A0A024R9T6_HUMAN Loading...

HCG17415, isoform CRA_a

AlphaFold DB (Q9P270), UniProt , Accession A0A024R9T6, Species HUMAN (Homo sapiens, Human), Gene SLAIN2, Length 581 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
1M45.7Very low67.6Low225 Ų225115.8 Ų115.8100%1.10864%0.637SS**  0950-159.5152.3-163.700105.4
2E59.3Low69.5Low189 Ų189113.8 Ų113.888%0.88362%0.619SS**  trans-118.580.1-160-67162.7144.600108.8
3D61.2Low71.1Confident125 Ų125112.6 Ų112.667%0.66861%0.607SS**  trans-111.224.7177.2-68.9-62.5000112.5
4V64.1Low72.8Confident112 Ų112109.7 Ų109.768%0.67960%0.595SS**SBendtrans-93.4-13-173.2-162.50000113.1
5N62.2Low74.2Confident150 Ų150113.3 Ų113.380%0.80260%0.596SS**THydrogen-bonded Turntrans-92.6-12.9-172.7-9138.4000115.8
6S62.1Low75.5Confident88 Ų88114.1 Ų114.162%0.61559%0.593SS**THydrogen-bonded Turntrans-82.8-35.518052.10000112.9V8 N9 A10S6-V8 PolarHBondContact O-N 3.48Å; S6-N9 PolarHBondContact O-N 3.48Å; S6-A10 PolarHBondContact O-N 3.22Å
7N61.6Low76.8Confident102 Ų102113.6 Ų113.655%0.54559%0.591SS.*Hα-helixtrans-69.5-33-176.6-163.244.6000113.1N9 A10 D11N7-N9 PolarHBondContact O-N 2.97Å; N7-A10 WeakPolarHBondContact O-CB 3.32Å; N7-A10 PolarHBondContact O-N 3.28Å; N7-D11 PolarHBondContact ND2-OD2 3.07Å; N7-D11 PolarHBondContact O-N 3.48Å
8V70.3Confident77.9Confident82 Ų82114.2 Ų114.250%0.49759%0.59SS.*Hα-helixtrans-61.1-31.3177179.90000111.6S6 Q12S6-V8 PolarHBondContact O-N 3.48Å; V8-Q12 VanDerWaalsContact O-CG 3.31Å; V8-Q12 WeakPolarHBondContact O-CG 3.43Å; V8-Q12 PolarHBondContact O-N 3.4Å
9N80.3Confident78.9Confident80 Ų80115.8 Ų115.843%0.42860%0.595SS.*Hα-helixtrans-73.7-39.1175.2-171.147.8000111.8S6 N7 Q12 E13S6-N9 PolarHBondContact O-N 3.48Å; N7-N9 PolarHBondContact O-N 2.97Å; N9-Q12 PolarHBondContact O-N 2.89Å; N9-E13 PolarHBondContact ND2-OE1 3Å; N9-E13 WeakPolarHBondContact O-CG 3.49Å; N9-E13 PolarHBondContact O-N 3.46Å
10A86.9Confident79.8Confident44 Ų44114.8 Ų114.836%0.36459%0.59SS.*Hα-helixtrans-62-45.3175.900000111.7S6 N7 Q12 E13 V14S6-A10 PolarHBondContact O-N 3.22Å; N7-A10 WeakPolarHBondContact O-CB 3.32Å; N7-A10 PolarHBondContact O-N 3.28Å; A10-Q12 VanDerWaalsContact C-N 3.32Å; A10-Q12 PolarHBondContact O-N 3.03Å; A10-E13 PolarHBondContact O-N 2.83Å; A10-V14 WeakPolarHBondContact O-CG2 3.47Å; A10-V14 PolarHBondContact O-N 3.27Å
11D90.2Very high80.6Confident77 Ų77112.9 Ų112.941%0.41258%0.583SS.*Hα-helixtrans-62.3-37.6176-73.5-53.6000112.4N7 R15N7-D11 PolarHBondContact ND2-OD2 3.07Å; N7-D11 PolarHBondContact O-N 3.48Å; D11-R15 WeakPolarHBondContact O-CG 3.31Å; D11-R15 PolarHBondContact O-N 3.2Å
12Q90.5Very high83.1Confident91 Ų91109.6 Ų109.643%0.42556%0.563SS.*Hα-helixtrans-68.3-39174.6-76.2-177.922.800112.5V8 N9 A10 R15 K16V8-Q12 VanDerWaalsContact O-CG 3.31Å; V8-Q12 WeakPolarHBondContact O-CG 3.43Å; V8-Q12 PolarHBondContact O-N 3.4Å; N9-Q12 PolarHBondContact O-N 2.89Å; A10-Q12 VanDerWaalsContact C-N 3.32Å; A10-Q12 PolarHBondContact O-N 3.03Å; Q12-R15 PolarHBondContact O-N 3.47Å; Q12-K16 VanDerWaalsContact O-CG 3.29Å; Q12-K16 WeakPolarHBondContact O-CG 3.31Å; Q12-K16 PolarHBondContact O-N 3.35Å
13E90.4Very high84.9Confident99 Ų99107.1 Ų107.146%0.46355%0.549SS..Hα-helixtrans-65-42.2174.7-76.5178.1-15400111.4N9 A10 R15 K16 L17N9-E13 PolarHBondContact ND2-OE1 3Å; N9-E13 WeakPolarHBondContact O-CG 3.49Å; N9-E13 PolarHBondContact O-N 3.46Å; A10-E13 PolarHBondContact O-N 2.83Å; E13-R15 PolarHBondContact O-N 3.39Å; E13-K16 PolarHBondContact O-N 3.05Å; E13-L17 WeakPolarHBondContact O-CB 3.38Å; E13-L17 VanDerWaalsContact O-CG 3.31Å; E13-L17 WeakPolarHBondContact O-CG 3.28Å; E13-L17 PolarHBondContact O-N 3.21Å
14V94.4Very high86.6Confident72 Ų72105.3 Ų105.344%0.43654%0.539SS..Hα-helixtrans-61.4-43.5174.61730000111.1A10 K16 L17 Q18A10-V14 WeakPolarHBondContact O-CG2 3.47Å; A10-V14 PolarHBondContact O-N 3.27Å; V14-K16 PolarHBondContact O-N 3.2Å; V14-L17 PolarHBondContact O-N 2.84Å; V14-Q18 HydrophobicContact CG1-CG 4.47Å; V14-Q18 WeakPolarHBondContact O-CG 3.35Å; V14-Q18 PolarHBondContact O-N 3.28Å
15R94.2Very high88.1Confident164 Ų164105.9 Ų105.962%0.61953%0.534SS*.Hα-helixtrans-62.2-42.6174.8-73.1179.6-162.7162.66.9112.4D11 Q12 E13 L17 Q18 E19D11-R15 WeakPolarHBondContact O-CG 3.31Å; D11-R15 PolarHBondContact O-N 3.2Å; Q12-R15 PolarHBondContact O-N 3.47Å; E13-R15 PolarHBondContact O-N 3.39Å; R15-L17 VanDerWaalsContact C-N 3.32Å; R15-L17 PolarHBondContact O-N 3.46Å; R15-Q18 PolarHBondContact O-N 2.85Å; R15-E19 PolarHBondContact O-N 2.88Å
16K94.7Very high89.7Confident126 Ų126106.4 Ų106.455%0.54853%0.53SS..Hα-helixtrans-61.6-40.7175.2-74.6171-176.11690111.6Q12 E13 V14 E19 L20Q12-K16 VanDerWaalsContact O-CG 3.29Å; Q12-K16 WeakPolarHBondContact O-CG 3.31Å; Q12-K16 PolarHBondContact O-N 3.35Å; E13-K16 PolarHBondContact O-N 3.05Å; V14-K16 PolarHBondContact O-N 3.2Å; K16-E19 PolarHBondContact O-N 2.87Å; K16-L20 WeakPolarHBondContact O-CB 3.29Å; K16-L20 PolarHBondContact O-N 2.89Å
17L97.1Very high91.2Very high105 Ų105107.1 Ų107.155%0.5552%0.523SS..Hα-helixtrans-66.7-41.5176.2-72.2171.4000111.6E13 V14 R15 L20 V21E13-L17 WeakPolarHBondContact O-CB 3.38Å; E13-L17 VanDerWaalsContact O-CG 3.31Å; E13-L17 WeakPolarHBondContact O-CG 3.28Å; E13-L17 PolarHBondContact O-N 3.21Å; V14-L17 PolarHBondContact O-N 2.84Å; R15-L17 VanDerWaalsContact C-N 3.32Å; R15-L17 PolarHBondContact O-N 3.46Å; L17-L20 PolarHBondContact O-N 3.43Å; L17-V21 VanDerWaalsContact O-CG2 3.31Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 2.87Å
18Q96.7Very high92.8Very high124 Ų124106.1 Ų106.158%0.57952%0.518SS*.Hα-helixtrans-62.1-43.7175-73.9173.9-8.200112.1V14 R15 L20 V21 K22V14-Q18 HydrophobicContact CG1-CG 4.47Å; V14-Q18 WeakPolarHBondContact O-CG 3.35Å; V14-Q18 PolarHBondContact O-N 3.28Å; R15-Q18 PolarHBondContact O-N 2.85Å; Q18-L20 VanDerWaalsContact C-N 3.34Å; Q18-V21 PolarHBondContact O-N 2.85Å; Q18-K22 WeakPolarHBondContact O-CB 3.43Å; Q18-K22 PolarHBondContact O-N 2.96Å
19E96.6Very high93.9Very high146 Ų146107.5 Ų107.568%0.68252%0.519SS*.Hα-helixtrans-62.9-40.5174.2-76.7-172.4169.800112.1R15 K16 K22 K23R15-E19 PolarHBondContact O-N 2.88Å; K16-E19 PolarHBondContact O-N 2.87Å; E19-K22 PolarHBondContact O-N 3.3Å; E19-K23 WeakPolarHBondContact O-CB 3.33Å; E19-K23 PolarHBondContact O-N 3.26Å
20L97.3Very high94.4Very high94 Ų94109.6 Ų109.649%0.49253%0.526SS..Hα-helixtrans-65-46.7177.8-176.663.9000111.7K16 L17 Q18 K23 L24K16-L20 WeakPolarHBondContact O-CB 3.29Å; K16-L20 PolarHBondContact O-N 2.89Å; L17-L20 PolarHBondContact O-N 3.43Å; Q18-L20 VanDerWaalsContact C-N 3.34Å; L20-K23 PolarHBondContact O-N 3.49Å; L20-L24 HydrophobicContact CG-CD1 4.24Å; L20-L24 WeakPolarHBondContact O-CG 3.35Å; L20-L24 PolarHBondContact O-N 3.46Å
21V97Very high94.6Very high75 Ų75111.9 Ų111.946%0.45553%0.532SS..Hα-helixtrans-59.5-47.9176.2170.20000110.2L17 Q18 K23 L24 E25L17-V21 VanDerWaalsContact O-CG2 3.31Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 2.87Å; Q18-V21 PolarHBondContact O-N 2.85Å; V21-K23 VanDerWaalsContact C-N 3.27Å; V21-K23 PolarHBondContact O-N 2.95Å; V21-L24 PolarHBondContact O-N 3.48Å; V21-L24 VanDerWaalsContact O-N 3.13Å; V21-E25 HydrophobicContact CG1-CG 4.33Å; V21-E25 WeakPolarHBondContact O-CG 3.31Å; V21-E25 PolarHBondContact O-N 3.23Å
22K97.3Very high94.4Very high156 Ų156115.9 Ų115.968%0.67854%0.541SS*.Hα-helixtrans-59.6-37.3177.1-172.2174.2-176173.10112.5Q18 E19 K26Q18-K22 WeakPolarHBondContact O-CB 3.43Å; Q18-K22 PolarHBondContact O-N 2.96Å; E19-K22 PolarHBondContact O-N 3.3Å; K22-K26 WeakPolarHBondContact O-CB 3.48Å; K22-K26 PolarHBondContact O-N 2.95Å; K22-K26 VanDerWaalsContact O-N 3.11Å
23K97.1Very high94.3Very high138 Ų138115 Ų11560%0.655%0.545SS*.Hα-helixtrans-69.1-42.1176-169175.3-179.7-177.70111.6E19 L20 V21 K26 Q27E19-K23 WeakPolarHBondContact O-CB 3.33Å; E19-K23 PolarHBondContact O-N 3.26Å; L20-K23 PolarHBondContact O-N 3.49Å; V21-K23 VanDerWaalsContact C-N 3.27Å; V21-K23 PolarHBondContact O-N 2.95Å; K23-K26 PolarHBondContact O-N 2.86Å; K23-Q27 WeakPolarHBondContact O-CG 3.3Å; K23-Q27 PolarHBondContact O-N 2.86Å
24L96.9Very high94Very high86 Ų86118.3 Ų118.345%0.4555%0.553SS.*Hα-helixtrans-65.8-40.7176.3-74.9171.9000112.1L20 V21 Q27 N28L20-L24 HydrophobicContact CG-CD1 4.24Å; L20-L24 WeakPolarHBondContact O-CG 3.35Å; L20-L24 PolarHBondContact O-N 3.46Å; V21-L24 PolarHBondContact O-N 3.48Å; V21-L24 VanDerWaalsContact O-N 3.13Å; L24-Q27 PolarHBondContact O-N 3.4Å; L24-N28 WeakPolarHBondContact O-CB 3.29Å; L24-N28 PolarHBondContact O-N 2.85Å
25E95.4Very high92.9Very high124 Ų124118.3 Ų118.358%0.57956%0.557SS**Hα-helixtrans-60-46173.5-74.5176.5159.200110.9V21 Q27 N28 E29V21-E25 HydrophobicContact CG1-CG 4.33Å; V21-E25 WeakPolarHBondContact O-CG 3.31Å; V21-E25 PolarHBondContact O-N 3.23Å; E25-Q27 PolarHBondContact O-N 3.4Å; E25-N28 PolarHBondContact O-N 2.87Å; E25-E29 WeakPolarHBondContact O-CB 3.13Å; E25-E29 PolarHBondContact O-N 3.39Å
26K95.9Very high91.5Very high162 Ų162112.8 Ų112.870%0.70455%0.55SS**Hα-helixtrans-62.8-41.5176.4-171.7177-179.6179.30112.5K22 K23 E29 Q30K22-K26 WeakPolarHBondContact O-CB 3.48Å; K22-K26 PolarHBondContact O-N 2.95Å; K22-K26 VanDerWaalsContact O-N 3.11Å; K23-K26 PolarHBondContact O-N 2.86Å; K26-E29 PolarHBondContact O-N 3.32Å; K26-Q30 PolarHBondContact O-N 3.47Å
27Q94.8Very high89.7Confident102 Ų102110.4 Ų110.448%0.47755%0.554SS.*Hα-helixtrans-65.1-43.1175-75.1-176.1-65.100111.5K23 L24 E25 E29 Q30 L31K23-Q27 WeakPolarHBondContact O-CG 3.3Å; K23-Q27 PolarHBondContact O-N 2.86Å; L24-Q27 PolarHBondContact O-N 3.4Å; E25-Q27 PolarHBondContact O-N 3.4Å; Q27-E29 PolarHBondContact O-N 3.45Å; Q27-Q30 WeakPolarHBondContact O-CB 3.4Å; Q27-Q30 PolarHBondContact O-N 3.37Å; Q27-L31 WeakPolarHBondContact O-CG 3.34Å; Q27-L31 PolarHBondContact O-N 2.9Å
28N93.8Very high87.8Confident81 Ų81111 Ų11143%0.43356%0.562SS.*Hα-helixtrans-64.1-38176.5-95.9-37.6000112.7L24 E25 Q30 L31 R32L24-N28 WeakPolarHBondContact O-CB 3.29Å; L24-N28 PolarHBondContact O-N 2.85Å; E25-N28 PolarHBondContact O-N 2.87Å; N28-Q30 VanDerWaalsContact C-N 3.34Å; N28-L31 PolarHBondContact O-N 3.25Å; N28-R32 WeakPolarHBondContact O-CG 3.39Å; N28-R32 PolarHBondContact O-N 3.3Å
29E93.8Very high85.9Confident111 Ų111113.2 Ų113.252%0.51957%0.572SS.*Hα-helixtrans-65.8-39.2174.9-167.856.9-142.500111.4E25 K26 Q27 R32 S33E25-E29 WeakPolarHBondContact O-CB 3.13Å; E25-E29 PolarHBondContact O-N 3.39Å; K26-E29 PolarHBondContact O-N 3.32Å; Q27-E29 PolarHBondContact O-N 3.45Å; E29-R32 PolarHBondContact O-N 2.94Å; E29-S33 WeakPolarHBondContact O-CB 3.44Å; E29-S33 PolarHBondContact O-N 3.45Å; E29-S33 PolarHBondContact O-OG 2.99Å
30Q91.9Very high83.6Confident125 Ų125109.7 Ų109.758%0.58458%0.575SS**Hα-helixtrans-64.1-40.4173.3-171.7175.27.200111.7K26 Q27 N28 S33 R34K26-Q30 PolarHBondContact O-N 3.47Å; Q27-Q30 WeakPolarHBondContact O-CB 3.4Å; Q27-Q30 PolarHBondContact O-N 3.37Å; N28-Q30 VanDerWaalsContact C-N 3.34Å; Q30-S33 PolarHBondContact O-N 2.96Å; Q30-R34 VanDerWaalsContact O-CG 3.3Å; Q30-R34 WeakPolarHBondContact O-CG 3.31Å; Q30-R34 PolarHBondContact O-N 3.01Å
31L90.5Very high81.3Confident92 Ų92109.6 Ų109.648%0.48259%0.588SS.*Hα-helixtrans-65-43.7174.4-69.5173.6000111.5Q27 N28 S33 R34 S35Q27-L31 WeakPolarHBondContact O-CG 3.34Å; Q27-L31 PolarHBondContact O-N 2.9Å; N28-L31 PolarHBondContact O-N 3.25Å; L31-S33 VanDerWaalsContact C-N 3.34Å; L31-S33 PolarHBondContact O-N 3.41Å; L31-R34 PolarHBondContact O-N 2.91Å; L31-S35 WeakPolarHBondContact O-CB 3.38Å; L31-S35 PolarHBondContact O-N 2.86Å; L31-S35 PolarHBondContact O-OG 3.28Å; L31-S35 VanDerWaalsContact O-OG 3.13Å
32R87Confident78.6Confident160 Ų160109.7 Ų109.760%0.60460%0.604SS**Hα-helixtrans-58.2-45173.7-77.4-179.4167.788.22.1112.1N28 E29 R34 S35 G36N28-R32 WeakPolarHBondContact O-CG 3.39Å; N28-R32 PolarHBondContact O-N 3.3Å; E29-R32 PolarHBondContact O-N 2.94Å; R32-R34 PolarHBondContact O-N 2.82Å; R32-S35 PolarHBondContact O-N 3.47Å; R32-G36 PolarHBondContact O-N 3.41Å
33S87.1Confident76Confident72 Ų72107.5 Ų107.550%0.50361%0.609SS.*Hα-helixtrans-63.2-39.5177.1-61.90000112.3E29 Q30 L31 A37E29-S33 WeakPolarHBondContact O-CB 3.44Å; E29-S33 PolarHBondContact O-N 3.45Å; E29-S33 PolarHBondContact O-OG 2.99Å; Q30-S33 PolarHBondContact O-N 2.96Å; L31-S33 VanDerWaalsContact C-N 3.34Å; L31-S33 PolarHBondContact O-N 3.41Å; S33-A37 PolarHBondContact O-N 3.44Å
34R84.5Confident73.7Confident169 Ų169109.4 Ų109.464%0.63862%0.624SS**Hα-helixtrans-70.6-41.9176.3-70.7179.381.3-163.44112.1Q30 L31 R32 G36 A37 V38Q30-R34 VanDerWaalsContact O-CG 3.3Å; Q30-R34 WeakPolarHBondContact O-CG 3.31Å; Q30-R34 PolarHBondContact O-N 3.01Å; L31-R34 PolarHBondContact O-N 2.91Å; R32-R34 PolarHBondContact O-N 2.82Å; R34-G36 VanDerWaalsContact C-N 3.33Å; R34-A37 PolarHBondContact O-N 2.88Å; R34-V38 PolarHBondContact O-N 3.29Å
35S72.1Confident71Confident73 Ų73108.7 Ų108.751%0.5164%0.638SS.*Hα-helixtrans-68-32.4177.2-63.60000112.4L31 R32 V38L31-S35 WeakPolarHBondContact O-CB 3.38Å; L31-S35 PolarHBondContact O-N 2.86Å; L31-S35 PolarHBondContact O-OG 3.28Å; L31-S35 VanDerWaalsContact O-OG 3.13Å; R32-S35 PolarHBondContact O-N 3.47Å; S35-V38 PolarHBondContact O-N 2.79Å
36G64.3Low68.7Low47 Ų47109.6 Ų109.649%0.48565%0.654SS.*Hα-helixtrans-67.4-34.5173.100000113.5R32 R34 V38 Q39R32-G36 PolarHBondContact O-N 3.41Å; R34-G36 VanDerWaalsContact C-N 3.33Å; G36-V38 VanDerWaalsContact C-N 3.32Å; G36-V38 PolarHBondContact O-N 3.3Å; G36-Q39 PolarHBondContact O-N 2.97Å
37A57.2Low66.2Low76 Ų76105.5 Ų105.563%0.62866%0.658SS**Hα-helixtrans-69.7-27177.700000113.4S33 R34S33-A37 PolarHBondContact O-N 3.44Å; R34-A37 PolarHBondContact O-N 2.88Å
38V57.6Low63.5Low118 Ų118106 Ų10672%0.71567%0.673SS**Hα-helixtrans-82.4-21.3-179.8178.40000112.4R34 S35 G36R34-V38 PolarHBondContact O-N 3.29Å; S35-V38 PolarHBondContact O-N 2.79Å; G36-V38 VanDerWaalsContact C-N 3.32Å; G36-V38 PolarHBondContact O-N 3.3Å
39Q56Low61.3Low170 Ų170107.6 Ų107.679%0.79469%0.688SS**THydrogen-bonded Turntrans-83.3-8177.7-66.5-171.914.500114G36G36-Q39 PolarHBondContact O-N 2.97Å
40G49.2Very low58.8Low73 Ų73108.3 Ų108.375%0.75370%0.7SS**THydrogen-bonded Turntrans-87.7-5.1-179.400000116.5
41A48.2Very low56.3Low92 Ų92113.8 Ų113.876%0.7672%0.715SS**SBendtrans-127.119.7-169.700000114.8
42G40Very low54Low77 Ų77114.3 Ų114.379%0.79473%0.733SS**  trans-115.658.4-172.500000114.5
43S42.4Very low51.7Low110 Ų110110.1 Ų110.177%0.76974%0.739SS**  trans-132.2108.4162.7-175.50000106.8
44L49.7Very low49.6Very low177 Ų177111.5 Ų111.593%0.92776%0.755SS**  trans157.399.8159.1-82.5160.6000108.4
45G41Very low47.6Very low72 Ų72109 Ų10974%0.74276%0.764SS**  trans-76.9157.7177.600000113.3
46P47.1Very low46.2Very low142 Ų142113 Ų11392%0.92278%0.778SS**  trans-90.7113.9-175.533.4-28.7000111.6
47G42Very low45.4Very low76 Ų76116.6 Ų116.678%0.78479%0.792SS**  trans-106.5135.1165.700000111.2
48S37.9Very low44.6Very low113 Ų113117.7 Ų117.779%0.7980%0.795SS**  trans-70153.1-177.1-175.30000114.8
49P47.7Very low44Very low115 Ų115117.8 Ų117.875%0.74780%0.801SS**  trans-139.6121.8130.233.5-18.1000112.1
50V42.1Very low43.3Very low126 Ų126113.1 Ų113.176%0.76480%0.798SS**  57.599.489-177.50000116.4
51R39.6Very low43.1Very low240 Ų240114.8 Ų114.891%0.90681%0.805SS**  53.7118.4126.6-162.5-177.2-165.5-161.33.4121.8
52A41.2Very low42.7Very low103 Ų103115.1 Ų115.185%0.85181%0.808SS**  161.2140.4125.900000108.2
53G39.9Very low42.7Very low71 Ų71116.9 Ų116.973%0.73281%0.808SS**  cis159141.34.400000107.9
54A42.7Very low43.1Very low102 Ų102116.6 Ų116.684%0.84380%0.804SS**  trans69.6140.5166.700000118
55S41.5Very low42.7Very low117 Ų117120.2 Ų120.282%0.81881%0.805SS**  cis-172.7146.90.935.40000108.9
56I43.6Very low42.7Very low157 Ų157120.4 Ų120.481%0.80581%0.807SS**  trans-79.7171.5173.6-24.1179.1000110.3
57P47.8Very low42.6Very low121 Ų121123.6 Ų123.679%0.78681%0.807SS**  -150.3144.366.434.2-10.5000119
58S40.6Very low42.7Very low100 Ų100125.2 Ų125.270%0.69980%0.804SS**  trans20.1132.1131.2-175.50000123.1
59S44.6Very low42.8Very low120 Ų120128.3 Ų128.384%0.83981%0.81SS**  164.6142.8120.4-71.80000109.2
60G41.2Very low42.4Very low71 Ų71126.6 Ų126.673%0.73281%0.814SS**  cis164.5149.92.700000108.7
61A43.6Very low42.5Very low109 Ų109129.5 Ų129.590%0.90182%0.824SS**  trans62.6145.9159.100000118.9
62A41.3Very low42.6Very low98 Ų98124.1 Ų124.181%0.8182%0.823SS**  cis-162.5155.6-200000109.3
63S40Very low42.6Very low115 Ų115123.2 Ų123.280%0.80482%0.816SS**  trans-70.2-169.8172.5-119.50000113
64P49.9Very low42.9Very low104 Ų104128.9 Ų128.968%0.67582%0.82SS**  cis-142.6-170.9-19.132.3-9.3000114.8
65R42.1Very low42.9Very low252 Ų252129.5 Ų129.595%0.95182%0.819SS**  trans88.2124.8149.1-81.7173.7145.1173.3-7121.2
66G41Very low42.8Very low77 Ų77127.7 Ų127.779%0.79482%0.819SS**  trans138.698.5136.600000117.6
67F43.5Very low42.5Very low208 Ų208124.1 Ų124.191%0.91282%0.821SS**  trans-63.7168.1152.1-68.9-81000110
68P46Very low42.1Very low111 Ų111122 Ų12272%0.72182%0.82SS**  cis-150.517531.139.7-16.1000119
69L40Very low42.4Very low177 Ų177123.7 Ų123.793%0.92783%0.829SS**  trans17.6134145.4-57.2170.1000121
70G39.4Very low42.3Very low80 Ų80121.6 Ų121.683%0.82583%0.826SS**  trans-179100.4159.800000114.2
71L43.5Very low42.4Very low186 Ų186124.1 Ų124.197%0.97483%0.833SS**  trans-67.3136.8169.5-70.5149.7000110.6
72S41.1Very low42.2Very low127 Ų127121.8 Ų121.889%0.88882%0.82SS**  trans-151.6143.5153.2-160.60000112.3
73A41.5Very low42.5Very low85 Ų85124 Ų12470%0.70283%0.825SS**  trans-77.1162-169.400000113.7
74K47.1Very low42.2Very low189 Ų189127.4 Ų127.482%0.82282%0.821SS**  155.4137.998.2-163.3144.478.6172.90112.7
75S41.5Very low41.7Very low116 Ų116131.1 Ų131.181%0.81182%0.821SS**  trans59.4137.315361.50000119.3
76G39.5Very low41.6Very low79 Ų79124.9 Ų124.981%0.81481%0.811SS**  cis163.7162.45.900000109.6
77G37.6Very low41.3Very low82 Ų82126.5 Ų126.585%0.84581%0.81SS**  trans99.982.315000000119.4
78G39.6Very low41Very low75 Ų75121.5 Ų121.577%0.77380%0.801SS**  71.5156.4113.100000122.2
79P47.5Very low40.7Very low136 Ų136124.9 Ų124.988%0.88381%0.807SS**  trans-124.6172.7-136.638.2-22.3000115
80G41.4Very low40.6Very low76 Ų76125.1 Ų125.178%0.78480%0.804SS**  trans152.8127.1151.100000118.7
81S43.4Very low40.7Very low124 Ų124127 Ų12787%0.86779%0.794SS**  trans85.9110.1144.8-150.80000120.3
82G39.9Very low40.5Very low61 Ų61128.1 Ų128.163%0.62979%0.786SS**  trans-81.9176.6151.300000112
83P46.4Very low40.2Very low143 Ų143129.4 Ų129.493%0.92978%0.782SS**  -144.6-172.3117.234.4-15.6000113.7
84R35.3Very low40.3Very low187 Ų187129.7 Ų129.771%0.70679%0.785SS**  trans-134.4154.6-148.1-165.2-160168.9-166.6-0.8111.8
85R38.3Very low39.8Very low182 Ų182127.8 Ų127.869%0.68779%0.789SS**  trans75144.3161.4-43.8-167.6-173.7-13220.6116.1
86T39.8Very low39.9Very low121 Ų121126.5 Ų126.574%0.74278%0.78SS**  -170.9133.253.149.10000108.5
87S36.2Very low40.2Very low111 Ų111130.3 Ų130.378%0.77678%0.781SS**  77.1143.498.676.50000120.3
88S37.2Very low40.2Very low103 Ų103134.5 Ų134.572%0.7278%0.783SS**  trans79.7114.6165.4-87.80000118.7
89E38.7Very low40.3Very low182 Ų182135.4 Ų135.485%0.8578%0.784SS**  80.4103.466.6-74.3-162.2135.700114.6
90E38.9Very low40.1Very low182 Ų182134.1 Ų134.185%0.8578%0.784SS**  trans167.2115.5136.5-102.5-169.992.600108.8
91L39.6Very low39.9Very low120 Ų120134.2 Ų134.263%0.62879%0.785SS**  78.5112.274.4-137.589.2000114.8
92R40.5Very low39.7Very low210 Ų210137.7 Ų137.779%0.79279%0.788SS**  trans92.3127.3145.3-42.2-160.4175.8168.96.3121.5
93D34.6Very low39.4Very low153 Ų153138.8 Ų138.882%0.81880%0.799SS**  trans54.2116.9139.2-83.9-16.5000120.1
94A43.1Very low38.7Very low91 Ų91135.7 Ų135.775%0.75279%0.793SS**  -172.6104.2108.100000110S96A94-S96 PolarHBondContact O-N 2.86Å; A94-S96 VanDerWaalsContact O-N 3.08Å
95T37.7Very low39.1Very low150 Ų150133.7 Ų133.792%0.9280%0.795SS**  trans-54.2106.9153-550000108.1
96S43Very low39.5Very low89 Ų89133.9 Ų133.962%0.62281%0.809SS**  trans-148.7128.3170.6-1480000110.5A94A94-S96 PolarHBondContact O-N 2.86Å; A94-S96 VanDerWaalsContact O-N 3.08Å
97L46.3Very low39.9Very low158 Ų158134.4 Ų134.483%0.82781%0.807SS**  trans83.276.2155-62.4154.9000117A99L97-A99 PolarHBondContact O-N 3.26Å
98L37.9Very low40.4Very low171 Ų171138 Ų13890%0.89581%0.812SS**  -33.1123.3126.9-57.2167.4000110.9
99A40.4Very low41.2Very low94 Ų94139.8 Ų139.878%0.77782%0.818SS**  trans166137132.200000111.8L97L97-A99 PolarHBondContact O-N 3.26Å
100A43.1Very low42.1Very low108 Ų108138.1 Ų138.189%0.89381%0.81SS**  trans79.2129.6151.400000118.4
101G37.6Very low43Very low78 Ų78134.8 Ų134.880%0.80480%0.804SS**  trans129.198.2144.100000113.8
102E39.8Very low43.5Very low198 Ų198135.6 Ų135.693%0.92581%0.809SS**  trans-57.3149.7172-62.2163.512200113.3
103G32.3Very low44.2Very low83 Ų83133.2 Ų133.286%0.85680%0.8SS**  trans90.5108.7136.300000118.1
104G33Very low45.4Very low78 Ų78130.5 Ų130.580%0.80479%0.79SS**  trans119.5142.8151.400000114.9
105L42.9Very low46.3Very low145 Ų145131 Ų13176%0.75978%0.78SS**  trans92.859.2164.6-14875000117.7D107L105-D107 VanDerWaalsContact C-N 3.29Å; L105-D107 HydrophobicContact CD1-CB 4.4Å
106L46Very low47.3Very low186 Ų186127.3 Ų127.397%0.97475%0.753SS**  trans-96.965.1144.4-67.9-177.2000108.4
107D48.7Very low48Very low132 Ų132129.1 Ų129.171%0.70676%0.755SS**  trans-138.672171.6-173.649.8000106.7L105L105-D107 VanDerWaalsContact C-N 3.29Å; L105-D107 HydrophobicContact CD1-CB 4.4Å
108E47Very low48.6Very low186 Ų186128.5 Ų128.587%0.86975%0.748SS**  trans174.585159.2-102.1-164.2168.200108.4
109V54.2Low49.4Very low141 Ų141127 Ų12786%0.85573%0.73SS**  trans-125.198.1154-176.90000106.5
110E58.2Low49.9Very low147 Ų147128.4 Ų128.469%0.68772%0.724SS**  trans-46.7130.4176.6-172.7174.1176.200111.5L112E110-L112 PolarHBondContact O-N 2.87Å
111P56.8Low50.4Low112 Ų112126.8 Ų126.873%0.72771%0.706SS**  trans-61.4108.9174.7-18.429.4000110R113P111-R113 PolarHBondContact O-N 3.48Å
112L49.9Very low50.8Low137 Ų137125.9 Ų125.972%0.71770%0.696SS**  trans-51.8125.9173.6-76.9151.6000109.5E110 E116E110-L112 PolarHBondContact O-N 2.87Å; L112-E116 WeakPolarHBondContact CD2-OE2 3.34Å
113R55.5Low51.1Low160 Ų160125.3 Ų125.360%0.60469%0.686SS**  trans-58.6145.7-172-69.5-75.9162.7118.5-0.8110.9P111 D115 E116P111-R113 PolarHBondContact O-N 3.48Å; R113-D115 PolarHBondContact O-N 2.98Å; R113-E116 HydrophobicContact CB-CG 4.49Å; R113-E116 PolarHBondContact O-N 3.49Å
114P60Low52Low96 Ų96129.3 Ų129.362%0.62368%0.682SS**Hα-helixtrans-49.3-30.7175.2-2734.4000113.4E116 L117 E118P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 2.89Å; P114-L117 PolarHBondContact O-N 3.2Å; P114-E118 PolarHBondContact O-N 2.94Å
115D61.3Low53.1Low101 Ų101133.3 Ų133.354%0.5468%0.68SS.*Hα-helixtrans-69.5-20.8179.6-46.1-40000113.8R113 R119R113-D115 PolarHBondContact O-N 2.98Å; D115-R119 VanDerWaalsContact O-CG 3.31Å; D115-R119 WeakPolarHBondContact O-CG 3.48Å; D115-R119 PolarHBondContact O-NH1 3.08Å
116E60.2Low53.8Low74 Ų74131.3 Ų131.335%0.34667%0.667SS.*Hα-helixtrans-85.8-33.6173.6-51.3-142.1122.100111.5L112 R113 P114 R119 L120L112-E116 WeakPolarHBondContact CD2-OE2 3.34Å; R113-E116 HydrophobicContact CB-CG 4.49Å; R113-E116 PolarHBondContact O-N 3.49Å; P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 2.89Å; E116-R119 VanDerWaalsContact CD-NH2 3.27Å; E116-R119 VanDerWaalsContact CG-NH2 3.29Å; E116-R119 PolarHBondContact O-N 2.72Å; E116-R119 IonicContact OE1-CZ 3.79Å; E116-R119 IonicContact OE1-NH2 2.72Å; E116-R119 PolarHBondContact OE1-NH2 3.26Å; E116-L120 VanDerWaalsContact O-CG 3.3Å; E116-L120 WeakPolarHBondContact O-CG 3.41Å; E116-L120 PolarHBondContact O-N 3.26Å
117L56.6Low54.3Low126 Ų126130.1 Ų130.166%0.6666%0.656SS**Hα-helixtrans-69.9-35.3175.3-165.863.4000111.4P114 R119 L120 S121P114-L117 PolarHBondContact O-N 3.2Å; L117-R119 VanDerWaalsContact C-N 3.33Å; L117-R119 PolarHBondContact O-N 2.86Å; L117-L120 PolarHBondContact O-N 3.26Å; L117-S121 WeakPolarHBondContact O-CB 3.13Å; L117-S121 PolarHBondContact O-N 3.04Å; L117-S121 PolarHBondContact O-OG 3.37Å
118E59.5Low54.7Low146 Ų146130.2 Ų130.268%0.68265%0.652SS**Hα-helixtrans-70.6-26.4175.1-165.2171-158.400113.1P114 S121P114-E118 PolarHBondContact O-N 2.94Å; E118-S121 WeakPolarHBondContact CA-OG 3.3Å; E118-S121 PolarHBondContact O-OG 3.11Å
119R55Low55.4Low140 Ų140123.5 Ų123.553%0.52863%0.626SS.*Hα-helixtrans-79-21.7172.1-68.3-176.3-37.3-10510.7113.1D115 E116 L117 W123D115-R119 VanDerWaalsContact O-CG 3.31Å; D115-R119 WeakPolarHBondContact O-CG 3.48Å; D115-R119 PolarHBondContact O-NH1 3.08Å; E116-R119 VanDerWaalsContact CD-NH2 3.27Å; E116-R119 VanDerWaalsContact CG-NH2 3.29Å; E116-R119 PolarHBondContact O-N 2.72Å; E116-R119 IonicContact OE1-CZ 3.79Å; E116-R119 IonicContact OE1-NH2 2.72Å; E116-R119 PolarHBondContact OE1-NH2 3.26Å; L117-R119 VanDerWaalsContact C-N 3.33Å; L117-R119 PolarHBondContact O-N 2.86Å; R119-W123 PolarHBondContact O-NE1 3.44Å
120L50.7Low56.1Low123 Ų123126.6 Ų126.664%0.64462%0.623SS**Hα-helixtrans-93.8-26.1178.9-68.9170.5000112.2E116 L117 G122E116-L120 VanDerWaalsContact O-CG 3.3Å; E116-L120 WeakPolarHBondContact O-CG 3.41Å; E116-L120 PolarHBondContact O-N 3.26Å; L117-L120 PolarHBondContact O-N 3.26Å; L120-G122 VanDerWaalsContact C-N 3.29Å; L120-G122 PolarHBondContact O-N 3.45Å
121S53.4Low56.5Low73 Ų73126.8 Ų126.851%0.5163%0.628SS.*G310 helixtrans-73.4-16.6174.3630000114L117 E118 W123L117-S121 WeakPolarHBondContact O-CB 3.13Å; L117-S121 PolarHBondContact O-N 3.04Å; L117-S121 PolarHBondContact O-OG 3.37Å; E118-S121 WeakPolarHBondContact CA-OG 3.3Å; E118-S121 PolarHBondContact O-OG 3.11Å; S121-W123 PolarHBondContact O-N 2.76Å
122G45.5Very low56.7Low59 Ų59131.3 Ų131.361%0.60863%0.632SS**G310 helixtrans-75.1-2.2178.700000115.9L120L120-G122 VanDerWaalsContact C-N 3.29Å; L120-G122 PolarHBondContact O-N 3.45Å
123W45.6Very low57Low187 Ų187128 Ų12871%0.70862%0.62SS**G310 helixtrans-105.1-12.3-174.5-58.485.1000113.9R119 S121R119-W123 PolarHBondContact O-NE1 3.44Å; S121-W123 PolarHBondContact O-N 2.76Å
124E52.6Low56.9Low166 Ų166124.6 Ų124.678%0.77662%0.621SS**SBendtrans-94.2-11.4-173.2-150.2-179.6-157.900113.4
125E55.6Low57Low163 Ų163125.5 Ų125.576%0.76263%0.627SS**SBendtrans-97.5-2.5-177.7-141.5178.6-162.600113.7S129E125-S129 PolarHBondContact O-OG 3.43Å
126E57.8Low56.5Low102 Ų102128.7 Ų128.748%0.47764%0.636SS.*SBendtrans-88.1-22.9-176.4-165.6162.6-144.200113.2S129 K138E126-S129 PolarHBondContact O-N 2.88Å; E126-K138 IonicContact OE1-NZ 2.87Å; E126-K138 PolarHBondContact OE1-NZ 3.43Å
127E56.4Low56.6Low161 Ų161133.4 Ų133.475%0.75266%0.655SS**SBendtrans-76.5-35.1-174.5-64.8-164.6159.600113.3
128E57.3Low56.6Low134 Ų134136.1 Ų136.163%0.62666%0.662SS**G310 helixtrans-84-12.3173.9-6870.2-152.900113.3W130E128-W130 VanDerWaalsContact C-N 3.3Å; E128-W130 PolarHBondContact O-N 2.82Å
129S60.6Low56.6Low46 Ų46133.1 Ų133.132%0.32265%0.65SS.*G310 helixtrans-77.5-11.2-175.5-810000113.9E125 E126 L131 Y132 S133E125-S129 PolarHBondContact O-OG 3.43Å; E126-S129 PolarHBondContact O-N 2.88Å; S129-L131 VanDerWaalsContact C-N 3.29Å; S129-L131 PolarHBondContact O-N 3.35Å; S129-Y132 PolarHBondContact O-N 2.88Å; S129-S133 WeakPolarHBondContact O-CB 3.36Å; S129-S133 PolarHBondContact O-N 2.83Å; S129-S133 PolarHBondContact O-OG 2.86Å
130W70.3Confident56.9Low205 Ų205130.1 Ų130.178%0.77765%0.647SS**G310 helixtrans-70.3-24.4-176.3-132.5-53.2000113.7E128E128-W130 VanDerWaalsContact C-N 3.3Å; E128-W130 PolarHBondContact O-N 2.82Å
131L66.6Low57.4Low152 Ų152129.4 Ų129.480%0.79665%0.65SS**THydrogen-bonded Turntrans-86-26.4-179.7-151.581.2000112.9S129S129-L131 VanDerWaalsContact C-N 3.29Å; S129-L131 PolarHBondContact O-N 3.35Å
132Y60.6Low57.7Low206 Ų206133 Ų13381%0.80866%0.66SS**THydrogen-bonded Turntrans-109.8-11-176.4-66.7-77.5000114S129S129-Y132 PolarHBondContact O-N 2.88Å
133S55.1Low58.6Low67 Ų67135.3 Ų135.347%0.46966%0.655SS.*SBendtrans-109.1116.5174.4-61.90000110.6S129S129-S133 WeakPolarHBondContact O-CB 3.36Å; S129-S133 PolarHBondContact O-N 2.83Å; S129-S133 PolarHBondContact O-OG 2.86Å
134S53.8Low59.4Low90 Ų90133.7 Ų133.763%0.62965%0.653SS**  trans-54.7131173.4176.50000110.4K136S134-K136 PolarHBondContact O-N 2.99Å; S134-K136 PolarHBondContact OG-N 3.28Å
135P61.8Low60Low114 Ų114130 Ų13074%0.7465%0.645SS**SBendtrans-59.91.5175.6-2634.8000115.1
136K52.5Low61Low168 Ų168124.9 Ų124.973%0.7363%0.626SS**SBendtrans-117.8109-176.7-69.8-176.4167.3167.70110.4S134S134-K136 PolarHBondContact O-N 2.99Å; S134-K136 PolarHBondContact OG-N 3.28Å
137K60.7Low62.1Low173 Ų173122.8 Ų122.875%0.75262%0.622SS**  trans79.2102.8173.2-52.2172-178172.80113.2L139K137-L139 PolarHBondContact O-N 2.92Å
138K57.4Low63.6Low184 Ų184119.9 Ų119.980%0.862%0.617SS**  trans-57.2102.1162-66.2-96.5-179.2178.70106.2E126 T140E126-K138 IonicContact OE1-NZ 2.87Å; E126-K138 PolarHBondContact OE1-NZ 3.43Å; K138-T140 PolarHBondContact O-N 2.92Å
139L59.7Low65.1Low82 Ų82120 Ų12043%0.42962%0.621SS.*  trans-55.3129.4177.1-97.570.6000108K137 Q143 K144K137-L139 PolarHBondContact O-N 2.92Å; L139-Q143 HydrophobicContact CB-CB 3.98Å; L139-Q143 HydrophobicContact CD2-CB 3.74Å; L139-Q143 HydrophobicContact CG-CB 3.74Å; L139-K144 HydrophobicContact CB-CG 3.88Å; L139-K144 WeakPolarHBondContact O-CE 3.31Å
140T61.7Low66.5Low78 Ų78121.9 Ų121.948%0.47963%0.631SS.*  trans-57.8150.517150.80000109.1K138 M142 Q143 K144K138-T140 PolarHBondContact O-N 2.92Å; T140-M142 PolarHBondContact O-N 3.43Å; T140-Q143 PolarHBondContact O-N 2.91Å; T140-K144 PolarHBondContact O-N 3.37Å
141P61.4Low67.3Low108 Ų108119.2 Ų119.270%0.70162%0.621SS**Hα-helixtrans-51.5-29.9179.1-26.433.5000113.2K144 S145P141-K144 PolarHBondContact O-N 2.78Å; P141-S145 PolarHBondContact O-N 3.03Å
142M59.1Low68.3Low147 Ų147114.7 Ų114.772%0.72460%0.601SS**Hα-helixtrans-68.9-28.8174.8-64.9-100.367.700114.3T140 S145T140-M142 PolarHBondContact O-N 3.43Å; M142-S145 PolarHBondContact O-OG 2.98Å
143Q63.2Low69.8Low108 Ų108113 Ų11351%0.50559%0.594SS.*Hα-helixtrans-80.1-29.1173.5-75.1-171.7-64.800112.3L139 T140 S145 V146L139-Q143 HydrophobicContact CB-CB 3.98Å; L139-Q143 HydrophobicContact CD2-CB 3.74Å; L139-Q143 HydrophobicContact CG-CB 3.74Å; T140-Q143 PolarHBondContact O-N 2.91Å; Q143-S145 VanDerWaalsContact C-N 3.3Å; Q143-S145 PolarHBondContact O-N 3.42Å; Q143-V146 PolarHBondContact O-N 3.43Å
144K62.8Low71.3Confident154 Ų154115 Ų11567%0.6760%0.595SS**Hα-helixtrans-69.9-26179.4-60-179.2180-1720112.9L139 T140 P141L139-K144 HydrophobicContact CB-CG 3.88Å; L139-K144 WeakPolarHBondContact O-CE 3.31Å; T140-K144 PolarHBondContact O-N 3.37Å; P141-K144 PolarHBondContact O-N 2.78Å
145S66.1Low72.9Confident87 Ų87112.7 Ų112.761%0.60858%0.578SS**THydrogen-bonded Turntrans-891.4179.559.40000114.4P141 M142 Q143 S147P141-S145 PolarHBondContact O-N 3.03Å; M142-S145 PolarHBondContact O-OG 2.98Å; Q143-S145 VanDerWaalsContact C-N 3.3Å; Q143-S145 PolarHBondContact O-N 3.42Å; S145-S147 PolarHBondContact O-N 3.38Å
146V75.8Confident74Confident57 Ų57113.9 Ų113.935%0.34558%0.577SS.*SBendtrans-74.2118.7176.7-177.90000109.1Q143 V150 W151Q143-V146 PolarHBondContact O-N 3.43Å; V146-V150 HydrophobicContact CG1-CB 3.93Å; V146-V150 HydrophobicContact CG1-CG1 3.9Å; V146-W151 HydrophobicContact CG1-CB 3.85Å
147S82Confident75.8Confident58 Ų58110.5 Ų110.541%0.40657%0.567SS.*  trans-52.4134.3171.81740000110.1S145 L149 V150 W151S145-S147 PolarHBondContact O-N 3.38Å; S147-L149 PolarHBondContact O-N 3.42Å; S147-V150 WeakPolarHBondContact O-CA 3.2Å; S147-V150 WeakPolarHBondContact O-CB 3.41Å; S147-V150 PolarHBondContact O-N 3.18Å; S147-W151 PolarHBondContact O-N 2.85Å
148P86.6Confident77.1Confident100 Ų100110.2 Ų110.265%0.64956%0.562SS**Hα-helixtrans-51.9-35.7-179.4-29.534.9000113.6W151 C152P148-W151 PolarHBondContact O-N 2.85Å; P148-C152 WeakPolarHBondContact O-CB 3.37Å; P148-C152 PolarHBondContact O-N 2.93Å; P148-C152 PolarHBondContact O-SG 3.48Å
149L90Very high78.5Confident136 Ų136103.5 Ų103.571%0.71254%0.537SS*.Hα-helixtrans-64.6-41.1175.2-77.8157.5000112.6S147 R153S147-L149 PolarHBondContact O-N 3.42Å; L149-R153 WeakPolarHBondContact O-CG 3.34Å; L149-R153 PolarHBondContact O-N 3.38Å
150V88.5Confident79.8Confident86 Ų86102.7 Ų102.752%0.52154%0.538SS..Hα-helixtrans-68.7-40.1176.51770000110.1V146 S147 R153 Q154V146-V150 HydrophobicContact CG1-CB 3.93Å; V146-V150 HydrophobicContact CG1-CG1 3.9Å; S147-V150 WeakPolarHBondContact O-CA 3.2Å; S147-V150 WeakPolarHBondContact O-CB 3.41Å; S147-V150 PolarHBondContact O-N 3.18Å; V150-R153 PolarHBondContact O-N 3.44Å; V150-Q154 WeakPolarHBondContact O-CB 3.49Å; V150-Q154 PolarHBondContact O-N 3.46Å
151W88.9Confident81.2Confident148 Ų148103.4 Ų103.456%0.56155%0.545SS*.Hα-helixtrans-62-46.4174.2-179.785.4000111.7V146 S147 P148 R153 Q154 V155V146-W151 HydrophobicContact CG1-CB 3.85Å; S147-W151 PolarHBondContact O-N 2.85Å; P148-W151 PolarHBondContact O-N 2.85Å; W151-R153 VanDerWaalsContact C-N 3.35Å; W151-R153 PolarHBondContact O-N 3.47Å; W151-Q154 PolarHBondContact O-N 3.37Å; W151-V155 HydrophobicContact CD2-CG2 4.07Å; W151-V155 HydrophobicContact CG-CG2 4.5Å; W151-V155 HydrophobicContact CH2-CG2 4.43Å; W151-V155 HydrophobicContact CZ2-CG2 3.9Å; W151-V155 WeakPolarHBondContact O-CG2 3.31Å; W151-V155 PolarHBondContact O-N 2.82Å
152C87.7Confident82.7Confident57 Ų57103.9 Ų103.939%0.38554%0.541SS..Hα-helixtrans-58.2-46.2175.9-72.40000111.5P148 V155 L156P148-C152 WeakPolarHBondContact O-CB 3.37Å; P148-C152 PolarHBondContact O-N 2.93Å; P148-C152 PolarHBondContact O-SG 3.48Å; C152-V155 PolarHBondContact O-N 3.13Å; C152-L156 WeakPolarHBondContact O-CB 3.47Å; C152-L156 VanDerWaalsContact O-CG 3.24Å; C152-L156 WeakPolarHBondContact O-CG 3.38Å; C152-L156 PolarHBondContact O-N 3.37Å
153R90.8Very high84.2Confident172 Ų172100 Ų10065%0.64953%0.525SS*.Hα-helixtrans-62.4-43.9175.4-73.7-178.766.7172.80.5111.8L149 V150 W151 V155 L156 D157L149-R153 WeakPolarHBondContact O-CG 3.34Å; L149-R153 PolarHBondContact O-N 3.38Å; V150-R153 PolarHBondContact O-N 3.44Å; W151-R153 VanDerWaalsContact C-N 3.35Å; W151-R153 PolarHBondContact O-N 3.47Å; R153-V155 PolarHBondContact O-N 3.29Å; R153-L156 PolarHBondContact O-N 2.85Å; R153-D157 IonicContact NE-OD2 2.66Å; R153-D157 WeakPolarHBondContact O-CB 3.37Å; R153-D157 PolarHBondContact O-N 3.27Å
154Q87.3Confident85.5Confident107 Ų10799 Ų9950%0.552%0.521SS..Hα-helixtrans-60.2-43.9178.2-177.462.250.100112.1V150 W151 Y158V150-Q154 WeakPolarHBondContact O-CB 3.49Å; V150-Q154 PolarHBondContact O-N 3.46Å; W151-Q154 PolarHBondContact O-N 3.37Å; Q154-Y158 CarbonylContact O-C 3.34Å; Q154-Y158 WeakPolarHBondContact O-CA 3.45Å; Q154-Y158 WeakPolarHBondContact O-CB 3.5Å; Q154-Y158 PolarHBondContact O-N 3.47Å; Q154-Y158 VanDerWaalsContact O-O 3.07Å
155V86.4Confident87Confident43 Ų4395.4 Ų95.426%0.26151%0.514SS..Hα-helixtrans-72.6-34.6-179.1174.50000112.1W151 C152 R153 P159W151-V155 HydrophobicContact CD2-CG2 4.07Å; W151-V155 HydrophobicContact CG-CG2 4.5Å; W151-V155 HydrophobicContact CH2-CG2 4.43Å; W151-V155 HydrophobicContact CZ2-CG2 3.9Å; W151-V155 WeakPolarHBondContact O-CG2 3.31Å; W151-V155 PolarHBondContact O-N 2.82Å; C152-V155 PolarHBondContact O-N 3.13Å; R153-V155 PolarHBondContact O-N 3.29Å; V155-P159 VanDerWaalsContact O-CA 3.3Å; V155-P159 WeakPolarHBondContact O-CA 3.3Å
156L85.6Confident88.3Confident139 Ų13994.1 Ų94.173%0.72851%0.509SS*.Hα-helixtrans-81.6-42179.7-68.8174000113C152 R153C152-L156 WeakPolarHBondContact O-CB 3.47Å; C152-L156 VanDerWaalsContact O-CG 3.24Å; C152-L156 WeakPolarHBondContact O-CG 3.38Å; C152-L156 PolarHBondContact O-N 3.37Å; R153-L156 PolarHBondContact O-N 2.85Å
157D90.4Very high89.2Confident97 Ų9797 Ų9752%0.51952%0.517SS..Hα-helixtrans-76.9-31.3-179.5-63.5-23.2000111R153R153-D157 IonicContact NE-OD2 2.66Å; R153-D157 WeakPolarHBondContact O-CB 3.37Å; R153-D157 PolarHBondContact O-N 3.27Å
158Y87.8Confident89.8Confident166 Ų166101.2 Ų101.265%0.65153%0.528SS*.SBendtrans-138.274.4-179.1-55.9-82.1000111.3Q154 S160Q154-Y158 CarbonylContact O-C 3.34Å; Q154-Y158 WeakPolarHBondContact O-CA 3.45Å; Q154-Y158 WeakPolarHBondContact O-CB 3.5Å; Q154-Y158 PolarHBondContact O-N 3.47Å; Q154-Y158 VanDerWaalsContact O-O 3.07Å; Y158-S160 PolarHBondContact O-N 2.83Å
159P87.2Confident90.2Very high43 Ų43100.1 Ų100.128%0.27952%0.522SS..  trans-62.4135179.727.2-35000111.2V155 V163 E164V155-P159 VanDerWaalsContact O-CA 3.3Å; V155-P159 WeakPolarHBondContact O-CA 3.3Å; P159-V163 HydrophobicContact CB-CB 4.37Å; P159-V163 HydrophobicContact CB-CG1 4.2Å; P159-E164 HydrophobicContact CB-CG 3.84Å; P159-E164 HydrophobicContact CG-CG 3.82Å
160S87.4Confident90.6Very high65 Ų6598.5 Ų98.546%0.45551%0.514SS..  trans-63149171.1172.10000110.4Y158 D162 V163 E164Y158-S160 PolarHBondContact O-N 2.83Å; S160-D162 PolarHBondContact O-N 2.95Å; S160-V163 WeakPolarHBondContact O-CA 3.27Å; S160-V163 WeakPolarHBondContact O-CB 3.43Å; S160-V163 PolarHBondContact O-N 3.33Å; S160-E164 PolarHBondContact O-N 3.3Å
161P91.1Very high90.9Very high94 Ų9499.3 Ų99.361%0.6151%0.514SS*.Hα-helixtrans-51.5-33.3175.9-28.435.1000113.8E164 C165P161-E164 PolarHBondContact O-N 3.06Å; P161-C165 VanDerWaalsContact O-CB 3.29Å; P161-C165 WeakPolarHBondContact O-CB 3.34Å; P161-C165 PolarHBondContact O-N 3.45Å; P161-C165 PolarHBondContact O-SG 3.16Å
162D91.4Very high91.2Very high117 Ų11797.8 Ų97.863%0.62651%0.513SS*.Hα-helixtrans-64.9-42.5175.2-173.846000112.2S160 C165 A166S160-D162 PolarHBondContact O-N 2.95Å; D162-C165 PolarHBondContact O-N 3.24Å; D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 3.26Å
163V90.9Very high91.6Very high65 Ų65101.6 Ų101.639%0.39452%0.523SS..Hα-helixtrans-66.8-40.4175.7177.40000110.5P159 S160 A166 K167P159-V163 HydrophobicContact CB-CB 4.37Å; P159-V163 HydrophobicContact CB-CG1 4.2Å; S160-V163 WeakPolarHBondContact O-CA 3.27Å; S160-V163 WeakPolarHBondContact O-CB 3.43Å; S160-V163 PolarHBondContact O-N 3.33Å; V163-A166 PolarHBondContact O-N 2.99Å; V163-K167 WeakPolarHBondContact O-CB 3.33Å; V163-K167 PolarHBondContact O-N 3.36Å
164E91.4Very high91.9Very high88 Ų8898.1 Ų98.141%0.41152%0.517SS..Hα-helixtrans-64.8-43.1175-64-162.4142.200112.3P159 S160 P161 K167 K168P159-E164 HydrophobicContact CB-CG 3.84Å; P159-E164 HydrophobicContact CG-CG 3.82Å; S160-E164 PolarHBondContact O-N 3.3Å; P161-E164 PolarHBondContact O-N 3.06Å; E164-K167 PolarHBondContact O-N 3.49Å; E164-K168 WeakPolarHBondContact O-CB 3.43Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.38Å; E164-K168 PolarHBondContact O-N 2.83Å
165C93.1Very high92.2Very high78 Ų7897.7 Ų97.753%0.52752%0.518SS..Hα-helixtrans-62.6-45.1175.1-76.40000111.7P161 D162 K167 K168 S169P161-C165 VanDerWaalsContact O-CB 3.29Å; P161-C165 WeakPolarHBondContact O-CB 3.34Å; P161-C165 PolarHBondContact O-N 3.45Å; P161-C165 PolarHBondContact O-SG 3.16Å; D162-C165 PolarHBondContact O-N 3.24Å; C165-K167 VanDerWaalsContact C-N 3.34Å; C165-K167 PolarHBondContact O-N 3.22Å; C165-K168 PolarHBondContact O-N 3.5Å; C165-S169 VanDerWaalsContact O-CB 3.31Å; C165-S169 WeakPolarHBondContact O-CB 3.38Å; C165-S169 PolarHBondContact O-N 3.38Å
166A93.8Very high92.5Very high60 Ų60101.4 Ų101.450%0.49653%0.532SS..Hα-helixtrans-60.6-43.6175.200000111.5D162 V163 S169 L170D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 3.26Å; V163-A166 PolarHBondContact O-N 2.99Å; A166-S169 PolarHBondContact O-N 2.97Å; A166-L170 WeakPolarHBondContact O-CB 3.24Å; A166-L170 PolarHBondContact O-N 3.25Å
167K94Very high92.8Very high119 Ų11998.1 Ų98.152%0.51752%0.519SS..Hα-helixtrans-59.9-48.1174.4-173.7-175.674.4-178.30111.6V163 E164 C165 L170 I171V163-K167 WeakPolarHBondContact O-CB 3.33Å; V163-K167 PolarHBondContact O-N 3.36Å; E164-K167 PolarHBondContact O-N 3.49Å; C165-K167 VanDerWaalsContact C-N 3.34Å; C165-K167 PolarHBondContact O-N 3.22Å; K167-L170 PolarHBondContact O-N 2.88Å; K167-I171 HydrophobicContact CG-CD1 4.06Å; K167-I171 VanDerWaalsContact O-CG1 3.31Å; K167-I171 WeakPolarHBondContact O-CG1 3.43Å; K167-I171 PolarHBondContact O-N 3.45Å
168K95.2Very high92.7Very high146 Ų14698.4 Ų98.464%0.63552%0.518SS*.Hα-helixtrans-63.6-41.7178.9-71.9172.475.5175.10111.8E164 C165 I171 H172E164-K168 WeakPolarHBondContact O-CB 3.43Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.38Å; E164-K168 PolarHBondContact O-N 2.83Å; C165-K168 PolarHBondContact O-N 3.5Å; K168-I171 PolarHBondContact O-N 2.7Å; K168-H172 WeakPolarHBondContact O-CB 3.43Å; K168-H172 PolarHBondContact O-N 3.45Å
169S96.1Very high92.7Very high76 Ų7693 Ų9353%0.53150%0.504SS..Hα-helixtrans-63.4-43.3176-177.10000111.8C165 A166 H172 K173C165-S169 VanDerWaalsContact O-CB 3.31Å; C165-S169 WeakPolarHBondContact O-CB 3.38Å; C165-S169 PolarHBondContact O-N 3.38Å; A166-S169 PolarHBondContact O-N 2.97Å; S169-H172 PolarHBondContact O-N 2.96Å; S169-K173 WeakPolarHBondContact O-CB 3.15Å; S169-K173 PolarHBondContact O-N 3.06Å
170L96.5Very high92.3Very high103 Ų10393.1 Ų93.154%0.53951%0.509SS..Hα-helixtrans-62.7-46.1176.1179.661.6000111.9A166 K167 H172 K173 L174A166-L170 WeakPolarHBondContact O-CB 3.24Å; A166-L170 PolarHBondContact O-N 3.25Å; K167-L170 PolarHBondContact O-N 2.88Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 3.19Å; L170-K173 PolarHBondContact O-N 3.31Å; L170-L174 HydrophobicContact CD1-CD1 4.36Å; L170-L174 HydrophobicContact CD1-CG 4.34Å; L170-L174 HydrophobicContact CG-CD1 4.24Å; L170-L174 WeakPolarHBondContact O-CG 3.44Å; L170-L174 PolarHBondContact O-N 2.88Å
171I95.1Very high92.1Very high102 Ų10294 Ų9452%0.52351%0.508SS..Hα-helixtrans-59.6-44.8175.9-68.1165.7000110.3K167 K168 K173 L174 D175K167-I171 HydrophobicContact CG-CD1 4.06Å; K167-I171 VanDerWaalsContact O-CG1 3.31Å; K167-I171 WeakPolarHBondContact O-CG1 3.43Å; K167-I171 PolarHBondContact O-N 3.45Å; K168-I171 PolarHBondContact O-N 2.7Å; I171-K173 PolarHBondContact O-N 3.05Å; I171-L174 PolarHBondContact O-N 3.13Å; I171-D175 WeakPolarHBondContact O-CB 3.34Å; I171-D175 PolarHBondContact O-N 2.82Å
172H95.9Very high91.3Very high117 Ų11796.3 Ų96.354%0.54251%0.509SS..Hα-helixtrans-61.8-42.2177.2-178.668.7000112.3K168 S169 L170 D175 Q176K168-H172 WeakPolarHBondContact O-CB 3.43Å; K168-H172 PolarHBondContact O-N 3.45Å; S169-H172 PolarHBondContact O-N 2.96Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 3.19Å; H172-D175 PolarHBondContact O-N 2.85Å; H172-Q176 VanDerWaalsContact O-CB 3.3Å; H172-Q176 WeakPolarHBondContact O-CB 3.46Å; H172-Q176 PolarHBondContact O-N 3.45Å
173K96.5Very high90.3Very high137 Ų13799.3 Ų99.360%0.59651%0.511SS*.Hα-helixtrans-64-42.6176.7-171.4176.4179.2-1790111.6S169 L170 I171 Q176 T177S169-K173 WeakPolarHBondContact O-CB 3.15Å; S169-K173 PolarHBondContact O-N 3.06Å; L170-K173 PolarHBondContact O-N 3.31Å; I171-K173 PolarHBondContact O-N 3.05Å; K173-Q176 PolarHBondContact O-N 3.36Å; K173-T177 WeakPolarHBondContact O-CG2 3.47Å; K173-T177 PolarHBondContact O-N 3.39Å; K173-T177 PolarHBondContact O-OG1 2.93Å
174L96.6Very high88.9Confident99 Ų99101.3 Ų101.352%0.51852%0.516SS..Hα-helixtrans-67.1-38.9176.4-71.3174.6000112.4L170 I171 Q176 T177 M178L170-L174 HydrophobicContact CD1-CD1 4.36Å; L170-L174 HydrophobicContact CD1-CG 4.34Å; L170-L174 HydrophobicContact CG-CD1 4.24Å; L170-L174 WeakPolarHBondContact O-CG 3.44Å; L170-L174 PolarHBondContact O-N 2.88Å; I171-L174 PolarHBondContact O-N 3.13Å; L174-Q176 VanDerWaalsContact C-N 3.34Å; L174-T177 WeakPolarHBondContact CA-OG1 3.43Å; L174-T177 PolarHBondContact O-N 3.33Å; L174-T177 PolarHBondContact O-OG1 3.46Å; L174-M178 VanDerWaalsContact O-CB 3.3Å; L174-M178 WeakPolarHBondContact O-CB 3.3Å; L174-M178 WeakPolarHBondContact O-CG 3.39Å; L174-M178 PolarHBondContact O-N 2.95Å
175D94.6Very high87.3Confident98 Ų98102.4 Ų102.452%0.52453%0.525SS..Hα-helixtrans-66.8-38.4175.1-173.358.2000111.4I171 H172 S179I171-D175 WeakPolarHBondContact O-CB 3.34Å; I171-D175 PolarHBondContact O-N 2.82Å; H172-D175 PolarHBondContact O-N 2.85Å; D175-S179 WeakPolarHBondContact O-CB 2.97Å; D175-S179 PolarHBondContact O-N 2.88Å; D175-S179 PolarHBondContact O-OG 3.35Å
176Q92.5Very high85.5Confident120 Ų120105.2 Ų105.256%0.56153%0.534SS*.Hα-helixtrans-64.1-44.6173.6-174.8174.277.600111.8H172 K173 L174 A180H172-Q176 VanDerWaalsContact O-CB 3.3Å; H172-Q176 WeakPolarHBondContact O-CB 3.46Å; H172-Q176 PolarHBondContact O-N 3.45Å; K173-Q176 PolarHBondContact O-N 3.36Å; L174-Q176 VanDerWaalsContact C-N 3.34Å; Q176-A180 VanDerWaalsContact O-CB 3.27Å; Q176-A180 WeakPolarHBondContact O-CB 3.28Å; Q176-A180 PolarHBondContact O-N 3.48Å
177T91.7Very high83.8Confident71 Ų71112 Ų11244%0.43655%0.548SS..Hα-helixtrans-69-40.9177.456.50000112K173 L174 A180 L181K173-T177 WeakPolarHBondContact O-CG2 3.47Å; K173-T177 PolarHBondContact O-N 3.39Å; K173-T177 PolarHBondContact O-OG1 2.93Å; L174-T177 WeakPolarHBondContact CA-OG1 3.43Å; L174-T177 PolarHBondContact O-N 3.33Å; L174-T177 PolarHBondContact O-OG1 3.46Å; T177-A180 PolarHBondContact O-N 2.87Å; T177-L181 VanDerWaalsContact O-CB 3.31Å; T177-L181 WeakPolarHBondContact O-CB 3.44Å; T177-L181 PolarHBondContact O-N 3.31Å
178M88.5Confident81.8Confident103 Ų103111.6 Ų111.651%0.50755%0.552SS.*Hα-helixtrans-67.1-37175.6-76.6-63.2-70.300112.3L174 L181 K182L174-M178 VanDerWaalsContact O-CB 3.3Å; L174-M178 WeakPolarHBondContact O-CB 3.3Å; L174-M178 WeakPolarHBondContact O-CG 3.39Å; L174-M178 PolarHBondContact O-N 2.95Å; M178-L181 PolarHBondContact O-N 2.92Å; M178-K182 WeakPolarHBondContact O-CB 3.31Å; M178-K182 WeakPolarHBondContact O-CG 3.44Å; M178-K182 PolarHBondContact O-N 3.3Å
179S86.3Confident79.3Confident52 Ų52109.5 Ų109.536%0.36455%0.548SS..Hα-helixtrans-69.4-37.9174-67.20000112D175 R183D175-S179 WeakPolarHBondContact O-CB 2.97Å; D175-S179 PolarHBondContact O-N 2.88Å; D175-S179 PolarHBondContact O-OG 3.35Å; S179-R183 PolarHBondContact O-N 2.96Å
180A80.7Confident77Confident46 Ų46110.8 Ų110.838%0.3855%0.554SS.*Hα-helixtrans-65.5-40.9172.200000111.5Q176 T177 R183 Q184Q176-A180 VanDerWaalsContact O-CB 3.27Å; Q176-A180 WeakPolarHBondContact O-CB 3.28Å; Q176-A180 PolarHBondContact O-N 3.48Å; T177-A180 PolarHBondContact O-N 2.87Å; A180-R183 CarbonylContact O-C 3.59Å; A180-R183 PolarHBondContact O-N 3.48Å; A180-Q184 WeakPolarHBondContact O-CB 3.44Å; A180-Q184 PolarHBondContact O-N 3.13Å
181L81.9Confident74.6Confident84 Ų84114.9 Ų114.944%0.4457%0.568SS.*Hα-helixtrans-69.4-34.2177.3-17361.5000112.3T177 M178 Q184 N185T177-L181 VanDerWaalsContact O-CB 3.31Å; T177-L181 WeakPolarHBondContact O-CB 3.44Å; T177-L181 PolarHBondContact O-N 3.31Å; M178-L181 PolarHBondContact O-N 2.92Å; L181-Q184 PolarHBondContact O-N 2.83Å; L181-N185 WeakPolarHBondContact O-CB 3.42Å; L181-N185 PolarHBondContact O-N 3.22Å; L181-N185 PolarHBondContact O-ND2 3.25Å
182K75.2Confident72.1Confident142 Ų142116.5 Ų116.562%0.61758%0.577SS**Hα-helixtrans-65.3-40.8170.6-80178.5176.9174.90111.8M178 N185 L186M178-K182 WeakPolarHBondContact O-CB 3.31Å; M178-K182 WeakPolarHBondContact O-CG 3.44Å; M178-K182 PolarHBondContact O-N 3.3Å; K182-N185 PolarHBondContact O-N 2.9Å; K182-L186 WeakPolarHBondContact O-CD1 3.4Å; K182-L186 PolarHBondContact O-N 3.43Å
183R69.8Low69.4Low180 Ų180116 Ų11668%0.67959%0.587SS**Hα-helixtrans-69.5-37.7173.6-72.1-162.6-71.3165.1-3.2111.9S179 A180 L186 Y187S179-R183 PolarHBondContact O-N 2.96Å; A180-R183 CarbonylContact O-C 3.59Å; A180-R183 PolarHBondContact O-N 3.48Å; R183-L186 PolarHBondContact O-N 2.98Å; R183-Y187 WeakPolarHBondContact O-CD2 3.38Å; R183-Y187 PolarHBondContact O-N 3.31Å
184Q62Low66.9Low107 Ų107117.2 Ų117.250%0.560%0.597SS.*Hα-helixtrans-64.4-40.9172.3-101.6-167.2-22.200111.4A180 L181 L186 Y187 N188A180-Q184 WeakPolarHBondContact O-CB 3.44Å; A180-Q184 PolarHBondContact O-N 3.13Å; L181-Q184 PolarHBondContact O-N 2.83Å; Q184-L186 PolarHBondContact O-N 3.44Å; Q184-L186 VanDerWaalsContact O-N 3.13Å; Q184-Y187 PolarHBondContact O-N 2.89Å; Q184-N188 PolarHBondContact NE2-ND2 3.47Å; Q184-N188 WeakPolarHBondContact O-CA 3.45Å; Q184-N188 VanDerWaalsContact O-CB 3.28Å; Q184-N188 WeakPolarHBondContact O-CB 3.3Å; Q184-N188 PolarHBondContact O-N 3.4Å
185N57.1Low64Low110 Ų110118 Ų11859%0.58861%0.611SS**Hα-helixtrans-61.1-25.2176.6-91.4-75.7000113.7L181 K182L181-N185 WeakPolarHBondContact O-CB 3.42Å; L181-N185 PolarHBondContact O-N 3.22Å; L181-N185 PolarHBondContact O-ND2 3.25Å; K182-N185 PolarHBondContact O-N 2.9Å
186L56.6Low61.7Low137 Ų137122.5 Ų122.572%0.71762%0.622SS**Hα-helixtrans-84.9-21176.3-72156.4000113.4K182 R183 Q184K182-L186 WeakPolarHBondContact O-CD1 3.4Å; K182-L186 PolarHBondContact O-N 3.43Å; R183-L186 PolarHBondContact O-N 2.98Å; Q184-L186 PolarHBondContact O-N 3.44Å; Q184-L186 VanDerWaalsContact O-N 3.13Å
187Y56.2Low59.4Low203 Ų203122.7 Ų122.780%0.79663%0.631SS**Hα-helixtrans-117.2-16.1-175.8-76.3-82.9000114.7R183 Q184R183-Y187 WeakPolarHBondContact O-CD2 3.38Å; R183-Y187 PolarHBondContact O-N 3.31Å; Q184-Y187 PolarHBondContact O-N 2.89Å
188N52.6Low56.6Low110 Ų110124.9 Ų124.959%0.58865%0.65SS**  trans-103.937.3176-95.3-3.5000111.8Q184 P190Q184-N188 PolarHBondContact NE2-ND2 3.47Å; Q184-N188 WeakPolarHBondContact O-CA 3.45Å; Q184-N188 VanDerWaalsContact O-CB 3.28Å; Q184-N188 WeakPolarHBondContact O-CB 3.3Å; Q184-N188 PolarHBondContact O-N 3.4Å; N188-P190 WeakPolarHBondContact O-CD 2.99Å
189N42.7Very low54.6Low103 Ų103124.8 Ų124.855%0.55166%0.657SS**  trans-102.981.1166.2-148.5-19.4000109.2F191N189-F191 PolarHBondContact O-N 3.32Å
190P48.8Very low52.5Low103 Ų103133 Ų13367%0.66968%0.681SS**THydrogen-bonded Turntrans-77.44.2177.131-32.5000113.3N188N188-P190 WeakPolarHBondContact O-CD 2.99Å
191F45.4Very low50.5Low188 Ų188136.1 Ų136.183%0.82570%0.7SS**THydrogen-bonded Turntrans-135.452.5-177.3-68.3-77.2000112.9N189N189-F191 PolarHBondContact O-N 3.32Å
192N43.2Very low48.7Very low136 Ų136137.7 Ų137.773%0.72772%0.715SS**  trans-150.367.9162.2-148.8-0.6000111.9
193S38.6Very low46.9Very low106 Ų106138 Ų13874%0.74172%0.724SS**  trans-156.473.3169.2174.40000109.3
194M43.3Very low45.5Very low163 Ų163133.9 Ų133.980%0.80373%0.728SS**  trans-149.452.8165.8-130.470.5141.900109.2Y196M194-Y196 VanDerWaalsContact C-N 3.3Å; M194-Y196 HydrophobicContact CG-CD2 4.11Å; M194-Y196 HydrophobicContact CG-CE2 4.38Å; M194-Y196 PolarHBondContact O-N 3.27Å; M194-Y196 HydrophobicContact SD-CD2 4.47Å; M194-Y196 HydrophobicContact SD-CE2 4.14Å
195S36.7Very low44.6Very low116 Ų116133.4 Ų133.481%0.81174%0.737SS**  trans-8477.5163.8-59.40000108.9T197S195-T197 PolarHBondContact O-N 3.47Å
196Y46.4Very low43.5Very low193 Ų193133.8 Ų133.876%0.75775%0.748SS**  trans-8699.7163.3-83.8-85.4000108.8M194 S198M194-Y196 VanDerWaalsContact C-N 3.3Å; M194-Y196 HydrophobicContact CG-CD2 4.11Å; M194-Y196 HydrophobicContact CG-CE2 4.38Å; M194-Y196 PolarHBondContact O-N 3.27Å; M194-Y196 HydrophobicContact SD-CD2 4.47Å; M194-Y196 HydrophobicContact SD-CE2 4.14Å; Y196-S198 PolarHBondContact O-N 3.44Å
197T44.3Very low43Very low124 Ų124131.9 Ų131.976%0.76174%0.744SS**  trans23.993.1137.864.70000116.1S195S195-T197 PolarHBondContact O-N 3.47Å
198S32.9Very low42.4Very low117 Ų117132.5 Ų132.582%0.81875%0.746SS**  trans-109.5114.1154.3-174.90000108Y196Y196-S198 PolarHBondContact O-N 3.44Å
199P46.7Very low42Very low101 Ų101133.3 Ų133.366%0.65676%0.76SS**  trans-102.971-169.238.7-32.1000111.6
200Y40.8Very low42.1Very low224 Ų224133.8 Ų133.888%0.87877%0.772SS**  trans-146.198.2158.5-78.2-73.2000110.3
201S39.1Very low41.6Very low112 Ų112132 Ų13278%0.78377%0.772SS**  trans-61.2179.2165.8-39.30000111.1
202P44.9Very low41.4Very low116 Ų116132.3 Ų132.375%0.75377%0.773SS**  cis-144151.612.237.2-15.1000117.5
203N36Very low41.5Very low149 Ų149132 Ų13280%0.79777%0.772SS**  31.9114.4127.9-167.124.9000119.8S205N203-S205 PolarHBondContact OD1-N 3.23Å
204A40.8Very low41.3Very low94 Ų94131.3 Ų131.378%0.77777%0.767SS**  trans-138.883.4146.500000109.7
205S42.7Very low41.4Very low97 Ų97129.8 Ų129.868%0.67877%0.77SS**  trans31.1115.3134.357.30000119.2N203N203-S205 PolarHBondContact OD1-N 3.23Å
206S35.6Very low41.3Very low117 Ų117129.4 Ų129.482%0.81877%0.767SS**  -162.4125122-165.30000112.2
207P45.7Very low41.1Very low97 Ų97125.5 Ų125.563%0.6377%0.767SS**  trans-91.2169.3176.936.3-30.3000112.3
208Y43.3Very low40.8Very low217 Ų217125 Ų12585%0.85177%0.765SS**  trans96.988.9176.7-61.9-80.7000117.6
209S44Very low41.5Very low126 Ų126124.5 Ų124.588%0.88176%0.759SS**  trans-158.681.7130.9-152.10000110.6
210S44.3Very low41.4Very low113 Ų113125.9 Ų125.979%0.7977%0.765SS**  trans-61.8148.5155.550.60000109.3
211G39.2Very low41.8Very low66 Ų66126 Ų12668%0.6876%0.763SS**  cis132.6114.628.700000108.1
212F41.2Very low42.7Very low194 Ų194125.9 Ų125.985%0.85176%0.76SS**  trans-156.793.3151.7-133-87.9000105.6
213N44.1Very low42.8Very low130 Ų130125.9 Ų125.970%0.69576%0.76SS**  63.7127.289.4-75.8-14.4000112.8
214S35.5Very low43.1Very low92 Ų92126.5 Ų126.564%0.64376%0.762SS**  cis-170.5143-4.3-74.40000107
215P45.9Very low43.4Very low131 Ų131128.6 Ų128.685%0.85177%0.765SS**  trans-86.1109.3157.731.5-24.3000108.6
216S34.2Very low43.3Very low107 Ų107133.1 Ų133.175%0.74877%0.772SS**  trans-94.194.8172177.90000109.7
217S42.7Very low43.6Very low111 Ų111135.7 Ų135.778%0.77677%0.771SS**  trans-96.7111.3160.7-67.30000108.6P219S217-P219 WeakPolarHBondContact O-CD 3.42Å
218T38.3Very low43.4Very low115 Ų115137.5 Ų137.571%0.70678%0.775SS**  trans-88.1120.116441.90000108.9
219P46.6Very low43.3Very low106 Ų106133.5 Ų133.569%0.68877%0.767SS**  trans-103.4101.7145.329.9-22.8000106.7S217 R221S217-P219 WeakPolarHBondContact O-CD 3.42Å; P219-R221 PolarHBondContact O-N 3.43Å
220V44.6Very low43.4Very low129 Ų129134.8 Ų134.878%0.78276%0.763SS**  trans-65.9101.1169.6-172.80000106.7
221R48.9Very low43.8Very low226 Ų226135 Ų13585%0.85376%0.762SS**PPolyproline II helixtrans-75.1126.6164.3-64.5-172.3-168.1175.23.9107.6P219P219-R221 PolarHBondContact O-N 3.43Å
222P57.5Low43.7Very low111 Ų111135.6 Ų135.672%0.72177%0.768SS**PPolyproline II helixtrans-73.7150.8169.330.9-31.1000109.9
223P48.5Very low43.6Very low116 Ų116134.1 Ų134.175%0.75377%0.769SS**PPolyproline II helixtrans-74.1145.3176.731.6-32000110.9V225P223-V225 PolarHBondContact O-N 3.36Å
224I41.6Very low43.5Very low162 Ų162133.1 Ų133.183%0.83177%0.772SS**PPolyproline II helixtrans-50.3127.8169.6-83.7161.8000111.3
225V46.9Very low43.7Very low137 Ų137132 Ų13283%0.8377%0.774SS**  trans-135.2129156.3-147.50000108.1P223P223-V225 PolarHBondContact O-N 3.36Å
226K40.8Very low43.5Very low193 Ų193132.8 Ų132.884%0.83977%0.772SS**  trans-71.7131.2-173.2-56.3163.3178.1175.90110.7
227Q42.3Very low43.8Very low170 Ų170134.6 Ų134.679%0.79477%0.772SS**  trans-169.9130.2143.4-130.1165.5-10.100112.1
228L40.9Very low43.7Very low136 Ų136138.5 Ų138.571%0.71278%0.775SS**  trans44.8141.9142.4-94.254.6000119.1
229I42.3Very low43.6Very low133 Ų133138 Ų13868%0.68278%0.776SS**  cis164.7145-5.7-128.9142000103.7
230L45.2Very low43.5Very low153 Ų153137.7 Ų137.780%0.80178%0.777SS**  trans84.7149.8157.8-90.172.4000121.6
231P52.3Low43.2Very low118 Ų118138.5 Ų138.577%0.76678%0.777SS**  -139.6-178.6-127.532.9-6.5000115.2
232G38.5Very low43.1Very low78 Ų78138.2 Ų138.280%0.80478%0.776SS**  trans67119.5136.100000121.4
233N39Very low42.2Very low162 Ų162140 Ų14087%0.86678%0.779SS**  trans-152.4152.9138.3-16034.8000111.5
234S41.2Very low41.9Very low110 Ų110140.3 Ų140.377%0.76978%0.781SS**  trans-118167.7-147.440.50000116.4
235G40Very low42.3Very low67 Ų67138.1 Ų138.169%0.69178%0.777SS**  trans125.9134.7158.100000113.5
236N41.1Very low42.2Very low148 Ų148139.5 Ų139.579%0.79178%0.78SS**  cis-158.4129.317.1-82.9-2.3000108.1
237L41.5Very low42.2Very low145 Ų145135.7 Ų135.776%0.75978%0.777SS**  75.4118.493.9-62.8176.4000119.3
238K40.5Very low42.5Very low193 Ų193133 Ų13384%0.83977%0.774SS**  trans75.7140.9146.2-66.6177173.6-176.30117.8
239S36Very low42.5Very low104 Ų104135.4 Ų135.473%0.72778%0.782SS**  cis177.4151-1.538.40000109.5
240S43.1Very low42.8Very low101 Ų101134.4 Ų134.471%0.70679%0.787SS**  trans64.9121.1162-82.20000119.6
241D39.4Very low42.9Very low145 Ų145131.8 Ų131.878%0.77578%0.781SS**  101.112755.8-81.8-53.2000111.7
242R46.2Very low42.9Very low221 Ų221133.4 Ų133.483%0.83478%0.782SS**  trans102.7114.5158.3-59.1-158.1169.2-151.2-2.9120.4
243N39Very low43.4Very low147 Ų147136 Ų13679%0.78678%0.777SS**  trans95.1117.8145.6-60.5-36.8000120.1
244P42.4Very low44.3Very low124 Ų124132.4 Ų132.481%0.80577%0.765SS**  -132.1-177.9129.839.1-26.8000111.1
245P49.5Very low44.8Very low115 Ų115136.2 Ų136.275%0.74777%0.77SS**  -120153.2-5536.1-21.8000112.3
246L44.4Very low45.4Very low167 Ų167140.5 Ų140.587%0.87478%0.777SS**  trans-144.2107.6168-66.4173.4000107.3
247S42.3Very low45.8Very low113 Ų113138.7 Ų138.779%0.7978%0.775SS**  86.7151.685.5-91.10000114
248P47.1Very low45.8Very low112 Ų112137.1 Ų137.173%0.72778%0.783SS**  -127.3-165.2-120.438.6-20.7000114.4
249Q41.8Very low46.4Very low187 Ų187131.7 Ų131.787%0.87477%0.77SS**  trans96.5106.2162-54-150.1-64.700118.5
250S47.5Very low47.1Very low112 Ų112135.7 Ų135.778%0.78378%0.777SS**  -173.4142.712461.10000107.7
251S47.5Very low48.3Very low99 Ų99136.9 Ų136.969%0.69278%0.775SS**  cis176.2127.7-8.1-82.50000103
252I53.5Low49Very low152 Ų152135.6 Ų135.678%0.77977%0.768SS**  trans45.1117.1144.9151.3152.2000118.4
253D48.1Very low49.6Very low132 Ų132133.8 Ų133.871%0.70677%0.769SS**  -179.3144.293-157.733.7000115
254S57.5Low50.3Low86 Ų86132.7 Ų132.760%0.60176%0.763SS**  trans73.984.4152.5-72.70000120.7
255E52.6Low50.8Low190 Ų190131.3 Ų131.389%0.88876%0.756SS**  trans-65.7111.2144.2-57.7-170.498.900110.5
256L53.6Low51Low158 Ų158132.5 Ų132.583%0.82776%0.755SS**  trans-147.6110.6156.6-73.2-177.8000110.7
257S48.1Very low51.7Low109 Ų109127.2 Ų127.276%0.76274%0.741SS**  trans36.787.9150.3-670000118.1S259S257-S259 PolarHBondContact O-N 3.23Å
258A41.4Very low52.7Low112 Ų112127.5 Ų127.593%0.92674%0.743SS**  trans-67.379.6140.400000108.6
259S53.1Low53.7Low79 Ų79129.2 Ų129.255%0.55275%0.746SS**  trans-86.8111.9166.6770000109.2S257S257-S259 PolarHBondContact O-N 3.23Å
260E51.6Low55.3Low188 Ų188126.3 Ų126.388%0.87973%0.728SS**  trans-9.8120.2149.9-62.5174.9100.100114.5
261L66.7Low57.1Low127 Ų127129.5 Ų129.567%0.66573%0.728SS**  trans-138.795.9151.7-94.5167.4000106.2
262D55Low59.1Low118 Ų118128.8 Ų128.863%0.63172%0.716SS**  trans58.271.2149.8-56.7-62.2000118.5D264D262-D264 PolarHBondContact O-N 3.48Å; D262-D264 VanDerWaalsContact O-N 3.14Å
263E58.8Low60.8Low182 Ų182128.2 Ų128.285%0.8571%0.714SS**  trans-78.160.4148.4-74.1-84123.400109.5S265E263-S265 PolarHBondContact O-N 3.29Å
264D53Low62.9Low125 Ų125125.7 Ų125.767%0.66870%0.7SS**  trans-7146.8163.2-96.3-25.9000110.1D262 I266D262-D264 PolarHBondContact O-N 3.48Å; D262-D264 VanDerWaalsContact O-N 3.14Å; D264-I266 WeakPolarHBondContact O-CG1 3.4Å; D264-I266 PolarHBondContact O-N 2.76Å
265S53.7Low64.7Low94 Ų94126.2 Ų126.266%0.65770%0.7SS**  trans-69.486.6167.6-1410000106.6E263 G267E263-S265 PolarHBondContact O-N 3.29Å; S265-G267 PolarHBondContact O-N 2.8Å
266I53.3Low66.7Low140 Ų140120.4 Ų120.472%0.71868%0.677SS**  trans-62.821.6169.2-61.6142.1000110.6D264D264-I266 WeakPolarHBondContact O-CG1 3.4Å; D264-I266 PolarHBondContact O-N 2.76Å
267G60.3Low68.8Low56 Ų56113.9 Ų113.958%0.57764%0.644SS**  trans-103.325.3-152.200000117S265S265-G267 PolarHBondContact O-N 2.8Å
268S61.9Low71Confident119 Ų119112.2 Ų112.283%0.83263%0.628SS**SBendtrans-151.7-2.7172.3-102.30000119.2
269N68.4Low73.6Confident149 Ų149112 Ų11280%0.79761%0.608SS**  trans-131.79.3-175.644.2-73.2000114.9K271N269-K271 PolarHBondContact O-N 2.8Å
270Y74.5Confident75.6Confident125 Ų125112.4 Ų112.449%0.4960%0.603SS.*  trans-81.2104.6168.4-167.2-105.3000110.3L272 D277 L281Y270-L272 HydrophobicContact CD1-CD2 4.21Å; Y270-L272 HydrophobicContact CE1-CD2 4.02Å; Y270-D277 HydrophobicContact CE1-CB 3.99Å; Y270-D277 PolarHBondContact OH-OD1 2.95Å; Y270-L281 HydrophobicContact CD1-CD1 4.4Å
271K85.4Confident77.7Confident180 Ų180106.4 Ų106.478%0.78358%0.577SS**  trans-88.3109.6178.3-170.5177.2174.5-170.30108.6N269 N273N269-K271 PolarHBondContact O-N 2.8Å; K271-N273 PolarHBondContact O-N 2.78Å
272L90.3Very high79.1Confident84 Ų84102.9 Ų102.944%0.4457%0.566SS.*  trans-54.6102.8173-67174.6000109.8Y270 D277 V278 L281Y270-L272 HydrophobicContact CD1-CD2 4.21Å; Y270-L272 HydrophobicContact CE1-CD2 4.02Å; L272-D277 HydrophobicContact CB-CB 4.48Å; L272-D277 HydrophobicContact CD2-CB 3.49Å; L272-D277 VanDerWaalsContact CD2-CB 3.49Å; L272-V278 HydrophobicContact CB-CG2 4.41Å; L272-V278 HydrophobicContact CD1-CG2 4.13Å; L272-V278 HydrophobicContact CD2-CG2 4.37Å; L272-L281 HydrophobicContact CD1-CD1 4.23Å; L272-L281 HydrophobicContact CD2-CD1 3.48Å; L272-L281 VanDerWaalsContact CD2-CD1 3.48Å; L272-L281 HydrophobicContact CD2-CG 4.07Å; L272-L281 HydrophobicContact CG-CD1 4.14Å
273N88.5Confident81.1Confident139 Ų139105 Ų10574%0.74357%0.565SS**  trans-92-31.1-171.1-170.862.5000111.7K271 D277K271-N273 PolarHBondContact O-N 2.78Å; N273-D277 WeakPolarHBondContact CB-OD2 3.46Å; N273-D277 PolarHBondContact N-OD2 3.32Å
274D93.1Very high82.8Confident79 Ų79101.4 Ų101.442%0.42255%0.55SS..SBendtrans-142.2-179.6177.164.828.8000112.7T276 D277 V278D274-T276 PolarHBondContact O-N 3.47Å; D274-T276 VanDerWaalsContact OD1-CA 3.3Å; D274-T276 WeakPolarHBondContact OD1-CA 3.19Å; D274-T276 WeakPolarHBondContact OD1-CB 3.3Å; D274-T276 PolarHBondContact OD1-N 2.85Å; D274-D277 PolarHBondContact O-N 3.42Å; D274-D277 PolarHBondContact OD1-N 2.91Å; D274-V278 PolarHBondContact O-N 3.35Å
275V94.9Very high84.8Confident97 Ų97102.5 Ų102.559%0.58855%0.551SS**Hα-helixtrans-67.2-21.717868.10000112.4V278 Q279V275-V278 PolarHBondContact O-N 2.99Å; V275-Q279 VanDerWaalsContact O-CG 3.23Å; V275-Q279 WeakPolarHBondContact O-CG 3.19Å; V275-Q279 PolarHBondContact O-N 3.49Å
276T96.1Very high86.7Confident68 Ų68103.2 Ų103.242%0.41754%0.544SS..Hα-helixtrans-71.5-42.3178.1-62.10000110.1D274 V278 Q279 I280D274-T276 PolarHBondContact O-N 3.47Å; D274-T276 VanDerWaalsContact OD1-CA 3.3Å; D274-T276 WeakPolarHBondContact OD1-CA 3.19Å; D274-T276 WeakPolarHBondContact OD1-CB 3.3Å; D274-T276 PolarHBondContact OD1-N 2.85Å; T276-V278 VanDerWaalsContact C-N 3.28Å; T276-V278 PolarHBondContact O-N 3.11Å; T276-Q279 WeakPolarHBondContact O-CB 3.23Å; T276-Q279 PolarHBondContact O-N 3.37Å; T276-Q279 VanDerWaalsContact O-N 3.11Å; T276-I280 HydrophobicContact CG2-CD1 3.91Å; T276-I280 HydrophobicContact CG2-CG1 4.41Å; T276-I280 VanDerWaalsContact O-CG1 3.31Å; T276-I280 WeakPolarHBondContact O-CG1 3.49Å; T276-I280 PolarHBondContact O-N 3.46Å
277D95.9Very high88.7Confident22 Ų22102.4 Ų102.412%0.11854%0.537CS..Hα-helixtrans-59.2-42174.2-63.7-16.9000111.4Y270 L272 N273 D274 I280 L281Y270-D277 HydrophobicContact CE1-CB 3.99Å; Y270-D277 PolarHBondContact OH-OD1 2.95Å; L272-D277 HydrophobicContact CB-CB 4.48Å; L272-D277 HydrophobicContact CD2-CB 3.49Å; L272-D277 VanDerWaalsContact CD2-CB 3.49Å; N273-D277 WeakPolarHBondContact CB-OD2 3.46Å; N273-D277 PolarHBondContact N-OD2 3.32Å; D274-D277 PolarHBondContact O-N 3.42Å; D274-D277 PolarHBondContact OD1-N 2.91Å; D277-I280 PolarHBondContact O-N 2.97Å; D277-L281 PolarHBondContact O-N 2.89Å
278V95.6Very high90.2Very high73 Ų73102.4 Ų102.444%0.44253%0.528SS..Hα-helixtrans-62.1-44.3175.3179.40000110.8L272 D274 V275 T276 I280 A282L272-V278 HydrophobicContact CB-CG2 4.41Å; L272-V278 HydrophobicContact CD1-CG2 4.13Å; L272-V278 HydrophobicContact CD2-CG2 4.37Å; D274-V278 PolarHBondContact O-N 3.35Å; V275-V278 PolarHBondContact O-N 2.99Å; T276-V278 VanDerWaalsContact C-N 3.28Å; T276-V278 PolarHBondContact O-N 3.11Å; V278-I280 VanDerWaalsContact C-N 3.35Å; V278-A282 WeakPolarHBondContact O-CB 3.34Å; V278-A282 PolarHBondContact O-N 2.87Å
279Q96.2Very high91.7Very high108 Ų108100.8 Ų100.851%0.50551%0.509SS..Hα-helixtrans-65.7-36.5178-74.31719.900112.4V275 T276 R283V275-Q279 VanDerWaalsContact O-CG 3.23Å; V275-Q279 WeakPolarHBondContact O-CG 3.19Å; V275-Q279 PolarHBondContact O-N 3.49Å; T276-Q279 WeakPolarHBondContact O-CB 3.23Å; T276-Q279 PolarHBondContact O-N 3.37Å; T276-Q279 VanDerWaalsContact O-N 3.11Å; Q279-R283 VanDerWaalsContact O-CB 3.24Å; Q279-R283 WeakPolarHBondContact O-CB 3.13Å; Q279-R283 PolarHBondContact O-N 3.33Å
280I94.8Very high92.9Very high87 Ų87101.3 Ų101.345%0.44650%0.5SS..Hα-helixtrans-67.3-48.8177.1-69.1166.7000109.9T276 D277 V278 A282 R283 M284T276-I280 HydrophobicContact CG2-CD1 3.91Å; T276-I280 HydrophobicContact CG2-CG1 4.41Å; T276-I280 VanDerWaalsContact O-CG1 3.31Å; T276-I280 WeakPolarHBondContact O-CG1 3.49Å; T276-I280 PolarHBondContact O-N 3.46Å; D277-I280 PolarHBondContact O-N 2.97Å; V278-I280 VanDerWaalsContact C-N 3.35Å; I280-A282 PolarHBondContact O-N 3.45Å; I280-R283 PolarHBondContact O-N 3.46Å; I280-M284 WeakPolarHBondContact O-CB 3.36Å; I280-M284 PolarHBondContact O-N 2.87Å
281L95.6Very high93.6Very high63 Ų63101.8 Ų101.833%0.3351%0.507SS..Hα-helixtrans-63.7-41.9176.6-72.9-170.4000112.1Y270 L272 D277 R283 M284 Q285Y270-L281 HydrophobicContact CD1-CD1 4.4Å; L272-L281 HydrophobicContact CD1-CD1 4.23Å; L272-L281 HydrophobicContact CD2-CD1 3.48Å; L272-L281 VanDerWaalsContact CD2-CD1 3.48Å; L272-L281 HydrophobicContact CD2-CG 4.07Å; L272-L281 HydrophobicContact CG-CD1 4.14Å; D277-L281 PolarHBondContact O-N 2.89Å; L281-R283 VanDerWaalsContact C-N 3.34Å; L281-R283 PolarHBondContact O-N 3.3Å; L281-M284 HydrophobicContact CD2-CE 3.56Å; L281-M284 PolarHBondContact O-N 3.47Å; L281-Q285 WeakPolarHBondContact O-CB 3.3Å; L281-Q285 PolarHBondContact O-N 3.09Å
282A95.4Very high93.6Very high52 Ų5298.7 Ų98.743%0.4350%0.495SS..Hα-helixtrans-62.1-41.8176.700000111.7V278 I280 Q285 E286V278-A282 WeakPolarHBondContact O-CB 3.34Å; V278-A282 PolarHBondContact O-N 2.87Å; I280-A282 PolarHBondContact O-N 3.45Å; A282-Q285 PolarHBondContact O-N 3Å; A282-E286 WeakPolarHBondContact O-CB 3.28Å; A282-E286 PolarHBondContact O-N 3.06Å
283R96.6Very high93.2Very high162 Ų162102.1 Ų102.161%0.61150%0.504SS*.Hα-helixtrans-64.5-44.8174.9-177-174.8-60.51693.8111.5Q279 I280 L281 Q285 E286 E287Q279-R283 VanDerWaalsContact O-CB 3.24Å; Q279-R283 WeakPolarHBondContact O-CB 3.13Å; Q279-R283 PolarHBondContact O-N 3.33Å; I280-R283 PolarHBondContact O-N 3.46Å; L281-R283 VanDerWaalsContact C-N 3.34Å; L281-R283 PolarHBondContact O-N 3.3Å; R283-Q285 VanDerWaalsContact C-N 3.3Å; R283-Q285 PolarHBondContact O-N 3.14Å; R283-E286 PolarHBondContact O-N 3.48Å; R283-E287 VanDerWaalsContact O-CB 3.27Å; R283-E287 WeakPolarHBondContact O-CB 3.31Å; R283-E287 PolarHBondContact O-N 3.18Å
284M95.6Very high92.7Very high107 Ų10798.1 Ų98.153%0.52749%0.49SS..Hα-helixtrans-61.9-40.5178.6-175-179.473.600111.4I280 L281 S288I280-M284 WeakPolarHBondContact O-CB 3.36Å; I280-M284 PolarHBondContact O-N 2.87Å; L281-M284 HydrophobicContact CD2-CE 3.56Å; L281-M284 PolarHBondContact O-N 3.47Å; M284-S288 PolarHBondContact O-N 3.37Å; M284-S288 PolarHBondContact O-OG 3.31Å
285Q95.1Very high91.8Very high148 Ų14896.5 Ų96.569%0.69249%0.487SS*.Hα-helixtrans-68.4-41.2175.4-171.7175.5-6.100111.9L281 A282 R283 L289L281-Q285 WeakPolarHBondContact O-CB 3.3Å; L281-Q285 PolarHBondContact O-N 3.09Å; A282-Q285 PolarHBondContact O-N 3Å; R283-Q285 VanDerWaalsContact C-N 3.3Å; R283-Q285 PolarHBondContact O-N 3.14Å; Q285-L289 PolarHBondContact O-N 2.93Å
286E94.5Very high90.4Very high109 Ų10996 Ų9651%0.50949%0.485SS..Hα-helixtrans-66-38.3174.6-176.1177-157.400112.2A282 R283 L289 R290A282-E286 WeakPolarHBondContact O-CB 3.28Å; A282-E286 PolarHBondContact O-N 3.06Å; R283-E286 PolarHBondContact O-N 3.48Å; E286-L289 PolarHBondContact O-N 3.5Å; E286-R290 VanDerWaalsContact CD-NH1 3.29Å; E286-R290 VanDerWaalsContact CG-NH1 3.33Å; E286-R290 WeakPolarHBondContact O-CB 2.98Å; E286-R290 WeakPolarHBondContact O-CG 3.35Å; E286-R290 PolarHBondContact O-N 2.85Å; E286-R290 IonicContact OE1-CZ 3.98Å; E286-R290 IonicContact OE1-NH1 3.79Å; E286-R290 PolarHBondContact OE1-NH1 2.94Å
287E93.6Very high88.6Confident124 Ų12497.7 Ų97.758%0.57950%0.495SS*.Hα-helixtrans-66.3-43.4176-179.2168.3-164.700111.3R283 R290 Q291R283-E287 VanDerWaalsContact O-CB 3.27Å; R283-E287 WeakPolarHBondContact O-CB 3.31Å; R283-E287 PolarHBondContact O-N 3.18Å; E287-R290 PolarHBondContact O-N 3.19Å; E287-Q291 WeakPolarHBondContact O-CB 3.27Å; E287-Q291 PolarHBondContact O-N 2.78Å
288S92.6Very high86.7Confident55 Ų5599.9 Ų99.939%0.38551%0.512SS..Hα-helixtrans-57-52172.2-72.40000110.9M284 R290 Q291 E292M284-S288 PolarHBondContact O-N 3.37Å; M284-S288 PolarHBondContact O-OG 3.31Å; S288-R290 VanDerWaalsContact C-N 3.32Å; S288-R290 PolarHBondContact O-N 2.87Å; S288-Q291 WeakPolarHBondContact O-CA 3.48Å; S288-Q291 WeakPolarHBondContact O-CB 3.24Å; S288-Q291 PolarHBondContact O-N 3.27Å; S288-E292 VanDerWaalsContact O-CG 3.28Å; S288-E292 WeakPolarHBondContact O-CG 3.4Å; S288-E292 PolarHBondContact O-N 2.91Å
289L93.8Very high84.6Confident85 Ų85105.8 Ų105.845%0.44553%0.527SS..Hα-helixtrans-60.1-41.7179.9-174.164.7000112Q285 E286 Q291 E292 Y293Q285-L289 PolarHBondContact O-N 2.93Å; E286-L289 PolarHBondContact O-N 3.5Å; L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 2.91Å; L289-E292 WeakPolarHBondContact CA-OE1 3.33Å; L289-E292 WeakPolarHBondContact O-CB 3.47Å; L289-E292 PolarHBondContact O-N 3.32Å; L289-Y293 HydrophobicContact CD1-CD2 4.41Å; L289-Y293 HydrophobicContact CD1-CE2 3.89Å; L289-Y293 HydrophobicContact CD2-CE2 4.26Å; L289-Y293 HydrophobicContact CG-CD2 4.11Å; L289-Y293 HydrophobicContact CG-CE2 3.75Å; L289-Y293 WeakPolarHBondContact O-CD2 3.41Å; L289-Y293 PolarHBondContact O-N 3.49Å
290R93.3Very high82.6Confident160 Ų160111.9 Ų111.960%0.60455%0.545SS*.Hα-helixtrans-63.6-38.6174.7-82.3-171.6149.477.9-1.8112.7E286 E287 S288 E292 Y293 A294E286-R290 VanDerWaalsContact CD-NH1 3.29Å; E286-R290 VanDerWaalsContact CG-NH1 3.33Å; E286-R290 WeakPolarHBondContact O-CB 2.98Å; E286-R290 WeakPolarHBondContact O-CG 3.35Å; E286-R290 PolarHBondContact O-N 2.85Å; E286-R290 IonicContact OE1-CZ 3.98Å; E286-R290 IonicContact OE1-NH1 3.79Å; E286-R290 PolarHBondContact OE1-NH1 2.94Å; E287-R290 PolarHBondContact O-N 3.19Å; S288-R290 VanDerWaalsContact C-N 3.32Å; S288-R290 PolarHBondContact O-N 2.87Å; R290-E292 VanDerWaalsContact C-N 3.33Å; R290-Y293 PolarHBondContact O-N 2.84Å; R290-A294 PolarHBondContact O-N 3.31Å
291Q89.6Confident80.5Confident135 Ų135112.4 Ų112.463%0.63156%0.556SS**Hα-helixtrans-66.6-37.9177.1-163171.834.500111E287 S288 L289 A294 A295E287-Q291 WeakPolarHBondContact O-CB 3.27Å; E287-Q291 PolarHBondContact O-N 2.78Å; S288-Q291 WeakPolarHBondContact O-CA 3.48Å; S288-Q291 WeakPolarHBondContact O-CB 3.24Å; S288-Q291 PolarHBondContact O-N 3.27Å; L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 2.91Å; Q291-A294 PolarHBondContact O-N 3.31Å; Q291-A295 VanDerWaalsContact O-CB 3.25Å; Q291-A295 WeakPolarHBondContact O-CB 3.21Å; Q291-A295 PolarHBondContact O-N 3.06Å
292E85.1Confident78Confident115 Ų115113.3 Ų113.354%0.53757%0.568SS.*Hα-helixtrans-62.6-43.1173.2-63.1170.2-114.700111.8S288 L289 R290 A295 T296S288-E292 VanDerWaalsContact O-CG 3.28Å; S288-E292 WeakPolarHBondContact O-CG 3.4Å; S288-E292 PolarHBondContact O-N 2.91Å; L289-E292 WeakPolarHBondContact CA-OE1 3.33Å; L289-E292 WeakPolarHBondContact O-CB 3.47Å; L289-E292 PolarHBondContact O-N 3.32Å; R290-E292 VanDerWaalsContact C-N 3.33Å; E292-A295 PolarHBondContact O-N 3.04Å; E292-T296 WeakPolarHBondContact O-CB 3.37Å; E292-T296 VanDerWaalsContact O-CG2 3.26Å; E292-T296 WeakPolarHBondContact O-CG2 3.26Å; E292-T296 PolarHBondContact O-N 3.14Å; E292-T296 PolarHBondContact O-OG1 3.34Å
293Y81.7Confident75.2Confident156 Ų156114.8 Ų114.861%0.61259%0.588SS**Hα-helixtrans-63.1-41.8173.1-79.8-69000112.6L289 R290 T296 T297L289-Y293 HydrophobicContact CD1-CD2 4.41Å; L289-Y293 HydrophobicContact CD1-CE2 3.89Å; L289-Y293 HydrophobicContact CD2-CE2 4.26Å; L289-Y293 HydrophobicContact CG-CD2 4.11Å; L289-Y293 HydrophobicContact CG-CE2 3.75Å; L289-Y293 WeakPolarHBondContact O-CD2 3.41Å; L289-Y293 PolarHBondContact O-N 3.49Å; R290-Y293 PolarHBondContact O-N 2.84Å; Y293-T296 WeakPolarHBondContact CA-OG1 3.41Å; Y293-T296 PolarHBondContact O-N 3.11Å; Y293-T296 PolarHBondContact O-OG1 2.8Å; Y293-T297 WeakPolarHBondContact O-CB 3.49Å; Y293-T297 WeakPolarHBondContact O-CG2 3.41Å; Y293-T297 PolarHBondContact O-N 3.47Å
294A78.9Confident73Confident56 Ų56111.6 Ų111.646%0.46359%0.59SS.*Hα-helixtrans-66.4-40.3176.800000112R290 Q291 T296 T297 S298R290-A294 PolarHBondContact O-N 3.31Å; Q291-A294 PolarHBondContact O-N 3.31Å; A294-T296 VanDerWaalsContact C-N 3.34Å; A294-T297 WeakPolarHBondContact O-CG2 3.33Å; A294-S298 WeakPolarHBondContact O-CB 3.25Å; A294-S298 PolarHBondContact O-N 2.91Å
295A73.4Confident70.7Confident44 Ų44111.8 Ų111.836%0.36460%0.602SS.*Hα-helixtrans-70-30178.100000112.6Q291 E292 R299Q291-A295 VanDerWaalsContact O-CB 3.25Å; Q291-A295 WeakPolarHBondContact O-CB 3.21Å; Q291-A295 PolarHBondContact O-N 3.06Å; E292-A295 PolarHBondContact O-N 3.04Å; A295-R299 WeakPolarHBondContact O-CD 3.5Å; A295-R299 WeakPolarHBondContact O-CG 3.32Å; A295-R299 PolarHBondContact O-NE 2.95Å
296T64.6Low68.1Low87 Ų87110.9 Ų110.953%0.53461%0.611SS.*Hα-helixtrans-83-34.917850.10000112.7E292 Y293 A294E292-T296 WeakPolarHBondContact O-CB 3.37Å; E292-T296 VanDerWaalsContact O-CG2 3.26Å; E292-T296 WeakPolarHBondContact O-CG2 3.26Å; E292-T296 PolarHBondContact O-N 3.14Å; E292-T296 PolarHBondContact O-OG1 3.34Å; Y293-T296 WeakPolarHBondContact CA-OG1 3.41Å; Y293-T296 PolarHBondContact O-N 3.11Å; Y293-T296 PolarHBondContact O-OG1 2.8Å; A294-T296 VanDerWaalsContact C-N 3.34Å
297T59.3Low65.8Low104 Ų104113.3 Ų113.364%0.63863%0.627SS**Hα-helixtrans-73.4-32.6173.7-166.10000112.6Y293 A294 R299Y293-T297 WeakPolarHBondContact O-CB 3.49Å; Y293-T297 WeakPolarHBondContact O-CG2 3.41Å; Y293-T297 PolarHBondContact O-N 3.47Å; A294-T297 WeakPolarHBondContact O-CG2 3.33Å; T297-R299 PolarHBondContact O-N 3.03Å
298S54.6Low63.5Low67 Ų67112.6 Ų112.647%0.46964%0.636SS.*G310 helixtrans-70.6-16.5177.3-1690000113.8A294 R300 S301A294-S298 WeakPolarHBondContact O-CB 3.25Å; A294-S298 PolarHBondContact O-N 2.91Å; S298-R300 VanDerWaalsContact C-N 3.28Å; S298-R300 PolarHBondContact O-N 3.43Å; S298-S301 PolarHBondContact O-N 3.4Å
299R53.3Low61.3Low198 Ų198115.1 Ų115.175%0.74765%0.649SS**G310 helixtrans-79.8-1.4-178.1-78.9171.8-167.3-112.94.7114.6A295 T297A295-R299 WeakPolarHBondContact O-CD 3.5Å; A295-R299 WeakPolarHBondContact O-CG 3.32Å; A295-R299 PolarHBondContact O-NE 2.95Å; T297-R299 PolarHBondContact O-N 3.03Å
300R54Low59.2Low236 Ų236120.2 Ų120.289%0.89166%0.663SS**G310 helixtrans-91.5-0.4170.8-66.8-176.472.4-134.23.1114S298S298-R300 VanDerWaalsContact C-N 3.28Å; S298-R300 PolarHBondContact O-N 3.43Å
301S50.5Low57.1Low98 Ų98124.2 Ų124.269%0.68568%0.678SS**THydrogen-bonded Turntrans-142.74.6-177.841.40000116.3S298S298-S301 PolarHBondContact O-N 3.4Å
302S43Very low55.1Low81 Ų81121 Ų12157%0.56668%0.681SS**  trans-154.193.1169.1-67.70000111.5S304S302-S304 PolarHBondContact O-N 3.31Å
303G37.3Very low53.2Low83 Ų83121.2 Ų121.286%0.85669%0.69SS**  trans-72.1104.4159.400000109.3
304S50.1Low51.8Low95 Ų95123.3 Ų123.366%0.66470%0.703SS**  trans170.6102.415943.60000107.7S302S302-S304 PolarHBondContact O-N 3.31Å
305S46.8Very low50.4Low111 Ų111126.5 Ų126.578%0.77672%0.722SS**  87.590.2101.473.40000113.5
306C40.5Very low49.2Very low130 Ų130131.8 Ų131.888%0.87874%0.744SS**  trans-168.368.6148.250.50000110.7
307N46.5Very low48.4Very low159 Ų159135.7 Ų135.785%0.8576%0.756SS**  trans-126.281.3147.158.7-18.4000107.2
308S44.7Very low48.2Very low110 Ų110139.2 Ų139.277%0.76977%0.765SS**  trans-65.6138.1173.2-172.60000109.7
309T46.5Very low48.1Very low107 Ų107143.8 Ų143.866%0.65678%0.784SS**  trans88.383.5163.4-32.50000116.1
310R50.5Low48.1Very low192 Ų192140.3 Ų140.373%0.72578%0.78SS**  -179.1129.8106.8-91.9169.6-164.5-95.94111.3
311R48.6Very low47.6Very low244 Ų244133.5 Ų133.592%0.92177%0.774SS**  trans-46.2134.5169.4-87.8167.9167.4-124.3-2.3112.1
312G47.3Very low47.3Very low67 Ų67136.5 Ų136.569%0.69178%0.777SS**  trans-152.399.4160.300000108F314G312-F314 PolarHBondContact O-N 2.97Å
313T45.7Very low47.6Very low120 Ų120137.9 Ų137.974%0.73679%0.787SS**  trans-74.5112.8-177.447.10000110.6
314F52.3Low48.5Very low200 Ų200140.4 Ų140.488%0.87778%0.78SS**  trans-134.1112.2156.3-65.8-79000107.9G312G312-F314 PolarHBondContact O-N 2.97Å
315S49.2Very low48.5Very low123 Ų123144.2 Ų144.286%0.8679%0.793SS**  trans26.9101.1164.3-650000119.3
316D48.6Very low49Very low156 Ų156144 Ų14483%0.83478%0.783SS**  trans-58.9154137.3-179.822.6000110.2
317Q46.3Very low49.7Very low169 Ų169145.6 Ų145.679%0.7978%0.777SS**  trans9667.4166.2-157.2170.375.300119.7
318E56Low49.9Very low178 Ų178144.6 Ų144.683%0.83277%0.772SS**  trans163.6114.2149.154.6-162.8129.800106.8
319L53.4Low50.1Low163 Ų163146.6 Ų146.685%0.85377%0.774SS**  cis-150.711447.1-71164.5000108.1A321L319-A321 PolarHBondContact O-N 2.99Å
320D52Low49.8Very low125 Ų125148.4 Ų148.467%0.66878%0.78SS**  trans-37114.6157.4-170.543.7000111.7Q322D320-Q322 VanDerWaalsContact C-N 3.29Å; D320-Q322 PolarHBondContact O-N 3.07Å; D320-Q322 PolarHBondContact OD2-NE2 3.37Å
321A44.2Very low49.5Very low93 Ų93146.4 Ų146.477%0.76978%0.781SS**SBendtrans8.461.6133.500000118.5L319L319-A321 PolarHBondContact O-N 2.99Å
322Q44.5Very low49.1Very low161 Ų161141.4 Ų141.475%0.75277%0.767SS**  trans-144.7143.8166.1-61.4-160.731.700111.8D320D320-Q322 VanDerWaalsContact C-N 3.29Å; D320-Q322 PolarHBondContact O-N 3.07Å; D320-Q322 PolarHBondContact OD2-NE2 3.37Å
323S48.9Very low49Very low109 Ų109146.4 Ų146.476%0.76277%0.773SS**  trans86.472.8168.3-145.20000117.5D325S323-D325 PolarHBondContact O-N 2.82Å
324L55.3Low48.6Very low137 Ų137145 Ų14572%0.71777%0.773SS**  16104.2117.6-162.588.2000114.8D326L324-D326 VanDerWaalsContact C-N 3.33Å; L324-D326 HydrophobicContact CD2-CB 4.1Å; L324-D326 WeakPolarHBondContact CD2-OD2 3.14Å; L324-D326 HydrophobicContact CG-CB 4.48Å; L324-D326 PolarHBondContact O-N 2.66Å
325D51.1Low48.2Very low174 Ų174140.8 Ų140.893%0.9376%0.763SS**  trans-66.992.4160.8-71-70.3000108.4S323S323-D325 PolarHBondContact O-N 2.82Å
326D56.1Low47.8Very low106 Ų106145.2 Ų145.257%0.56776%0.763SS**  trans-104.9111.5168.4-121.3-119.3000108.1L324L324-D326 VanDerWaalsContact C-N 3.33Å; L324-D326 HydrophobicContact CD2-CB 4.1Å; L324-D326 WeakPolarHBondContact CD2-OD2 3.14Å; L324-D326 HydrophobicContact CG-CB 4.48Å; L324-D326 PolarHBondContact O-N 2.66Å
327E55.2Low47.5Very low164 Ų164143.6 Ų143.677%0.76676%0.761SS**  trans83.5138.3135.6-27.9-127.2101.800120.6
328D51.7Low47.1Very low138 Ų138139.8 Ų139.874%0.73876%0.758SS**  trans-57.7172.7-179.2-52.8-94.7000115.4
329D49.1Very low46.5Very low153 Ų153137.8 Ų137.882%0.81876%0.757SS**  trans72.499.5167.9-59-58.5000116.6
330N40.7Very low45.9Very low145 Ų145136.6 Ų136.678%0.77575%0.752SS**  -177.212395.1-13683.8000111.8
331M43.1Very low45.3Very low150 Ų150140.3 Ų140.374%0.73976%0.757SS**  trans-42.3147.6156.2-145.589.978.700112
332H41.2Very low45.1Very low138 Ų138145 Ų14564%0.63976%0.76SS**  trans125.1103.2146.7-61.1-59.8000118.2
333H45.3Very low44.9Very low173 Ų173142.7 Ų142.780%0.80176%0.762SS**  70117.1126.6-59.5-56000120.9
334A37.1Very low44.8Very low89 Ų89142.9 Ų142.974%0.73676%0.76SS**  trans-56.5155.2156.200000113.1
335V43.1Very low44.2Very low112 Ų112141.9 Ų141.968%0.67977%0.765SS**  trans82.2114.4161.3-156.30000115.7
336Y40Very low43.8Very low217 Ų217139.1 Ų139.185%0.85176%0.757SS**  trans147.2122.5132.2-79.8-67.7000111.4
337P43.2Very low43.4Very low122 Ų122145.6 Ų145.679%0.79277%0.773SS**  trans-93.3149.4168.235.1-27.5000111.6
338A36.8Very low42.7Very low88 Ų88145.7 Ų145.773%0.72778%0.779SS**  trans103.6126.3146.600000119.1
339V45Very low42.1Very low136 Ų136143.9 Ų143.982%0.82478%0.777SS**  trans87131.5148.6-48.60000121.7
340N39.6Very low41.9Very low139 Ų139141.8 Ų141.874%0.74377%0.772SS**  trans97.289.1155.8-81.922.7000120.8
341R40Very low41.8Very low202 Ų202146.1 Ų146.176%0.76278%0.777SS**  37113.9118.1-61.9-178-165.9-160.92.2117
342F40.6Very low41.9Very low192 Ų192143.5 Ų143.584%0.84277%0.771SS**  158.7112.2111.6-82.1-69.5000109.5
343S40.8Very low42.1Very low112 Ų112142.7 Ų142.778%0.78378%0.781SS**  trans-70.6152.3166.248.90000111.2
344P45.8Very low41.9Very low113 Ų113139.5 Ų139.573%0.73478%0.776SS**  -153.3132.495.735.4-15.3000115.1
345S43.1Very low42.5Very low117 Ų117144.4 Ų144.482%0.81878%0.781SS**  94.8129.2103-70.70000116.7
346P42.5Very low42.5Very low116 Ų116148 Ų14875%0.75379%0.79SS**  trans-100.9156.3178.538.3-31.2000112.8
347R47.4Very low42.6Very low241 Ų241142.9 Ų142.991%0.90979%0.786SS**  trans146.7117.6147.9-81.9165.296.7-153.44.6111.5
348N39.8Very low42.6Very low167 Ų167143 Ų14389%0.89379%0.787SS**  -157.9144128.1-132.427.4000111.3
349S40.6Very low42.8Very low100 Ų100149.7 Ų149.770%0.69979%0.793SS**  trans-107-153.8-160.3510000111.6
350P43.5Very low42.6Very low109 Ų109150.8 Ų150.871%0.70880%0.795SS**  -135.8151.5-75.537.5-19.5000116
351R39.3Very low42.5Very low236 Ų236149.1 Ų149.189%0.89179%0.794SS**  trans51.1177.6146.5-103.7-173.5169.3-119.7-0.4120.6
352P45Very low43.1Very low94 Ų94145.7 Ų145.761%0.6180%0.798SS**  cis-132.8167.2-33.134.3-17.3000113.5
353S45.1Very low42.9Very low122 Ų122147.2 Ų147.285%0.85380%0.798SS**  trans-175.9153.4135.4-84.40000114.5
354P41.2Very low42.8Very low106 Ų106146.6 Ų146.669%0.68879%0.794SS**  trans-117.6178.5-159.239.1-23.2000114.9
355K49.7Very low43Very low192 Ų192152.6 Ų152.684%0.83580%0.802SS**  trans108.2127.2173.6-60.9166.2-175.7-174.10110.7
356Q43.7Very low42.7Very low187 Ų187153 Ų15387%0.87481%0.805SS**  cis-16313130-130.8151.4-30.500108.4
357S41.1Very low42.9Very low109 Ų109152.8 Ų152.876%0.76280%0.803SS**  trans-91158.7163.6-57.20000110
358P44.9Very low42.5Very low125 Ų125146.1 Ų146.181%0.81280%0.799SS**  -143122.597.316.56.1000112.8
359R40.9Very low42.7Very low228 Ų228150.4 Ų150.486%0.8680%0.803SS**  52.396.572.7-161.5172.1164.4140.6-2.2113.2
360N40.8Very low42.9Very low160 Ų160148.9 Ų148.986%0.85680%0.804SS**  trans-168.3101.8138-98.8-23.4000113.2
361S35.9Very low43Very low104 Ų104150.4 Ų150.473%0.72780%0.804SS**  trans-82.2142.4154.81680000108.9R363S361-R363 PolarHBondContact OG-N 3.43Å
362P52.9Low43.4Very low130 Ų130148.4 Ų148.484%0.84481%0.805SS**  trans-107.286.4158.731-18.4000110.3
363R38Very low42.9Very low223 Ų223153.1 Ų153.184%0.84281%0.812SS**  trans-69.5127.3150.4-174.1167.9179.6131.4-4.1107.8S361S361-R363 PolarHBondContact OG-N 3.43Å
364S38.5Very low42.6Very low100 Ų100152 Ų15270%0.69980%0.804SS**  trans52.6108.3161.156.90000118.3
365R49.3Very low42.8Very low238 Ų238157.8 Ų157.890%0.89881%0.812SS**  trans-163.6111.7148.7-104.6164.7-159.7-82.91.6110.3
366S36.2Very low42.6Very low126 Ų126155.2 Ų155.288%0.88181%0.813SS**  trans-75.3136156.9-50.10000109.1
367P46.4Very low42.5Very low111 Ų111151.8 Ų151.872%0.72181%0.809SS**  trans-142.6124.9140.48.415.5000112.4
368A40.4Very low42.6Very low101 Ų101152.3 Ų152.384%0.83581%0.81SS**  83.1121.48800000114.4
369R42.6Very low42.4Very low257 Ų257154.3 Ų154.397%0.9781%0.808SS**  trans-61.8147.4173.2-82.6177.6163.4130.9-6112.3
370G45.5Very low42.7Very low69 Ų69149 Ų14971%0.71180%0.804SS**  trans17192.616000000108.8
371I45.7Very low42.7Very low140 Ų140149.2 Ų149.272%0.71880%0.802SS**  66.2104.192.1-136.4147.4000112.6Y373I371-Y373 HydrophobicContact CD1-CE2 4.46Å; I371-Y373 HydrophobicContact CG1-CE2 3.85Å
372E47.6Very low43.5Very low194 Ų194152.4 Ų152.491%0.90781%0.809SS**  trans-162.3146139.838.8-162.1166.300112.5
373Y34.7Very low43Very low194 Ų194151.2 Ų151.276%0.76180%0.803SS**  trans-95.8140.2-157.9-63.3-108.2000110.6I371I371-Y373 HydrophobicContact CD1-CE2 4.46Å; I371-Y373 HydrophobicContact CG1-CE2 3.85Å
374S39.2Very low43Very low99 Ų99152.1 Ų152.169%0.69281%0.807SS**  trans-178.9113133.5-98.50000116.7
375R44.1Very low43.6Very low226 Ų226154.6 Ų154.685%0.85381%0.811SS**  86119122.5-50.3-105.1-176.1169.31.5119.7
376V46.3Very low43.5Very low139 Ų139150.8 Ų150.884%0.84280%0.804SS**  trans85.698.9152.9-41.30000118.6
377S40.8Very low43.6Very low114 Ų114153.9 Ų153.980%0.79780%0.804SS**  92.9145.557.8-173.80000113.7
378P44.4Very low43.7Very low120 Ų120153.9 Ų153.978%0.77980%0.804SS**  cis-136.2168-35.437.7-19.3000115.8
379Q41.4Very low43.5Very low167 Ų167160.5 Ų160.578%0.7881%0.808SS**  trans-64175.3178.3-80.7-88.8-17.700116.8
380P46.4Very low43.5Very low118 Ų118156 Ų15677%0.76680%0.802SS**  -141.9129.999.735.3-18.8000117.4
381M40.7Very low43.3Very low164 Ų164157.8 Ų157.881%0.80880%0.804SS**  trans22.8125133.3-60.1-152.1-69.800121.6
382I51.6Low43Very low171 Ų171159.5 Ų159.588%0.87781%0.813SS**  -157.1122.2119.921.9170.4000113.6
383S42.8Very low42.7Very low105 Ų105159 Ų15973%0.73481%0.811SS**  trans47.8104.2150.3-66.70000121.4
384R38.9Very low42.9Very low241 Ų241153.1 Ų153.191%0.90981%0.81SS**  59.6101.781.7-74-174.3173.1147.4-1.1114.3
385L50.8Low42.8Very low152 Ų152157.4 Ų157.480%0.79682%0.818SS**  177.699.5105.2-145.258.4000108.8
386Q46.7Very low42.9Very low158 Ų158151.4 Ų151.474%0.73881%0.809SS**  93.182108-156.295.751.300113.9
387Q39.4Very low42.7Very low192 Ų192151 Ų15190%0.89781%0.807SS**  trans-100.5114.9157.5-70.2-166-23.800108.8R389Q387-R389 PolarHBondContact O-N 3.29Å
388P48.6Very low42.7Very low111 Ų111151.9 Ų151.972%0.72180%0.802SS**  trans-80.4104.8168.1-10.928000109.4
389R34.9Very low42.5Very low239 Ų239154.1 Ų154.190%0.90281%0.807SS**  trans-76.1116.6162.8-156.1-172.5-175144.76.5107Q387Q387-R389 PolarHBondContact O-N 3.29Å
390L43.4Very low42.4Very low164 Ų164154.5 Ų154.586%0.85981%0.809SS**  trans-118.4127.6164-71.7-178.6000110.3
391S41.1Very low42.3Very low106 Ų106154.5 Ų154.574%0.74181%0.807SS**  trans-67.2145.4-173.530.50000113.9Q393S391-Q393 PolarHBondContact O-N 3.46Å
392L38.9Very low42.5Very low175 Ų175151.4 Ų151.492%0.91680%0.802SS**  trans-53.9119.1159.1-70.6142.7000110
393Q41.6Very low42.4Very low183 Ų183149.2 Ų149.286%0.85579%0.792SS**  trans-160.9117.7164.6-17368.836.300109.5S391S391-Q393 PolarHBondContact O-N 3.46Å
394G38.2Very low43Very low72 Ų72149.4 Ų149.474%0.74279%0.788SS**  trans105.8110153.900000118.4
395H38.1Very low44Very low188 Ų188145.8 Ų145.887%0.8778%0.779SS**  trans-52.8-174.7164-74.6-78.2000115.7
396P46.6Very low44.6Very low101 Ų101142.3 Ų142.366%0.65676%0.761SS**  -137132.7-61.837.7-20.3000112
397T42.1Very low45.8Very low131 Ų131139.5 Ų139.580%0.80475%0.748SS**  trans-175.5137.9153.24.30000111.8
398D39.3Very low47.3Very low131 Ų131135.8 Ų135.870%0.70173%0.731SS**  trans66.897.7148.8-58.9-37.3000121.3Q400D398-Q400 PolarHBondContact O-N 3.03Å
399L41.4Very low48.4Very low167 Ų167137.6 Ų137.687%0.87473%0.727SS**  22.182.9113.1-70.5161.2000117.2
400Q39.4Very low50.2Low175 Ų175130.6 Ų130.682%0.81871%0.707SS**  trans168.5162.1146.2-101.6-178.738.800106.2D398D398-Q400 PolarHBondContact O-N 3.03Å
401T44.3Very low51.4Low118 Ų118128.5 Ų128.572%0.72469%0.688SS**  trans93.631.1170.584.10000118.9
402S44.9Very low52.8Low100 Ų100132.8 Ų132.870%0.69969%0.688SS**SBendtrans-82.2-18.4166.771.80000114.5
403N48.8Very low54Low125 Ų125128 Ų12867%0.66867%0.669SS**SBendtrans-82.1-22.6-173.1-75.1-43.5000115.1N406N403-N406 PolarHBondContact O-OD1 2.98Å
404V56.3Low55.3Low109 Ų109123 Ų12366%0.66165%0.648SS**Hα-helixtrans-86.1-25.8-173.1-167.10000112.2
405K58.7Low56.5Low165 Ų165124.2 Ų124.272%0.71764%0.642SS**Hα-helixtrans-86.3-13-175.4-159.4165177.5175.40113.5
406N63.2Low57.2Low79 Ų79122.6 Ų122.642%0.42264%0.64SS.*Hα-helixtrans-84.4-28.5173.182.8-3.6000111.9N403 K409 L410N403-N406 PolarHBondContact O-OD1 2.98Å; N406-K409 WeakPolarHBondContact O-CB 3.17Å; N406-K409 PolarHBondContact O-N 3.03Å; N406-K409 VanDerWaalsContact O-N 3.16Å; N406-L410 WeakPolarHBondContact O-CD1 3.39Å; N406-L410 WeakPolarHBondContact O-CG 3.46Å; N406-L410 PolarHBondContact O-N 3.46Å
407E72Confident57.7Low98 Ų98123.7 Ų123.746%0.45864%0.64SS.*Hα-helixtrans-65.5-47-176.9-164.4-159.1146.200110.3K409 L410 R411E407-K409 PolarHBondContact O-N 2.91Å; E407-L410 WeakPolarHBondContact O-CB 3.44Å; E407-L410 PolarHBondContact O-N 3.25Å; E407-L410 VanDerWaalsContact O-N 3.13Å; E407-R411 WeakPolarHBondContact O-CB 3.21Å; E407-R411 WeakPolarHBondContact O-CG 3.48Å; E407-R411 PolarHBondContact O-N 3.13Å; E407-R411 IonicContact OE1-NH1 3.23Å; E407-R411 PolarHBondContact OE1-NH1 2.59Å
408E71.5Confident58.1Low114 Ų114120 Ų12053%0.53362%0.62SS.*Hα-helixtrans-58.5-36.1174.6-171.179-139.800112.2R412E408-R412 VanDerWaalsContact O-CG 3.27Å; E408-R412 WeakPolarHBondContact O-CG 3.4Å; E408-R412 PolarHBondContact O-N 3.3Å
409K71.1Confident58.8Low150 Ų150125.4 Ų125.465%0.65263%0.63SS**Hα-helixtrans-71.2-38.6177.3-71.2178.2168.9-173.40111.8N406 E407 R412 S413N406-K409 WeakPolarHBondContact O-CB 3.17Å; N406-K409 PolarHBondContact O-N 3.03Å; N406-K409 VanDerWaalsContact O-N 3.16Å; E407-K409 PolarHBondContact O-N 2.91Å; K409-R412 PolarHBondContact O-N 3.21Å; K409-S413 PolarHBondContact O-N 3.21Å; K409-S413 PolarHBondContact O-OG 3.37Å
410L72.4Confident59Low92 Ų92123.4 Ų123.448%0.48263%0.625SS.*Hα-helixtrans-66.7-37.7174.2-76.6154.6000111.8N406 E407 R412 S413 L414N406-L410 WeakPolarHBondContact O-CD1 3.39Å; N406-L410 WeakPolarHBondContact O-CG 3.46Å; N406-L410 PolarHBondContact O-N 3.46Å; E407-L410 WeakPolarHBondContact O-CB 3.44Å; E407-L410 PolarHBondContact O-N 3.25Å; E407-L410 VanDerWaalsContact O-N 3.13Å; L410-R412 VanDerWaalsContact C-N 3.26Å; L410-R412 PolarHBondContact O-N 3.38Å; L410-S413 WeakPolarHBondContact CA-OG 3.44Å; L410-S413 PolarHBondContact O-N 3.3Å; L410-S413 PolarHBondContact O-OG 2.78Å; L410-S413 VanDerWaalsContact O-OG 3.1Å; L410-L414 PolarHBondContact O-N 3.15Å
411R68.9Low59.2Low119 Ų119120.1 Ų120.145%0.44962%0.622SS.*Hα-helixtrans-65.5-27175.2-68169.681.785.913.5112.9E407E407-R411 WeakPolarHBondContact O-CB 3.21Å; E407-R411 WeakPolarHBondContact O-CG 3.48Å; E407-R411 PolarHBondContact O-N 3.13Å; E407-R411 IonicContact OE1-NH1 3.23Å; E407-R411 PolarHBondContact OE1-NH1 2.59Å
412R71.1Confident58.9Low196 Ų196121.4 Ų121.474%0.7462%0.624SS**Hα-helixtrans-90.2-28.3177.4-67.5174.591.21173113.7E408 K409 L410 L414E408-R412 VanDerWaalsContact O-CG 3.27Å; E408-R412 WeakPolarHBondContact O-CG 3.4Å; E408-R412 PolarHBondContact O-N 3.3Å; K409-R412 PolarHBondContact O-N 3.21Å; L410-R412 VanDerWaalsContact C-N 3.26Å; L410-R412 PolarHBondContact O-N 3.38Å; R412-L414 VanDerWaalsContact C-N 3.32Å
413S63.4Low58.9Low76 Ų76122.8 Ų122.853%0.53163%0.628SS.*Hα-helixtrans-80-14.817658.40000113.3K409 L410 P415K409-S413 PolarHBondContact O-N 3.21Å; K409-S413 PolarHBondContact O-OG 3.37Å; L410-S413 WeakPolarHBondContact CA-OG 3.44Å; L410-S413 PolarHBondContact O-N 3.3Å; L410-S413 PolarHBondContact O-OG 2.78Å; L410-S413 VanDerWaalsContact O-OG 3.1Å; S413-P415 WeakPolarHBondContact O-CD 3.15Å
414L69.6Low58.5Low78 Ų78124.7 Ų124.741%0.40863%0.633SS.*  trans-126.773.1-177.8-61173.6000110.9L410 R412 N416 L417L410-L414 PolarHBondContact O-N 3.15Å; R412-L414 VanDerWaalsContact C-N 3.32Å; L414-N416 PolarHBondContact O-N 3.22Å; L414-L417 HydrophobicContact CB-CB 4.11Å; L414-L417 HydrophobicContact CB-CD1 4.02Å; L414-L417 HydrophobicContact CD1-CD1 3.87Å; L414-L417 HydrophobicContact CD2-CD1 4.02Å; L414-L417 HydrophobicContact CG-CD1 4.18Å; L414-L417 PolarHBondContact O-N 3.1Å
415P63.2Low57.6Low96 Ų96124.9 Ų124.962%0.62363%0.634SS**THydrogen-bonded Turntrans-62-10.5-177.624.4-33.6000114.1S413S413-P415 WeakPolarHBondContact O-CD 3.15Å
416N53Low56.6Low154 Ų154124.8 Ų124.882%0.82464%0.642SS**THydrogen-bonded Turntrans-108.21.2-176.4-63.4-49.8000114.4L414L414-N416 PolarHBondContact O-N 3.22Å
417L56.9Low55.5Low125 Ų125126 Ų12665%0.65466%0.657SS**THydrogen-bonded Turntrans-119.9-4.4-173.9-75.4154.8000114.2L414 R419L414-L417 HydrophobicContact CB-CB 4.11Å; L414-L417 HydrophobicContact CB-CD1 4.02Å; L414-L417 HydrophobicContact CD1-CD1 3.87Å; L414-L417 HydrophobicContact CD2-CD1 4.02Å; L414-L417 HydrophobicContact CG-CD1 4.18Å; L414-L417 PolarHBondContact O-N 3.1Å; L417-R419 PolarHBondContact O-N 3.42Å; L417-R419 VanDerWaalsContact O-N 3.13Å
418S51.8Low53.8Low54 Ų54128.1 Ų128.138%0.37868%0.676SS.*  trans-82.720.9-174.541.50000115.2
419R52.5Low52.5Low244 Ų244132.4 Ų132.492%0.92169%0.693SS**  trans-107.357.4175.4-77.9-178.2160.9-114.10.3111.8L417L417-R419 PolarHBondContact O-N 3.42Å; L417-R419 VanDerWaalsContact O-N 3.13Å
420T47.2Very low51Low125 Ų125130.7 Ų130.777%0.76770%0.7SS**SBendtrans-137.8129.2154.755.50000108.8
421S41.9Very low49.4Very low106 Ų106131.5 Ų131.574%0.74171%0.713SS**  trans-84.5128.8-159.438.40000112.4T423S421-T423 PolarHBondContact O-N 2.95Å
422N39.5Very low48.2Very low144 Ų144136.6 Ų136.677%0.7773%0.732SS**  trans-58.3112.7157.3-17641.6000109.8
423T44.2Very low46.8Very low129 Ų129132.9 Ų132.979%0.79174%0.736SS**  trans-138.388.4159.447.70000108.6S421S421-T423 PolarHBondContact O-N 2.95Å
424Q40.6Very low45.6Very low166 Ų166136.9 Ų136.978%0.77675%0.751SS**  trans-69.3127.8160.7-122.7-167.5-29.600108.8
425V36.3Very low44.2Very low113 Ų113138 Ų13869%0.68577%0.766SS**  trans9.8113.7148-57.30000117.6
426D38Very low43.2Very low162 Ų162140.6 Ų140.687%0.86678%0.775SS**  trans-172.2141.5133.8-93.7-40000111.2
427S40.2Very low42.5Very low106 Ų106142.4 Ų142.474%0.74178%0.775SS**  trans79.188.9165.5-64.90000120.2
428V36.1Very low41.9Very low142 Ų142145.5 Ų145.586%0.86179%0.787SS**  5.7118.6127.8-86.70000117.4
429K44.4Very low41.6Very low203 Ų203149 Ų14988%0.88381%0.805SS**  153.8134.6117.8-157.3156179.6176.20112.1
430S39.2Very low41.3Very low115 Ų115143.7 Ų143.780%0.80480%0.802SS**  trans74.998.6174.1-77.10000117.4
431S40.2Very low41.3Very low108 Ų108145 Ų14576%0.75581%0.805SS**  89.9127.652.6-1690000114
432R43.8Very low41.3Very low227 Ų227143.4 Ų143.486%0.85781%0.805SS**  trans89.295.5171.6-55.9179.8158.3178.6-8.5114.4
433S40.5Very low41.3Very low117 Ų117139.8 Ų139.882%0.81880%0.801SS**  53.598.554.4-48.80000113.1
434D39.1Very low41.3Very low160 Ų160141.6 Ų141.686%0.85681%0.805SS**  trans-154.5123.2136.2-123.4-48.7000111.1
435S40.8Very low41.4Very low101 Ų101139.2 Ų139.271%0.70680%0.804SS**  trans-92.3127.4174.650.80000108.4
436N41.9Very low41.5Very low152 Ų152144.3 Ų144.381%0.81381%0.81SS**  trans-160.1136150.9-117.6-43.8000112.3
437F38.3Very low41.7Very low192 Ų192143.3 Ų143.384%0.84280%0.802SS**  trans-58.8134.4173-66.6-102.5000110.5
438Q42.8Very low41.7Very low190 Ų190146 Ų14689%0.88880%0.803SS**  trans-170.9125.9134.2-110.8157.622.600113.8
439V47.2Very low42.1Very low127 Ų127144.1 Ų144.177%0.7779%0.794SS**  trans-44150160.1-108.60000112.4N441V439-N441 PolarHBondContact O-N 3.24Å; V439-N441 VanDerWaalsContact O-N 3.15Å
440P45.9Very low42Very low132 Ų132143.5 Ų143.586%0.85779%0.794SS**  trans-78.6104.3-176.132.1-29.2000109.4
441N45.7Very low41.9Very low153 Ų153142.7 Ų142.782%0.81879%0.794SS**  trans-117.5107.6168.2-159.856.3000109.5V439V439-N441 PolarHBondContact O-N 3.24Å; V439-N441 VanDerWaalsContact O-N 3.15Å
442G41.9Very low41.9Very low73 Ų73143.3 Ų143.375%0.75380%0.799SS**  trans-68.5140.3165.800000110.8
443G39.9Very low41.7Very low67 Ų67137.3 Ų137.369%0.69180%0.798SS**  trans123.788162.800000116.4
444I44Very low41.7Very low168 Ų168139.3 Ų139.386%0.86280%0.797SS**  trans-19.2155.1146.141.4167.6000116.6
445P43.4Very low42.2Very low116 Ų116137 Ų13775%0.75379%0.792SS**  cis-157.3159.74640.2-16.6000121.3
446R38.8Very low42.2Very low219 Ų219137.5 Ų137.583%0.82680%0.795SS**  54.3125.8128.5-164.7-170.8178.888.6-0.7123.6
447M42.3Very low42.1Very low141 Ų141136.7 Ų136.770%0.69580%0.798SS**  -168.5108.1130-79.2-63.178.500108.9
448Q40.2Very low42.2Very low164 Ų164130.6 Ų130.677%0.76679%0.789SS**  92.8146.890.9-173.3177.88.500114
449P43.3Very low42.6Very low102 Ų102130.8 Ų130.866%0.66279%0.787SS**  cis-127.6156.7-14.728.6-8.8000115.8
450Q42.9Very low42.4Very low189 Ų189134.7 Ų134.788%0.88379%0.794SS**  169.3127.2117.7-89-161.2-13.300112.8
451A38Very low42.1Very low98 Ų98139.4 Ų139.481%0.8179%0.794SS**  trans47134.2157.800000120
452S38.9Very low41.8Very low121 Ų121137.6 Ų137.685%0.84679%0.794SS**  cis-166.8135.70.7-78.20000102.6
453A39.2Very low41.8Very low101 Ų101139 Ų13984%0.83579%0.79SS**  -162.8149.753.800000110.4
454I41.4Very low42Very low159 Ų159140 Ų14082%0.81579%0.791SS**  trans-88.6172.8-172.9-65.7153.9000109.1
455P48.9Very low41.6Very low113 Ų113136.7 Ų136.773%0.73479%0.789SS**  cis-129.3179.33.212.815.4000113.5
456S42.5Very low41.9Very low110 Ų110136.4 Ų136.477%0.76979%0.788SS**  cis-173134.71-100.60000107.5
457P38.8Very low41.8Very low136 Ų136131 Ų13188%0.88378%0.783SS**  trans-110.7157.2164.536.2-25.4000111.4
458G40.3Very low41.7Very low63 Ų63130 Ų13065%0.64979%0.787SS**  trans155.6113.1165.800000113.7
459K51.1Low41.8Very low195 Ų195130.2 Ų130.285%0.84879%0.793SS**  177.2106.6129.2-87.5149.2-168.9-170.40110.1
460F44.1Very low41.6Very low209 Ų209129 Ų12992%0.91779%0.792SS**  trans33.8119.6133.5-62.2-84.2000119
461R39.6Very low41.5Very low230 Ų230127.4 Ų127.487%0.86879%0.788SS**  174.6107.6116.4-169.6164.1-164.2148.91.1111.7
462S39.3Very low41.8Very low115 Ų115133.3 Ų133.380%0.80479%0.789SS**  trans-81153145.4-51.40000107.8
463P42Very low41.9Very low104 Ų104135.4 Ų135.468%0.67579%0.786SS**  -147.3143.598.434.2-14.4000112.5
464A42.2Very low42.4Very low87 Ų87136.7 Ų136.772%0.71979%0.786SS**  69.2120.596.300000114.5
465A37.6Very low42.4Very low99 Ų99133.7 Ų133.782%0.81877%0.774SS**  trans-56.3144.7153.500000109.5
466P48.3Very low42Very low110 Ų110138.6 Ų138.671%0.71478%0.784SS**  -148.8147.6127.430.8-11.1000114.6
467S36.3Very low41.7Very low105 Ų105135.9 Ų135.973%0.73477%0.769SS**  trans73.2120.5134.6-58.60000121
468P40.3Very low41.9Very low121 Ų121139.2 Ų139.279%0.78677%0.769SS**  trans-79.7127.7154.533.3-25.5000108
469L42.6Very low41.7Very low167 Ų167141.4 Ų141.487%0.87478%0.775SS**  trans-178.9121.1156.2-101.8160.2000110.7
470A38.5Very low40.9Very low78 Ų78138.2 Ų138.265%0.64577%0.767SS**  trans63.4147.8142.500000120.4
471L41.1Very low40.9Very low154 Ų154136.6 Ų136.681%0.80676%0.762SS**  trans85.5115.7168.9-49.4166.5000113.6
472R45.1Very low40.8Very low222 Ų222129.3 Ų129.384%0.83876%0.758SS**  cis-169137.515.6-108.1158.5144.1-126.4-9.6107.3
473Q41.5Very low41.1Very low166 Ų166130 Ų13078%0.77676%0.763SS**  trans-50.2156159.8-64.2179.6-37.600110.3V475Q473-V475 HydrophobicContact CB-CG2 4.18Å; Q473-V475 HydrophobicContact CG-CG2 4.5Å
474P49.7Very low41.2Very low127 Ų127128.7 Ų128.783%0.82577%0.769SS**  -116.9115.4115.930.6-29.2000110.3K476P474-K476 PolarHBondContact O-N 3.03Å
475V41.3Very low41.3Very low96 Ų96130.4 Ų130.458%0.58278%0.776SS**  trans-55.4124.4158.1-177.40000107.3Q473 A477Q473-V475 HydrophobicContact CB-CG2 4.18Å; Q473-V475 HydrophobicContact CG-CG2 4.5Å; V475-A477 HydrophobicContact CG1-CB 3.78Å
476K39.4Very low41.4Very low217 Ų217131.7 Ų131.794%0.94378%0.775SS**  trans-117.484.7158.3-130.4170-175.5-179.50107.2P474P474-K476 PolarHBondContact O-N 3.03Å
477A36.8Very low41Very low53 Ų53129.8 Ų129.844%0.43878%0.776SS.*  trans-90.2143.9168.900000108.2V475V475-A477 HydrophobicContact CG1-CB 3.78Å
478F42.2Very low41.2Very low205 Ų205129.8 Ų129.890%0.89978%0.776SS**  trans58.2117160.7-48.7-71000117.7
479S37Very low41.4Very low110 Ų110132.4 Ų132.477%0.76978%0.777SS**  173.9131.795-166.50000110.4
480N34.6Very low41.1Very low128 Ų128131.7 Ų131.768%0.68477%0.77SS**  trans-51.4165.2152.2-97.5-2.9000111
481H44Very low41.3Very low175 Ų175134 Ų13481%0.8177%0.77SS**  trans96.5127.3160.5-48.6-69000116.9
482G36.6Very low41.2Very low76 Ų76131.7 Ų131.778%0.78476%0.762SS**  trans112.785.713500000115.8
483S46Very low41Very low129 Ų129128.6 Ų128.690%0.90276%0.758SS**  trans-56.6135.3143.653.60000110.1
484G43.2Very low40.9Very low77 Ų77127.2 Ų127.279%0.79476%0.755SS**  trans157.6106.616400000114.8
485S44.6Very low40.3Very low124 Ų124126.1 Ų126.187%0.86775%0.746SS**  trans-69.7163.7168-145.10000111.4
486P40.6Very low40.3Very low125 Ų125129.2 Ų129.281%0.81275%0.754SS**  trans-95.4160.8-145.937.9-36.6000115.4
487G38.8Very low40.2Very low70 Ų70124 Ų12472%0.72274%0.74SS**  trans-178.6102.5166.100000113.9
488S41.4Very low40.4Very low105 Ų105127.6 Ų127.673%0.73476%0.757SS**  trans52.3124.7143.7-64.10000123.3
489Q43.9Very low40.4Very low176 Ų176123.7 Ų123.782%0.82276%0.755SS**  trans66.7145.5133.7-60.5-175.66.700117.2
490E37.7Very low40.9Very low153 Ų153123.8 Ų123.872%0.71576%0.756SS**  cis-169.7161.6-6.4-135-164.7138.100105.3
491I41.1Very low41.7Very low125 Ų125124.1 Ų124.164%0.64177%0.765SS**  trans74.497.8149.1-58.3161.9000120
492T40Very low41.6Very low106 Ų106119.3 Ų119.365%0.6576%0.763SS**  63.5122.5109.9-48.50000123.2
493Q40.8Very low42.8Very low158 Ų158121.6 Ų121.674%0.73876%0.764SS**  trans92.4124.1141-83.2178.5104.700123.9
494L39.2Very low43.3Very low137 Ų137121.2 Ų121.272%0.71776%0.758SS**  trans85.9109.9130.2-68.3167.7000123.4
495T37.9Very low43.5Very low104 Ų104125.6 Ų125.664%0.63876%0.76SS**  56.2132.3127.811.90000125.4
496Q39.7Very low43.7Very low160 Ų160124.1 Ų124.175%0.74875%0.746SS**  trans95.4133.9131.2-91.8173.566.500123.8
497T38.6Very low43.9Very low108 Ų108127 Ų12766%0.66375%0.748SS**  trans71.7108.8144.654.10000120.4
498T40.6Very low43.9Very low129 Ų129127.9 Ų127.979%0.79174%0.743SS**  68.8116.582.162.10000117
499S42.8Very low43.9Very low122 Ų122128.5 Ų128.585%0.85374%0.743SS**  166.9132.6126.556.20000114
500S47.2Very low43.8Very low113 Ų113126.6 Ų126.679%0.7974%0.743SS**  trans-75.7179.5169.7-45.80000112.8
501P50.1Low44Very low134 Ų134124.9 Ų124.987%0.8775%0.748SS**  -154.5174.581.934.6-10.9000117.2
502G43.5Very low44.1Very low74 Ų74123.4 Ų123.476%0.76375%0.754SS**  trans-100.6-159.3-169.100000119
503P62Low44.2Very low125 Ų125126.1 Ų126.181%0.81277%0.765SS**  trans-112.7-174.8-160.743.3-33.8000114.8
504P56.3Low45Very low121 Ų121123.7 Ų123.779%0.78676%0.763SS**  trans-151.5148.7142.132.8-12.2000118.9
505M47.3Very low45.4Very low168 Ų168122.4 Ų122.483%0.82876%0.763SS**  trans61.9143.2132.3-133.6170.774.900119.9
506V49.3Very low45.6Very low94 Ų94122.6 Ų122.657%0.5777%0.768SS**  -172.1145.950.7-1450000112
507Q44.4Very low45.5Very low184 Ų184121.8 Ų121.886%0.8677%0.769SS**  trans36.9154.9140-72.3163.67.600122.7
508S38.2Very low45.9Very low89 Ų89122.7 Ų122.762%0.62277%0.769SS**  cis178140-11.5-179.60000107.2
509T41.6Very low45.9Very low119 Ų119123 Ų12373%0.7377%0.765SS**  trans49.4132.5146.756.10000120.6
510V42Very low45.8Very low135 Ų135122.5 Ų122.582%0.81876%0.762SS**  -175.8142.659.7-93.20000112.4
511S41.1Very low45.5Very low117 Ų117121.2 Ų121.282%0.81876%0.758SS**  trans41125.1136.5-132.10000124.4
512A43.2Very low45Very low94 Ų94120.7 Ų120.778%0.77775%0.753SS**  165.2102.6119.300000114.8
513N43Very low44.9Very low164 Ų164124.8 Ų124.888%0.87776%0.756SS**  trans39.3155140.7-74.1-13.2000127.1
514P56.2Low44Very low107 Ų107126 Ų12670%0.69576%0.761SS**  trans-110-170.4-161.744.4-30.2000113.1
515P48.8Very low43.1Very low109 Ų109131.3 Ų131.371%0.70877%0.766SS**  -162.5173.187.640.4-17.7000118.3
516S41.5Very low43Very low108 Ų108128.5 Ų128.576%0.75576%0.76SS**  trans49.5152.4137.464.20000121.9
517N39Very low42.6Very low143 Ų143129 Ų12977%0.76577%0.774SS**  cis171172.7-9.2-166.67.8000104.1
518I45.2Very low42.5Very low127 Ų127123.5 Ų123.565%0.65177%0.767SS**  trans92.4106.4150.9-60.6167.1000120.3
519N41.4Very low42.9Very low136 Ų136125.6 Ų125.673%0.72778%0.776SS**  79.7118.7127.9-59.5-2.6000124.7
520S40Very low42.9Very low111 Ų111126.2 Ų126.278%0.77678%0.78SS**  68.7130116.5-54.40000123
521A41Very low42.9Very low86 Ų86124 Ų12471%0.71178%0.775SS**  trans100131.5130.400000120.7
522T39.9Very low43.1Very low124 Ų124126.3 Ų126.376%0.76178%0.775SS**  trans79.9103.8140.543.90000121.5
523L42Very low43.3Very low160 Ų160133.3 Ų133.384%0.83878%0.782SS**  36.7119.3121.1-81.7144.1000119.1
524T42.7Very low43.4Very low149 Ų149131 Ų13191%0.91478%0.778SS**  -173.7129.2123.519.50000111.5
525R38.2Very low42.8Very low233 Ų233129.3 Ų129.388%0.87978%0.78SS**  trans-98.8167.7162-150.5169.163.4-161.7-3.4105.4
526P44.4Very low43.2Very low110 Ų110132.6 Ų132.671%0.71479%0.791SS**  cis-155.2-173.325.741.7-17.6000119.3
527A40.3Very low44Very low105 Ų105133.4 Ų133.487%0.86879%0.794SS**  trans89.6127.2146.600000119.9
528G42.7Very low44.8Very low68 Ų68137.5 Ų137.570%0.70180%0.798SS**  trans136.987.1153.300000117.9
529T45.8Very low45Very low132 Ų132137.5 Ų137.581%0.8181%0.807SS**  trans62.4111.714164.60000122.7
530T43.1Very low45.3Very low132 Ų132136.6 Ų136.681%0.8181%0.811SS**  trans62.5108.1133.264.10000121
531A41.7Very low45.9Very low88 Ų88136 Ų13673%0.72781%0.813SS**  175.6109.5120.900000113
532M46Very low46.7Very low166 Ų166138.3 Ų138.382%0.81882%0.82SS**  trans57.6120.7134.3-43.1-51.4168.500122.8
533R45.7Very low46.8Very low241 Ų241138 Ų13891%0.90982%0.824SS**  trans78.2131.4148.3-65.7168.1150.4-102.8-2.6118
534S45.3Very low47Very low115 Ų115135.3 Ų135.380%0.80483%0.825SS**  cis-161.2124.9-5.758.50000108.5
535G44.1Very low47.3Very low72 Ų72132.3 Ų132.374%0.74282%0.823SS**  trans-109.5134.1166.600000109.6
536L58.5Low47.6Very low179 Ų179124.7 Ų124.794%0.93782%0.817SS**PPolyproline II helixtrans-62.2130.7177.3-76.297.5000110.9
537P57.2Low48.1Very low124 Ų124127.3 Ų127.381%0.80582%0.823SS**PPolyproline II helixtrans-92.7136.9171.733.5-27.4000111.7
538R55.1Low48.4Very low229 Ų229127.9 Ų127.986%0.86482%0.818SS**PPolyproline II helixtrans-63.3143.3167.6-173.3177.6-175177.71.5110.5S540R538-S540 PolarHBondContact O-N 3.46Å
539P50.5Low48.9Very low127 Ų127131.3 Ų131.383%0.82583%0.825SS**PPolyproline II helixtrans-76.7123.1-179.929.9-31.3000110.9
540S48.2Very low48.8Very low118 Ų118130.2 Ų130.283%0.82582%0.82SS**  trans-110.5134.8165-660000108.6R538R538-S540 PolarHBondContact O-N 3.46Å
541A52.4Low48.9Very low97 Ų97135.3 Ų135.380%0.80282%0.824SS**  trans-63.5149.1-177.400000113.4
542P57.9Low49.4Very low135 Ų135137 Ų13788%0.87783%0.831SS**  trans-83.8136.2173.531.8-30.3000112
543S42.2Very low49.4Very low119 Ų119138.8 Ų138.883%0.83283%0.834SS**  trans-115.3143.3165.9179.20000109.4
544A45.6Very low49.4Very low103 Ų103135.4 Ų135.485%0.85183%0.833SS**  trans88.8118161.800000120.3
545G49.5Very low49.5Very low86 Ų86134.7 Ų134.789%0.88784%0.835SS**  trans105.9118160.200000113.6
546G42.8Very low50Low72 Ų72139.6 Ų139.674%0.74284%0.838SS**  cis150.6107.44.600000107.3
547I55.5Low49.4Very low165 Ų165136.4 Ų136.485%0.84683%0.828SS**  trans-153.2131.2164.8-39.3173.9000108.6
548P46.3Very low49Very low118 Ų118136.8 Ų136.877%0.76683%0.828SS**  trans-98.3133.7-170.635.6-29.4000112.7
549V54Low48.8Very low139 Ų139137.5 Ų137.584%0.84283%0.831SS**  trans-147.7135.7160.9-173.80000110.1
550P43.1Very low48.8Very low109 Ų109142.2 Ų142.271%0.70883%0.832SS**  trans-103.5163.9-163.640.2-33.9000115
551R44.8Very low49.1Very low239 Ų239141.9 Ų141.990%0.90283%0.829SS**  trans85.8112160.9-53.5177.192.595.9-5.9117.6
552S53.2Low49.4Very low123 Ų123144.7 Ų144.786%0.8683%0.83SS**  -175143.192.9-1660000110.4
553K45.3Very low49.2Very low204 Ų204144 Ų14489%0.88783%0.825SS**  trans-78.3124.4-170.5-64.8-173175.9-179.60111.1
554L46.3Very low49.8Very low170 Ų170142.4 Ų142.489%0.8982%0.82SS**  trans-141.3129.6153-155.168.5000109.6
555A48.1Very low50.2Low101 Ų101143.5 Ų143.584%0.83582%0.818SS**PPolyproline II helixtrans-62.7134.4-16700000113.2
556Q52.8Low50.4Low175 Ų175148.4 Ų148.482%0.81882%0.815SS**PPolyproline II helixtrans-89.1136.5172.4-76-85.6-31.800110
557P47.6Very low50.4Low112 Ų112151.7 Ų151.773%0.72782%0.821SS**PPolyproline II helixtrans-72.3131.7175.728.4-30.4000110.8R559P557-R559 PolarHBondContact O-N 3.23Å
558V47.1Very low50Low132 Ų132152.5 Ų152.580%0.882%0.815SS**  trans-57.5105.6176173.10000110R560V558-R560 PolarHBondContact O-N 2.85Å; V558-R560 VanDerWaalsContact O-N 3.14Å
559R52.5Low49.7Very low244 Ų244149.8 Ų149.892%0.92181%0.808SS**  trans-70102.9162.3-81.2-166.9175.3-170.2-0.3108.2P557 S561P557-R559 PolarHBondContact O-N 3.23Å; R559-S561 PolarHBondContact O-N 2.94Å; R559-S561 VanDerWaalsContact O-N 3.11Å
560R50.8Low49.3Very low226 Ų226149 Ų14985%0.85381%0.809SS**  trans-62.5105.7162.6-75.1169.680.7165.62.4107.7V558 L562V558-R560 PolarHBondContact O-N 2.85Å; V558-R560 VanDerWaalsContact O-N 3.14Å; R560-L562 PolarHBondContact O-N 3.13Å
561S54.3Low49.5Very low110 Ų110150 Ų15077%0.76981%0.805SS**PPolyproline II helixtrans-65.9123.3161.145.20000108R559R559-S561 PolarHBondContact O-N 2.94Å; R559-S561 VanDerWaalsContact O-N 3.11Å
562L58.4Low50.1Low157 Ų157147.8 Ų147.882%0.82280%0.802SS**PPolyproline II helixtrans-72.1134169.9-67.5173.1000108.5R560R560-L562 PolarHBondContact O-N 3.13Å
563P53.9Low50.3Low119 Ų119147 Ų14777%0.77379%0.788SS**PPolyproline II helixtrans-64.8142.2172.7-15.128.6000110.7
564A54Low51.5Low87 Ų87141.1 Ų141.172%0.71977%0.767SS**PPolyproline II helixtrans-58.3145.2173.100000111.3K566A564-K566 PolarHBondContact O-N 2.93Å
565P55Low52.5Low125 Ų125137.5 Ų137.581%0.81276%0.755SS**PPolyproline II helixtrans-66.1127.2-179.926.7-31.4000110.1T567P565-T567 PolarHBondContact O-N 3.27Å
566K52.5Low53.7Low189 Ų189141.5 Ų141.582%0.82275%0.749SS**PPolyproline II helixtrans-67.1126.4172.5-78.2171.3173.6172.80109.5A564 Y568A564-K566 PolarHBondContact O-N 2.93Å; K566-Y568 PolarHBondContact O-N 3.16Å
567T43.1Very low54.4Low142 Ų142139 Ų13987%0.87174%0.736SS**  trans-58.2110.1168.6-460000109.7P565 G569P565-T567 PolarHBondContact O-N 3.27Å; T567-G569 PolarHBondContact O-N 3.31Å
568Y46.6Very low55.4Low182 Ų182141.3 Ų141.371%0.71474%0.742SS**  trans-83102.5168.6-92.3-87.8000108.9K566 M571K566-Y568 PolarHBondContact O-N 3.16Å; Y568-M571 HydrophobicContact CD1-CE 3.18Å; Y568-M571 HydrophobicContact CD1-CG 4.33Å; Y568-M571 HydrophobicContact CD1-SD 3.58Å; Y568-M571 VanDerWaalsContact CD1-SD 3.58Å; Y568-M571 HydrophobicContact CE1-CE 3.46Å; Y568-M571 VanDerWaalsContact CE1-CE 3.46Å; Y568-M571 HydrophobicContact CE1-SD 3.61Å; Y568-M571 HydrophobicContact CG-CE 3.94Å
569G41Very low56.1Low60 Ų60137.8 Ų137.862%0.61973%0.732SS**  trans-78.5139.116100000110.4T567T567-G569 PolarHBondContact O-N 3.31Å
570S44.4Very low56.1Low123 Ų123132.6 Ų132.686%0.8673%0.731SS**  trans46.677.3156.4-172.50000117.1
571M48.8Very low55.8Low129 Ų129136.6 Ų136.664%0.63575%0.749SS**  trans-116.9103.5158.6-53.4-169.5-69.100107.9Y568 D573Y568-M571 HydrophobicContact CD1-CE 3.18Å; Y568-M571 HydrophobicContact CD1-CG 4.33Å; Y568-M571 HydrophobicContact CD1-SD 3.58Å; Y568-M571 VanDerWaalsContact CD1-SD 3.58Å; Y568-M571 HydrophobicContact CE1-CE 3.46Å; Y568-M571 VanDerWaalsContact CE1-CE 3.46Å; Y568-M571 HydrophobicContact CE1-SD 3.61Å; Y568-M571 HydrophobicContact CG-CE 3.94Å; M571-D573 VanDerWaalsContact C-N 3.27Å; M571-D573 PolarHBondContact O-N 3.22Å; M571-D573 VanDerWaalsContact O-N 3.09Å
572K57Low55.9Low194 Ų194138 Ų13884%0.84375%0.748SS**  trans-79.780.7176.3-148.3166.4-175.6178.10106.3
573D57.2Low55.8Low106 Ų106136.9 Ų136.957%0.56774%0.744SS**  trans-98.789.1-176.8-139.3-67.2000109M571 S575M571-D573 VanDerWaalsContact C-N 3.27Å; M571-D573 PolarHBondContact O-N 3.22Å; M571-D573 VanDerWaalsContact O-N 3.09Å; D573-S575 PolarHBondContact O-N 3.23Å; D573-S575 WeakPolarHBondContact OD1-CB 3.48Å; D573-S575 PolarHBondContact OD1-OG 3.35Å
574D69.8Low55.9Low80 Ų80137.9 Ų137.943%0.42874%0.742SS.*  trans-76.116173.8-85.7-70000112.6W576 K577D574-W576 PolarHBondContact O-N 3.41Å; D574-K577 PolarHBondContact O-N 3.3Å; D574-K577 VanDerWaalsContact OD1-CD 3.3Å; D574-K577 WeakPolarHBondContact OD1-CD 3.46Å; D574-K577 WeakPolarHBondContact OD1-CE 3.27Å
575S67.1Low56Low94 Ų94140.9 Ų140.966%0.65774%0.744SS**THydrogen-bonded Turntrans-61-6.8-179.7-69.20000115.1D573D573-S575 PolarHBondContact O-N 3.23Å; D573-S575 WeakPolarHBondContact OD1-CB 3.48Å; D573-S575 PolarHBondContact OD1-OG 3.35Å
576W73.7Confident56Low186 Ų186141.9 Ų141.971%0.70574%0.739SS**THydrogen-bonded Turntrans-90-10.217565.4-82.4000113.6D574D574-W576 PolarHBondContact O-N 3.41Å
577K68.5Low56.3Low123 Ų123138.8 Ų138.854%0.53573%0.734SS.*SBendtrans-85.3-18.2-179.8-67.6-170.6-177.8-66.40114D574D574-K577 PolarHBondContact O-N 3.3Å; D574-K577 VanDerWaalsContact OD1-CD 3.3Å; D574-K577 WeakPolarHBondContact OD1-CD 3.46Å; D574-K577 WeakPolarHBondContact OD1-CE 3.27Å
578D68.4Low57.2Low160 Ų160138.6 Ų138.686%0.85672%0.724SS**SBendtrans-95.115-175.3-78.1-29.3000114.7
579G61Low58Low57 Ų57135.2 Ų135.259%0.58873%0.725SS**SBendtrans-135.568.9-171.800000114.8
580C51.9Low59.5Low135 Ų135141.5 Ų141.591%0.91273%0.734SS**  trans173.8104.3149.8-91.10000109.3
581Y45.6Very low60.8Low311 Ų311143.2 Ų143.2100%1.2272%0.722SS**  trans-134.40161.5-126.3-80.9000108.9

Retrieved 581 of 581 residues in 62.3 ms (Link to these results)