.28Å; P38-E56 WeakPolarHBondContact CG-OE2 3.46Å
39S85.8Confident88.7Confident43 Ų4359.5 Ų59.530%0.30131%0.307SS..  trans-90.8139.517655.90000111.1L37 R50 I51L37-S39 PolarHBondContact O-N 3.01Å; S39-R50 PolarHBondContact OG-NH1 3.05Å; S39-I51 WeakPolarHBondContact CA-O 3.34Å
40K86Confident88.7Confident53 Ų5365.2 Ų65.223%0.2333%0.329CS..EExtended strand (participates in β ladder)trans-108.4152.5167.5-81-172.3-176.71440111.4R50 I51 E168 F169K40-R50 CarbonylContact O-C 3.56Å; K40-R50 WeakPolarHBondContact O-CA 3.23Å; K40-I51 PolarHBondContact N-O 2.93Å; K40-I51 PolarHBondContact O-N 3.45Å; K40-E168 WeakPolarHBondContact CE-O 3.34Å; K40-E168 PolarHBondContact NZ-O 3.34Å; K40-F169 HydrophobicContact CB-CE1 4.05Å; K40-F169 HydrophobicContact CB-CZ 4.18Å; K40-F169 HydrophobicContact CD-CD1 4.16Å; K40-F169 HydrophobicContact CD-CD2 4.25Å; K40-F169 HydrophobicContact CD-CE1 3.93Å; K40-F169 HydrophobicContact CD-CE2 3.97Å; K40-F169 HydrophobicContact CD-CG 4.31Å; K40-F169 HydrophobicContact CD-CZ 3.83Å; K40-F169 VanDerWaalsContact CE-CA 3.47Å; K40-F169 HydrophobicContact CG-CD1 4.03Å; K40-F169 HydrophobicContact CG-CE1 3.75Å; K40-F169 HydrophobicContact CG-CZ 4.09Å; K40-F169 VanDerWaalsContact NZ-CG 3.34Å
41E89.1Confident88.7Confident119 Ų11965.4 Ų65.456%0.55633%0.33SS*.EExtended strand (participates in β ladder)trans-83.3131.6168.8-65.3178.6-169.600110.6I48 V49E41-I48 HydrophobicContact CB-CG2 4.09Å; E41-I48 HydrophobicContact CG-CG2 4.24Å; E41-V49 WeakPolarHBondContact CA-O 3.28Å
42G87.7Confident88.8Confident0 Ų064 Ų640%032%0.323CS..EExtended strand (participates in β ladder)trans-138.8177.4164.700000111.2I48 V49 I51 M179G42-I48 CarbonylContact O-C 3.55Å; G42-I48 WeakPolarHBondContact O-CA 3.38Å; G42-V49 PolarHBondContact N-O 3.19Å; G42-V49 PolarHBondContact O-N 3.45Å; G42-I51 VanDerWaalsContact N-CD1 3.35Å; G42-M179 CarbonylContact C-O 3.56Å; G42-M179 WeakPolarHBondContact CA-O 3.46Å
43R88.1Confident88.9Confident114 Ų11463.2 Ų63.243%0.4332%0.322SS..EExtended strand (participates in β ladder)trans-116.5109.9-171.4-163.6175.5-171.6-174.5-3109.1G46 M47 P178 M179 R180 L181R43-G46 PolarHBondContact NE-O 3.26Å; R43-M47 CarbonylContact C-O 3.59Å; R43-M47 VanDerWaalsContact CA-O 3.3Å; R43-M47 WeakPolarHBondContact CA-O 3.38Å; R43-P178 HydrophobicContact CB-CB 4.33Å; R43-P178 HydrophobicContact CB-CG 4.42Å; R43-M179 PolarHBondContact N-O 3.29Å; R43-R180 WeakPolarHBondContact O-CA 3.42Å; R43-L181 PolarHBondContact O-N 3.39Å
44L87.5Confident88.9Confident19 Ų1963.4 Ų63.410%0.09932%0.324CS..EExtended strand (participates in β ladder)trans-113.5121.3176.6-173.566.5000108.2G46 M47 V49 L181 I183 V199L44-G46 PolarHBondContact O-N 3.39Å; L44-M47 PolarHBondContact N-O 3.01Å; L44-M47 PolarHBondContact O-N 3.45Å; L44-V49 HydrophobicContact CB-CG1 4.21Å; L44-V49 HydrophobicContact CB-CG2 3.74Å; L44-L181 HydrophobicContact CD1-CB 4.04Å; L44-L181 WeakPolarHBondContact CD1-O 3.12Å; L44-I183 HydrophobicContact CD1-CD1 4.49Å; L44-I183 HydrophobicContact CD1-CG1 3.69Å; L44-I183 HydrophobicContact CD2-CD1 4.18Å; L44-I183 HydrophobicContact CD2-CG1 4.01Å; L44-I183 HydrophobicContact CG-CG1 4.22Å; L44-V199 HydrophobicContact CD2-CG1 4.25Å; L44-V199 HydrophobicContact CD2-CG2 4.34Å
45S85.4Confident88.9Confident112 Ų11266.4 Ų66.478%0.78334%0.339SS*.THydrogen-bonded Turntrans50.927178.8-560000115.4
46G83.8Confident89.1Confident43 Ų4360.3 Ų60.344%0.44331%0.313SS..THydrogen-bonded Turntrans96.2-22.1-178.100000115R43 L44R43-G46 PolarHBondContact NE-O 3.26Å; L44-G46 PolarHBondContact O-N 3.39Å
47M88.1Confident89.2Confident138 Ų13854.4 Ų54.468%0.6829%0.288SS*.EExtended strand (participates in β ladder)trans-80.7146.3176-62.517767.200111.3R43 L44 V49R43-M47 CarbonylContact C-O 3.59Å; R43-M47 VanDerWaalsContact CA-O 3.3Å; R43-M47 WeakPolarHBondContact CA-O 3.38Å; L44-M47 PolarHBondContact N-O 3.01Å; L44-M47 PolarHBondContact O-N 3.45Å; M47-V49 HydrophobicContact CB-CG1 4.39Å
48I90.1Very high89.3Confident114 Ų11454.1 Ų54.159%0.58529%0.286SS*.EExtended strand (participates in β ladder)trans-86.2123.4171.7-59.9171.3000107.3E41 G42E41-I48 HydrophobicContact CB-CG2 4.09Å; E41-I48 HydrophobicContact CG-CG2 4.24Å; G42-I48 CarbonylContact O-C 3.55Å; G42-I48 WeakPolarHBondContact O-CA 3.38Å
49V91.1Very high89.5Confident25 Ų2557 Ų5715%0.15229%0.294CS..EExtended strand (participates in β ladder)trans-128.6152.1-175.8-61.60000110.8E41 G42 L44 M47 I51 V199E41-V49 WeakPolarHBondContact CA-O 3.28Å; G42-V49 PolarHBondContact N-O 3.19Å; G42-V49 PolarHBondContact O-N 3.45Å; L44-V49 HydrophobicContact CB-CG1 4.21Å; L44-V49 HydrophobicContact CB-CG2 3.74Å; M47-V49 HydrophobicContact CB-CG1 4.39Å; V49-I51 HydrophobicContact CG2-CG1 4.27Å; V49-V199 HydrophobicContact CB-CG1 3.62Å; V49-V199 HydrophobicContact CG1-CG1 4.14Å; V49-V199 HydrophobicContact CG2-CG1 3.58Å; V49-V199 HydrophobicContact CG2-CG2 4.17Å
50R91.3Very high89.8Confident120 Ų12056.5 Ų56.545%0.45329%0.288SS..EExtended strand (participates in β ladder)trans-87.5133.8175.9-68.5-178.3-177.7-86.5-6110.6S39 K40 W200S39-R50 PolarHBondContact OG-NH1 3.05Å; K40-R50 CarbonylContact O-C 3.56Å; K40-R50 WeakPolarHBondContact O-CA 3.23Å; R50-W200 HydrophobicContact CB-CB 4.48Å; R50-W200 PolarHBondContact O-N 3.45Å
51I91.9Very high90Very high5 Ų554 Ų543%0.02628%0.277CS..EExtended strand (participates in β ladder)trans-126.5142.9-171.2-59.1155.1000109.9S39 K40 G42 V49 F169 L181 F197 Y198 V199S39-I51 WeakPolarHBondContact CA-O 3.34Å; K40-I51 PolarHBondContact N-O 2.93Å; K40-I51 PolarHBondContact O-N 3.45Å; G42-I51 VanDerWaalsContact N-CD1 3.35Å; V49-I51 HydrophobicContact CG2-CG1 4.27Å; I51-F169 HydrophobicContact CG2-CZ 4.49Å; I51-L181 HydrophobicContact CD1-CD1 3.21Å; I51-L181 HydrophobicContact CD1-CD2 3.85Å; I51-L181 HydrophobicContact CD1-CG 4.14Å; I51-L181 HydrophobicContact CG1-CD1 4.21Å; I51-L181 HydrophobicContact CG1-CD2 4.35Å; I51-L181 HydrophobicContact CG2-CD2 4.46Å; I51-F197 HydrophobicContact CG2-CB 3.35Å; I51-F197 HydrophobicContact CG2-CD1 4.15Å; I51-F197 HydrophobicContact CG2-CG 3.97Å; I51-Y198 CarbonylContact C-O 3.56Å; I51-Y198 VanDerWaalsContact CA-O 3.27Å; I51-Y198 WeakPolarHBondContact CA-O 3.25Å; I51-V199 HydrophobicContact CG1-CG2 4.11Å
52F92.8Very high90Very high0 Ų052.1 Ų52.10%027%0.269CS..EExtended strand (participates in β ladder)trans-135.9166175.669.2-83.4000111.8L37 A57 M88 F97 Y198 W200L37-F52 HydrophobicContact CD1-CD2 4.29Å; F52-A57 HydrophobicContact CD2-CB 4.01Å; F52-A57 HydrophobicContact CE2-CB 3.96Å; F52-M88 HydrophobicContact CE2-CE 4.07Å; F52-M88 HydrophobicContact CZ-CE 4.41Å; F52-F97 HydrophobicContact CE1-CB 3.84Å; F52-F97 HydrophobicContact CE1-CD1 4.48Å; F52-F97 HydrophobicContact CE1-CG 4.06Å; F52-F97 HydrophobicContact CZ-CB 4.02Å; F52-F97 AromaticContact CZ-CD1 3.97Å; F52-F97 HydrophobicContact CZ-CD1 3.97Å; F52-F97 AromaticContact CZ-CD2 3.89Å; F52-F97 HydrophobicContact CZ-CD2 3.89Å; F52-F97 HydrophobicContact CZ-CE1 4.41Å; F52-F97 HydrophobicContact CZ-CE2 4.31Å; F52-F97 AromaticContact CZ-CG 3.7Å; F52-F97 HydrophobicContact CZ-CG 3.7Å; F52-Y198 WeakPolarHBondContact CD1-O 3.46Å; F52-Y198 HydrophobicContact CE2-CD2 4.48Å; F52-Y198 HydrophobicContact CE2-CG 4.23Å; F52-Y198 HydrophobicContact CZ-CG 4.11Å; F52-Y198 PolarHBondContact N-O 2.84Å; F52-Y198 PolarHBondContact O-N 2.76Å; F52-W200 AromaticContact CD1-CD1 3.57Å; F52-W200 AromaticContact CD1-CD2 3.97Å; F52-W200 HydrophobicContact CD1-CD2 3.97Å; F52-W200 AromaticContact CD1-CE2 3.34Å; F52-W200 HydrophobicContact CD1-CG 4.08Å; F52-W200 AromaticContact CD1-CZ2 3.76Å; F52-W200 HydrophobicContact CD1-CZ2 3.76Å; F52-W200 AromaticContact CD1-NE1 3.1Å; F52-W200 AromaticContact CE1-CD2 3.74Å; F52-W200 HydrophobicContact CE1-CD2 3.74Å; F52-W200 AromaticContact CE1-CE2 3.4Å; F52-W200 VanDerWaalsContact CE1-CE2 3.4Å; F52-W200 HydrophobicContact CE1-CE3 4.26Å; F52-W200 HydrophobicContact CE1-CG 4.14Å; F52-W200 HydrophobicContact CE1-CH2 4.15Å; F52-W200 AromaticContact CE1-CZ2 3.61Å; F52-W200 HydrophobicContact CE1-CZ2 3.61Å; F52-W200 HydrophobicContact CE1-CZ3 4.45Å; F52-W200 AromaticContact CE1-NE1 3.68Å; F52-W200 HydrophobicContact CE2-CZ2 4.43Å; F52-W200 HydrophobicContact CG-CZ2 4.2Å; F52-W200 AromaticContact CG-NE1 3.77Å; F52-W200 HydrophobicContact CZ-CH2 4.24Å; F52-W200 AromaticContact CZ-CZ2 3.96Å; F52-W200 HydrophobicContact CZ-CZ2 3.96Å
53V92.1Very high90Very high26 Ų2656 Ų5616%0.15829%0.29CS..  trans-101.5139.2175.9-177.30000109.6M55 E56 A57 F169 F197V53-M55 HydrophobicContact CG1-CB 4.36Å; V53-M55 PolarHBondContact O-N 3.42Å; V53-E56 HydrophobicContact CB-CG 4.25Å; V53-E56 PolarHBondContact O-N 2.82Å; V53-A57 PolarHBondContact O-N 3.44Å; V53-F169 HydrophobicContact CG2-CD1 4.36Å; V53-F169 HydrophobicContact CG2-CD2 3.62Å; V53-F169 HydrophobicContact CG2-CE1 4.15Å; V53-F169 HydrophobicContact CG2-CE2 3.42Å; V53-F169 VanDerWaalsContact CG2-CE2 3.42Å; V53-F169 HydrophobicContact CG2-CG 4.13Å; V53-F169 HydrophobicContact CG2-CZ 3.7Å; V53-F197 HydrophobicContact CG2-CD1 4.1Å; V53-F197 HydrophobicContact CG2-CE1 4.15Å
54A92.1Very high90Very high4 Ų450.6 Ų50.63%0.03327%0.27CS..Hα-helixtrans-62.1-41-178.100000113.8E56 A57 V58 F189 L191 Y198A54-E56 PolarHBondContact O-N 3.37Å; A54-A57 WeakPolarHBondContact O-CB 3.43Å; A54-A57 PolarHBondContact O-N 3.39Å; A54-V58 WeakPolarHBondContact O-CG2 3.1Å; A54-V58 PolarHBondContact O-N 2.96Å; A54-F189 HydrophobicContact CB-CE2 3.79Å; A54-F189 HydrophobicContact CB-CZ 3.77Å; A54-L191 HydrophobicContact CB-CD1 3.98Å; A54-Y198 HydrophobicContact CB-CD2 3.88Å; A54-Y198 HydrophobicContact CB-CE2 3.54Å
55M90.2Very high89.8Confident101 Ų10155 Ų5550%0.49829%0.29SS..Hα-helixtrans-57.3-48.1179.1-70.9-67.7-71.300112V53 A57 V58 E59 L191V53-M55 HydrophobicContact CG1-CB 4.36Å; V53-M55 PolarHBondContact O-N 3.42Å; M55-A57 VanDerWaalsContact C-N 3.29Å; M55-A57 PolarHBondContact O-N 3.21Å; M55-V58 PolarHBondContact O-N 2.81Å; M55-E59 WeakPolarHBondContact O-CB 3.31Å; M55-E59 PolarHBondContact O-N 2.74Å; M55-L191 HydrophobicContact CG-CD1 3.96Å; M55-L191 HydrophobicContact CG-CG 4.45Å; M55-L191 HydrophobicContact SD-CD1 3.34Å; M55-L191 WeakPolarHBondContact SD-CD1 3.49Å; M55-L191 HydrophobicContact SD-CD2 3.88Å; M55-L191 HydrophobicContact SD-CG 3.36Å; M55-L191 WeakPolarHBondContact SD-CG 3.27Å
56E90.6Very high89.8Confident38 Ų3851.2 Ų51.218%0.17826%0.258CS..Hα-helixtrans-63.8-36179-63.6175170.400111.6L37 P38 V53 A54 L60L37-E56 HydrophobicContact CD2-CB 4.21Å; P38-E56 VanDerWaalsContact CG-OE2 3.28Å; P38-E56 WeakPolarHBondContact CG-OE2 3.46Å; V53-E56 HydrophobicContact CB-CG 4.25Å; V53-E56 PolarHBondContact O-N 2.82Å; A54-E56 PolarHBondContact O-N 3.37Å; E56-L60 VanDerWaalsContact O-CB 3.27Å; E56-L60 WeakPolarHBondContact O-CB 3.29Å; E56-L60 PolarHBondContact O-N 3.25Å
57A92.8Very high89.8Confident0 Ų050.3 Ų50.30%025%0.247CC..Hα-helixtrans-63.8-46.7174.700000112.3L33 L37 F52 V53 A54 M55 L60 L61 M88L33-A57 HydrophobicContact CD2-CB 4.41Å; L37-A57 HydrophobicContact CD1-CB 3.97Å; L37-A57 HydrophobicContact CD2-CB 4.27Å; F52-A57 HydrophobicContact CD2-CB 4.01Å; F52-A57 HydrophobicContact CE2-CB 3.96Å; V53-A57 PolarHBondContact O-N 3.44Å; A54-A57 WeakPolarHBondContact O-CB 3.43Å; A54-A57 PolarHBondContact O-N 3.39Å; M55-A57 VanDerWaalsContact C-N 3.29Å; M55-A57 PolarHBondContact O-N 3.21Å; A57-L60 PolarHBondContact O-N 3.22Å; A57-L61 WeakPolarHBondContact O-CG 3.5Å; A57-L61 PolarHBondContact O-N 2.98Å; A57-M88 HydrophobicContact CB-CE 3.82Å
58V92.3Very high89.1Confident2 Ų252.1 Ų52.11%0.01225%0.246CC..Hα-helixtrans-66.1-42.2179.1175.30000111.2A54 M55 L60 L61 M62 Q81 A84 V85 M88 F189 L191A54-V58 WeakPolarHBondContact O-CG2 3.1Å; A54-V58 PolarHBondContact O-N 2.96Å; M55-V58 PolarHBondContact O-N 2.81Å; V58-L60 VanDerWaalsContact C-N 3.35Å; V58-L60 PolarHBondContact O-N 3.06Å; V58-L61 PolarHBondContact O-N 2.93Å; V58-M62 WeakPolarHBondContact O-CG 3.4Å; V58-M62 PolarHBondContact O-N 3.42Å; V58-Q81 HydrophobicContact CG1-CG 3.61Å; V58-A84 HydrophobicContact CG1-CB 4.1Å; V58-V85 HydrophobicContact CG1-CG2 4.37Å; V58-V85 HydrophobicContact CG2-CG2 4.11Å; V58-M88 HydrophobicContact CG2-CG 4.42Å; V58-F189 HydrophobicContact CG2-CE1 4.42Å; V58-F189 HydrophobicContact CG2-CZ 4.17Å; V58-L191 HydrophobicContact CG2-CD1 3.99Å
59E91.5Very high87.8Confident120 Ų12048.4 Ų48.456%0.56123%0.23SC*.Hα-helixtrans-62.4-41.5176.2-175177.3-178.100111.9M55 L61 M62 N63M55-E59 WeakPolarHBondContact O-CB 3.31Å; M55-E59 PolarHBondContact O-N 2.74Å; E59-L61 VanDerWaalsContact C-N 3.32Å; E59-L61 PolarHBondContact O-N 3.07Å; E59-M62 PolarHBondContact O-N 2.91Å; E59-N63 PolarHBondContact O-N 3.26Å; E59-N63 PolarHBondContact O-ND2 3.01Å; E59-N63 VanDerWaalsContact O-ND2 3.16Å
60L91Very high86.3Confident34 Ų3454.6 Ų54.618%0.17826%0.262CS..Hα-helixtrans-66-34.6177.1-171.471.9000112.2Y32 L33 K36 L37 E56 A57 V58 N63 S64Y32-L60 HydrophobicContact CE1-CD2 4.19Å; Y32-L60 HydrophobicContact CE1-CG 4.02Å; L33-L60 HydrophobicContact CD2-CD2 4.1Å; K36-L60 HydrophobicContact CB-CD1 4.29Å; K36-L60 HydrophobicContact CB-CD2 3.68Å; L37-L60 HydrophobicContact CD2-CB 4.15Å; L37-L60 HydrophobicContact CD2-CD2 3.76Å; L37-L60 HydrophobicContact CG-CD2 3.65Å; E56-L60 VanDerWaalsContact O-CB 3.27Å; E56-L60 WeakPolarHBondContact O-CB 3.29Å; E56-L60 PolarHBondContact O-N 3.25Å; A57-L60 PolarHBondContact O-N 3.22Å; V58-L60 VanDerWaalsContact C-N 3.35Å; V58-L60 PolarHBondContact O-N 3.06Å; L60-N63 PolarHBondContact O-N 3.16Å; L60-S64 WeakPolarHBondContact O-CB 3.48Å; L60-S64 PolarHBondContact O-N 3.36Å
61L91.1Very high84.9Confident0 Ų054.7 Ų54.70%027%0.272CS..Hα-helixtrans-66-42.2173.1-71.6177.4000111.7V29 L33 A57 V58 E59 N63 S64 A67 F78 A84 F87 M88V29-L61 HydrophobicContact CG1-CD2 3.38Å; L33-L61 HydrophobicContact CD1-CD2 4.13Å; L33-L61 HydrophobicContact CD2-CD2 3.92Å; L33-L61 HydrophobicContact CD2-CG 3.99Å; L33-L61 HydrophobicContact CG-CD2 4.13Å; A57-L61 WeakPolarHBondContact O-CG 3.5Å; A57-L61 PolarHBondContact O-N 2.98Å; V58-L61 PolarHBondContact O-N 2.93Å; E59-L61 VanDerWaalsContact C-N 3.32Å; E59-L61 PolarHBondContact O-N 3.07Å; L61-N63 PolarHBondContact O-N 3.39Å; L61-S64 VanDerWaalsContact O-CB 3.29Å; L61-S64 WeakPolarHBondContact O-CB 3.41Å; L61-S64 PolarHBondContact O-N 3.12Å; L61-S64 VanDerWaalsContact O-N 3.12Å; L61-S64 PolarHBondContact O-OG 3.47Å; L61-A67 WeakPolarHBondContact O-CB 3.12Å; L61-F78 HydrophobicContact CB-CD2 4.33Å; L61-F78 HydrophobicContact CB-CE2 4.45Å; L61-F78 HydrophobicContact CD1-CZ 4.48Å; L61-F78 HydrophobicContact CD2-CE2 3.89Å; L61-F78 HydrophobicContact CD2-CZ 4.2Å; L61-A84 HydrophobicContact CB-CB 4.31Å; L61-A84 HydrophobicContact CD1-CB 4.29Å; L61-F87 HydrophobicContact CD1-CD1 4.36Å; L61-M88 HydrophobicContact CD1-CG 3.82Å; L61-M88 HydrophobicContact CD1-SD 3.78Å
62M88.8Confident83.4Confident79 Ų7962.9 Ų62.939%0.38932%0.316SS..Hα-helixtrans-66.6-25.9175.7-70.6-168.965.200113.4V58 E59 A67 Q81V58-M62 WeakPolarHBondContact O-CG 3.4Å; V58-M62 PolarHBondContact O-N 3.42Å; E59-M62 PolarHBondContact O-N 2.91Å; M62-A67 WeakPolarHBondContact O-CB 3.49Å; M62-Q81 HydrophobicContact SD-CB 3.81Å; M62-Q81 HydrophobicContact SD-CG 4.11Å
63N88.5Confident81.9Confident81 Ų8167.4 Ų67.443%0.43335%0.353SS..THydrogen-bonded Turntrans-91-2.3174.4-72.2-43.1000113.7E59 L60 L61 R68E59-N63 PolarHBondContact O-N 3.26Å; E59-N63 PolarHBondContact O-ND2 3.01Å; E59-N63 VanDerWaalsContact O-ND2 3.16Å; L60-N63 PolarHBondContact O-N 3.16Å; L61-N63 PolarHBondContact O-N 3.39Å; N63-R68 PolarHBondContact OD1-NH2 3.02Å
64S87.7Confident80.6Confident1 Ų173.2 Ų73.21%0.00738%0.376CS..SBendtrans-77.9165.5-177.477.20000112.7L60 L61 W66 A67 R68L60-S64 WeakPolarHBondContact O-CB 3.48Å; L60-S64 PolarHBondContact O-N 3.36Å; L61-S64 VanDerWaalsContact O-CB 3.29Å; L61-S64 WeakPolarHBondContact O-CB 3.41Å; L61-S64 PolarHBondContact O-N 3.12Å; L61-S64 VanDerWaalsContact O-N 3.12Å; L61-S64 PolarHBondContact O-OG 3.47Å; S64-W66 PolarHBondContact O-N 3.39Å; S64-W66 VanDerWaalsContact O-N 3.15Å; S64-W66 PolarHBondContact OG-N 3.44Å; S64-A67 PolarHBondContact O-N 2.97Å; S64-A67 VanDerWaalsContact O-N 3.09Å; S64-R68 PolarHBondContact O-N 2.94Å
65H83.9Confident79.4Confident112 Ų11277.5 Ų77.552%0.51940%0.404SS..THydrogen-bonded Turntrans-61.1-17.2172.566.8154.9000114.5S69H65-S69 PolarHBondContact O-N 3.25Å
66W84.9Confident78.6Confident32 Ų3275.8 Ų75.812%0.12140%0.399CS..THydrogen-bonded Turntrans-80.2-19.1175.4-64.3-72.9000113.6D28 V29 Y32 S64 T76 L77 F78D28-W66 HydrophobicContact CB-CZ2 4.3Å; V29-W66 VanDerWaalsContact CA-CH2 3.45Å; V29-W66 HydrophobicContact CB-CH2 4.07Å; V29-W66 HydrophobicContact CB-CZ2 4.35Å; V29-W66 HydrophobicContact CB-CZ3 4.15Å; V29-W66 HydrophobicContact CG1-CE3 4.33Å; V29-W66 HydrophobicContact CG1-CH2 4.5Å; V29-W66 HydrophobicContact CG1-CZ3 4.09Å; V29-W66 HydrophobicContact CG2-CD2 3.8Å; V29-W66 HydrophobicContact CG2-CE3 3.87Å; V29-W66 HydrophobicContact CG2-CH2 3.72Å; V29-W66 HydrophobicContact CG2-CZ2 3.56Å; V29-W66 HydrophobicContact CG2-CZ3 3.85Å; Y32-W66 HydrophobicContact CD1-CH2 4.46Å; Y32-W66 AromaticContact CD1-CZ3 3.69Å; Y32-W66 HydrophobicContact CD1-CZ3 3.69Å; Y32-W66 HydrophobicContact CD2-CH2 4.44Å; Y32-W66 HydrophobicContact CD2-CZ3 4.24Å; Y32-W66 HydrophobicContact CE1-CZ3 4.34Å; Y32-W66 AromaticContact CG-CH2 3.97Å; Y32-W66 HydrophobicContact CG-CH2 3.97Å; Y32-W66 AromaticContact CG-CZ3 3.63Å; Y32-W66 HydrophobicContact CG-CZ3 3.63Å; S64-W66 PolarHBondContact O-N 3.39Å; S64-W66 VanDerWaalsContact O-N 3.15Å; S64-W66 PolarHBondContact OG-N 3.44Å; W66-T76 WeakPolarHBondContact O-CA 3.36Å; W66-L77 HydrophobicContact CB-CB 4.4Å; W66-L77 HydrophobicContact CG-CD1 4.32Å; W66-L77 PolarHBondContact O-N 3.26Å; W66-L77 VanDerWaalsContact O-N 3.16Å; W66-F78 HydrophobicContact CB-CD2 3.58Å; W66-F78 HydrophobicContact CB-CE2 3.66Å; W66-F78 HydrophobicContact CD2-CE2 4.5Å; W66-F78 HydrophobicContact CE3-CE2 4.43Å; W66-F78 HydrophobicContact CG-CE2 4.22Å
67A83.2Confident77.9Confident24 Ų2476 Ų7620%0.19840%0.401CS..THydrogen-bonded Turntrans-90.9-29.4174.700000112.2L61 M62 S64 F78L61-A67 WeakPolarHBondContact O-CB 3.12Å; M62-A67 WeakPolarHBondContact O-CB 3.49Å; S64-A67 PolarHBondContact O-N 2.97Å; S64-A67 VanDerWaalsContact O-N 3.09Å; A67-F78 HydrophobicContact CB-CB 4.13Å
68R73Confident77.5Confident177 Ų17776.3 Ų76.367%0.66840%0.403SS*.SBendtrans-109.123.3-174.8-60.5-172.9-177.6-179.52.8114N63 S64 N70N63-R68 PolarHBondContact OD1-NH2 3.02Å; S64-R68 PolarHBondContact O-N 2.94Å; R68-N70 PolarHBondContact O-N 3.19Å; R68-N70 VanDerWaalsContact O-N 3.14Å
69S63.3Low77.1Confident36 Ų3681.8 Ų81.825%0.25244%0.436SS..  trans-65122.3-17679.90000110.4H65 K74 T76H65-S69 PolarHBondContact O-N 3.25Å; S69-K74 PolarHBondContact OG-O 3.22Å; S69-T76 WeakPolarHBondContact OG-CG2 3.29Å
70N59.4Low77Confident155 Ų15578.6 Ų78.683%0.82943%0.427SS*.  trans-100.25.7170.1-145.14.9000110.2R68R68-N70 PolarHBondContact O-N 3.19Å; R68-N70 VanDerWaalsContact O-N 3.14Å
71D62.6Low77Confident121 Ų12181.2 Ų81.265%0.64744%0.438SS*.  trans-107115.6-175.4-63.7-33.2000109.6A73 K74D71-A73 PolarHBondContact O-N 3.03Å; D71-K74 PolarHBondContact O-N 3.41Å
72D60Low77Confident177 Ų17785.5 Ų85.595%0.94747%0.465SS*.THydrogen-bonded Turntrans-59.2-13.3-178.6-61.4-50.2000114.4
73A62.1Low77.2Confident96 Ų9684.5 Ų84.579%0.79346%0.463SS*.THydrogen-bonded Turntrans-81-17-173.500000114.5D71D71-A73 PolarHBondContact O-N 3.03Å
74K64.5Low77.4Confident148 Ų14880.6 Ų80.664%0.64344%0.442SS*.SBendtrans-132.5121.8177.8-67.4-177.7-176.6-178.80109.5S69 D71 T76S69-K74 PolarHBondContact OG-O 3.22Å; D71-K74 PolarHBondContact O-N 3.41Å; K74-T76 PolarHBondContact O-N 2.89Å
75P66.1Low77.7Confident93 Ų9382 Ų8260%0.60445%0.451SS*.  trans-59.6136-177.225.4-33.4000110.2L77P75-L77 HydrophobicContact CG-CD2 4.42Å; P75-L77 PolarHBondContact O-N 3.13Å
76T72.9Confident78.1Confident66 Ų6681.2 Ų81.241%0.40545%0.45SS..  trans-60.6104.1169.350.70000108.4W66 S69 K74 F78W66-T76 WeakPolarHBondContact O-CA 3.36Å; S69-T76 WeakPolarHBondContact OG-CG2 3.29Å; K74-T76 PolarHBondContact O-N 2.89Å; T76-F78 VanDerWaalsContact C-N 3.31Å
77L76.3Confident78.4Confident43 Ų4381.1 Ų81.123%0.22545%0.451CS..SBendtrans-74.1-25.6-177.4-64.8175.8000112W66 P75 T83W66-L77 HydrophobicContact CB-CB 4.4Å; W66-L77 HydrophobicContact CG-CD1 4.32Å; W66-L77 PolarHBondContact O-N 3.26Å; W66-L77 VanDerWaalsContact O-N 3.16Å; P75-L77 HydrophobicContact CG-CD2 4.42Å; P75-L77 PolarHBondContact O-N 3.13Å; L77-T83 WeakPolarHBondContact O-CG2 3.46Å
78F83.8Confident78.8Confident6 Ų680 Ų803%0.02644%0.441CS..  trans-126.579.6-170.9-51.4-54.4000112.2V29 L61 W66 A67 T76 A84 F87V29-F78 HydrophobicContact CG1-CE2 4.5Å; V29-F78 HydrophobicContact CG1-CZ 4.42Å; L61-F78 HydrophobicContact CB-CD2 4.33Å; L61-F78 HydrophobicContact CB-CE2 4.45Å; L61-F78 HydrophobicContact CD1-CZ 4.48Å; L61-F78 HydrophobicContact CD2-CE2 3.89Å; L61-F78 HydrophobicContact CD2-CZ 4.2Å; W66-F78 HydrophobicContact CB-CD2 3.58Å; W66-F78 HydrophobicContact CB-CE2 3.66Å; W66-F78 HydrophobicContact CD2-CE2 4.5Å; W66-F78 HydrophobicContact CE3-CE2 4.43Å; W66-F78 HydrophobicContact CG-CE2 4.22Å; A67-F78 HydrophobicContact CB-CB 4.13Å; T76-F78 VanDerWaalsContact C-N 3.31Å; F78-A84 HydrophobicContact CD1-CB 4.11Å; F78-F87 HydrophobicContact CE1-CB 3.58Å; F78-F87 AromaticContact CE1-CD1 3.73Å; F78-F87 HydrophobicContact CE1-CD1 3.73Å; F78-F87 HydrophobicContact CE1-CD2 4.02Å; F78-F87 HydrophobicContact CE1-CE1 4.4Å; F78-F87 AromaticContact CE1-CG 3.5Å; F78-F87 HydrophobicContact CE1-CG 3.5Å; F78-F87 HydrophobicContact CZ-CB 4.33Å; F78-F87 AromaticContact CZ-CD1 3.6Å; F78-F87 HydrophobicContact CZ-CD1 3.6Å; F78-F87 HydrophobicContact CZ-CD2 4.17Å; F78-F87 AromaticContact CZ-CE1 3.83Å; F78-F87 HydrophobicContact CZ-CE1 3.83Å; F78-F87 HydrophobicContact CZ-CE2 4.37Å; F78-F87 AromaticContact CZ-CG 3.77Å; F78-F87 HydrophobicContact CZ-CG 3.77Å; F78-F87 HydrophobicContact CZ-CZ 4.2Å
79T85Confident79.8Confident117 Ų11773.4 Ų73.472%0.71842%0.421SS*.SBendtrans-76.1-33.5173.3-45.90000112.6
80S89Confident81.1Confident53 Ų5374 Ų7437%0.37142%0.423SS..SBendtrans-135.7156.2-175.1179.70000111.1T82 T83 A84S80-T82 PolarHBondContact O-N 2.9Å; S80-T82 PolarHBondContact OG-N 3.26Å; S80-T83 WeakPolarHBondContact O-CB 3.27Å; S80-T83 PolarHBondContact O-N 2.8Å; S80-A84 PolarHBondContact O-N 2.9Å
81Q91Very high82.6Confident88 Ų8866.6 Ų66.641%0.41138%0.384SS..Hα-helixtrans-54.2-37.5172.6-168.5179.36.700111.3V58 M62 T83 A84 V85V58-Q81 HydrophobicContact CG1-CG 3.61Å; M62-Q81 HydrophobicContact SD-CB 3.81Å; M62-Q81 HydrophobicContact SD-CG 4.11Å; Q81-T83 VanDerWaalsContact C-N 3.32Å; Q81-T83 PolarHBondContact O-N 2.89Å; Q81-A84 PolarHBondContact O-N 3.4Å; Q81-V85 VanDerWaalsContact O-CG2 3.31Å; Q81-V85 WeakPolarHBondContact O-CG2 3.5Å; Q81-V85 PolarHBondContact O-N 3.4Å
82T92.2Very high83.9Confident90 Ų9061.3 Ų61.355%0.55236%0.355SS*.Hα-helixtrans-61-40.4177-47.50000111.9S80 V85 N86S80-T82 PolarHBondContact O-N 2.9Å; S80-T82 PolarHBondContact OG-N 3.26Å; T82-V85 PolarHBondContact O-N 3.41Å; T82-N86 WeakPolarHBondContact O-CB 3.41Å; T82-N86 VanDerWaalsContact O-CG 3.25Å; T82-N86 PolarHBondContact O-N 2.88Å; T82-N86 PolarHBondContact O-ND2 3.35Å
83T91.9Very high85.3Confident58 Ų5859 Ų5936%0.35634%0.339SS..Hα-helixtrans-66.9-40.2177.8-44.50000111.1L77 S80 Q81 N86 F87L77-T83 WeakPolarHBondContact O-CG2 3.46Å; S80-T83 WeakPolarHBondContact O-CB 3.27Å; S80-T83 PolarHBondContact O-N 2.8Å; Q81-T83 VanDerWaalsContact C-N 3.32Å; Q81-T83 PolarHBondContact O-N 2.89Å; T83-N86 PolarHBondContact O-N 3.35Å; T83-F87 WeakPolarHBondContact O-CB 3.33Å; T83-F87 PolarHBondContact O-N 3.31Å
84A92.4Very high86.6Confident0 Ų056.1 Ų56.10%031%0.308CS..Hα-helixtrans-64-40.3173.900000112.1V58 L61 F78 S80 Q81 F87 M88V58-A84 HydrophobicContact CG1-CB 4.1Å; L61-A84 HydrophobicContact CB-CB 4.31Å; L61-A84 HydrophobicContact CD1-CB 4.29Å; F78-A84 HydrophobicContact CD1-CB 4.11Å; S80-A84 PolarHBondContact O-N 2.9Å; Q81-A84 PolarHBondContact O-N 3.4Å; A84-F87 PolarHBondContact O-N 2.96Å; A84-M88 WeakPolarHBondContact O-CB 3.18Å; A84-M88 VanDerWaalsContact O-CG 3.29Å; A84-M88 WeakPolarHBondContact O-CG 3.5Å; A84-M88 PolarHBondContact O-N 3.5Å
85V93.4Very high87.8Confident31 Ų3153.2 Ų53.219%0.18830%0.297CS..Hα-helixtrans-65.3-42.3175.7170.20000111.6V58 Q81 T82 F87 M88 T89 F189 L191V58-V85 HydrophobicContact CG1-CG2 4.37Å; V58-V85 HydrophobicContact CG2-CG2 4.11Å; Q81-V85 VanDerWaalsContact O-CG2 3.31Å; Q81-V85 WeakPolarHBondContact O-CG2 3.5Å; Q81-V85 PolarHBondContact O-N 3.4Å; T82-V85 PolarHBondContact O-N 3.41Å; V85-F87 VanDerWaalsContact C-N 3.34Å; V85-M88 PolarHBondContact O-N 3.08Å; V85-T89 WeakPolarHBondContact O-CB 3.3Å; V85-T89 PolarHBondContact O-N 2.96Å; V85-T89 PolarHBondContact O-OG1 2.9Å; V85-F189 HydrophobicContact CB-CE1 4.46Å; V85-F189 HydrophobicContact CG1-CD1 4.05Å; V85-F189 HydrophobicContact CG1-CE1 4.05Å; V85-F189 HydrophobicContact CG2-CE1 4.42Å; V85-L191 HydrophobicContact CG2-CD2 4Å
86N92.3Very high88.9Confident94 Ų9449 Ų4950%0.50327%0.269SS..Hα-helixtrans-62.2-44.1175.6-72.1-15000111.1T82 T83 T89 T90T82-N86 WeakPolarHBondContact O-CB 3.41Å; T82-N86 VanDerWaalsContact O-CG 3.25Å; T82-N86 PolarHBondContact O-N 2.88Å; T82-N86 PolarHBondContact O-ND2 3.35Å; T83-N86 PolarHBondContact O-N 3.35Å; N86-T89 CarbonylContact O-C 3.59Å; N86-T89 WeakPolarHBondContact O-CA 3.48Å; N86-T89 VanDerWaalsContact O-CB 3.29Å; N86-T89 WeakPolarHBondContact O-CB 3.47Å; N86-T89 PolarHBondContact O-N 2.89Å; N86-T89 VanDerWaalsContact O-N 3.11Å; N86-T90 PolarHBondContact O-N 2.96Å; N86-T90 PolarHBondContact O-OG1 3.11Å
87F92Very high89.8Confident30 Ų3045.9 Ų45.913%0.13225%0.25CS..Hα-helixtrans-62.9-43.4176.1-178-95.5000112.5E26 V29 L61 F78 T83 A84 V85 T89 T90 L91E26-F87 HydrophobicContact CB-CZ 4.4Å; E26-F87 HydrophobicContact CG-CE2 3.77Å; E26-F87 HydrophobicContact CG-CZ 3.95Å; V29-F87 HydrophobicContact CB-CE1 3.84Å; V29-F87 HydrophobicContact CB-CZ 3.79Å; V29-F87 HydrophobicContact CG1-CD1 4.45Å; V29-F87 HydrophobicContact CG1-CE1 3.45Å; V29-F87 VanDerWaalsContact CG1-CE1 3.45Å; V29-F87 HydrophobicContact CG1-CZ 3.94Å; V29-F87 HydrophobicContact CG2-CE1 4.22Å; V29-F87 HydrophobicContact CG2-CZ 3.86Å; L61-F87 HydrophobicContact CD1-CD1 4.36Å; F78-F87 HydrophobicContact CE1-CB 3.58Å; F78-F87 AromaticContact CE1-CD1 3.73Å; F78-F87 HydrophobicContact CE1-CD1 3.73Å; F78-F87 HydrophobicContact CE1-CD2 4.02Å; F78-F87 HydrophobicContact CE1-CE1 4.4Å; F78-F87 AromaticContact CE1-CG 3.5Å; F78-F87 HydrophobicContact CE1-CG 3.5Å; F78-F87 HydrophobicContact CZ-CB 4.33Å; F78-F87 AromaticContact CZ-CD1 3.6Å; F78-F87 HydrophobicContact CZ-CD1 3.6Å; F78-F87 HydrophobicContact CZ-CD2 4.17Å; F78-F87 AromaticContact CZ-CE1 3.83Å; F78-F87 HydrophobicContact CZ-CE1 3.83Å; F78-F87 HydrophobicContact CZ-CE2 4.37Å; F78-F87 AromaticContact CZ-CG 3.77Å; F78-F87 HydrophobicContact CZ-CG 3.77Å; F78-F87 HydrophobicContact CZ-CZ 4.2Å; T83-F87 WeakPolarHBondContact O-CB 3.33Å; T83-F87 PolarHBondContact O-N 3.31Å; A84-F87 PolarHBondContact O-N 2.96Å; V85-F87 VanDerWaalsContact C-N 3.34Å; F87-T89 PolarHBondContact O-N 2.83Å; F87-T90 WeakPolarHBondContact O-CB 3.14Å; F87-T90 PolarHBondContact O-N 2.89Å; F87-T90 VanDerWaalsContact O-N 3.08Å; F87-L91 HydrophobicContact CD1-CD1 4Å; F87-L91 HydrophobicContact CD1-CG 4.14Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE1-CD2 4.1Å; F87-L91 HydrophobicContact CE1-CG 3.8Å; F87-L91 HydrophobicContact CZ-CD1 4.34Å; F87-L91 HydrophobicContact CZ-CD2 4.1Å; F87-L91 HydrophobicContact CZ-CG 4.27Å; F87-L91 PolarHBondContact O-N 3.15Å
88M92.4Very high90.5Very high0 Ų046.2 Ų46.20%025%0.25CS..Hα-helixtrans-60.7-35.6172.6-72.9-62.4-69.700111.9L33 F52 A57 V58 L61 A84 V85 L91 F92 F97 F189L33-M88 HydrophobicContact CD1-SD 3.95Å; F52-M88 HydrophobicContact CE2-CE 4.07Å; F52-M88 HydrophobicContact CZ-CE 4.41Å; A57-M88 HydrophobicContact CB-CE 3.82Å; V58-M88 HydrophobicContact CG2-CG 4.42Å; L61-M88 HydrophobicContact CD1-CG 3.82Å; L61-M88 HydrophobicContact CD1-SD 3.78Å; A84-M88 WeakPolarHBondContact O-CB 3.18Å; A84-M88 VanDerWaalsContact O-CG 3.29Å; A84-M88 WeakPolarHBondContact O-CG 3.5Å; A84-M88 PolarHBondContact O-N 3.5Å; V85-M88 PolarHBondContact O-N 3.08Å; M88-L91 PolarHBondContact O-N 2.92Å; M88-L91 HydrophobicContact SD-CD1 4.08Å; M88-F92 VanDerWaalsContact O-CB 3.28Å; M88-F92 WeakPolarHBondContact O-CB 3.35Å; M88-F92 PolarHBondContact O-N 2.8Å; M88-F97 HydrophobicContact CE-CE1 3.81Å; M88-F97 HydrophobicContact CE-CE2 4.26Å; M88-F97 HydrophobicContact CE-CZ 3.5Å; M88-F97 VanDerWaalsContact CE-CZ 3.5Å; M88-F97 WeakPolarHBondContact O-CZ 3.22Å; M88-F97 HydrophobicContact SD-CZ 4.39Å; M88-F189 HydrophobicContact CB-CD1 4Å; M88-F189 HydrophobicContact CB-CD2 4.24Å; M88-F189 HydrophobicContact CB-CE1 3.61Å; M88-F189 HydrophobicContact CB-CE2 3.87Å; M88-F189 HydrophobicContact CB-CG 4.3Å; M88-F189 HydrophobicContact CB-CZ 3.54Å; M88-F189 HydrophobicContact CE-CE2 3.9Å; M88-F189 HydrophobicContact CE-CZ 4.18Å; M88-F189 HydrophobicContact CG-CE1 4.35Å; M88-F189 HydrophobicContact CG-CE2 4.46Å; M88-F189 HydrophobicContact CG-CZ 3.97Å
89T92.6Very high90.9Very high40 Ų4046.7 Ų46.725%0.24525%0.252CS..Hα-helixtrans-65.3-38.7173.6-54.40000111.4V85 N86 F87 F92 Q93V85-T89 WeakPolarHBondContact O-CB 3.3Å; V85-T89 PolarHBondContact O-N 2.96Å; V85-T89 PolarHBondContact O-OG1 2.9Å; N86-T89 CarbonylContact O-C 3.59Å; N86-T89 WeakPolarHBondContact O-CA 3.48Å; N86-T89 VanDerWaalsContact O-CB 3.29Å; N86-T89 WeakPolarHBondContact O-CB 3.47Å; N86-T89 PolarHBondContact O-N 2.89Å; N86-T89 VanDerWaalsContact O-N 3.11Å; F87-T89 PolarHBondContact O-N 2.83Å; T89-F92 WeakPolarHBondContact O-CB 3.29Å; T89-F92 PolarHBondContact O-N 2.69Å; T89-Q93 WeakPolarHBondContact O-CG 3.38Å; T89-Q93 PolarHBondContact O-N 3.44Å
90T90.7Very high91.1Very high47 Ų4741.2 Ų41.229%0.28822%0.218SC..Hα-helixtrans-65.2-44.8173.2-54.10000112.2N86 F87 F92 Q93 K94N86-T90 PolarHBondContact O-N 2.96Å; N86-T90 PolarHBondContact O-OG1 3.11Å; F87-T90 WeakPolarHBondContact O-CB 3.14Å; F87-T90 PolarHBondContact O-N 2.89Å; F87-T90 VanDerWaalsContact O-N 3.08Å; T90-F92 VanDerWaalsContact C-N 3.25Å; T90-F92 PolarHBondContact O-N 2.92Å; T90-Q93 PolarHBondContact O-N 3.23Å; T90-K94 HydrophobicContact CG2-CD 4.33Å; T90-K94 WeakPolarHBondContact O-CG 3.47Å; T90-K94 PolarHBondContact O-N 3.36Å
91L91Very high91.1Very high1 Ų140.9 Ų40.91%0.00521%0.214CC..Hα-helixtrans-61.4-36.3175.2-66.4-175.4000112.2E26 L33 F87 M88 K94 Q95 M96 F97E26-L91 HydrophobicContact CB-CD2 3.73Å; E26-L91 HydrophobicContact CG-CD2 3.97Å; L33-L91 HydrophobicContact CD1-CD1 4.22Å; F87-L91 HydrophobicContact CD1-CD1 4Å; F87-L91 HydrophobicContact CD1-CG 4.14Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE1-CD2 4.1Å; F87-L91 HydrophobicContact CE1-CG 3.8Å; F87-L91 HydrophobicContact CZ-CD1 4.34Å; F87-L91 HydrophobicContact CZ-CD2 4.1Å; F87-L91 HydrophobicContact CZ-CG 4.27Å; F87-L91 PolarHBondContact O-N 3.15Å; M88-L91 PolarHBondContact O-N 2.92Å; M88-L91 HydrophobicContact SD-CD1 4.08Å; L91-K94 CarbonylContact O-C 3.59Å; L91-K94 PolarHBondContact O-N 3.09Å; L91-Q95 PolarHBondContact O-N 3.05Å; L91-M96 HydrophobicContact CD2-SD 3.66Å; L91-M96 PolarHBondContact O-N 3.07Å; L91-F97 HydrophobicContact CB-CE1 3.62Å; L91-F97 HydrophobicContact CB-CZ 4.1Å; L91-F97 HydrophobicContact CD1-CE1 4.32Å
92F90.7Very high90.8Very high10 Ų1040.9 Ų40.94%0.04421%0.21CC..Hα-helixtrans-65.5-45.4175.1-179.3-89.7000112M88 T89 T90 K94 Q95 F97 R99 Q187 Y198M88-F92 VanDerWaalsContact O-CB 3.28Å; M88-F92 WeakPolarHBondContact O-CB 3.35Å; M88-F92 PolarHBondContact O-N 2.8Å; T89-F92 WeakPolarHBondContact O-CB 3.29Å; T89-F92 PolarHBondContact O-N 2.69Å; T90-F92 VanDerWaalsContact C-N 3.25Å; T90-F92 PolarHBondContact O-N 2.92Å; F92-K94 PolarHBondContact O-N 3.12Å; F92-Q95 PolarHBondContact O-N 2.63Å; F92-F97 HydrophobicContact CB-CD2 4.45Å; F92-F97 HydrophobicContact CB-CE2 3.7Å; F92-F97 HydrophobicContact CB-CZ 3.91Å; F92-F97 AromaticContact CD2-CD2 3.74Å; F92-F97 HydrophobicContact CD2-CD2 3.74Å; F92-F97 AromaticContact CD2-CE2 3.59Å; F92-F97 HydrophobicContact CD2-CE2 3.59Å; F92-F97 HydrophobicContact CG-CE2 4.14Å; F92-R99 HydrophobicContact CE2-CB 4.23Å; F92-Q187 HydrophobicContact CE1-CB 3.88Å; F92-Q187 WeakPolarHBondContact CE1-O 3.47Å; F92-Q187 HydrophobicContact CZ-CB 3.55Å; F92-Q187 HydrophobicContact CZ-CG 4.34Å; F92-Y198 HydrophobicContact CD2-CD1 4.49Å; F92-Y198 HydrophobicContact CD2-CE1 4.2Å; F92-Y198 HydrophobicContact CE2-CD1 4.47Å; F92-Y198 HydrophobicContact CE2-CE1 4.08Å
93Q90.1Very high90.4Very high129 Ų12939.4 Ų39.460%0.60320%0.201SC*.Hα-helixtrans-58.8-34174.5-73.9172.6-6.200111.9T89 T90 Q95T89-Q93 WeakPolarHBondContact O-CG 3.38Å; T89-Q93 PolarHBondContact O-N 3.44Å; T90-Q93 PolarHBondContact O-N 3.23Å; Q93-Q95 PolarHBondContact O-N 2.75Å
94K89.4Confident89.7Confident35 Ų3544 Ų4415%0.15222%0.216CC..THydrogen-bonded Turntrans-78.710.2175.2-69.9174.4165.3177.30114.4P22 E26 T90 L91 F92 M96P22-K94 HydrophobicContact CB-CD 4.23Å; E26-K94 IonicContact OE1-NZ 3.73Å; E26-K94 PolarHBondContact OE1-NZ 3.04Å; E26-K94 WeakPolarHBondContact OE2-CD 3.44Å; E26-K94 WeakPolarHBondContact OE2-CE 3.31Å; E26-K94 IonicContact OE2-NZ 3.8Å; E26-K94 PolarHBondContact OE2-NZ 2.88Å; T90-K94 HydrophobicContact CG2-CD 4.33Å; T90-K94 WeakPolarHBondContact O-CG 3.47Å; T90-K94 PolarHBondContact O-N 3.36Å; L91-K94 CarbonylContact O-C 3.59Å; L91-K94 PolarHBondContact O-N 3.09Å; F92-K94 PolarHBondContact O-N 3.12Å; K94-M96 HydrophobicContact CB-CG 4.4Å; K94-M96 PolarHBondContact O-N 2.93Å
95Q88.9Confident88.5Confident87 Ų8751.3 Ų51.341%0.40725%0.248SC..THydrogen-bonded Turntrans59.128175.4-63.3-65.7-61.700114.4L91 F92 Q93 F97L91-Q95 PolarHBondContact O-N 3.05Å; F92-Q95 PolarHBondContact O-N 2.63Å; Q93-Q95 PolarHBondContact O-N 2.75Å; Q95-F97 VanDerWaalsContact C-N 3.28Å; Q95-F97 PolarHBondContact O-N 3.39Å
96M89Confident86.7Confident5 Ų558.8 Ų58.83%0.02528%0.278CS..SBendtrans-72.6-25.6177.1-60-160.277.100112.6P22 A30 L91 K94 I201 Y202P22-M96 HydrophobicContact CB-SD 4.28Å; A30-M96 HydrophobicContact CB-CE 3.25Å; A30-M96 HydrophobicContact CB-SD 3.83Å; L91-M96 HydrophobicContact CD2-SD 3.66Å; L91-M96 PolarHBondContact O-N 3.07Å; K94-M96 HydrophobicContact CB-CG 4.4Å; K94-M96 PolarHBondContact O-N 2.93Å; M96-I201 PolarHBondContact O-N 3.49Å; M96-Y202 HydrophobicContact CE-CD1 3.58Å; M96-Y202 HydrophobicContact CE-CD2 3.52Å; M96-Y202 HydrophobicContact CE-CE1 4Å; M96-Y202 HydrophobicContact CE-CE2 3.96Å; M96-Y202 HydrophobicContact CE-CG 3.32Å; M96-Y202 PolarHBondContact O-N 2.93Å
97F91.9Very high84.8Confident0 Ų059.6 Ų59.60%029%0.288CS..EExtended strand (participates in β ladder)trans-152.4158.317551.8-95.6000110.4F52 M88 L91 F92 Q95 F189 Y198 V199 W200F52-F97 HydrophobicContact CE1-CB 3.84Å; F52-F97 HydrophobicContact CE1-CD1 4.48Å; F52-F97 HydrophobicContact CE1-CG 4.06Å; F52-F97 HydrophobicContact CZ-CB 4.02Å; F52-F97 AromaticContact CZ-CD1 3.97Å; F52-F97 HydrophobicContact CZ-CD1 3.97Å; F52-F97 AromaticContact CZ-CD2 3.89Å; F52-F97 HydrophobicContact CZ-CD2 3.89Å; F52-F97 HydrophobicContact CZ-CE1 4.41Å; F52-F97 HydrophobicContact CZ-CE2 4.31Å; F52-F97 AromaticContact CZ-CG 3.7Å; F52-F97 HydrophobicContact CZ-CG 3.7Å; M88-F97 HydrophobicContact CE-CE1 3.81Å; M88-F97 HydrophobicContact CE-CE2 4.26Å; M88-F97 HydrophobicContact CE-CZ 3.5Å; M88-F97 VanDerWaalsContact CE-CZ 3.5Å; M88-F97 WeakPolarHBondContact O-CZ 3.22Å; M88-F97 HydrophobicContact SD-CZ 4.39Å; L91-F97 HydrophobicContact CB-CE1 3.62Å; L91-F97 HydrophobicContact CB-CZ 4.1Å; L91-F97 HydrophobicContact CD1-CE1 4.32Å; F92-F97 HydrophobicContact CB-CD2 4.45Å; F92-F97 HydrophobicContact CB-CE2 3.7Å; F92-F97 HydrophobicContact CB-CZ 3.91Å; F92-F97 AromaticContact CD2-CD2 3.74Å; F92-F97 HydrophobicContact CD2-CD2 3.74Å; F92-F97 AromaticContact CD2-CE2 3.59Å; F92-F97 HydrophobicContact CD2-CE2 3.59Å; F92-F97 HydrophobicContact CG-CE2 4.14Å; Q95-F97 VanDerWaalsContact C-N 3.28Å; Q95-F97 PolarHBondContact O-N 3.39Å; F97-F189 HydrophobicContact CE2-CD2 4.01Å; F97-F189 HydrophobicContact CE2-CE2 4.34Å; F97-F189 HydrophobicContact CZ-CD2 4.45Å; F97-Y198 AromaticContact CD2-CD1 3.63Å; F97-Y198 HydrophobicContact CD2-CD1 3.63Å; F97-Y198 HydrophobicContact CD2-CE1 4.39Å; F97-Y198 HydrophobicContact CD2-CG 4.2Å; F97-Y198 AromaticContact CE2-CD1 3.94Å; F97-Y198 HydrophobicContact CE2-CD1 3.94Å; F97-Y198 HydrophobicContact CE2-CE1 4.33Å; F97-V199 CarbonylContact C-O 3.56Å; F97-V199 WeakPolarHBondContact CA-O 3.44Å; F97-V199 WeakPolarHBondContact CB-O 3.31Å; F97-W200 HydrophobicContact CB-CE3 4.4Å; F97-W200 HydrophobicContact CD1-CH2 4.48Å; F97-W200 HydrophobicContact CD1-CZ3 4.03Å
98Q91.1Very high82.5Confident50 Ų5064.7 Ų64.723%0.23432%0.322CS..EExtended strand (participates in β ladder)trans-122.7154.5179.6-90.9166.333.800111.8Y198 V199 I201Q98-Y198 CarbonylContact O-C 3.58Å; Q98-Y198 WeakPolarHBondContact O-CA 3.42Å; Q98-V199 PolarHBondContact N-O 2.99Å; Q98-V199 PolarHBondContact O-N 3.22Å; Q98-I201 HydrophobicContact CB-CD1 3.82Å; Q98-I201 VanDerWaalsContact CD-CD1 3.42Å; Q98-I201 HydrophobicContact CG-CD1 3.42Å; Q98-I201 VanDerWaalsContact CG-CD1 3.42Å
99R91.5Very high80Confident16 Ų1674 Ų746%0.0636%0.362CS..EExtended strand (participates in β ladder)trans-79.1127.6176.2-167.3-174.9179.6176.84110.2F92 V184 E186 Q187 D193 T196 Y198F92-R99 HydrophobicContact CE2-CB 4.23Å; R99-V184 HydrophobicContact CG-CB 4.35Å; R99-V184 HydrophobicContact CG-CG2 4.3Å; R99-V184 PolarHBondContact O-N 3.08Å; R99-E186 WeakPolarHBondContact CD-O 3.36Å; R99-Q187 PolarHBondContact O-NE2 3.26Å; R99-D193 IonicContact CZ-OD2 2.58Å; R99-D193 IonicContact NH2-OD2 2.69Å; R99-D193 PolarHBondContact NH2-OD2 3.18Å; R99-T196 HydrophobicContact CG-CG2 3.41Å; R99-T196 VanDerWaalsContact CG-CG2 3.41Å; R99-T196 VanDerWaalsContact NE-CG2 3.27Å; R99-T196 PolarHBondContact NE-OG1 3.33Å; R99-T196 PolarHBondContact NH2-OG1 3.19Å; R99-Y198 HydrophobicContact CB-CD1 4.4Å; R99-Y198 HydrophobicContact CB-CE1 3.97Å; R99-Y198 HydrophobicContact CG-CE1 4.11Å
100A90.6Very high77.4Confident1 Ų179.6 Ų79.61%0.00839%0.385CS..EExtended strand (participates in β ladder)trans-135148176.600000111.3L181 E182 F197 V199A100-L181 HydrophobicContact CB-CB 4.11Å; A100-L181 HydrophobicContact CB-CD2 3.9Å; A100-E182 CarbonylContact C-O 3.54Å; A100-E182 VanDerWaalsContact CA-O 3.28Å; A100-E182 WeakPolarHBondContact CA-O 3.48Å; A100-F197 CarbonylContact C-O 3.58Å; A100-F197 PolarHBondContact N-O 2.91Å; A100-F197 CarbonylContact O-C 3.56Å; A100-F197 PolarHBondContact O-N 2.85Å; A100-V199 HydrophobicContact CB-CG2 3.61Å
101V88.6Confident75.1Confident47 Ų4787.8 Ų87.829%0.28541%0.411SS..EExtended strand (participates in β ladder)trans-120148.2178.6168.90000110V103 L181 E182 V184V101-V103 PolarHBondContact O-N 2.92Å; V101-L181 WeakPolarHBondContact O-CA 3.18Å; V101-E182 PolarHBondContact N-O 3.4Å; V101-E182 PolarHBondContact O-N 3.39Å; V101-E182 VanDerWaalsContact O-N 3.07Å; V101-V184 HydrophobicContact CB-CG2 3.83Å; V101-V184 HydrophobicContact CG2-CG2 3.28Å
102R85.3Confident72.9Confident87 Ų8796.5 Ų96.533%0.32845%0.452SS..EExtended strand (participates in β ladder)trans-66.2119.4174.5-173.4173.8-163.6154.79110.5K104 E168 M179 F197R102-K104 PolarHBondContact O-N 3.08Å; R102-E168 IonicContact CZ-OE2 3.85Å; R102-E168 IonicContact NH1-OE1 2.76Å; R102-E168 IonicContact NH1-OE2 3.17Å; R102-E168 PolarHBondContact NH1-OE2 3.26Å; R102-E168 IonicContact NH2-OE1 3.79Å; R102-E168 IonicContact NH2-OE2 2.7Å; R102-M179 HydrophobicContact CB-CE 3.32Å; R102-M179 HydrophobicContact CB-SD 3.99Å; R102-M179 WeakPolarHBondContact CD-SD 3.35Å; R102-M179 HydrophobicContact CG-CE 3.45Å; R102-M179 VanDerWaalsContact CG-CE 3.45Å; R102-M179 HydrophobicContact CG-CG 3.77Å; R102-M179 HydrophobicContact CG-SD 3.45Å; R102-M179 WeakPolarHBondContact CG-SD 3.38Å; R102-M179 PolarHBondContact NE-SD 2.98Å; R102-F197 HydrophobicContact CB-CE2 4.08Å
103V82.9Confident70.6Confident59 Ų59102.5 Ų102.536%0.35848%0.484SS..  trans-74.6102168.4-174.30000108.4V101 K105 R180 E182V101-V103 PolarHBondContact O-N 2.92Å; V103-K105 PolarHBondContact O-N 2.85Å; V103-R180 PolarHBondContact N-O 3.43Å; V103-R180 VanDerWaalsContact N-O 3.14Å; V103-E182 HydrophobicContact CG2-CB 3.39Å
104K76.6Confident68.4Low154 Ų15499.5 Ų99.567%0.6748%0.482SS*.  trans-69.3114.7164.1-67.6-178.9-176.8174.30106.6R102 K106R102-K104 PolarHBondContact O-N 3.08Å; K104-K106 PolarHBondContact O-N 3.36Å
105K66.9Low66.3Low154 Ų154107.7 Ų107.767%0.6752%0.517SS*.  trans-56113.6171.1-71.8-177178.6-179.60107.4V103V103-K105 PolarHBondContact O-N 2.85Å
106K55.5Low63.8Low188 Ų188108.1 Ų108.182%0.81753%0.53SS*.  trans-55.3132.1164.5-77.6-179.7179.3175.80106.6K104 T108K104-K106 PolarHBondContact O-N 3.36Å; K106-T108 PolarHBondContact O-N 3.32Å
107P52.7Low61.6Low112 Ų112116.1 Ų116.173%0.72757%0.572SS**  trans-60112169.925.4-31.1000106.5K109P107-K109 PolarHBondContact O-N 3.41Å
108T45Very low59.2Low136 Ų136125.8 Ų125.883%0.83461%0.614SS**  trans-63.689.9170.129.70000107.9K106 H110K106-T108 PolarHBondContact O-N 3.32Å; T108-H110 PolarHBondContact O-N 2.93Å
109K40.2Very low56.5Low196 Ų196129.3 Ų129.385%0.85264%0.641SS**  trans-73.476.6158.7-75.7-172.1175.9-175.10107.7P107P107-K109 PolarHBondContact O-N 3.41Å
110H37.6Very low53.6Low157 Ų157138.2 Ų138.273%0.72768%0.68SS**  trans173.9107.3156-119.1-88.2000107.9T108T108-H110 PolarHBondContact O-N 2.93Å
111R41.7Very low51Low219 Ų219146 Ų14683%0.82672%0.721SS**  trans178.855.7130.3-161171178.3166.20109.7
112E45Very low48.4Very low185 Ų185152.7 Ų152.786%0.86475%0.746SS**SBendtrans-98-17.8164.4-73.8-170.1147.900112.4A114E112-A114 PolarHBondContact O-N 2.91Å
113D42.8Very low45.9Very low135 Ų135159 Ų15972%0.72278%0.776SS**THydrogen-bonded Turntrans-97.665.1178.8-49.4-53000112.4
114A44.3Very low43.7Very low66 Ų66163.5 Ų163.555%0.54580%0.797SS.*THydrogen-bonded Turntrans-155.912.2168.800000115.7E112E112-A114 PolarHBondContact O-N 2.91Å
115K43.5Very low41.7Very low207 Ų207162.6 Ų162.690%0.981%0.805SS**SBendtrans-121.8-3.1177.3-86.8-175.8177.4179.80115.7L117K115-L117 PolarHBondContact O-N 3.06Å
116S37.4Very low40.1Very low96 Ų96163.2 Ų163.267%0.67182%0.815SS**SBendtrans-86104.5161.952.80000108.3
117L43Very low39.2Very low173 Ų173157.3 Ų157.391%0.90681%0.808SS**  trans149.466159.6-79.6162.9000110K115K115-L117 PolarHBondContact O-N 3.06Å
118K40.7Very low38.2Very low204 Ų204161 Ų16189%0.88781%0.812SS**  trans-140.4120.3147.5-74.7-162.1177.7-176.90109.5
119P34.8Very low37.4Very low124 Ų124161.9 Ų161.981%0.80581%0.81SS**  trans-81.2141.5-17232.3-32.9000112.3
120K31.5Very low37.2Very low202 Ų202158.6 Ų158.688%0.87881%0.807SS**  trans17.1114.7148.1-63.4-177.7176.6176.70118.1
121L34.8Very low36.9Very low164 Ų164155.6 Ų155.686%0.85980%0.803SS**  trans-15098.7133.2-152.867.7000112.5
122K34.3Very low36.5Very low189 Ų189150.1 Ų150.182%0.82280%0.798SS**  trans22.1114.6143.2-60.2175.6179.1178.90118.4
123K33.7Very low36Very low218 Ų218149.4 Ų149.495%0.94879%0.793SS**  -149.7124.5125.3-114.8174.8-177.5-179.70110.1
124L36.5Very low35.6Very low154 Ų154149.1 Ų149.181%0.80679%0.791SS**  trans-78.1173.7-177.7-81.6149.6000111.5
125T34Very low35.2Very low135 Ų135151.6 Ų151.683%0.82880%0.799SS**  trans93.5132169.671.30000114.8
126D34Very low34.9Very low168 Ų168148 Ų14890%0.89879%0.794SS**  cis-170.4151.2-25.9-144.4-28000104.9
127G35.5Very low34.4Very low64 Ų64150.8 Ų150.866%0.6680%0.801SS**  trans11091.2157.900000120.6
128K31.3Very low34.1Very low188 Ų188147.5 Ų147.582%0.81780%0.799SS**  70.498.8124-140174.4-168.1-172.20118.9
129I29Very low33.5Very low155 Ų155143.3 Ų143.380%0.79579%0.791SS**  69.5137.370.8-50.9168000114.5
130V36.4Very low33.5Very low128 Ų128142.1 Ų142.178%0.77679%0.786SS**  trans115.8128.9149.8-178.40000112.1
131S30.4Very low33.4Very low93 Ų93139.4 Ų139.465%0.6578%0.781SS**  cis174.7161.8-4177.60000108.8
132S34.4Very low33.6Very low104 Ų104140.8 Ų140.873%0.72778%0.783SS**  trans80.4141.4145.8-70.70000119.6
133K34Very low33.4Very low171 Ų171139 Ų13974%0.74378%0.782SS**  cis179.4160.8-9.3-145.6-178.4171.9167.20108.5
134N34.5Very low33.5Very low128 Ų128136.5 Ų136.568%0.68478%0.779SS**  trans84.4142.5151.7-65.7-16.9000119.8
135V34.8Very low33.3Very low118 Ų118133.9 Ų133.972%0.71577%0.773SS**  cis158.3157.5-20.6148.30000107.2
136V38.2Very low33.5Very low133 Ų133131.8 Ų131.881%0.80676%0.764SS**  trans98.6110.7173.4-510000115.4
137D26.8Very low33.8Very low153 Ų153132 Ų13282%0.81876%0.76SS**  cis79.8112.123.7-144.417.8000115.8
138A37Very low33.8Very low104 Ų104135.5 Ų135.586%0.8676%0.763SS**  trans179.8129.1150.700000112.3
139T27.6Very low34.1Very low116 Ų116131.6 Ų131.671%0.71276%0.757SS**  trans-101.5176.3-171.9-63.50000112.1
140S35.7Very low34.4Very low100 Ų100132.1 Ų132.170%0.69976%0.761SS**  trans112.1104.2152.2-55.40000114.7
141D28.7Very low34.6Very low145 Ų145130.4 Ų130.478%0.77576%0.755SS**  77.6117.178.7-70.4-40.6000113.2
142E38.6Very low35Very low192 Ų192134.9 Ų134.990%0.89776%0.763SS**  165.8144.7127.8-82.3-127.110400113.5
143N30.2Very low35Very low152 Ų152135.4 Ų135.481%0.81377%0.766SS**  trans-71.7162.3-178.2-79.4-63.9000113.9
144L36.4Very low34.9Very low166 Ų166133.1 Ų133.187%0.86977%0.769SS**  161.6116.6108.7-163.167.5000113.9
145S32.7Very low35Very low99 Ų99137.1 Ų137.169%0.69278%0.78SS**  trans11.5135.3144.6-1700000122
146S37.6Very low34.9Very low91 Ų91139.3 Ų139.364%0.63678%0.781SS**  153.8130.4102.9-54.50000114.2
147Q39.3Very low35.1Very low172 Ų172135.8 Ų135.880%0.80477%0.771SS**  trans57.1140.9142.4-66.9173.58.300119.7
148D36.2Very low36Very low138 Ų138134.8 Ų134.874%0.73876%0.764SS**  cis-163.9166.31.5-99.3-38.7000107.1
149P37.7Very low36.3Very low106 Ų106134.2 Ų134.269%0.68875%0.747SS**  trans-101.6147.1-163.636.7-29.5000114.4
150D35Very low37.2Very low165 Ų165132.8 Ų132.888%0.88274%0.741SS**  trans-175.9146.7139.3-106.4-32.7000116.5
151S40.1Very low37.8Very low92 Ų92129.9 Ų129.964%0.64372%0.721SS**  trans81.1108.1156.6-100.50000123
152K40.2Very low38.7Very low187 Ų187125.3 Ų125.381%0.81370%0.696SS**  97.9107129.6-68.3170.4-174.9174.30121.3
153S34Very low39.3Very low115 Ų115119 Ų11980%0.80467%0.673SS**  trans95.1118.8134.974.60000119.8
154P31.7Very low40.6Very low123 Ų123115.1 Ų115.180%0.79966%0.658SS**  trans-106.9117.6177.435.5-24.2000112
155K35.8Very low41.4Very low212 Ų212108 Ų10892%0.92262%0.621SS**  trans-150.9147.5161.6-65-173.3-178.1165.50109.3
156F33.5Very low42.5Very low164 Ų164107.4 Ų107.472%0.71961%0.61SS**  trans108.261.5164.8-140.2-85.2000118.2L159F156-L159 HydrophobicContact CD1-CB 4.43Å; F156-L159 HydrophobicContact CD2-CD1 3.6Å; F156-L159 HydrophobicContact CE1-CB 3.73Å; F156-L159 HydrophobicContact CE1-CD1 4.27Å; F156-L159 HydrophobicContact CE2-CB 4.07Å; F156-L159 HydrophobicContact CE2-CD1 3.01Å; F156-L159 HydrophobicContact CE2-CG 4.11Å; F156-L159 HydrophobicContact CG-CD1 4.45Å; F156-L159 HydrophobicContact CZ-CB 3.52Å; F156-L159 HydrophobicContact CZ-CD1 3.4Å; F156-L159 HydrophobicContact CZ-CG 4.06Å
157G41.4Very low43.4Very low59 Ų59107.5 Ų107.561%0.60860%0.603SS**SBendtrans-115.6-11.7165.100000115.4
158I45.9Very low44.3Very low132 Ų132101.5 Ų101.568%0.67758%0.575SS**SBendtrans-96.1-23-169.4-63.8170000112.7S160 S161 I162I158-S160 PolarHBondContact O-N 3.36Å; I158-S161 PolarHBondContact O-OG 2.93Å; I158-I162 HydrophobicContact CG2-CD1 4.06Å
159L43.3Very low45.3Very low93 Ų9395.7 Ų95.749%0.48754%0.543SS..Hα-helixtrans-76.2-19.8-173.9-77.7159.6000114.1F156 I162 S163F156-L159 HydrophobicContact CD1-CB 4.43Å; F156-L159 HydrophobicContact CD2-CD1 3.6Å; F156-L159 HydrophobicContact CE1-CB 3.73Å; F156-L159 HydrophobicContact CE1-CD1 4.27Å; F156-L159 HydrophobicContact CE2-CB 4.07Å; F156-L159 HydrophobicContact CE2-CD1 3.01Å; F156-L159 HydrophobicContact CE2-CG 4.11Å; F156-L159 HydrophobicContact CG-CD1 4.45Å; F156-L159 HydrophobicContact CZ-CB 3.52Å; F156-L159 HydrophobicContact CZ-CD1 3.4Å; F156-L159 HydrophobicContact CZ-CG 4.06Å; L159-I162 HydrophobicContact CD2-CD1 4.3Å; L159-S163 PolarHBondContact O-N 3.23Å
160S48.1Very low46.2Very low86 Ų8695.3 Ų95.360%0.60154%0.539SS*.Hα-helixtrans-73.1-36179.960.60000113.4I158 S164I158-S160 PolarHBondContact O-N 3.36Å; S160-S164 PolarHBondContact O-N 3.08Å
161S47.7Very low47.1Very low38 Ų3894.6 Ų94.627%0.26653%0.533SS..Hα-helixtrans-72.6-36.3178.161.70000111.8I158 S164 S165I158-S161 PolarHBondContact O-OG 2.93Å; S161-S164 PolarHBondContact O-N 3.45Å; S161-S164 PolarHBondContact O-OG 3.02Å; S161-S165 PolarHBondContact O-N 3Å
162I47.1Very low47.6Very low50 Ų5099.9 Ų99.926%0.25654%0.544SS..Hα-helixtrans-61.3-47.3177.8-63.9168.4000110.5I158 L159 S164 S165 I166 P194I158-I162 HydrophobicContact CG2-CD1 4.06Å; L159-I162 HydrophobicContact CD2-CD1 4.3Å; I162-S164 VanDerWaalsContact C-N 3.28Å; I162-S164 PolarHBondContact O-N 2.96Å; I162-S165 PolarHBondContact O-N 3.38Å; I162-I166 HydrophobicContact CG2-CD1 3.65Å; I162-I166 WeakPolarHBondContact O-CG1 3.08Å; I162-I166 PolarHBondContact O-N 3.18Å; I162-P194 HydrophobicContact CG1-CB 4.03Å; I162-P194 HydrophobicContact CG1-CG 3.96Å
163S52.2Low48.3Very low59 Ų5994.8 Ų94.841%0.41353%0.532SS..Hα-helixtrans-61.5-36.6178.4-172.20000112.3L159 N167L159-S163 PolarHBondContact O-N 3.23Å; S163-N167 VanDerWaalsContact O-CB 3.26Å; S163-N167 WeakPolarHBondContact O-CB 3.14Å; S163-N167 PolarHBondContact O-N 2.95Å; S163-N167 PolarHBondContact O-ND2 3.26Å; S163-N167 PolarHBondContact OG-ND2 2.96Å
164S56.5Low49.5Very low71 Ų7195.1 Ų95.150%0.49753%0.531SS..Hα-helixtrans-69.3-37.717973.20000114S160 S161 I162 E168S160-S164 PolarHBondContact O-N 3.08Å; S161-S164 PolarHBondContact O-N 3.45Å; S161-S164 PolarHBondContact O-OG 3.02Å; I162-S164 VanDerWaalsContact C-N 3.28Å; I162-S164 PolarHBondContact O-N 2.96Å; S164-E168 PolarHBondContact O-N 3.23Å
165S52.9Low50.7Low15 Ų1596.4 Ų96.411%0.10553%0.531CS..Hα-helixtrans-68.1-40.7176.7-74.10000111.9S161 I162 P194S161-S165 PolarHBondContact O-N 3Å; I162-S165 PolarHBondContact O-N 3.38Å; S165-P194 WeakPolarHBondContact CB-O 3.24Å; S165-P194 PolarHBondContact OG-O 2.7Å
166I56.6Low52.3Low88 Ų8892.7 Ų92.745%0.45152%0.515SS..Hα-helixtrans-71.8-46.1-178.8-63.5170.5000110.5I162 E168 F169I162-I166 HydrophobicContact CG2-CD1 3.65Å; I162-I166 WeakPolarHBondContact O-CG1 3.08Å; I162-I166 PolarHBondContact O-N 3.18Å; I166-E168 PolarHBondContact O-N 3.47Å; I166-F169 PolarHBondContact O-N 2.99Å
167N55.8Low54.4Low92 Ų9294.1 Ų94.149%0.49252%0.521SS..Hα-helixtrans-64.8-24.4179.8-72.4-17.8000113.2S163 F169 T170S163-N167 VanDerWaalsContact O-CB 3.26Å; S163-N167 WeakPolarHBondContact O-CB 3.14Å; S163-N167 PolarHBondContact O-N 2.95Å; S163-N167 PolarHBondContact O-ND2 3.26Å; S163-N167 PolarHBondContact OG-ND2 2.96Å; N167-F169 PolarHBondContact O-N 3.46Å; N167-T170 PolarHBondContact O-OG1 3.14Å
168E58.2Low56Low47 Ų4793.9 Ų93.922%0.2251%0.509CS..Hα-helixtrans-65.8-29.4175-160.4168-172.300110.4K40 R102 S164 I166 K176K40-E168 WeakPolarHBondContact CE-O 3.34Å; K40-E168 PolarHBondContact NZ-O 3.34Å; R102-E168 IonicContact CZ-OE2 3.85Å; R102-E168 IonicContact NH1-OE1 2.76Å; R102-E168 IonicContact NH1-OE2 3.17Å; R102-E168 PolarHBondContact NH1-OE2 3.26Å; R102-E168 IonicContact NH2-OE1 3.79Å; R102-E168 IonicContact NH2-OE2 2.7Å; S164-E168 PolarHBondContact O-N 3.23Å; I166-E168 PolarHBondContact O-N 3.47Å; E168-K176 IonicContact OE1-NZ 2.66Å; E168-K176 PolarHBondContact OE1-NZ 2.97Å
169F56.8Low57.6Low15 Ų1589.1 Ų89.17%0.06648%0.484CS..Hα-helixtrans-75.5-25.1-175.2-96.6-92.6000114.6K40 I51 V53 I166 N167 F197K40-F169 HydrophobicContact CB-CE1 4.05Å; K40-F169 HydrophobicContact CB-CZ 4.18Å; K40-F169 HydrophobicContact CD-CD1 4.16Å; K40-F169 HydrophobicContact CD-CD2 4.25Å; K40-F169 HydrophobicContact CD-CE1 3.93Å; K40-F169 HydrophobicContact CD-CE2 3.97Å; K40-F169 HydrophobicContact CD-CG 4.31Å; K40-F169 HydrophobicContact CD-CZ 3.83Å; K40-F169 VanDerWaalsContact CE-CA 3.47Å; K40-F169 HydrophobicContact CG-CD1 4.03Å; K40-F169 HydrophobicContact CG-CE1 3.75Å; K40-F169 HydrophobicContact CG-CZ 4.09Å; K40-F169 VanDerWaalsContact NZ-CG 3.34Å; I51-F169 HydrophobicContact CG2-CZ 4.49Å; V53-F169 HydrophobicContact CG2-CD1 4.36Å; V53-F169 HydrophobicContact CG2-CD2 3.62Å; V53-F169 HydrophobicContact CG2-CE1 4.15Å; V53-F169 HydrophobicContact CG2-CE2 3.42Å; V53-F169 VanDerWaalsContact CG2-CE2 3.42Å; V53-F169 HydrophobicContact CG2-CG 4.13Å; V53-F169 HydrophobicContact CG2-CZ 3.7Å; I166-F169 PolarHBondContact O-N 2.99Å; N167-F169 PolarHBondContact O-N 3.46Å; F169-F197 HydrophobicContact CD2-CE1 4.45Å; F169-F197 AromaticContact CE2-CD1 3.84Å; F169-F197 HydrophobicContact CE2-CD1 3.84Å; F169-F197 AromaticContact CE2-CE1 3.55Å; F169-F197 HydrophobicContact CE2-CE1 3.55Å; F169-F197 HydrophobicContact CZ-CD1 4.13Å; F169-F197 HydrophobicContact CZ-CE1 4.3Å
170T56.5Low59.3Low98 Ų9891.1 Ų91.160%0.60149%0.485SS*.Hα-helixtrans-88.1-19.9-175.454.80000113.8N167N167-T170 PolarHBondContact O-OG1 3.14Å
171M54.3Low61.1Low151 Ų15187.6 Ų87.674%0.74446%0.46SS*.  trans-99.293.5-179.1-66.1-74.1175.200111.2S173M171-S173 VanDerWaalsContact C-N 3.25Å; M171-S173 PolarHBondContact O-N 3.36Å
172K51.8Low62.9Low202 Ų20291.8 Ų91.888%0.87848%0.475SS*.  trans-6679.9168.9-73.4-179179.81760110.3P174K172-P174 WeakPolarHBondContact O-CD 3.28Å
173S54.5Low64.9Low81 Ų8192.7 Ų92.757%0.56648%0.48SS*.  trans-88.8112.8168.9-1710000109.2M171 N175M171-S173 VanDerWaalsContact C-N 3.25Å; M171-S173 PolarHBondContact O-N 3.36Å; S173-N175 PolarHBondContact O-N 3.3Å
174P59.2Low66.5Low121 Ų12191.5 Ų91.579%0.78647%0.47SS*.THydrogen-bonded Turntrans-67.9-6.7-17125.9-34.6000114.8K172K172-P174 WeakPolarHBondContact O-CD 3.28Å
175N56.7Low67.6Low150 Ų15096 Ų9680%0.80249%0.489SS*.THydrogen-bonded Turntrans-115.211-170.7-73-46.7000115.1S173S173-N175 PolarHBondContact O-N 3.3Å
176K69.7Low69Low135 Ų135100.8 Ų100.859%0.58751%0.509SS*.PPolyproline II helixtrans-85.3126.2179.3-158.7173.6-170.71790110.8E168E168-K176 IonicContact OE1-NZ 2.66Å; E168-K176 PolarHBondContact OE1-NZ 2.97Å
177K76.3Confident70.3Confident193 Ų19399.7 Ų99.784%0.83950%0.502SS*.PPolyproline II helixtrans-52.1135.9175.5-66.8173.1-177.8173.80110.3M179K177-M179 PolarHBondContact O-N 3.16Å
178P76.8Confident71.7Confident55 Ų55100.5 Ų100.536%0.35750%0.501SS..PPolyproline II helixtrans-61.1136.8-176.324.6-33.9000110.6R43R43-P178 HydrophobicContact CB-CB 4.33Å; R43-P178 HydrophobicContact CB-CG 4.42Å
179M77.8Confident73Confident32 Ų3299.2 Ų99.216%0.15850%0.495CS..EExtended strand (participates in β ladder)trans-66133.3-177.8-170.4174.9101.700110.3G42 R43 R102 K177 L181 F197G42-M179 CarbonylContact C-O 3.56Å; G42-M179 WeakPolarHBondContact CA-O 3.46Å; R43-M179 PolarHBondContact N-O 3.29Å; R102-M179 HydrophobicContact CB-CE 3.32Å; R102-M179 HydrophobicContact CB-SD 3.99Å; R102-M179 WeakPolarHBondContact CD-SD 3.35Å; R102-M179 HydrophobicContact CG-CE 3.45Å; R102-M179 VanDerWaalsContact CG-CE 3.45Å; R102-M179 HydrophobicContact CG-CG 3.77Å; R102-M179 HydrophobicContact CG-SD 3.45Å; R102-M179 WeakPolarHBondContact CG-SD 3.38Å; R102-M179 PolarHBondContact NE-SD 2.98Å; K177-M179 PolarHBondContact O-N 3.16Å; M179-L181 HydrophobicContact CE-CD2 3.71Å; M179-L181 HydrophobicContact CE-CG 3.86Å; M179-L181 VanDerWaalsContact O-CD1 3.23Å; M179-L181 WeakPolarHBondContact O-CD1 3.02Å; M179-F197 HydrophobicContact CE-CD2 3.62Å; M179-F197 HydrophobicContact CE-CE2 3.55Å; M179-F197 HydrophobicContact CE-CG 4.45Å; M179-F197 HydrophobicContact CE-CZ 4.32Å; M179-F197 HydrophobicContact SD-CE2 4.46Å
180R81Confident74.5Confident135 Ų13599.9 Ų99.951%0.50950%0.5SS..EExtended strand (participates in β ladder)trans-77.8127.9174.1-68.1-174-179169.9-3.7110R43 V103R43-R180 WeakPolarHBondContact O-CA 3.42Å; V103-R180 PolarHBondContact N-O 3.43Å; V103-R180 VanDerWaalsContact N-O 3.14Å
181L85Confident75.9Confident11 Ų1196.7 Ų96.76%0.05848%0.479CS..EExtended strand (participates in β ladder)trans-117.7155.7175.7-55.8102.7000110.8R43 L44 I51 A100 V101 M179 F197R43-L181 PolarHBondContact O-N 3.39Å; L44-L181 HydrophobicContact CD1-CB 4.04Å; L44-L181 WeakPolarHBondContact CD1-O 3.12Å; I51-L181 HydrophobicContact CD1-CD1 3.21Å; I51-L181 HydrophobicContact CD1-CD2 3.85Å; I51-L181 HydrophobicContact CD1-CG 4.14Å; I51-L181 HydrophobicContact CG1-CD1 4.21Å; I51-L181 HydrophobicContact CG1-CD2 4.35Å; I51-L181 HydrophobicContact CG2-CD2 4.46Å; A100-L181 HydrophobicContact CB-CB 4.11Å; A100-L181 HydrophobicContact CB-CD2 3.9Å; V101-L181 WeakPolarHBondContact O-CA 3.18Å; M179-L181 HydrophobicContact CE-CD2 3.71Å; M179-L181 HydrophobicContact CE-CG 3.86Å; M179-L181 VanDerWaalsContact O-CD1 3.23Å; M179-L181 WeakPolarHBondContact O-CD1 3.02Å; L181-F197 HydrophobicContact CD2-CB 4.12Å; L181-F197 HydrophobicContact CD2-CD2 4.27Å; L181-F197 HydrophobicContact CD2-CG 4.49Å
182E86.1Confident77.1Confident127 Ų12796.4 Ų96.459%0.59348%0.481SS*.EExtended strand (participates in β ladder)trans-126142.9172.6-179.7169.2-159.800108.1A100 V101 V103A100-E182 CarbonylContact C-O 3.54Å; A100-E182 VanDerWaalsContact CA-O 3.28Å; A100-E182 WeakPolarHBondContact CA-O 3.48Å; V101-E182 PolarHBondContact N-O 3.4Å; V101-E182 PolarHBondContact O-N 3.39Å; V101-E182 VanDerWaalsContact O-N 3.07Å; V103-E182 HydrophobicContact CG2-CB 3.39Å
183I87.7Confident78.5Confident69 Ų6990.2 Ų90.235%0.35446%0.457SS..EExtended strand (participates in β ladder)trans-74.3132.1177.8-54179000107.1L44 Q187L44-I183 HydrophobicContact CD1-CD1 4.49Å; L44-I183 HydrophobicContact CD1-CG1 3.69Å; L44-I183 HydrophobicContact CD2-CD1 4.18Å; L44-I183 HydrophobicContact CD2-CG1 4.01Å; L44-I183 HydrophobicContact CG-CG1 4.22Å; I183-Q187 VanDerWaalsContact CG2-NE2 3.27Å
184V85.6Confident79.6Confident34 Ų3488.4 Ų88.421%0.20644%0.444CS..  trans-83.8135.8177.4-178.60000109.2R99 V101 E186 Q187R99-V184 HydrophobicContact CG-CB 4.35Å; R99-V184 HydrophobicContact CG-CG2 4.3Å; R99-V184 PolarHBondContact O-N 3.08Å; V101-V184 HydrophobicContact CB-CG2 3.83Å; V101-V184 HydrophobicContact CG2-CG2 3.28Å; V184-E186 VanDerWaalsContact C-N 3.3Å; V184-E186 HydrophobicContact CG1-CB 4.16Å; V184-E186 PolarHBondContact O-N 2.82Å; V184-Q187 PolarHBondContact O-NE2 3.19Å
185D80.5Confident80.7Confident166 Ų16686.2 Ų86.289%0.88842%0.423SS*.SBendtrans-64.3-37.2178-61.3-38.2000111.9Q187D185-Q187 PolarHBondContact O-N 3.21Å
186E82.4Confident82.1Confident115 Ų11579.3 Ų79.354%0.53739%0.386SS..SBendtrans-75.486.3172-70.1-166.8-169.400112.4R99 V184 K188R99-E186 WeakPolarHBondContact CD-O 3.36Å; V184-E186 VanDerWaalsContact C-N 3.3Å; V184-E186 HydrophobicContact CG1-CB 4.16Å; V184-E186 PolarHBondContact O-N 2.82Å; E186-K188 PolarHBondContact O-N 2.92Å; E186-K188 VanDerWaalsContact OE2-CE 3.29Å; E186-K188 WeakPolarHBondContact OE2-CE 3.41Å; E186-K188 IonicContact OE2-NZ 3.53Å; E186-K188 PolarHBondContact OE2-NZ 2.74Å
187Q83.7Confident83.1Confident64 Ų6473.4 Ų73.430%0.29936%0.36SS..  trans-78.783.2173-67.9-62.5-32.400110.2F92 R99 I183 V184 D185F92-Q187 HydrophobicContact CE1-CB 3.88Å; F92-Q187 WeakPolarHBondContact CE1-O 3.47Å; F92-Q187 HydrophobicContact CZ-CB 3.55Å; F92-Q187 HydrophobicContact CZ-CG 4.34Å; R99-Q187 PolarHBondContact O-NE2 3.26Å; I183-Q187 VanDerWaalsContact CG2-NE2 3.27Å; V184-Q187 PolarHBondContact O-NE2 3.19Å; D185-Q187 PolarHBondContact O-N 3.21Å
188K84.9Confident83.8Confident110 Ų11064.2 Ų64.248%0.47832%0.321SS..  trans-133.7147.4167.454.1171.6179.4-156.60110.9E186 V190 Y198E186-K188 PolarHBondContact O-N 2.92Å; E186-K188 VanDerWaalsContact OE2-CE 3.29Å; E186-K188 WeakPolarHBondContact OE2-CE 3.41Å; E186-K188 IonicContact OE2-NZ 3.53Å; E186-K188 PolarHBondContact OE2-NZ 2.74Å; K188-V190 HydrophobicContact CD-CG2 3.79Å; K188-V190 HydrophobicContact CG-CG2 3.74Å; K188-V190 PolarHBondContact O-N 2.67Å; K188-Y198 PolarHBondContact O-OH 3.3Å
189F86.8Confident84.6Confident19 Ų1961.9 Ų61.98%0.08331%0.305CS..  trans-76.8117.2172.5-172.3-102.2000109.3A54 V58 V85 M88 F97 Y198A54-F189 HydrophobicContact CB-CE2 3.79Å; A54-F189 HydrophobicContact CB-CZ 3.77Å; V58-F189 HydrophobicContact CG2-CE1 4.42Å; V58-F189 HydrophobicContact CG2-CZ 4.17Å; V85-F189 HydrophobicContact CB-CE1 4.46Å; V85-F189 HydrophobicContact CG1-CD1 4.05Å; V85-F189 HydrophobicContact CG1-CE1 4.05Å; V85-F189 HydrophobicContact CG2-CE1 4.42Å; M88-F189 HydrophobicContact CB-CD1 4Å; M88-F189 HydrophobicContact CB-CD2 4.24Å; M88-F189 HydrophobicContact CB-CE1 3.61Å; M88-F189 HydrophobicContact CB-CE2 3.87Å; M88-F189 HydrophobicContact CB-CG 4.3Å; M88-F189 HydrophobicContact CB-CZ 3.54Å; M88-F189 HydrophobicContact CE-CE2 3.9Å; M88-F189 HydrophobicContact CE-CZ 4.18Å; M88-F189 HydrophobicContact CG-CE1 4.35Å; M88-F189 HydrophobicContact CG-CE2 4.46Å; M88-F189 HydrophobicContact CG-CZ 3.97Å; F97-F189 HydrophobicContact CE2-CD2 4.01Å; F97-F189 HydrophobicContact CE2-CE2 4.34Å; F97-F189 HydrophobicContact CZ-CD2 4.45Å; F189-Y198 WeakPolarHBondContact CA-OH 3.36Å; F189-Y198 AromaticContact CD2-CE1 3.9Å; F189-Y198 HydrophobicContact CD2-CE1 3.9Å; F189-Y198 HydrophobicContact CD2-CE2 4.25Å; F189-Y198 AromaticContact CD2-CZ 3.7Å; F189-Y198 HydrophobicContact CE2-CE1 4.48Å; F189-Y198 HydrophobicContact CE2-CE2 4.16Å
190V87.2Confident85.2Confident29 Ų2961.3 Ų61.318%0.17630%0.301CS..  trans-131127.3-178.31790000107.7K188 D192 Y198K188-V190 HydrophobicContact CD-CG2 3.79Å; K188-V190 HydrophobicContact CG-CG2 3.74Å; K188-V190 PolarHBondContact O-N 2.67Å; V190-D192 HydrophobicContact CG1-CB 4.4Å; V190-Y198 PolarHBondContact N-OH 3.03Å; V190-Y198 PolarHBondContact O-OH 3.09Å
191L85.7Confident85.7Confident32 Ų3258.6 Ų58.617%0.16830%0.296CS..SBendtrans-86.2-28.5-177.4-167.460.8000112.5A54 M55 V58 V85 D193A54-L191 HydrophobicContact CB-CD1 3.98Å; M55-L191 HydrophobicContact CG-CD1 3.96Å; M55-L191 HydrophobicContact CG-CG 4.45Å; M55-L191 HydrophobicContact SD-CD1 3.34Å; M55-L191 WeakPolarHBondContact SD-CD1 3.49Å; M55-L191 HydrophobicContact SD-CD2 3.88Å; M55-L191 HydrophobicContact SD-CG 3.36Å; M55-L191 WeakPolarHBondContact SD-CG 3.27Å; V58-L191 HydrophobicContact CG2-CD1 3.99Å; V85-L191 HydrophobicContact CG2-CD2 4Å; L191-D193 PolarHBondContact O-N 3.14Å
192D80.1Confident85.9Confident144 Ų14460.3 Ų60.377%0.7730%0.302SS*.SBendtrans-78.9-12.5-166.6-56.8-41.6000114.9V190 P194V190-D192 HydrophobicContact CG1-CB 4.4Å; D192-P194 VanDerWaalsContact O-CD 3.22Å; D192-P194 WeakPolarHBondContact O-CD 3.25Å
193D81.4Confident85.9Confident72 Ų7262.4 Ų62.439%0.38531%0.312SS..  trans-95.2106.3-170.4-74.6-35.1000113.1R99 L191 H195 T196R99-D193 IonicContact CZ-OD2 2.58Å; R99-D193 IonicContact NH2-OD2 2.69Å; R99-D193 PolarHBondContact NH2-OD2 3.18Å; L191-D193 PolarHBondContact O-N 3.14Å; D193-H195 PolarHBondContact O-N 3.35Å; D193-H195 VanDerWaalsContact O-N 3.13Å; D193-T196 WeakPolarHBondContact CB-OG1 3.36Å; D193-T196 PolarHBondContact O-N 3.22Å; D193-T196 VanDerWaalsContact O-N 3.16Å
194P78.1Confident85.8Confident44 Ų4460.8 Ų60.829%0.28631%0.306SS..THydrogen-bonded Turntrans-74-4.8-176.932.3-39.4000114.7I162 S165 D192I162-P194 HydrophobicContact CG1-CB 4.03Å; I162-P194 HydrophobicContact CG1-CG 3.96Å; S165-P194 WeakPolarHBondContact CB-O 3.24Å; S165-P194 PolarHBondContact OG-O 2.7Å; D192-P194 VanDerWaalsContact O-CD 3.22Å; D192-P194 WeakPolarHBondContact O-CD 3.25Å
195H81.4Confident85.7Confident74 Ų7463.3 Ų63.334%0.34332%0.323SS..THydrogen-bonded Turntrans-104.8-4.7176.5-64.1-41.7000113D193 F197D193-H195 PolarHBondContact O-N 3.35Å; D193-H195 VanDerWaalsContact O-N 3.13Å; H195-F197 WeakPolarHBondContact O-CD2 3.45Å; H195-F197 WeakPolarHBondContact O-CE2 3.49Å
196T86.1Confident85.9Confident6 Ų660.1 Ų60.14%0.03731%0.311CS..EExtended strand (participates in β ladder)trans-86.1129.1176-610000108.9R99 D193 Y198R99-T196 HydrophobicContact CG-CG2 3.41Å; R99-T196 VanDerWaalsContact CG-CG2 3.41Å; R99-T196 VanDerWaalsContact NE-CG2 3.27Å; R99-T196 PolarHBondContact NE-OG1 3.33Å; R99-T196 PolarHBondContact NH2-OG1 3.19Å; D193-T196 WeakPolarHBondContact CB-OG1 3.36Å; D193-T196 PolarHBondContact O-N 3.22Å; D193-T196 VanDerWaalsContact O-N 3.16Å; T196-Y198 HydrophobicContact CG2-CD2 4.44Å; T196-Y198 HydrophobicContact CG2-CE2 3.78Å
197F89.9Confident86Confident10 Ų1056.8 Ų56.84%0.04431%0.307CS..EExtended strand (participates in β ladder)trans-118.6154.9171.2-57.1-77.4000109.4I51 V53 A100 R102 F169 M179 L181 H195I51-F197 HydrophobicContact CG2-CB 3.35Å; I51-F197 HydrophobicContact CG2-CD1 4.15Å; I51-F197 HydrophobicContact CG2-CG 3.97Å; V53-F197 HydrophobicContact CG2-CD1 4.1Å; V53-F197 HydrophobicContact CG2-CE1 4.15Å; A100-F197 CarbonylContact C-O 3.58Å; A100-F197 PolarHBondContact N-O 2.91Å; A100-F197 CarbonylContact O-C 3.56Å; A100-F197 PolarHBondContact O-N 2.85Å; R102-F197 HydrophobicContact CB-CE2 4.08Å; F169-F197 HydrophobicContact CD2-CE1 4.45Å; F169-F197 AromaticContact CE2-CD1 3.84Å; F169-F197 HydrophobicContact CE2-CD1 3.84Å; F169-F197 AromaticContact CE2-CE1 3.55Å; F169-F197 HydrophobicContact CE2-CE1 3.55Å; F169-F197 HydrophobicContact CZ-CD1 4.13Å; F169-F197 HydrophobicContact CZ-CE1 4.3Å; M179-F197 HydrophobicContact CE-CD2 3.62Å; M179-F197 HydrophobicContact CE-CE2 3.55Å; M179-F197 HydrophobicContact CE-CG 4.45Å; M179-F197 HydrophobicContact CE-CZ 4.32Å; M179-F197 HydrophobicContact SD-CE2 4.46Å; L181-F197 HydrophobicContact CD2-CB 4.12Å; L181-F197 HydrophobicContact CD2-CD2 4.27Å; L181-F197 HydrophobicContact CD2-CG 4.49Å; H195-F197 WeakPolarHBondContact O-CD2 3.45Å; H195-F197 WeakPolarHBondContact O-CE2 3.49Å
198Y92.1Very high86.3Confident1 Ų161.2 Ų61.20%0.00433%0.332CS..EExtended strand (participates in β ladder)trans-113.1131177.1-70.3-85000109.6I51 F52 A54 F92 F97 Q98 R99 K188 F189 V190 T196I51-Y198 CarbonylContact C-O 3.56Å; I51-Y198 VanDerWaalsContact CA-O 3.27Å; I51-Y198 WeakPolarHBondContact CA-O 3.25Å; F52-Y198 WeakPolarHBondContact CD1-O 3.46Å; F52-Y198 HydrophobicContact CE2-CD2 4.48Å; F52-Y198 HydrophobicContact CE2-CG 4.23Å; F52-Y198 HydrophobicContact CZ-CG 4.11Å; F52-Y198 PolarHBondContact N-O 2.84Å; F52-Y198 PolarHBondContact O-N 2.76Å; A54-Y198 HydrophobicContact CB-CD2 3.88Å; A54-Y198 HydrophobicContact CB-CE2 3.54Å; F92-Y198 HydrophobicContact CD2-CD1 4.49Å; F92-Y198 HydrophobicContact CD2-CE1 4.2Å; F92-Y198 HydrophobicContact CE2-CD1 4.47Å; F92-Y198 HydrophobicContact CE2-CE1 4.08Å; F97-Y198 AromaticContact CD2-CD1 3.63Å; F97-Y198 HydrophobicContact CD2-CD1 3.63Å; F97-Y198 HydrophobicContact CD2-CE1 4.39Å; F97-Y198 HydrophobicContact CD2-CG 4.2Å; F97-Y198 AromaticContact CE2-CD1 3.94Å; F97-Y198 HydrophobicContact CE2-CD1 3.94Å; F97-Y198 HydrophobicContact CE2-CE1 4.33Å; Q98-Y198 CarbonylContact O-C 3.58Å; Q98-Y198 WeakPolarHBondContact O-CA 3.42Å; R99-Y198 HydrophobicContact CB-CD1 4.4Å; R99-Y198 HydrophobicContact CB-CE1 3.97Å; R99-Y198 HydrophobicContact CG-CE1 4.11Å; K188-Y198 PolarHBondContact O-OH 3.3Å; F189-Y198 WeakPolarHBondContact CA-OH 3.36Å; F189-Y198 AromaticContact CD2-CE1 3.9Å; F189-Y198 HydrophobicContact CD2-CE1 3.9Å; F189-Y198 HydrophobicContact CD2-CE2 4.25Å; F189-Y198 AromaticContact CD2-CZ 3.7Å; F189-Y198 HydrophobicContact CE2-CE1 4.48Å; F189-Y198 HydrophobicContact CE2-CE2 4.16Å; V190-Y198 PolarHBondContact N-OH 3.03Å; V190-Y198 PolarHBondContact O-OH 3.09Å; T196-Y198 HydrophobicContact CG2-CD2 4.44Å; T196-Y198 HydrophobicContact CG2-CE2 3.78Å
199V92.4Very high86.5Confident5 Ų564 Ų643%0.0335%0.345CS..EExtended strand (participates in β ladder)trans-99.4126.5-178.6176.90000108.4L44 V49 I51 F97 Q98 A100 I201L44-V199 HydrophobicContact CD2-CG1 4.25Å; L44-V199 HydrophobicContact CD2-CG2 4.34Å; V49-V199 HydrophobicContact CB-CG1 3.62Å; V49-V199 HydrophobicContact CG1-CG1 4.14Å; V49-V199 HydrophobicContact CG2-CG1 3.58Å; V49-V199 HydrophobicContact CG2-CG2 4.17Å; I51-V199 HydrophobicContact CG1-CG2 4.11Å; F97-V199 CarbonylContact C-O 3.56Å; F97-V199 WeakPolarHBondContact CA-O 3.44Å; F97-V199 WeakPolarHBondContact CB-O 3.31Å; Q98-V199 PolarHBondContact N-O 2.99Å; Q98-V199 PolarHBondContact O-N 3.22Å; A100-V199 HydrophobicContact CB-CG2 3.61Å; V199-I201 PolarHBondContact O-N 3.41Å
200W92.1Very high86.8Confident21 Ų2166.7 Ų66.78%0.0836%0.363CS..EExtended strand (participates in β ladder)trans-67.6127.5173.7-73.1109000110.6L33 L37 R50 F52 F97L33-W200 HydrophobicContact CB-CH2 3.77Å; L33-W200 HydrophobicContact CB-CZ2 4.08Å; L33-W200 HydrophobicContact CD1-CH2 4.42Å; L37-W200 HydrophobicContact CD1-CZ2 3.76Å; R50-W200 HydrophobicContact CB-CB 4.48Å; R50-W200 PolarHBondContact O-N 3.45Å; F52-W200 AromaticContact CD1-CD1 3.57Å; F52-W200 AromaticContact CD1-CD2 3.97Å; F52-W200 HydrophobicContact CD1-CD2 3.97Å; F52-W200 AromaticContact CD1-CE2 3.34Å; F52-W200 HydrophobicContact CD1-CG 4.08Å; F52-W200 AromaticContact CD1-CZ2 3.76Å; F52-W200 HydrophobicContact CD1-CZ2 3.76Å; F52-W200 AromaticContact CD1-NE1 3.1Å; F52-W200 AromaticContact CE1-CD2 3.74Å; F52-W200 HydrophobicContact CE1-CD2 3.74Å; F52-W200 AromaticContact CE1-CE2 3.4Å; F52-W200 VanDerWaalsContact CE1-CE2 3.4Å; F52-W200 HydrophobicContact CE1-CE3 4.26Å; F52-W200 HydrophobicContact CE1-CG 4.14Å; F52-W200 HydrophobicContact CE1-CH2 4.15Å; F52-W200 AromaticContact CE1-CZ2 3.61Å; F52-W200 HydrophobicContact CE1-CZ2 3.61Å; F52-W200 HydrophobicContact CE1-CZ3 4.45Å; F52-W200 AromaticContact CE1-NE1 3.68Å; F52-W200 HydrophobicContact CE2-CZ2 4.43Å; F52-W200 HydrophobicContact CG-CZ2 4.2Å; F52-W200 AromaticContact CG-NE1 3.77Å; F52-W200 HydrophobicContact CZ-CH2 4.24Å; F52-W200 AromaticContact CZ-CZ2 3.96Å; F52-W200 HydrophobicContact CZ-CZ2 3.96Å; F97-W200 HydrophobicContact CB-CE3 4.4Å; F97-W200 HydrophobicContact CD1-CH2 4.48Å; F97-W200 HydrophobicContact CD1-CZ3 4.03Å
201I90.6Very high87Confident77 Ų7774.3 Ų74.340%0.39539%0.388SS..  trans-105.8-36.5171.1-60.2162.9000109.2M96 Q98 V199 E203M96-I201 PolarHBondContact O-N 3.49Å; Q98-I201 HydrophobicContact CB-CD1 3.82Å; Q98-I201 VanDerWaalsContact CD-CD1 3.42Å; Q98-I201 HydrophobicContact CG-CD1 3.42Å; Q98-I201 VanDerWaalsContact CG-CD1 3.42Å; V199-I201 PolarHBondContact O-N 3.41Å; I201-E203 PolarHBondContact O-N 3.32Å
202Y88.3Confident87.5Confident48 Ų4877.8 Ų77.819%0.18841%0.407CS..  trans-70113.6175.8-178.8-104.8000110.9I27 A30 N31 M96 P204 P205I27-Y202 WeakPolarHBondContact CG2-OH 3.49Å; A30-Y202 HydrophobicContact CB-CD1 4.38Å; A30-Y202 HydrophobicContact CB-CE1 4.49Å; N31-Y202 WeakPolarHBondContact OD1-CE1 3.37Å; N31-Y202 PolarHBondContact OD1-OH 2.82Å; M96-Y202 HydrophobicContact CE-CD1 3.58Å; M96-Y202 HydrophobicContact CE-CD2 3.52Å; M96-Y202 HydrophobicContact CE-CE1 4Å; M96-Y202 HydrophobicContact CE-CE2 3.96Å; M96-Y202 HydrophobicContact CE-CG 3.32Å; M96-Y202 PolarHBondContact O-N 2.93Å; Y202-P204 HydrophobicContact CE1-CB 4.11Å; Y202-P205 WeakPolarHBondContact OH-CD 3.3Å
203E86.8Confident88.2Confident171 Ų17173.4 Ų73.480%0.79939%0.39SS*.PPolyproline II helixtrans-94.3119.2165.6-68.7-168.3167.100109.1I201I201-E203 PolarHBondContact O-N 3.32Å
204P85.5Confident88.9Confident34 Ų3471.5 Ų71.522%0.22139%0.388CS..PPolyproline II helixtrans-62.2145.6177.928.9-36.5000109.7N31 Y202N31-P204 WeakPolarHBondContact OD1-CB 3.34Å; Y202-P204 HydrophobicContact CE1-CB 4.11Å
205P84.2Confident89.8Confident88 Ų8870.6 Ų70.657%0.57138%0.384SS*.PPolyproline II helixtrans-55.8138.817822.7-32.3000110Y202 G207Y202-P205 WeakPolarHBondContact OH-CD 3.3Å; P205-G207 PolarHBondContact O-N 2.85Å
206P84.8Confident90.5Very high99 Ų9969.7 Ų69.764%0.64339%0.389SS*.PPolyproline II helixtrans-52.8133.7179.119.9-30.8000109.4T210P206-T210 VanDerWaalsContact C-OG1 3.26Å; P206-T210 WeakPolarHBondContact CB-OG1 3.29Å
207G84.8Confident91Very high44 Ų4475 Ų7545%0.45442%0.417SS..PPolyproline II helixtrans-57.2161179.900000112.2P205 F209 T210 W211P205-G207 PolarHBondContact O-N 2.85Å; G207-F209 PolarHBondContact O-N 2.98Å; G207-F209 VanDerWaalsContact O-N 3.09Å; G207-T210 PolarHBondContact N-OG1 2.84Å; G207-T210 PolarHBondContact O-N 2.97Å; G207-T210 PolarHBondContact O-OG1 3.5Å; G207-W211 PolarHBondContact O-N 3.41Å; G207-W211 VanDerWaalsContact O-N 3.15Å
208L88.9Confident91.4Very high158 Ų15879.3 Ų79.383%0.82744%0.44SS*.Hα-helixtrans-54.2-34.5177.8-61.3176.2000112W211 L212L208-W211 PolarHBondContact O-N 2.95Å; L208-L212 VanDerWaalsContact O-CB 3.26Å; L208-L212 WeakPolarHBondContact O-CB 3.35Å; L208-L212 PolarHBondContact O-N 2.83Å
209F90.2Very high91.6Very high168 Ų16883.8 Ų83.874%0.73746%0.462SS*.Hα-helixtrans-63.5-42.2176.2-174.3-99.6000112.9G207 L212 A213G207-F209 PolarHBondContact O-N 2.98Å; G207-F209 VanDerWaalsContact O-N 3.09Å; F209-L212 PolarHBondContact O-N 3.31Å; F209-A213 VanDerWaalsContact O-CB 3.27Å; F209-A213 WeakPolarHBondContact O-CB 3.37Å; F209-A213 PolarHBondContact O-N 3Å
210T91.5Very high91.7Very high75 Ų7585.3 Ų85.346%0.4648%0.48SS..Hα-helixtrans-67.7-36.4176.837.70000112P206 G207 G214P206-T210 VanDerWaalsContact C-OG1 3.26Å; P206-T210 WeakPolarHBondContact CB-OG1 3.29Å; G207-T210 PolarHBondContact N-OG1 2.84Å; G207-T210 PolarHBondContact O-N 2.97Å; G207-T210 PolarHBondContact O-OG1 3.5Å; T210-G214 PolarHBondContact O-N 2.83Å
211W92.9Very high91.9Very high189 Ų18988.9 Ų88.972%0.71650%0.499SS*.Hα-helixtrans-67.6-43.2173.7-168.679.8000111.6G207 L208 G214 A215G207-W211 PolarHBondContact O-N 3.41Å; G207-W211 VanDerWaalsContact O-N 3.15Å; L208-W211 PolarHBondContact O-N 2.95Å; W211-G214 PolarHBondContact O-N 3.26Å; W211-A215 WeakPolarHBondContact O-CB 3.4Å; W211-A215 PolarHBondContact O-N 3.37Å
212L95.9Very high92.2Very high106 Ų10689.4 Ų89.456%0.55550%0.502SS*.Hα-helixtrans-64-39.5175.9-174.163.2000111.9L208 F209 A215 A216L208-L212 VanDerWaalsContact O-CB 3.26Å; L208-L212 WeakPolarHBondContact O-CB 3.35Å; L208-L212 PolarHBondContact O-N 2.83Å; F209-L212 PolarHBondContact O-N 3.31Å; L212-A215 PolarHBondContact O-N 2.85Å; L212-A216 WeakPolarHBondContact O-CB 3.43Å; L212-A216 PolarHBondContact O-N 3.26Å
213A95.3Very high92.3Very high51 Ų5191 Ų9142%0.42151%0.513SS..Hα-helixtrans-63.3-43.2174.500000111.5F209 A216 L217F209-A213 VanDerWaalsContact O-CB 3.27Å; F209-A213 WeakPolarHBondContact O-CB 3.37Å; F209-A213 PolarHBondContact O-N 3Å; A213-A216 PolarHBondContact O-N 2.58Å; A213-L217 WeakPolarHBondContact O-CB 3.35Å; A213-L217 PolarHBondContact O-N 2.69Å
214G95.3Very high92.5Very high33 Ų3387.5 Ų87.534%0.3451%0.506SS..Hα-helixtrans-63.1-44.8173.900000112.7T210 W211 L217 I218T210-G214 PolarHBondContact O-N 2.83Å; W211-G214 PolarHBondContact O-N 3.26Å; G214-L217 WeakPolarHBondContact O-CB 3.22Å; G214-L217 PolarHBondContact O-N 3.43Å; G214-I218 WeakPolarHBondContact O-CG1 3.39Å; G214-I218 PolarHBondContact O-N 2.89Å
215A96.3Very high92.9Very high25 Ų2590.2 Ų90.221%0.20753%0.525CS..Hα-helixtrans-62.5-43.6174.800000111.7W211 L212 L217 I218 I219W211-A215 WeakPolarHBondContact O-CB 3.4Å; W211-A215 PolarHBondContact O-N 3.37Å; L212-A215 PolarHBondContact O-N 2.85Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 3.29Å; A215-I218 PolarHBondContact O-N 2.98Å; A215-I219 WeakPolarHBondContact O-CB 3.25Å; A215-I219 WeakPolarHBondContact O-CD1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.18Å; A215-I219 PolarHBondContact O-N 3.22Å
216A96.7Very high93.3Very high54 Ų5489.7 Ų89.745%0.44652%0.517SS..Hα-helixtrans-62.6-38.7177.500000112.2L212 A213 I219 G220L212-A216 WeakPolarHBondContact O-CB 3.43Å; L212-A216 PolarHBondContact O-N 3.26Å; A213-A216 PolarHBondContact O-N 2.58Å; A216-I219 PolarHBondContact O-N 2.85Å; A216-G220 PolarHBondContact O-N 2.96Å
217L97.3Very high93.4Very high118 Ų11890.4 Ų90.462%0.61851%0.51SS*.Hα-helixtrans-59.2-49.2173.4-18072.2000111.2A213 G214 A215 G220 I221A213-L217 WeakPolarHBondContact O-CB 3.35Å; A213-L217 PolarHBondContact O-N 2.69Å; G214-L217 WeakPolarHBondContact O-CB 3.22Å; G214-L217 PolarHBondContact O-N 3.43Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 3.29Å; L217-G220 PolarHBondContact O-N 3.47Å; L217-I221 HydrophobicContact CG-CD1 4.23Å; L217-I221 WeakPolarHBondContact O-CG1 2.96Å; L217-I221 PolarHBondContact O-N 3.13Å
218I97.8Very high93.6Very high101 Ų10193.1 Ų93.152%0.51852%0.52SS..Hα-helixtrans-63-46.4179.6-64.2161.5000110.6G214 A215 G220 I221 I222G214-I218 WeakPolarHBondContact O-CG1 3.39Å; G214-I218 PolarHBondContact O-N 2.89Å; A215-I218 PolarHBondContact O-N 2.98Å; I218-G220 VanDerWaalsContact C-N 3.32Å; I218-G220 PolarHBondContact O-N 3.27Å; I218-I221 PolarHBondContact O-N 3.27Å; I218-I222 HydrophobicContact CG2-CD1 3.86Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.32Å; I218-I222 PolarHBondContact O-N 3.37Å
219I96.5Very high93.7Very high94 Ų9491.7 Ų91.748%0.48251%0.512SS..Hα-helixtrans-59.8-43176.8-67.8159.9000110.6A215 A216 I221 I222 L223A215-I219 WeakPolarHBondContact O-CB 3.25Å; A215-I219 WeakPolarHBondContact O-CD1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.18Å; A215-I219 PolarHBondContact O-N 3.22Å; A216-I219 PolarHBondContact O-N 2.85Å; I219-I221 PolarHBondContact O-N 3.21Å; I219-I222 PolarHBondContact O-N 3.4Å; I219-L223 HydrophobicContact CG2-CD1 3.98Å; I219-L223 HydrophobicContact CG2-CG 4.28Å; I219-L223 WeakPolarHBondContact O-CB 3.19Å; I219-L223 WeakPolarHBondContact O-CG 3.48Å; I219-L223 PolarHBondContact O-N 3.15Å
220G94.6Very high93.7Very high38 Ų3886.4 Ų86.439%0.39249%0.487SS..Hα-helixtrans-60-42.7176.700000112.9A216 L217 I218 L223 C224A216-G220 PolarHBondContact O-N 2.96Å; L217-G220 PolarHBondContact O-N 3.47Å; I218-G220 VanDerWaalsContact C-N 3.32Å; I218-G220 PolarHBondContact O-N 3.27Å; G220-L223 PolarHBondContact O-N 2.99Å; G220-C224 WeakPolarHBondContact O-CB 3.09Å; G220-C224 PolarHBondContact O-N 3.22Å
221I96.6Very high93.6Very high96 Ų9686.6 Ų86.649%0.49249%0.489SS..Hα-helixtrans-63.4-46.3175.5-65.1161.6000110.6L217 I218 I219 L223 C224 C225L217-I221 HydrophobicContact CG-CD1 4.23Å; L217-I221 WeakPolarHBondContact O-CG1 2.96Å; L217-I221 PolarHBondContact O-N 3.13Å; I218-I221 PolarHBondContact O-N 3.27Å; I219-I221 PolarHBondContact O-N 3.21Å; I221-L223 PolarHBondContact O-N 3.33Å; I221-C224 WeakPolarHBondContact O-CB 3.47Å; I221-C224 PolarHBondContact O-N 3.4Å; I221-C225 PolarHBondContact O-N 2.86Å; I221-C225 PolarHBondContact O-SG 3.5Å; I221-C225 VanDerWaalsContact O-SG 3.37Å
222I95.7Very high93.4Very high88 Ų8881 Ų8145%0.45148%0.479SS..Hα-helixtrans-58.7-48.2177.1-67.1165.9000110.2I218 I219 C224 C225 L226I218-I222 HydrophobicContact CG2-CD1 3.86Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.32Å; I218-I222 PolarHBondContact O-N 3.37Å; I219-I222 PolarHBondContact O-N 3.4Å; I222-C224 VanDerWaalsContact C-N 3.29Å; I222-C224 PolarHBondContact O-N 3.49Å; I222-C225 PolarHBondContact O-N 3.27Å; I222-C225 VanDerWaalsContact O-N 3.15Å; I222-L226 HydrophobicContact CG2-CD1 3.81Å; I222-L226 WeakPolarHBondContact O-CB 3.43Å; I222-L226 WeakPolarHBondContact O-CD1 3.47Å; I222-L226 PolarHBondContact O-N 2.76Å
223L91.8Very high93.2Very high82 Ų8281.9 Ų81.943%0.42948%0.48SS..Hα-helixtrans-59.7-38.5178.3-74.8176.7000112.5I219 G220 I221 L226 F227 W230I219-L223 HydrophobicContact CG2-CD1 3.98Å; I219-L223 HydrophobicContact CG2-CG 4.28Å; I219-L223 WeakPolarHBondContact O-CB 3.19Å; I219-L223 WeakPolarHBondContact O-CG 3.48Å; I219-L223 PolarHBondContact O-N 3.15Å; G220-L223 PolarHBondContact O-N 2.99Å; I221-L223 PolarHBondContact O-N 3.33Å; L223-L226 PolarHBondContact O-N 3.38Å; L223-F227 PolarHBondContact O-N 2.99Å; L223-W230 HydrophobicContact CB-CZ2 4.18Å; L223-W230 PolarHBondContact O-NE1 2.86Å
224C90.3Very high93Very high97 Ų9783.2 Ų83.266%0.65548%0.48SS*.Hα-helixtrans-65.2-43.3174.2-170.50000112G220 I221 I222 L226 F227G220-C224 WeakPolarHBondContact O-CB 3.09Å; G220-C224 PolarHBondContact O-N 3.22Å; I221-C224 WeakPolarHBondContact O-CB 3.47Å; I221-C224 PolarHBondContact O-N 3.4Å; I222-C224 VanDerWaalsContact C-N 3.29Å; I222-C224 PolarHBondContact O-N 3.49Å; C224-L226 VanDerWaalsContact C-N 3.26Å; C224-L226 PolarHBondContact O-N 3.13Å; C224-F227 VanDerWaalsContact O-CB 3.27Å; C224-F227 WeakPolarHBondContact O-CB 3.47Å; C224-F227 PolarHBondContact O-N 3.43Å
225C93.9Very high92.8Very high91 Ų9187 Ų8762%0.61548%0.484SS*.Hα-helixtrans-67.4-27.7175.7-67.30000112.7I221 I222 F227 P228I221-C225 PolarHBondContact O-N 2.86Å; I221-C225 PolarHBondContact O-SG 3.5Å; I221-C225 VanDerWaalsContact O-SG 3.37Å; I222-C225 PolarHBondContact O-N 3.27Å; I222-C225 VanDerWaalsContact O-N 3.15Å; C225-F227 VanDerWaalsContact C-N 3.28Å; C225-F227 PolarHBondContact O-N 3.33Å; C225-P228 WeakPolarHBondContact O-CD 3.33Å
226L92.4Very high92.7Very high76 Ų7690.2 Ų90.240%0.39850%0.495SS..THydrogen-bonded Turntrans-83.54.1176.1-92.471.9000113.3I222 L223 C224 P228 I229 W230I222-L226 HydrophobicContact CG2-CD1 3.81Å; I222-L226 WeakPolarHBondContact O-CB 3.43Å; I222-L226 WeakPolarHBondContact O-CD1 3.47Å; I222-L226 PolarHBondContact O-N 2.76Å; L223-L226 PolarHBondContact O-N 3.38Å; C224-L226 VanDerWaalsContact C-N 3.26Å; C224-L226 PolarHBondContact O-N 3.13Å; L226-P228 VanDerWaalsContact O-N 3.07Å; L226-I229 HydrophobicContact CB-CG2 3.7Å; L226-I229 HydrophobicContact CD2-CG2 3.85Å; L226-I229 HydrophobicContact CG-CG2 3.65Å; L226-I229 WeakPolarHBondContact O-CG2 3.47Å; L226-I229 PolarHBondContact O-N 3.42Å; L226-W230 PolarHBondContact O-N 3.42Å
227F86.2Confident92.4Very high114 Ų11491.2 Ų91.250%0.550%0.498SS..G310 helixtrans-41.9-42.3172.9-169.6-101.6000115.1L223 C224 C225 I229 W230L223-F227 PolarHBondContact O-N 2.99Å; C224-F227 VanDerWaalsContact O-CB 3.27Å; C224-F227 WeakPolarHBondContact O-CB 3.47Å; C224-F227 PolarHBondContact O-N 3.43Å; C225-F227 VanDerWaalsContact C-N 3.28Å; C225-F227 PolarHBondContact O-N 3.33Å; F227-I229 VanDerWaalsContact C-N 3.27Å; F227-I229 PolarHBondContact O-N 2.96Å; F227-W230 PolarHBondContact O-N 2.96Å
228P88.6Confident92.2Very high101 Ų10187 Ų8766%0.65648%0.48SS*.G310 helixtrans-59.8-30.4175.122.1-35.4000114.5C225 L226 R235C225-P228 WeakPolarHBondContact O-CD 3.33Å; L226-P228 VanDerWaalsContact O-N 3.07Å; P228-R235 PolarHBondContact O-NH2 3.28Å
229I91.3Very high91.9Very high129 Ų12989.6 Ų89.666%0.66248%0.484SS*.G310 helixtrans-96.70.3-176.7-161.7151.1000114.1L226 F227L226-I229 HydrophobicContact CB-CG2 3.7Å; L226-I229 HydrophobicContact CD2-CG2 3.85Å; L226-I229 HydrophobicContact CG-CG2 3.65Å; L226-I229 WeakPolarHBondContact O-CG2 3.47Å; L226-I229 PolarHBondContact O-N 3.42Å; F227-I229 VanDerWaalsContact C-N 3.27Å; F227-I229 PolarHBondContact O-N 2.96Å
230W90.3Very high92Very high57 Ų5792 Ų9222%0.21649%0.488CS..  trans-61.1140.5-179.1-82.226.9000112.7L223 L226 F227 L234 R235 A238L223-W230 HydrophobicContact CB-CZ2 4.18Å; L223-W230 PolarHBondContact O-NE1 2.86Å; L226-W230 PolarHBondContact O-N 3.42Å; F227-W230 PolarHBondContact O-N 2.96Å; W230-L234 HydrophobicContact CD2-CB 4.14Å; W230-L234 HydrophobicContact CD2-CD1 4.36Å; W230-L234 HydrophobicContact CE3-CB 3.43Å; W230-L234 VanDerWaalsContact CE3-CB 3.43Å; W230-L234 HydrophobicContact CE3-CD1 4.29Å; W230-L234 HydrophobicContact CE3-CG 4.46Å; W230-L234 HydrophobicContact CZ3-CB 3.9Å; W230-R235 HydrophobicContact CB-CG 4.02Å; W230-R235 PolarHBondContact O-NE 2.79Å; W230-R235 VanDerWaalsContact O-NE 3.12Å; W230-R235 PolarHBondContact O-NH2 2.84Å; W230-R235 VanDerWaalsContact O-NH2 3.09Å; W230-A238 HydrophobicContact CZ3-CB 4.47Å
231P90.8Very high92Very high78 Ų7896.2 Ų96.251%0.50650%0.501SS..  trans-58.6151.7171.126.6-34.8000110.8E233 L234 R235P231-E233 PolarHBondContact O-N 3.25Å; P231-E233 VanDerWaalsContact O-N 3.16Å; P231-L234 HydrophobicContact CG-CB 4.17Å; P231-L234 HydrophobicContact CG-CD1 3.82Å; P231-L234 HydrophobicContact CG-CG 3.9Å; P231-L234 PolarHBondContact O-N 3.26Å; P231-L234 VanDerWaalsContact O-N 3.13Å; P231-R235 PolarHBondContact O-N 3.47Å
232S88Confident91.9Very high72 Ų7296 Ų9650%0.50350%0.504SS..Hα-helixtrans-53.8-37.6-177.347.20000113R235 Q236S232-R235 PolarHBondContact O-N 2.92Å; S232-Q236 WeakPolarHBondContact O-CG 3.49Å; S232-Q236 PolarHBondContact O-N 3.2Å; S232-Q236 VanDerWaalsContact O-N 3.15Å
233E91.5Very high92Very high124 Ų12496 Ų9658%0.57951%0.505SS*.Hα-helixtrans-58.9-48.6177.7-61.2-60148.300112.5P231 R235 Q236 C237P231-E233 PolarHBondContact O-N 3.25Å; P231-E233 VanDerWaalsContact O-N 3.16Å; E233-R235 VanDerWaalsContact C-N 3.32Å; E233-R235 PolarHBondContact O-N 2.8Å; E233-Q236 WeakPolarHBondContact O-CB 3.46Å; E233-Q236 PolarHBondContact O-N 3.01Å; E233-C237 PolarHBondContact O-N 3.33Å; E233-C237 PolarHBondContact O-SG 2.8Å; E233-C237 VanDerWaalsContact O-SG 3.35Å
234L90.9Very high92.2Very high79 Ų7996.7 Ų96.741%0.41451%0.513SS..Hα-helixtrans-68.6-31.9-179-72.1-178.9000112.4W230 P231 Q236 C237 A238W230-L234 HydrophobicContact CD2-CB 4.14Å; W230-L234 HydrophobicContact CD2-CD1 4.36Å; W230-L234 HydrophobicContact CE3-CB 3.43Å; W230-L234 VanDerWaalsContact CE3-CB 3.43Å; W230-L234 HydrophobicContact CE3-CD1 4.29Å; W230-L234 HydrophobicContact CE3-CG 4.46Å; W230-L234 HydrophobicContact CZ3-CB 3.9Å; P231-L234 HydrophobicContact CG-CB 4.17Å; P231-L234 HydrophobicContact CG-CD1 3.82Å; P231-L234 HydrophobicContact CG-CG 3.9Å; P231-L234 PolarHBondContact O-N 3.26Å; P231-L234 VanDerWaalsContact O-N 3.13Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; L234-C237 WeakPolarHBondContact O-CB 3.45Å; L234-C237 PolarHBondContact O-N 3.44Å; L234-A238 PolarHBondContact O-N 2.7Å
235R91.3Very high92.6Very high112 Ų11294.8 Ų94.842%0.42350%0.503SS..Hα-helixtrans-63.9-39.9173.6-63.7-176-170.2143.50.2111.2P228 W230 P231 S232 E233 A238 Y239P228-R235 PolarHBondContact O-NH2 3.28Å; W230-R235 HydrophobicContact CB-CG 4.02Å; W230-R235 PolarHBondContact O-NE 2.79Å; W230-R235 VanDerWaalsContact O-NE 3.12Å; W230-R235 PolarHBondContact O-NH2 2.84Å; W230-R235 VanDerWaalsContact O-NH2 3.09Å; P231-R235 PolarHBondContact O-N 3.47Å; S232-R235 PolarHBondContact O-N 2.92Å; E233-R235 VanDerWaalsContact C-N 3.32Å; E233-R235 PolarHBondContact O-N 2.8Å; R235-A238 PolarHBondContact O-N 2.86Å; R235-Y239 PolarHBondContact O-N 2.65Å
236Q93.5Very high92.7Very high94 Ų9494 Ų9444%0.43950%0.499SS..Hα-helixtrans-64.4-43.6173.4-66.4174.818.700111.2S232 E233 L234 A238 Y239 Y240S232-Q236 WeakPolarHBondContact O-CG 3.49Å; S232-Q236 PolarHBondContact O-N 3.2Å; S232-Q236 VanDerWaalsContact O-N 3.15Å; E233-Q236 WeakPolarHBondContact O-CB 3.46Å; E233-Q236 PolarHBondContact O-N 3.01Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; Q236-A238 VanDerWaalsContact C-N 3.32Å; Q236-A238 PolarHBondContact O-N 3.4Å; Q236-Y239 WeakPolarHBondContact O-CB 3.44Å; Q236-Y239 PolarHBondContact O-N 2.97Å; Q236-Y239 VanDerWaalsContact O-N 3.16Å; Q236-Y240 HydrophobicContact CB-CD2 4.36Å; Q236-Y240 HydrophobicContact CB-CE2 4.19Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.37Å; Q236-Y240 PolarHBondContact O-N 3.09Å
237C91.7Very high92.9Very high75 Ų7592.4 Ų92.451%0.50750%0.501SS..Hα-helixtrans-56.4-45.1174.6-63.20000112.2E233 L234 Y239 Y240 L241E233-C237 PolarHBondContact O-N 3.33Å; E233-C237 PolarHBondContact O-SG 2.8Å; E233-C237 VanDerWaalsContact O-SG 3.35Å; L234-C237 WeakPolarHBondContact O-CB 3.45Å; L234-C237 PolarHBondContact O-N 3.44Å; C237-Y239 PolarHBondContact O-N 3.15Å; C237-Y240 PolarHBondContact O-N 3.32Å; C237-L241 VanDerWaalsContact O-CB 3.25Å; C237-L241 WeakPolarHBondContact O-CB 3.28Å; C237-L241 PolarHBondContact O-N 2.93Å
238A91.8Very high93.3Very high30 Ų3091.1 Ų91.125%0.24850%0.499CS..Hα-helixtrans-63.5-39.6177.100000112.4W230 L234 R235 Q236 L241 T242W230-A238 HydrophobicContact CZ3-CB 4.47Å; L234-A238 PolarHBondContact O-N 2.7Å; R235-A238 PolarHBondContact O-N 2.86Å; Q236-A238 VanDerWaalsContact C-N 3.32Å; Q236-A238 PolarHBondContact O-N 3.4Å; A238-L241 PolarHBondContact O-N 3.39Å; A238-T242 WeakPolarHBondContact O-CB 3.18Å; A238-T242 PolarHBondContact O-N 2.83Å; A238-T242 PolarHBondContact O-OG1 2.97Å
239Y93.3Very high93.6Very high154 Ų15491.1 Ų91.160%0.60449%0.493SS*.Hα-helixtrans-62.3-50.1174.7174.5-99.7000111.8R235 Q236 C237 L241 T242 I243R235-Y239 PolarHBondContact O-N 2.65Å; Q236-Y239 WeakPolarHBondContact O-CB 3.44Å; Q236-Y239 PolarHBondContact O-N 2.97Å; Q236-Y239 VanDerWaalsContact O-N 3.16Å; C237-Y239 PolarHBondContact O-N 3.15Å; Y239-L241 VanDerWaalsContact C-N 3.32Å; Y239-L241 PolarHBondContact O-N 3.3Å; Y239-T242 PolarHBondContact O-N 3.36Å; Y239-I243 PolarHBondContact O-N 2.76Å
240Y96.8Very high93.8Very high144 Ų14486.8 Ų86.857%0.56548%0.48SS*.Hα-helixtrans-63.6-36.3177.6-72-61.2000112.6Q236 C237 I243 T244Q236-Y240 HydrophobicContact CB-CD2 4.36Å; Q236-Y240 HydrophobicContact CB-CE2 4.19Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.37Å; Q236-Y240 PolarHBondContact O-N 3.09Å; C237-Y240 PolarHBondContact O-N 3.32Å; Y240-I243 HydrophobicContact CD1-CG2 4.42Å; Y240-I243 WeakPolarHBondContact O-CG2 3.35Å; Y240-T244 VanDerWaalsContact O-CB 3.25Å; Y240-T244 WeakPolarHBondContact O-CB 3.45Å; Y240-T244 PolarHBondContact O-N 3.39Å; Y240-T244 PolarHBondContact O-OG1 3.38Å
241L95.1Very high93.9Very high127 Ų12788.7 Ų88.767%0.66549%0.494SS*.Hα-helixtrans-67.3-39.6175.3-168.3126.6000111.3C237 A238 Y239 T244 A245C237-L241 VanDerWaalsContact O-CB 3.25Å; C237-L241 WeakPolarHBondContact O-CB 3.28Å; C237-L241 PolarHBondContact O-N 2.93Å; A238-L241 PolarHBondContact O-N 3.39Å; Y239-L241 VanDerWaalsContact C-N 3.32Å; Y239-L241 PolarHBondContact O-N 3.3Å; L241-T244 PolarHBondContact O-N 2.88Å; L241-A245 VanDerWaalsContact O-CB 3.32Å; L241-A245 WeakPolarHBondContact O-CB 3.41Å; L241-A245 PolarHBondContact O-N 2.83Å
242T95.5Very high93.9Very high91 Ų9187.3 Ų87.356%0.55848%0.482SS*.Hα-helixtrans-68.3-44.7177.5-55.60000111.8A238 Y239 T244 A245 S246A238-T242 WeakPolarHBondContact O-CB 3.18Å; A238-T242 PolarHBondContact O-N 2.83Å; A238-T242 PolarHBondContact O-OG1 2.97Å; Y239-T242 PolarHBondContact O-N 3.36Å; T242-T244 VanDerWaalsContact C-N 3.3Å; T242-T244 PolarHBondContact O-N 2.8Å; T242-A245 PolarHBondContact O-N 3.36Å; T242-S246 WeakPolarHBondContact O-CB 3.34Å; T242-S246 PolarHBondContact O-N 2.95Å
243I97.1Very high94.1Very high89 Ų8989.2 Ų89.246%0.45649%0.486SS..Hα-helixtrans-65.3-35.6175.7-167.166.9000111.3Y239 Y240 G247Y239-I243 PolarHBondContact O-N 2.76Å; Y240-I243 HydrophobicContact CD1-CG2 4.42Å; Y240-I243 WeakPolarHBondContact O-CG2 3.35Å; I243-G247 PolarHBondContact O-N 3.41Å
244T96.8Very high94.1Very high97 Ų9788.8 Ų88.860%0.59548%0.483SS*.Hα-helixtrans-67.1-47.1175.4-58.60000111.5Y240 L241 T242 G247 L248Y240-T244 VanDerWaalsContact O-CB 3.25Å; Y240-T244 WeakPolarHBondContact O-CB 3.45Å; Y240-T244 PolarHBondContact O-N 3.39Å; Y240-T244 PolarHBondContact O-OG1 3.38Å; L241-T244 PolarHBondContact O-N 2.88Å; T242-T244 VanDerWaalsContact C-N 3.3Å; T242-T244 PolarHBondContact O-N 2.8Å; T244-G247 PolarHBondContact O-N 3.28Å; T244-L248 WeakPolarHBondContact O-CB 3.08Å; T244-L248 PolarHBondContact O-N 3.04Å
245A96.9Very high94Very high56 Ų5686 Ų8646%0.46347%0.469SS..Hα-helixtrans-64.6-41.6177.300000111.9L241 T242 L248 L249L241-A245 VanDerWaalsContact O-CB 3.32Å; L241-A245 WeakPolarHBondContact O-CB 3.41Å; L241-A245 PolarHBondContact O-N 2.83Å; T242-A245 PolarHBondContact O-N 3.36Å; A245-L248 PolarHBondContact O-N 2.85Å; A245-L249 WeakPolarHBondContact O-CB 3.45Å; A245-L249 PolarHBondContact O-N 3.39Å
246S96.7Very high93.9Very high74 Ų7481.5 Ų81.552%0.51746%0.457SS..Hα-helixtrans-64.1-40.7174.1-174.30000111.7T242 L249 G250T242-S246 WeakPolarHBondContact O-CB 3.34Å; T242-S246 PolarHBondContact O-N 2.95Å; S246-L249 PolarHBondContact O-N 2.88Å; S246-G250 PolarHBondContact O-N 2.82Å
247G96.9Very high93.8Very high44 Ų4481.9 Ų81.945%0.45446%0.462SS..Hα-helixtrans-63.8-43174.100000112.8I243 T244 G250 L251I243-G247 PolarHBondContact O-N 3.41Å; T244-G247 PolarHBondContact O-N 3.28Å; G247-G250 PolarHBondContact O-N 3.31Å; G247-L251 WeakPolarHBondContact O-CB 3.05Å; G247-L251 PolarHBondContact O-N 2.84Å
248L94.6Very high93.8Very high86 Ų8681.4 Ų81.445%0.4545%0.454SS..Hα-helixtrans-64.6-42.3175-174.866.5000111.5T244 A245 L251 L252T244-L248 WeakPolarHBondContact O-CB 3.08Å; T244-L248 PolarHBondContact O-N 3.04Å; A245-L248 PolarHBondContact O-N 2.85Å; L248-L251 PolarHBondContact O-N 3.42Å; L248-L252 HydrophobicContact CG-CD1 4.29Å; L248-L252 WeakPolarHBondContact O-CB 3.28Å; L248-L252 WeakPolarHBondContact O-CD1 3.48Å; L248-L252 VanDerWaalsContact O-CG 3.28Å; L248-L252 WeakPolarHBondContact O-CG 3.43Å; L248-L252 PolarHBondContact O-N 3.4Å
249L94.7Very high93.6Very high102 Ų10281.6 Ų81.653%0.53445%0.448SS..Hα-helixtrans-64.7-41.9174.5-176.863.1000111.8A245 S246 L252 L253A245-L249 WeakPolarHBondContact O-CB 3.45Å; A245-L249 PolarHBondContact O-N 3.39Å; S246-L249 PolarHBondContact O-N 2.88Å; L249-L252 WeakPolarHBondContact O-CB 3.48Å; L249-L252 PolarHBondContact O-N 3.26Å; L249-L253 HydrophobicContact CG-CD1 4.47Å; L249-L253 WeakPolarHBondContact O-CG 3.11Å; L249-L253 PolarHBondContact O-N 3.18Å
250G95.8Very high93.4Very high37 Ų3779.8 Ų79.838%0.38144%0.444SS..Hα-helixtrans-62.9-40.3174.800000112.3S246 G247 L253 F254S246-G250 PolarHBondContact O-N 2.82Å; G247-G250 PolarHBondContact O-N 3.31Å; G250-L253 PolarHBondContact O-N 3.3Å; G250-F254 VanDerWaalsContact O-CB 3.26Å; G250-F254 WeakPolarHBondContact O-CB 3.48Å; G250-F254 PolarHBondContact O-N 3.05Å
251L92.8Very high93Very high98 Ų9876.3 Ų76.351%0.51344%0.439SS..Hα-helixtrans-63.2-45.9173.3-179.370.4000111.3G247 L248 F254 V255G247-L251 WeakPolarHBondContact O-CB 3.05Å; G247-L251 PolarHBondContact O-N 2.84Å; L248-L251 PolarHBondContact O-N 3.42Å; L251-F254 PolarHBondContact O-N 2.86Å; L251-V255 WeakPolarHBondContact O-CG2 3.26Å; L251-V255 PolarHBondContact O-N 2.78Å
252L90.2Very high92.7Very high49 Ų4974.2 Ų74.226%0.25743%0.425SS..Hα-helixtrans-58.5-47.7174.8-76.6163.9000110.8L248 L249 F254 V255 G256 Y282 F288 F292L248-L252 HydrophobicContact CG-CD1 4.29Å; L248-L252 WeakPolarHBondContact O-CB 3.28Å; L248-L252 WeakPolarHBondContact O-CD1 3.48Å; L248-L252 VanDerWaalsContact O-CG 3.28Å; L248-L252 WeakPolarHBondContact O-CG 3.43Å; L248-L252 PolarHBondContact O-N 3.4Å; L249-L252 WeakPolarHBondContact O-CB 3.48Å; L249-L252 PolarHBondContact O-N 3.26Å; L252-F254 VanDerWaalsContact C-N 3.34Å; L252-F254 PolarHBondContact O-N 3.45Å; L252-V255 PolarHBondContact O-N 3.46Å; L252-G256 PolarHBondContact O-N 2.68Å; L252-Y282 WeakPolarHBondContact CA-OH 3.38Å; L252-Y282 WeakPolarHBondContact CB-OH 3.45Å; L252-Y282 HydrophobicContact CD2-CE2 3.83Å; L252-Y282 WeakPolarHBondContact CD2-OH 3.19Å; L252-Y282 PolarHBondContact O-OH 3.24Å; L252-F288 HydrophobicContact CD2-CE2 4.27Å; L252-F292 HydrophobicContact CD2-CZ 4.2Å
253L91.8Very high92.1Very high112 Ų11273.8 Ų73.859%0.58641%0.414SS*.Hα-helixtrans-64-38.1176-71.3176.9000112.5L249 G250 G256 L257L249-L253 HydrophobicContact CG-CD1 4.47Å; L249-L253 WeakPolarHBondContact O-CG 3.11Å; L249-L253 PolarHBondContact O-N 3.18Å; G250-L253 PolarHBondContact O-N 3.3Å; L253-G256 CarbonylContact O-C 3.56Å; L253-G256 WeakPolarHBondContact O-CA 3.36Å; L253-G256 PolarHBondContact O-N 3.46Å; L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.42Å
254F92.8Very high91.6Very high115 Ų11572.6 Ų72.650%0.50441%0.408SS..Hα-helixtrans-63.5-42176.2-178.6-105.8000111.8G250 L251 L252 G256 L257 L258G250-F254 VanDerWaalsContact O-CB 3.26Å; G250-F254 WeakPolarHBondContact O-CB 3.48Å; G250-F254 PolarHBondContact O-N 3.05Å; L251-F254 PolarHBondContact O-N 2.86Å; L252-F254 VanDerWaalsContact C-N 3.34Å; L252-F254 PolarHBondContact O-N 3.45Å; F254-G256 VanDerWaalsContact C-N 3.32Å; F254-G256 PolarHBondContact O-N 3.37Å; F254-L257 PolarHBondContact O-N 2.84Å; F254-L258 HydrophobicContact CD1-CD1 3.74Å; F254-L258 HydrophobicContact CD1-CG 4.23Å; F254-L258 HydrophobicContact CE1-CD1 3.37Å; F254-L258 HydrophobicContact CE1-CD2 4.39Å; F254-L258 HydrophobicContact CE1-CG 3.91Å; F254-L258 HydrophobicContact CE2-CG 4.45Å; F254-L258 HydrophobicContact CZ-CD1 3.93Å; F254-L258 HydrophobicContact CZ-CD2 4.09Å; F254-L258 HydrophobicContact CZ-CG 4.02Å; F254-L258 WeakPolarHBondContact O-CB 3.27Å; F254-L258 WeakPolarHBondContact O-CG 3.26Å; F254-L258 PolarHBondContact O-N 2.91Å
255V88.8Confident91.1Very high20 Ų2073.3 Ų73.312%0.12141%0.408CS..Hα-helixtrans-62.4-40.6172.5174.20000111L251 L252 L258 R259 F279 Y282 F292L251-V255 WeakPolarHBondContact O-CG2 3.26Å; L251-V255 PolarHBondContact O-N 2.78Å; L252-V255 PolarHBondContact O-N 3.46Å; V255-L258 PolarHBondContact O-N 2.88Å; V255-R259 PolarHBondContact O-N 3.2Å; V255-F279 HydrophobicContact CG1-CD2 3.79Å; V255-F279 HydrophobicContact CG1-CE2 4.07Å; V255-Y282 HydrophobicContact CB-CE2 4.21Å; V255-Y282 HydrophobicContact CG1-CD2 3.95Å; V255-Y282 HydrophobicContact CG1-CE2 3.87Å; V255-F292 HydrophobicContact CG1-CE1 4.29Å
256G89.2Confident90.6Very high18 Ų1872.1 Ų72.119%0.18640%0.395CS..Hα-helixtrans-60.8-44.1172.800000113.2L252 L253 F254 R259 F260L252-G256 PolarHBondContact O-N 2.68Å; L253-G256 CarbonylContact O-C 3.56Å; L253-G256 WeakPolarHBondContact O-CA 3.36Å; L253-G256 PolarHBondContact O-N 3.46Å; F254-G256 VanDerWaalsContact C-N 3.32Å; F254-G256 PolarHBondContact O-N 3.37Å; G256-R259 WeakPolarHBondContact O-CB 3.5Å; G256-R259 PolarHBondContact O-N 2.92Å; G256-F260 PolarHBondContact O-N 2.87Å
257L91.1Very high89.9Confident102 Ų10275.2 Ų75.253%0.53440%0.395SS..Hα-helixtrans-65.7-42.8175.8-77.8168.5000111.7L253 F254 R259 F260 C261L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.42Å; F254-L257 PolarHBondContact O-N 2.84Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 3.42Å; L257-F260 CarbonylContact O-C 3.57Å; L257-F260 WeakPolarHBondContact O-CB 3.35Å; L257-F260 PolarHBondContact O-N 2.75Å; L257-F260 VanDerWaalsContact O-N 3.13Å; L257-C261 WeakPolarHBondContact O-CB 3.44Å; L257-C261 PolarHBondContact O-N 3.47Å; L257-C261 PolarHBondContact O-SG 2.96Å
258L91.2Very high89.4Confident65 Ų6578.7 Ų78.734%0.3440%0.403SS..Hα-helixtrans-57.5-46.1173.5-76.8173.9000110.6F254 V255 F260 C261 F262F254-L258 HydrophobicContact CD1-CD1 3.74Å; F254-L258 HydrophobicContact CD1-CG 4.23Å; F254-L258 HydrophobicContact CE1-CD1 3.37Å; F254-L258 HydrophobicContact CE1-CD2 4.39Å; F254-L258 HydrophobicContact CE1-CG 3.91Å; F254-L258 HydrophobicContact CE2-CG 4.45Å; F254-L258 HydrophobicContact CZ-CD1 3.93Å; F254-L258 HydrophobicContact CZ-CD2 4.09Å; F254-L258 HydrophobicContact CZ-CG 4.02Å; F254-L258 WeakPolarHBondContact O-CB 3.27Å; F254-L258 WeakPolarHBondContact O-CG 3.26Å; F254-L258 PolarHBondContact O-N 2.91Å; V255-L258 PolarHBondContact O-N 2.88Å; L258-F260 VanDerWaalsContact C-N 3.3Å; L258-F260 PolarHBondContact O-N 3.42Å; L258-C261 PolarHBondContact O-N 3.25Å; L258-F262 HydrophobicContact CB-CD2 4.45Å; L258-F262 HydrophobicContact CB-CE2 4.46Å; L258-F262 HydrophobicContact CD2-CE2 4.41Å; L258-F262 WeakPolarHBondContact O-CB 3.32Å; L258-F262 WeakPolarHBondContact O-CD2 3.18Å; L258-F262 PolarHBondContact O-N 3.2Å
259R87.1Confident88.9Confident33 Ų3379.3 Ų79.313%0.12542%0.415CS..Hα-helixtrans-57.4-43174.7179.3177.4171.9147-0.3111.9V255 G256 L257 Y263 W277 I278 F279 P280V255-R259 PolarHBondContact O-N 3.2Å; G256-R259 WeakPolarHBondContact O-CB 3.5Å; G256-R259 PolarHBondContact O-N 2.92Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 3.42Å; R259-Y263 WeakPolarHBondContact O-CB 3.34Å; R259-Y263 PolarHBondContact O-N 2.99Å; R259-W277 HydrophobicContact CG-CE3 4.25Å; R259-W277 VanDerWaalsContact NH2-CZ3 3.29Å; R259-I278 VanDerWaalsContact CA-CG2 3.48Å; R259-I278 HydrophobicContact CB-CG2 3.6Å; R259-I278 WeakPolarHBondContact CD-O 3.38Å; R259-I278 HydrophobicContact CG-CG2 3.99Å; R259-F279 PolarHBondContact NH1-O 3.37Å; R259-P280 PolarHBondContact NH1-O 3.47Å; R259-P280 VanDerWaalsContact NH1-O 3.14Å
260F88.8Confident88.2Confident116 Ų11675.9 Ų75.951%0.50940%0.398SS..Hα-helixtrans-66.2-45.6176.1-179.1-109.4000112.7G256 L257 L258 F262 Y263 L264G256-F260 PolarHBondContact O-N 2.87Å; L257-F260 CarbonylContact O-C 3.57Å; L257-F260 WeakPolarHBondContact O-CB 3.35Å; L257-F260 PolarHBondContact O-N 2.75Å; L257-F260 VanDerWaalsContact O-N 3.13Å; L258-F260 VanDerWaalsContact C-N 3.3Å; L258-F260 PolarHBondContact O-N 3.42Å; F260-F262 PolarHBondContact O-N 3.41Å; F260-Y263 PolarHBondContact O-N 3.42Å; F260-L264 HydrophobicContact CD1-CD1 3.89Å; F260-L264 HydrophobicContact CD1-CG 4.37Å; F260-L264 HydrophobicContact CE1-CD1 3.3Å; F260-L264 HydrophobicContact CE1-CG 3.99Å; F260-L264 HydrophobicContact CE2-CD1 4.34Å; F260-L264 HydrophobicContact CE2-CD2 4.37Å; F260-L264 HydrophobicContact CE2-CG 4.18Å; F260-L264 HydrophobicContact CZ-CD1 3.57Å; F260-L264 HydrophobicContact CZ-CD2 4.12Å; F260-L264 HydrophobicContact CZ-CG 3.88Å; F260-L264 WeakPolarHBondContact O-CG 3.48Å; F260-L264 PolarHBondContact O-N 3.43Å
261C89.9Confident87.3Confident71 Ų7182 Ų8248%0.4842%0.421SS..Hα-helixtrans-60.2-45.5176.6-70.90000111.6L257 L258 L264 L265L257-C261 WeakPolarHBondContact O-CB 3.44Å; L257-C261 PolarHBondContact O-N 3.47Å; L257-C261 PolarHBondContact O-SG 2.96Å; L258-C261 PolarHBondContact O-N 3.25Å; C261-L264 PolarHBondContact O-N 3.27Å; C261-L265 WeakPolarHBondContact O-CB 3.36Å; C261-L265 PolarHBondContact O-N 2.87Å
262F87.3Confident86.1Confident84 Ų8479.2 Ų79.237%0.36842%0.415SS..Hα-helixtrans-64.2-40.9175.9-80.2-63.9000112.2L258 F260 L265 V266 F276 I278L258-F262 HydrophobicContact CB-CD2 4.45Å; L258-F262 HydrophobicContact CB-CE2 4.46Å; L258-F262 HydrophobicContact CD2-CE2 4.41Å; L258-F262 WeakPolarHBondContact O-CB 3.32Å; L258-F262 WeakPolarHBondContact O-CD2 3.18Å; L258-F262 PolarHBondContact O-N 3.2Å; F260-F262 PolarHBondContact O-N 3.41Å; F262-L265 PolarHBondContact O-N 3.37Å; F262-V266 WeakPolarHBondContact O-CB 3.2Å; F262-V266 WeakPolarHBondContact O-CG2 3.45Å; F262-V266 PolarHBondContact O-N 2.96Å; F262-F276 HydrophobicContact CB-CD1 4.17Å; F262-F276 HydrophobicContact CB-CE1 4.21Å; F262-F276 HydrophobicContact CD1-CE1 4.33Å; F262-F276 HydrophobicContact CG-CE1 4.29Å; F262-I278 HydrophobicContact CD2-CG2 4.31Å
263Y84.2Confident85Confident81 Ų8182.8 Ų82.832%0.31843%0.431SS..Hα-helixtrans-60.7-45.6173.9178.2-96.5000111.4R259 F260 W267 W277R259-Y263 WeakPolarHBondContact O-CB 3.34Å; R259-Y263 PolarHBondContact O-N 2.99Å; F260-Y263 PolarHBondContact O-N 3.42Å; Y263-W267 WeakPolarHBondContact O-CB 3.38Å; Y263-W267 PolarHBondContact O-N 3.23Å; Y263-W277 HydrophobicContact CD2-CH2 4.2Å; Y263-W277 HydrophobicContact CD2-CZ2 4.17Å; Y263-W277 HydrophobicContact CD2-CZ3 4.38Å; Y263-W277 HydrophobicContact CE2-CH2 4.28Å; Y263-W277 HydrophobicContact CE2-CZ2 4.01Å
264L86.4Confident83.8Confident64 Ų6482.1 Ų82.134%0.33542%0.421SS..Hα-helixtrans-62.3-44.3175.3-76.2-177.4000112.4F260 C261 V266 W267 L268F260-L264 HydrophobicContact CD1-CD1 3.89Å; F260-L264 HydrophobicContact CD1-CG 4.37Å; F260-L264 HydrophobicContact CE1-CD1 3.3Å; F260-L264 HydrophobicContact CE1-CG 3.99Å; F260-L264 HydrophobicContact CE2-CD1 4.34Å; F260-L264 HydrophobicContact CE2-CD2 4.37Å; F260-L264 HydrophobicContact CE2-CG 4.18Å; F260-L264 HydrophobicContact CZ-CD1 3.57Å; F260-L264 HydrophobicContact CZ-CD2 4.12Å; F260-L264 HydrophobicContact CZ-CG 3.88Å; F260-L264 WeakPolarHBondContact O-CG 3.48Å; F260-L264 PolarHBondContact O-N 3.43Å; C261-L264 PolarHBondContact O-N 3.27Å; L264-V266 PolarHBondContact O-N 3.46Å; L264-W267 PolarHBondContact O-N 3.35Å; L264-L268 WeakPolarHBondContact O-CB 3.25Å; L264-L268 PolarHBondContact O-N 3.47Å
265L87Confident82.4Confident112 Ų11278.7 Ų78.759%0.58641%0.412SS*.Hα-helixtrans-64.1-42.8-178.4-151.776.3000111.2C261 F262 S269C261-L265 WeakPolarHBondContact O-CB 3.36Å; C261-L265 PolarHBondContact O-N 2.87Å; F262-L265 PolarHBondContact O-N 3.37Å; L265-S269 VanDerWaalsContact O-CB 3.25Å; L265-S269 WeakPolarHBondContact O-CB 3.2Å; L265-S269 PolarHBondContact O-N 2.99Å; L265-S269 PolarHBondContact O-OG 3.25Å
266V84.8Confident81.6Confident32 Ų3279.4 Ų79.419%0.19441%0.413CS..Hα-helixtrans-70.9-40.5176.5172.60000111.1F262 L264 S269 T270 Y274 F276F262-V266 WeakPolarHBondContact O-CB 3.2Å; F262-V266 WeakPolarHBondContact O-CG2 3.45Å; F262-V266 PolarHBondContact O-N 2.96Å; L264-V266 PolarHBondContact O-N 3.46Å; V266-S269 PolarHBondContact O-N 3.15Å; V266-T270 WeakPolarHBondContact O-CB 3.18Å; V266-T270 PolarHBondContact O-N 3.35Å; V266-T270 PolarHBondContact O-OG1 3.41Å; V266-Y274 WeakPolarHBondContact CG1-O 3.25Å; V266-F276 HydrophobicContact CB-CB 4.14Å; V266-F276 HydrophobicContact CG1-CB 3.91Å; V266-F276 HydrophobicContact CG2-CB 3.75Å; V266-F276 HydrophobicContact CG2-CD1 4.12Å; V266-F276 HydrophobicContact CG2-CG 4.23Å
267W83.6Confident80.7Confident139 Ų13983 Ų8353%0.52742%0.421SS..Hα-helixtrans-63.5-45.3177.1-177.279.2000112Y263 L264 L271Y263-W267 WeakPolarHBondContact O-CB 3.38Å; Y263-W267 PolarHBondContact O-N 3.23Å; L264-W267 PolarHBondContact O-N 3.35Å; W267-L271 PolarHBondContact O-N 2.9Å; W267-L271 VanDerWaalsContact O-N 3.08Å
268L85.3Confident79.7Confident116 Ų11679.5 Ų79.561%0.60740%0.402SS*.Hα-helixtrans-62.3-47.5173.5-104.669.9000111.9L264 T270L264-L268 WeakPolarHBondContact O-CB 3.25Å; L264-L268 PolarHBondContact O-N 3.47Å; L268-T270 VanDerWaalsContact C-N 3.28Å; L268-T270 PolarHBondContact O-N 3.37Å
269S84.2Confident78.8Confident100 Ų10078 Ų7870%0.69939%0.393SS*.Hα-helixtrans-70.5-26.5-175.5-580000112.9L265 V266L265-S269 VanDerWaalsContact O-CB 3.25Å; L265-S269 WeakPolarHBondContact O-CB 3.2Å; L265-S269 PolarHBondContact O-N 2.99Å; L265-S269 PolarHBondContact O-OG 3.25Å; V266-S269 PolarHBondContact O-N 3.15Å
270T80.1Confident78Confident29 Ų2978.1 Ų78.118%0.17840%0.398CS..Hα-helixtrans-106.6-7.8-171.2-48.30000113.5V266 L268 G272 Q273 Y274V266-T270 WeakPolarHBondContact O-CB 3.18Å; V266-T270 PolarHBondContact O-N 3.35Å; V266-T270 PolarHBondContact O-OG1 3.41Å; L268-T270 VanDerWaalsContact C-N 3.28Å; L268-T270 PolarHBondContact O-N 3.37Å; T270-G272 PolarHBondContact O-N 3.49Å; T270-G272 VanDerWaalsContact O-N 3.08Å; T270-Q273 HydrophobicContact CG2-CB 3.63Å; T270-Q273 HydrophobicContact CG2-CG 4.42Å; T270-Q273 PolarHBondContact O-N 3.16Å; T270-Y274 HydrophobicContact CG2-CD2 3.2Å; T270-Y274 HydrophobicContact CG2-CE2 4.07Å; T270-Y274 HydrophobicContact CG2-CG 3.9Å; T270-Y274 VanDerWaalsContact CG2-N 3.33Å
271L76.2Confident77.6Confident167 Ų16774.8 Ų74.887%0.87439%0.386SS*.THydrogen-bonded Turntrans52.331-172.6-65.7157.6000112.4W267W267-L271 PolarHBondContact O-N 2.9Å; W267-L271 VanDerWaalsContact O-N 3.08Å
272G68.5Low76.9Confident38 Ų3872.9 Ų72.939%0.39237%0.369SS..THydrogen-bonded Turntrans94.13.7174.100000118.4T270T270-G272 PolarHBondContact O-N 3.49Å; T270-G272 VanDerWaalsContact O-N 3.08Å
273Q67.3Low76.3Confident124 Ų12476 Ų7658%0.57938%0.383SS*.SBendtrans-83-14-178.8-51.9-169.8-16.200116.2T270 A301T270-Q273 HydrophobicContact CG2-CB 3.63Å; T270-Q273 HydrophobicContact CG2-CG 4.42Å; T270-Q273 PolarHBondContact O-N 3.16Å; Q273-A301 WeakPolarHBondContact O-CB 3.43Å; Q273-A301 PolarHBondContact O-N 3.38Å
274Y66.7Low76.1Confident98 Ų9877.8 Ų77.838%0.38439%0.394SS..EExtended strand (participates in β ladder)trans-128130.1-178.5-71.6-75.7000109.8V266 T270 H300V266-Y274 WeakPolarHBondContact CG1-O 3.25Å; T270-Y274 HydrophobicContact CG2-CD2 3.2Å; T270-Y274 HydrophobicContact CG2-CE2 4.07Å; T270-Y274 HydrophobicContact CG2-CG 3.9Å; T270-Y274 VanDerWaalsContact CG2-N 3.33Å; Y274-H300 HydrophobicContact CD1-CB 4.43Å; Y274-H300 HydrophobicContact CE1-CB 4.14Å; Y274-H300 AromaticContact CE1-CD2 3.09Å; Y274-H300 WeakPolarHBondContact CE1-CD2 3.45Å; Y274-H300 AromaticContact CE1-CG 3.77Å; Y274-H300 AromaticContact CE1-NE2 3.83Å; Y274-H300 AromaticContact CZ-CD2 3.37Å; Y274-H300 AromaticContact CZ-NE2 3.61Å; Y274-H300 PolarHBondContact OH-CD2 3.16Å; Y274-H300 PolarHBondContact OH-NE2 3.49Å; Y274-H300 VanDerWaalsContact OH-NE2 3.14Å
275S62.8Low75.6Confident44 Ų4483 Ų8331%0.30842%0.422SS..EExtended strand (participates in β ladder)trans-104.998.2169.8-70.60000108.3K299S275-K299 PolarHBondContact N-O 3.04Å; S275-K299 VanDerWaalsContact N-O 3.13Å; S275-K299 PolarHBondContact O-N 3.13Å; S275-K299 VanDerWaalsContact O-N 3.12Å
276F71.4Confident75.1Confident34 Ų3480.5 Ų80.515%0.14941%0.413CS..EExtended strand (participates in β ladder)trans-93.6122.7171.2-179.2-112.9000109.6F262 V266 I278 Y296 L298F262-F276 HydrophobicContact CB-CD1 4.17Å; F262-F276 HydrophobicContact CB-CE1 4.21Å; F262-F276 HydrophobicContact CD1-CE1 4.33Å; F262-F276 HydrophobicContact CG-CE1 4.29Å; V266-F276 HydrophobicContact CB-CB 4.14Å; V266-F276 HydrophobicContact CG1-CB 3.91Å; V266-F276 HydrophobicContact CG2-CB 3.75Å; V266-F276 HydrophobicContact CG2-CD1 4.12Å; V266-F276 HydrophobicContact CG2-CG 4.23Å; F276-I278 HydrophobicContact CE1-CB 4.32Å; F276-I278 HydrophobicContact CE1-CD1 3.97Å; F276-I278 HydrophobicContact CZ-CD1 3.68Å; F276-Y296 HydrophobicContact CE2-CD2 4.27Å; F276-Y296 HydrophobicContact CE2-CG 4.29Å; F276-L298 HydrophobicContact CD2-CD1 3.18Å; F276-L298 HydrophobicContact CD2-CG 3.76Å; F276-L298 HydrophobicContact CE2-CD1 3.34Å; F276-L298 HydrophobicContact CE2-CG 4.39Å; F276-L298 HydrophobicContact CG-CD1 4.41Å
277W71.7Confident75Confident95 Ų9581.5 Ų81.536%0.3643%0.43SS..EExtended strand (participates in β ladder)trans-120114.8174.3-67.898.6000109.3R259 Y263 Y296 S297R259-W277 HydrophobicContact CG-CE3 4.25Å; R259-W277 VanDerWaalsContact NH2-CZ3 3.29Å; Y263-W277 HydrophobicContact CD2-CH2 4.2Å; Y263-W277 HydrophobicContact CD2-CZ2 4.17Å; Y263-W277 HydrophobicContact CD2-CZ3 4.38Å; Y263-W277 HydrophobicContact CE2-CH2 4.28Å; Y263-W277 HydrophobicContact CE2-CZ2 4.01Å; W277-Y296 CarbonylContact O-C 3.33Å; W277-Y296 WeakPolarHBondContact O-CA 3.2Å; W277-S297 PolarHBondContact N-O 3.32Å; W277-S297 PolarHBondContact O-N 3.35Å
278I70.2Confident74.8Confident27 Ų2779.7 Ų79.714%0.13843%0.426CS..EExtended strand (participates in β ladder)trans-77.7136165.7-150.678.9000108.1R259 F262 F276 L295R259-I278 VanDerWaalsContact CA-CG2 3.48Å; R259-I278 HydrophobicContact CB-CG2 3.6Å; R259-I278 WeakPolarHBondContact CD-O 3.38Å; R259-I278 HydrophobicContact CG-CG2 3.99Å; F262-I278 HydrophobicContact CD2-CG2 4.31Å; F276-I278 HydrophobicContact CE1-CB 4.32Å; F276-I278 HydrophobicContact CE1-CD1 3.97Å; F276-I278 HydrophobicContact CZ-CD1 3.68Å; I278-L295 CarbonylContact C-O 3.6Å; I278-L295 WeakPolarHBondContact CA-O 3.27Å; I278-L295 VanDerWaalsContact CD1-O 3.24Å; I278-L295 WeakPolarHBondContact CD1-O 3.37Å; I278-L295 VanDerWaalsContact CG1-O 3.25Å; I278-L295 WeakPolarHBondContact CG1-O 3.45Å
279F72.4Confident74.7Confident34 Ų3482.3 Ų82.315%0.14943%0.433CS..SBendtrans47.567.5-175.6-60.6-67.7000114.4V255 R259 N281 Y282 F292 L295V255-F279 HydrophobicContact CG1-CD2 3.79Å; V255-F279 HydrophobicContact CG1-CE2 4.07Å; R259-F279 PolarHBondContact NH1-O 3.37Å; F279-N281 PolarHBondContact O-N 3.4Å; F279-N281 VanDerWaalsContact O-N 3.09Å; F279-Y282 VanDerWaalsContact O-CB 3.31Å; F279-Y282 WeakPolarHBondContact O-CB 3.49Å; F279-Y282 PolarHBondContact O-N 2.97Å; F279-F292 HydrophobicContact CD1-CB 4.09Å; F279-F292 HydrophobicContact CD1-CD1 4.1Å; F279-F292 WeakPolarHBondContact CD1-O 3.44Å; F279-F292 HydrophobicContact CE1-CB 3.84Å; F279-F292 AromaticContact CE1-CD1 3.99Å; F279-F292 HydrophobicContact CE1-CD1 3.99Å; F279-F292 HydrophobicContact CE1-CG 4.41Å; F279-F292 VanDerWaalsContact CE1-O 3.23Å; F279-F292 WeakPolarHBondContact CE1-O 3.49Å; F279-F292 HydrophobicContact CG-CD1 4.43Å; F279-F292 HydrophobicContact CZ-CD1 4.25Å; F279-L295 HydrophobicContact CE1-CB 4.35Å; F279-L295 HydrophobicContact CE1-CD2 3.64Å; F279-L295 HydrophobicContact CE1-CG 3.72Å; F279-L295 HydrophobicContact CE2-CD2 4.43Å; F279-L295 HydrophobicContact CZ-CD2 3.49Å; F279-L295 VanDerWaalsContact CZ-CD2 3.49Å; F279-L295 HydrophobicContact CZ-CG 4.12Å; F279-L295 PolarHBondContact N-O 3.15Å
280P70.4Confident74.5Confident35 Ų3583.3 Ų83.323%0.22743%0.426CS..G310 helixtrans-46.7-41.7178.117.9-33.1000113.2R259 Y282 P294R259-P280 PolarHBondContact NH1-O 3.47Å; R259-P280 VanDerWaalsContact NH1-O 3.14Å; P280-Y282 VanDerWaalsContact C-N 3.32Å; P280-Y282 PolarHBondContact O-N 3.14Å; P280-P294 WeakPolarHBondContact CD-O 3.48Å; P280-P294 HydrophobicContact CG-CG 3.86Å
281N79Confident74.6Confident46 Ų4682.5 Ų82.525%0.24642%0.422CS..G310 helixtrans-82.65.1-175.6-66.3-6.7000115.2F279 F283 E284 S291 R293F279-N281 PolarHBondContact O-N 3.4Å; F279-N281 VanDerWaalsContact O-N 3.09Å; N281-F283 PolarHBondContact O-N 3.01Å; N281-E284 HydrophobicContact CB-CB 4.41Å; N281-E284 PolarHBondContact O-N 3.3Å; N281-S291 CarbonylContact C-O 3.55Å; N281-S291 WeakPolarHBondContact O-CA 3.46Å; N281-S291 WeakPolarHBondContact O-CB 3.32Å; N281-R293 PolarHBondContact ND2-O 3.17Å
282Y76.1Confident74.7Confident32 Ų3276.8 Ų76.813%0.12539%0.39CS..G310 helixtrans-60.7-32.1-175.4-174.8-102.1000114.1L252 V255 F279 P280 S291 F292L252-Y282 WeakPolarHBondContact CA-OH 3.38Å; L252-Y282 WeakPolarHBondContact CB-OH 3.45Å; L252-Y282 HydrophobicContact CD2-CE2 3.83Å; L252-Y282 WeakPolarHBondContact CD2-OH 3.19Å; L252-Y282 PolarHBondContact O-OH 3.24Å; V255-Y282 HydrophobicContact CB-CE2 4.21Å; V255-Y282 HydrophobicContact CG1-CD2 3.95Å; V255-Y282 HydrophobicContact CG1-CE2 3.87Å; F279-Y282 VanDerWaalsContact O-CB 3.31Å; F279-Y282 WeakPolarHBondContact O-CB 3.49Å; F279-Y282 PolarHBondContact O-N 2.97Å; P280-Y282 VanDerWaalsContact C-N 3.32Å; P280-Y282 PolarHBondContact O-N 3.14Å; Y282-S291 PolarHBondContact N-O 3.34Å; Y282-F292 HydrophobicContact CD2-CD1 4.23Å; Y282-F292 AromaticContact CD2-CE1 3.6Å; Y282-F292 HydrophobicContact CD2-CE1 3.6Å; Y282-F292 HydrophobicContact CD2-CZ 4.12Å; Y282-F292 AromaticContact CE2-CE1 3.55Å; Y282-F292 HydrophobicContact CE2-CE1 3.55Å; Y282-F292 AromaticContact CE2-CZ 3.8Å; Y282-F292 HydrophobicContact CE2-CZ 3.8Å
283F73.4Confident75Confident150 Ų15083.9 Ų83.966%0.65841%0.405SS*.G310 helixtrans-111.99.2177.5-63.9-71.1000113N281N281-F283 PolarHBondContact O-N 3.01Å
284E79.8Confident75.2Confident118 Ų11881.4 Ų81.455%0.55140%0.4SS*.SBendtrans-78.4151.4171.3-76.1-68165.100109.4N281 C286N281-E284 HydrophobicContact CB-CB 4.41Å; N281-E284 PolarHBondContact O-N 3.3Å; E284-C286 PolarHBondContact O-N 3.19Å
285D76.3Confident75.4Confident172 Ų17281.9 Ų81.992%0.9241%0.408SS*.SBendtrans-70.761.2179.9-73.2-32.1000111.3
286C77.7Confident75.9Confident61 Ų6186.9 Ų86.941%0.41242%0.421SS..  trans-119.9153.1-176.8-650000109.4E284 E290 S291E284-C286 PolarHBondContact O-N 3.19Å; C286-E290 HydrophobicContact CB-CB 3.83Å; C286-S291 PolarHBondContact O-OG 2.88Å
287G82Confident75.7Confident52 Ų5287.1 Ų87.154%0.53643%0.427SS..  trans-61.5154.2172.300000111.2F289 E290 S291G287-F289 PolarHBondContact O-N 3.39Å; G287-E290 PolarHBondContact O-N 2.98Å; G287-S291 PolarHBondContact O-N 3.33Å; G287-S291 VanDerWaalsContact O-N 3.13Å; G287-S291 PolarHBondContact O-OG 3.22Å
288F80.1Confident75.3Confident101 Ų10188 Ų8844%0.44344%0.438SS..Hα-helixtrans-43.7-43-175.2178.1-95.4000114.2L252 S291 F292L252-F288 HydrophobicContact CD2-CE2 4.27Å; F288-S291 PolarHBondContact O-N 3.41Å; F288-F292 HydrophobicContact CD1-CE2 4.09Å; F288-F292 AromaticContact CD2-CE2 3.67Å; F288-F292 HydrophobicContact CD2-CE2 3.67Å; F288-F292 HydrophobicContact CD2-CZ 4.31Å; F288-F292 HydrophobicContact CE1-CD2 4.37Å; F288-F292 AromaticContact CE1-CE2 3.86Å; F288-F292 HydrophobicContact CE1-CE2 3.86Å; F288-F292 AromaticContact CE2-CE2 3.42Å; F288-F292 HydrophobicContact CE2-CE2 3.42Å; F288-F292 VanDerWaalsContact CE2-CE2 3.42Å; F288-F292 AromaticContact CE2-CZ 3.83Å; F288-F292 HydrophobicContact CE2-CZ 3.83Å; F288-F292 AromaticContact CG-CE2 4Å; F288-F292 HydrophobicContact CG-CE2 4Å; F288-F292 HydrophobicContact CZ-CD2 4.4Å; F288-F292 AromaticContact CZ-CE2 3.52Å; F288-F292 HydrophobicContact CZ-CE2 3.52Å; F288-F292 HydrophobicContact CZ-CZ 4.11Å; F288-F292 WeakPolarHBondContact O-CD2 3.31Å; F288-F292 VanDerWaalsContact O-CE2 3.22Å; F288-F292 WeakPolarHBondContact O-CE2 3.09Å
289F82.1Confident75.1Confident172 Ų17292.5 Ų92.575%0.75446%0.457SS*.Hα-helixtrans-72.5-31.7-178.8-64.9-71.9000114.6G287G287-F289 PolarHBondContact O-N 3.39Å
290E80.4Confident74.2Confident120 Ų12094.5 Ų94.556%0.56147%0.467SS*.Hα-helixtrans-75.9-29.4177-72.5-65.8164.200111C286 G287 F292 R293C286-E290 HydrophobicContact CB-CB 3.83Å; G287-E290 PolarHBondContact O-N 2.98Å; E290-F292 PolarHBondContact O-N 3.5Å; E290-R293 PolarHBondContact O-N 3.22Å
291S83.3Confident73.6Confident12 Ų1295 Ų958%0.08447%0.474CS..Hα-helixtrans-60.8-27.5177.6-53.90000113.7N281 Y282 C286 G287 F288N281-S291 CarbonylContact C-O 3.55Å; N281-S291 WeakPolarHBondContact O-CA 3.46Å; N281-S291 WeakPolarHBondContact O-CB 3.32Å; Y282-S291 PolarHBondContact N-O 3.34Å; C286-S291 PolarHBondContact O-OG 2.88Å; G287-S291 PolarHBondContact O-N 3.33Å; G287-S291 VanDerWaalsContact O-N 3.13Å; G287-S291 PolarHBondContact O-OG 3.22Å; F288-S291 PolarHBondContact O-N 3.41Å
292F77.7Confident72.2Confident47 Ų4797.2 Ų97.221%0.20649%0.492CS..THydrogen-bonded Turntrans-97.69-178.9-58.4-74000114.5L252 V255 F279 Y282 F288 E290L252-F292 HydrophobicContact CD2-CZ 4.2Å; V255-F292 HydrophobicContact CG1-CE1 4.29Å; F279-F292 HydrophobicContact CD1-CB 4.09Å; F279-F292 HydrophobicContact CD1-CD1 4.1Å; F279-F292 WeakPolarHBondContact CD1-O 3.44Å; F279-F292 HydrophobicContact CE1-CB 3.84Å; F279-F292 AromaticContact CE1-CD1 3.99Å; F279-F292 HydrophobicContact CE1-CD1 3.99Å; F279-F292 HydrophobicContact CE1-CG 4.41Å; F279-F292 VanDerWaalsContact CE1-O 3.23Å; F279-F292 WeakPolarHBondContact CE1-O 3.49Å; F279-F292 HydrophobicContact CG-CD1 4.43Å; F279-F292 HydrophobicContact CZ-CD1 4.25Å; Y282-F292 HydrophobicContact CD2-CD1 4.23Å; Y282-F292 AromaticContact CD2-CE1 3.6Å; Y282-F292 HydrophobicContact CD2-CE1 3.6Å; Y282-F292 HydrophobicContact CD2-CZ 4.12Å; Y282-F292 AromaticContact CE2-CE1 3.55Å; Y282-F292 HydrophobicContact CE2-CE1 3.55Å; Y282-F292 AromaticContact CE2-CZ 3.8Å; Y282-F292 HydrophobicContact CE2-CZ 3.8Å; F288-F292 HydrophobicContact CD1-CE2 4.09Å; F288-F292 AromaticContact CD2-CE2 3.67Å; F288-F292 HydrophobicContact CD2-CE2 3.67Å; F288-F292 HydrophobicContact CD2-CZ 4.31Å; F288-F292 HydrophobicContact CE1-CD2 4.37Å; F288-F292 AromaticContact CE1-CE2 3.86Å; F288-F292 HydrophobicContact CE1-CE2 3.86Å; F288-F292 AromaticContact CE2-CE2 3.42Å; F288-F292 HydrophobicContact CE2-CE2 3.42Å; F288-F292 VanDerWaalsContact CE2-CE2 3.42Å; F288-F292 AromaticContact CE2-CZ 3.83Å; F288-F292 HydrophobicContact CE2-CZ 3.83Å; F288-F292 AromaticContact CG-CE2 4Å; F288-F292 HydrophobicContact CG-CE2 4Å; F288-F292 HydrophobicContact CZ-CD2 4.4Å; F288-F292 AromaticContact CZ-CE2 3.52Å; F288-F292 HydrophobicContact CZ-CE2 3.52Å; F288-F292 HydrophobicContact CZ-CZ 4.11Å; F288-F292 WeakPolarHBondContact O-CD2 3.31Å; F288-F292 VanDerWaalsContact O-CE2 3.22Å; F288-F292 WeakPolarHBondContact O-CE2 3.09Å; E290-F292 PolarHBondContact O-N 3.5Å
293R74.8Confident71.2Confident187 Ų187101.3 Ų101.371%0.70652%0.516SS*.  trans-128.7132174.2-66.4-173.9-178-1772.2109.4N281 E290N281-R293 PolarHBondContact ND2-O 3.17Å; E290-R293 PolarHBondContact O-N 3.22Å
294P70.9Confident70.4Confident73 Ų7399.3 Ų99.347%0.47452%0.516SS..SBendcis-76.1156.7-5.131.7-34.5000112.7P280 Y296P280-P294 WeakPolarHBondContact CD-O 3.48Å; P280-P294 HydrophobicContact CG-CG 3.86Å; P294-Y296 VanDerWaalsContact C-N 3.33Å; P294-Y296 PolarHBondContact O-N 3.39Å
295L71.6Confident69Low107 Ų107101.3 Ų101.356%0.5653%0.53SS*.SBendtrans-65.9-30-178.4-89.9128.8000113.9I278 F279I278-L295 CarbonylContact C-O 3.6Å; I278-L295 WeakPolarHBondContact CA-O 3.27Å; I278-L295 VanDerWaalsContact CD1-O 3.24Å; I278-L295 WeakPolarHBondContact CD1-O 3.37Å; I278-L295 VanDerWaalsContact CG1-O 3.25Å; I278-L295 WeakPolarHBondContact CG1-O 3.45Å; F279-L295 HydrophobicContact CE1-CB 4.35Å; F279-L295 HydrophobicContact CE1-CD2 3.64Å; F279-L295 HydrophobicContact CE1-CG 3.72Å; F279-L295 HydrophobicContact CE2-CD2 4.43Å; F279-L295 HydrophobicContact CZ-CD2 3.49Å; F279-L295 VanDerWaalsContact CZ-CD2 3.49Å; F279-L295 HydrophobicContact CZ-CG 4.12Å; F279-L295 PolarHBondContact N-O 3.15Å
296Y72.1Confident67.1Low149 Ų14996.3 Ų96.358%0.58451%0.512SS*.EExtended strand (participates in β ladder)trans-152.5152.5-178.763.4-90.1000111.8F276 W277 P294 L298F276-Y296 HydrophobicContact CE2-CD2 4.27Å; F276-Y296 HydrophobicContact CE2-CG 4.29Å; W277-Y296 CarbonylContact O-C 3.33Å; W277-Y296 WeakPolarHBondContact O-CA 3.2Å; P294-Y296 VanDerWaalsContact C-N 3.33Å; P294-Y296 PolarHBondContact O-N 3.39Å; Y296-L298 HydrophobicContact CD2-CD1 4.27Å
297S68.9Low65.2Low40 Ų4098.7 Ų98.728%0.2853%0.526SS..EExtended strand (participates in β ladder)trans-135.2116.7168.4-171.80000108.5W277W277-S297 PolarHBondContact N-O 3.32Å; W277-S297 PolarHBondContact O-N 3.35Å
298L62Low63.3Low112 Ų112101.9 Ų101.959%0.58654%0.541SS*.EExtended strand (participates in β ladder)trans-90.5123.9165.3-97.988.7000108.1F276 Y296F276-L298 HydrophobicContact CD2-CD1 3.18Å; F276-L298 HydrophobicContact CD2-CG 3.76Å; F276-L298 HydrophobicContact CE2-CD1 3.34Å; F276-L298 HydrophobicContact CE2-CG 4.39Å; F276-L298 HydrophobicContact CG-CD1 4.41Å; Y296-L298 HydrophobicContact CD2-CD1 4.27Å
299K65.7Low61.2Low123 Ų123104.2 Ų104.254%0.53556%0.558SS.*EExtended strand (participates in β ladder)trans-114.9126.4162.3-68.9-174.9177.8174.70109.2S275S275-K299 PolarHBondContact N-O 3.04Å; S275-K299 VanDerWaalsContact N-O 3.13Å; S275-K299 PolarHBondContact O-N 3.13Å; S275-K299 VanDerWaalsContact O-N 3.12Å
300H53.2Low59.1Low75 Ų75106 Ų10635%0.34757%0.565SS.*EExtended strand (participates in β ladder)trans-74.2137.2169.9-167.1-77.9000108.1Y274 C302 D303Y274-H300 HydrophobicContact CD1-CB 4.43Å; Y274-H300 HydrophobicContact CE1-CB 4.14Å; Y274-H300 AromaticContact CE1-CD2 3.09Å; Y274-H300 WeakPolarHBondContact CE1-CD2 3.45Å; Y274-H300 AromaticContact CE1-CG 3.77Å; Y274-H300 AromaticContact CE1-NE2 3.83Å; Y274-H300 AromaticContact CZ-CD2 3.37Å; Y274-H300 AromaticContact CZ-NE2 3.61Å; Y274-H300 PolarHBondContact OH-CD2 3.16Å; Y274-H300 PolarHBondContact OH-NE2 3.49Å; Y274-H300 VanDerWaalsContact OH-NE2 3.14Å; H300-C302 VanDerWaalsContact CE1-SG 3.56Å; H300-C302 PolarHBondContact ND1-N 3.09Å; H300-C302 PolarHBondContact ND1-SG 3.35Å; H300-C302 PolarHBondContact O-N 3.12Å; H300-D303 PolarHBondContact O-N 3.34Å
301A58.3Low57.1Low47 Ų47111.7 Ų111.739%0.38858%0.582SS.*G310 helixtrans-59-11.5-177.700000114.6Q273 D303Q273-A301 WeakPolarHBondContact O-CB 3.43Å; Q273-A301 PolarHBondContact O-N 3.38Å; A301-D303 VanDerWaalsContact C-N 3.31Å
302C49.7Very low54.8Low91 Ų91116.8 Ų116.862%0.61562%0.618SS**G310 helixtrans-75-17173.3-66.60000113.8H300H300-C302 VanDerWaalsContact CE1-SG 3.56Å; H300-C302 PolarHBondContact ND1-N 3.09Å; H300-C302 PolarHBondContact ND1-SG 3.35Å; H300-C302 PolarHBondContact O-N 3.12Å
303D55.3Low52.6Low118 Ų118124.9 Ų124.963%0.63165%0.652SS**G310 helixtrans-90.5-1.4179.8-75.4-25.4000113.8H300 A301 L305H300-D303 PolarHBondContact O-N 3.34Å; A301-D303 VanDerWaalsContact C-N 3.31Å; D303-L305 VanDerWaalsContact C-N 3.32Å
304V55.7Low50.8Low109 Ų109121.3 Ų121.366%0.66166%0.656SS**G310 helixtrans-84.6-6.9179.1-171.40000112.3
305L50.6Low49Very low160 Ų160126.9 Ų126.984%0.83867%0.673SS**SBendtrans-12414.1179-72.4172.4000114.7D303 P307D303-L305 VanDerWaalsContact C-N 3.32Å; L305-P307 WeakPolarHBondContact O-CD 3.16Å
306A37.6Very low47.2Very low66 Ų66128.1 Ų128.155%0.54569%0.685SS.*  trans-105.693179.100000112S308A306-S308 PolarHBondContact O-N 2.79Å
307P38.4Very low45.4Very low111 Ų111129.7 Ų129.772%0.72169%0.694SS**  trans-65.2122.1152.528.9-28.3000106.6L305 N309L305-P307 WeakPolarHBondContact O-CD 3.16Å; P307-N309 VanDerWaalsContact C-N 3.32Å; P307-N309 PolarHBondContact O-N 3.26Å
308S41.2Very low43.7Very low120 Ų120132 Ų13284%0.83971%0.711SS**  trans-64.392179.769.10000110.5A306A306-S308 PolarHBondContact O-N 2.79Å
309N36.8Very low42.3Very low149 Ų149132.5 Ų132.580%0.79772%0.719SS**  trans-115.379.4167-111.3-12.5000107.9P307P307-N309 VanDerWaalsContact C-N 3.32Å; P307-N309 PolarHBondContact O-N 3.26Å
310K36.6Very low40.9Very low211 Ų211131.2 Ų131.292%0.91773%0.725SS**  trans-94.2101.2157.5-78.7-179.1176176.60105
311R38.2Very low40Very low238 Ų238134.3 Ų134.390%0.89874%0.744SS**  44.290.655.9-100.5-171.1-176.8-176.42.9113
312S35.4Very low39Very low120 Ų120137.9 Ų137.984%0.83976%0.761SS**  trans-159.9103.2134.149.50000109.6
313K32.7Very low38.3Very low216 Ų216138.2 Ų138.294%0.93976%0.764SS**  trans-140.788.6162.8-166.4168.7-172.9169.50108.1
314S35.8Very low37.3Very low112 Ų112137.8 Ų137.878%0.78377%0.766SS**  trans-160.3131.9162.459.10000104.5
315K33.7Very low36.3Very low191 Ų191139.5 Ų139.583%0.8377%0.77SS**  cis-179.6154.91.9-166.9179.1-174.2174.80101.4
316V34.4Very low35.7Very low133 Ų133138.8 Ų138.881%0.80677%0.767SS**  trans77.7136.7164.7-166.60000114.1
317K33.4Very low35.5Very low181 Ų181144.4 Ų144.479%0.78778%0.779SS**  cis178.5150.9-18.9-175.6-175.5178178.80103.1
318S33.4Very low35.5Very low89 Ų89143.1 Ų143.162%0.62278%0.778SS**  trans75.699.9161.52.30000115.5
319T33.4Very low35.1Very low123 Ų123142.3 Ų142.376%0.75577%0.768SS**  96.1129.378.546.40000112.3
320S35Very low35.3Very low95 Ų95140.2 Ų140.266%0.66477%0.765SS**  trans60.7136.8145.954.50000118.2
321D35.1Very low35.6Very low141 Ų141135.2 Ų135.275%0.75476%0.757SS**  cis-169.4137.911.4-96.4-22.5000106.5
322V37.1Very low35.6Very low121 Ų121129.4 Ų129.473%0.73375%0.753SS**  90.8122.3107.5175.20000116.7
323S35Very low35.6Very low98 Ų98131.1 Ų131.169%0.68575%0.753SS**  trans90.2143.4138.368.50000124.6
324T34.5Very low35.7Very low109 Ų109127.2 Ų127.267%0.66975%0.747SS**  trans96.995.2148.4-28.60000114.7
325I34.7Very low36Very low145 Ų145126.3 Ų126.374%0.74474%0.741SS**  66.4121.466.2-44.5159.1000112.8
326D37.7Very low36.1Very low146 Ų146124.3 Ų124.378%0.78175%0.745SS**  trans160.4115.1143.6-79.3-18.4000108.2
327F32.5Very low36.2Very low183 Ų183122.6 Ų122.680%0.80374%0.744SS**  90.6142.351.4-157.7-89.9000114.2
328A40Very low36.4Very low84 Ų84120.9 Ų120.969%0.69475%0.75SS**  trans102.5105.2174.400000114.9
329T32.2Very low36.4Very low103 Ų103120.5 Ų120.563%0.63276%0.759SS**  cis86.912834.1-52.70000114.4
330S40.7Very low36.7Very low105 Ų105119.9 Ų119.973%0.73476%0.76SS**  trans82.4144.4161.2-62.70000117.9
331S42.1Very low36.7Very low106 Ų106123.2 Ų123.274%0.74177%0.77SS**  cis172.9136.8-10.1-90.20000104.1
332S38.1Very low37.1Very low117 Ų117120.8 Ų120.882%0.81877%0.77SS**  trans158.7129.8132.363.30000113.2
333N36.6Very low37.3Very low155 Ų155121.6 Ų121.683%0.82977%0.77SS**  trans-64.2159.9-177.2-51.5-36.5000114.1
334T34.8Very low37.5Very low134 Ų134123.8 Ų123.882%0.82277%0.773SS**  -176.9138.7114.2-700000111.6
335S41.4Very low37.8Very low94 Ų94124.4 Ų124.466%0.65778%0.776SS**  trans-49.6144.5-178.648.10000119
336T36.7Very low37.9Very low148 Ų148125.2 Ų125.291%0.90878%0.777SS**  -172.2134.7111.6140000111.1
337A36Very low37.8Very low97 Ų97126 Ų12680%0.80278%0.78SS**  trans-105.3134.6-17200000111.3
338T36.5Very low38.1Very low146 Ų146124.7 Ų124.790%0.89678%0.781SS**  trans-154108.8158.4-4.70000110.8
339G34.4Very low37.8Very low80 Ų80126.4 Ų126.483%0.82579%0.786SS**  trans52.6105.9145.300000120.8
340S40.1Very low37.9Very low111 Ų111128 Ų12878%0.77680%0.796SS**  trans173.992.7136.3166.20000110A342S340-A342 PolarHBondContact O-N 2.81Å
341D34.4Very low37.9Very low164 Ų164132 Ų13288%0.87780%0.8SS**  trans-77.699.7166.6-78.6-42.2000110
342A43.4Very low37.5Very low90 Ų90132.6 Ų132.674%0.74480%0.8SS**  trans-130.8104.5155.500000107.3S340S340-A342 PolarHBondContact O-N 2.81Å
343N42.5Very low37.3Very low139 Ų139133.1 Ų133.174%0.74380%0.798SS**  trans-137.5136.3-173.9-114.2-23.5000102.3
344I38.9Very low37.3Very low143 Ų143132.1 Ų132.173%0.73380%0.798SS**  cis-164.1153.227.8-60.9-171.7000105.2
345V39.3Very low37.4Very low122 Ų122135.2 Ų135.274%0.73980%0.8SS**  trans149.8106.4132.6171.70000111
346Q38.1Very low37.4Very low163 Ų163135.9 Ų135.976%0.76280%0.802SS**  trans100.172.8150.3-59-91.1-4.300118.6
347L34.9Very low37.7Very low161 Ų161134.4 Ų134.484%0.84380%0.795SS**  trans-60135.4136.6-172.484.4000110.4
348L39Very low38Very low156 Ų156137.9 Ų137.982%0.81779%0.794SS**  trans-171.9129.5137.8-99.9161.9000112.1
349C33.6Very low38Very low120 Ų120139 Ų13981%0.81179%0.79SS**  trans88.882.5157.6-120.50000119.8
350T34.1Very low38.2Very low136 Ų136141.1 Ų141.183%0.83479%0.786SS**  trans-76139.4146.145.90000110.4
351K40.1Very low38.2Very low189 Ų189145.7 Ų145.782%0.82279%0.792SS**  trans-163.4107.8144.6-113179.6-178.1-177.80113
352T35.3Very low38.5Very low120 Ų120142.4 Ų142.474%0.73678%0.778SS**  trans60.4101.813149.60000121
353T33.4Very low38.5Very low128 Ų128147.5 Ų147.579%0.78578%0.783SS**  4.7136.9115.5-45.50000115.4
354T36.8Very low38.5Very low134 Ų134147.6 Ų147.682%0.82278%0.784SS**  -177.415385.5-440000112.5
355K36.5Very low39Very low199 Ų199146.4 Ų146.487%0.86578%0.783SS**  trans-49.1169.1-174.4-103.7-178.6166.3-177.30121.5
356P40.6Very low39.3Very low108 Ų108147 Ų14770%0.70178%0.781SS**  trans-106.3177.8-178.842.7-31.6000114.9
357P44.8Very low39.8Very low117 Ų117147.5 Ų147.576%0.7678%0.781SS**  trans-133.9172.2144.135.5-19.1000110.5
358E42.1Very low40.6Very low169 Ų169149.6 Ų149.679%0.7978%0.777SS**  cis173.1162.2-10.4179.9173.4-176.100105.2
359E36.6Very low41.1Very low170 Ų170147.5 Ų147.579%0.79477%0.767SS**  trans81.388.7155.8-98.6-173.1152.500123.4
360V37.4Very low42.2Very low125 Ų125149.4 Ų149.476%0.75877%0.768SS**  15125.3116.3-173.60000119V362V360-V362 HydrophobicContact CG1-CG2 4.01Å
361K40.2Very low43.3Very low206 Ų206149.3 Ų149.390%0.89676%0.761SS**  trans-139.6121.5145.7-154.3167-171.41720113.1
362V41.8Very low44Very low95 Ų95146.4 Ų146.458%0.57675%0.753SS**  trans-72.9148179174.60000112.2V360V360-V362 HydrophobicContact CG1-CG2 4.01Å
363K42.6Very low45Very low197 Ų197148.1 Ų148.186%0.85776%0.758SS**  trans178.697.1138.3-97.3163.9-175.2-168.10109.6
364N43Very low46.2Very low141 Ų141154.7 Ų154.775%0.75478%0.779SS**  60.9127.877.3-96-4.2000116.5
365V48.5Very low46.6Very low119 Ų119155.7 Ų155.772%0.72178%0.777SS**  trans99.4109.2138.8173.60000119.1
366L46.3Very low47.2Very low134 Ų134153.4 Ų153.470%0.70277%0.772SS**  158.898.2129.8-88.9150.1000108.6
367K49Very low47.5Very low174 Ų174155.9 Ų155.976%0.75778%0.776SS**  72.1136.469.7-158.9173.4-172.5-176.70113.3
368R50.3Low47.7Very low204 Ų204158.2 Ų158.277%0.7778%0.777SS**  trans110.1133165.1-58.5-173.1-152.1103.4-2.5113.5
369D51.1Low48.1Very low113 Ų113157.6 Ų157.660%0.60478%0.777SS**  cis-179.6175.4-16.4-97.8-34.2000104.4
370I56.4Low48.8Very low159 Ų159156.7 Ų156.782%0.81578%0.775SS**  trans92.489.8170.9-47.2156.7000111.7
371I57Low49.6Very low134 Ų134159 Ų15969%0.68778%0.777SS**  cis61.9121.647.8-24.6-177000115.8
372I55Low50.4Low128 Ų128155.4 Ų155.466%0.65677%0.767SS**  trans124.1118.7131.6-61.1-170000116.6
373N55.3Low51.1Low157 Ų157160.4 Ų160.484%0.8478%0.783SS**  trans67.9127.9153.7-60.8-9.2000117.9
374E58.5Low51.8Low265 Ų265157.1 Ų157.1100%1.23878%0.777SS**  cis-141.1041.7-168.6178160.800112.8

Retrieved 374 of 374 residues in 454.3 ms (Link to these results)