A0A087XJ06_POEFO Loading...

Sterile alpha motif domain containing 7

AlphaFold DB , UniProt , Accession A0A087XJ06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 524 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
1M43.1Very low52.1Low166 Ų166132.7 Ų132.782%0.81864%0.643SS**  0149.40-63.9-162.472.400108.1E5M1-E5 WeakPolarHBondContact CA-OE2 3.39Å; M1-E5 VanDerWaalsContact CB-OE2 3.25Å; M1-E5 WeakPolarHBondContact CB-OE2 3.31Å; M1-E5 HydrophobicContact CE-CB 3.59Å; M1-E5 HydrophobicContact CE-CG 4.34Å
2T55.8Low51.5Low80 Ų80129 Ų12949%0.49165%0.65SS.*  trans-96156.5176.762.60000111R4 E5T2-R4 PolarHBondContact O-N 2.98Å; T2-E5 PolarHBondContact N-OE2 2.77Å; T2-E5 WeakPolarHBondContact O-CB 3.22Å; T2-E5 PolarHBondContact O-N 2.89Å
3P56.3Low51Low106 Ų106131.1 Ų131.169%0.68866%0.663SS**Hα-helixtrans-54.9-30.2-179.6-28.336000114.2E5 Q6 L7P3-E5 PolarHBondContact O-N 3.1Å; P3-Q6 PolarHBondContact O-N 2.84Å; P3-L7 PolarHBondContact O-N 3.2Å
4R54.5Low50.5Low208 Ų208127.3 Ų127.379%0.78567%0.673SS**Hα-helixtrans-69.2-12.1177.8-164.9171.7-176.9167.41.6114.3T2 R8T2-R4 PolarHBondContact O-N 2.98Å; R4-R8 PolarHBondContact O-NE 2.89Å
5E54.4Low50.2Low64 Ų64130.1 Ų130.130%0.29968%0.681SS.*Hα-helixtrans-93.4-29.3174.1-59.7171.914000111.7M1 T2 P3 R8 K9M1-E5 WeakPolarHBondContact CA-OE2 3.39Å; M1-E5 VanDerWaalsContact CB-OE2 3.25Å; M1-E5 WeakPolarHBondContact CB-OE2 3.31Å; M1-E5 HydrophobicContact CE-CB 3.59Å; M1-E5 HydrophobicContact CE-CG 4.34Å; T2-E5 PolarHBondContact N-OE2 2.77Å; T2-E5 WeakPolarHBondContact O-CB 3.22Å; T2-E5 PolarHBondContact O-N 2.89Å; P3-E5 PolarHBondContact O-N 3.1Å; E5-R8 PolarHBondContact O-N 2.88Å; E5-K9 PolarHBondContact O-N 3.39Å; E5-K9 VanDerWaalsContact O-N 3.09Å
6Q55.4Low50.1Low147 Ų147132.8 Ų132.869%0.68769%0.689SS**Hα-helixtrans-68.3-43.3177.9-166.4161.9-26.700111.3P3 R8 K9 M10P3-Q6 PolarHBondContact O-N 2.84Å; Q6-R8 VanDerWaalsContact C-N 3.34Å; Q6-R8 PolarHBondContact O-N 2.87Å; Q6-K9 PolarHBondContact O-N 2.85Å; Q6-M10 PolarHBondContact O-N 3.39Å; Q6-M10 VanDerWaalsContact O-N 3.09Å
7L53Low49.6Very low121 Ų121127.3 Ų127.363%0.63467%0.672SS**Hα-helixtrans-56.7-45.6171.1-92.881.3000112.2P3 K9 M10 T11P3-L7 PolarHBondContact O-N 3.2Å; L7-K9 VanDerWaalsContact C-N 3.33Å; L7-K9 PolarHBondContact O-N 3.46Å; L7-M10 WeakPolarHBondContact O-CA 3.42Å; L7-M10 WeakPolarHBondContact O-CB 3.34Å; L7-M10 PolarHBondContact O-N 3.45Å; L7-T11 PolarHBondContact O-N 2.99Å; L7-T11 PolarHBondContact O-OG1 3.29Å
8R55Low49.4Very low165 Ų165126.1 Ų126.162%0.62367%0.671SS**Hα-helixtrans-65.3-33.2-179.2-81.3-172.3-70.9163.30.8113.2R4 E5 Q6R4-R8 PolarHBondContact O-NE 2.89Å; E5-R8 PolarHBondContact O-N 2.88Å; Q6-R8 VanDerWaalsContact C-N 3.34Å; Q6-R8 PolarHBondContact O-N 2.87Å
9K50.5Low49.3Very low133 Ų133126.5 Ų126.558%0.57867%0.672SS**Hα-helixtrans-66.5-38.2170.4-79.3-176.9170.1179.30111.8E5 Q6 L7 T11 A12E5-K9 PolarHBondContact O-N 3.39Å; E5-K9 VanDerWaalsContact O-N 3.09Å; Q6-K9 PolarHBondContact O-N 2.85Å; L7-K9 VanDerWaalsContact C-N 3.33Å; L7-K9 PolarHBondContact O-N 3.46Å; K9-T11 PolarHBondContact O-N 3.19Å; K9-A12 PolarHBondContact O-N 3.04Å
10M44.7Very low49.2Very low152 Ų152125.2 Ų125.275%0.74967%0.666SS**Hα-helixtrans-66.7-33.6177.6-132.817075.400112.8Q6 L7 A12Q6-M10 PolarHBondContact O-N 3.39Å; Q6-M10 VanDerWaalsContact O-N 3.09Å; L7-M10 WeakPolarHBondContact O-CA 3.42Å; L7-M10 WeakPolarHBondContact O-CB 3.34Å; L7-M10 PolarHBondContact O-N 3.45Å; M10-A12 PolarHBondContact O-N 2.74Å
11T50.3Low49Very low118 Ų118123.8 Ų123.872%0.72466%0.655SS**Hα-helixtrans-66-22.1175.9-39.70000113.5L7 K9 L13L7-T11 PolarHBondContact O-N 2.99Å; L7-T11 PolarHBondContact O-OG1 3.29Å; K9-T11 PolarHBondContact O-N 3.19Å; T11-L13 VanDerWaalsContact C-N 3.35Å
12A44.5Very low49Very low88 Ų88121.9 Ų121.973%0.72764%0.642SS**THydrogen-bonded Turntrans-87.62.3-17500000114.4K9 M10K9-A12 PolarHBondContact O-N 3.04Å; M10-A12 PolarHBondContact O-N 2.74Å
13L45.8Very low48.6Very low156 Ų156123.3 Ų123.382%0.81764%0.643SS**  trans-130.837.2-167.3-126.6160.5000112.7T11T11-L13 VanDerWaalsContact C-N 3.35Å
14G43.3Very low48.1Very low78 Ų78126.1 Ų126.180%0.80464%0.64SS**  trans-112.982.1177.800000112.7
15E46.6Very low47.7Very low169 Ų169123.5 Ų123.579%0.7963%0.631SS**  trans-106.9143.7171.2-144.8-169.3126.300111.4
16Q48.9Very low47.7Very low174 Ų174129.8 Ų129.881%0.81365%0.653SS**  trans59.456.5174.6-51.5-160.221.500118.2
17G41.3Very low47.6Very low39 Ų39127.9 Ų127.940%0.40265%0.646SS.*  trans-88.9143.3145.500000111.2K22G17-K22 PolarHBondContact O-NZ 3.27Å
18T45.4Very low47.5Very low105 Ų105126.8 Ų126.864%0.64464%0.644SS**  trans-68.7166.1-173.3570000113D20T18-D20 VanDerWaalsContact C-N 3.25Å; T18-D20 PolarHBondContact O-N 3.15Å
19L48Very low47.4Very low134 Ų134125.7 Ų125.770%0.70265%0.651SS**THydrogen-bonded Turntrans-70.2-17.2-167.9-152.6100.3000114.3H23L19-H23 PolarHBondContact O-CE1 3.24Å; L19-H23 PolarHBondContact O-ND1 3.2Å; L19-H23 VanDerWaalsContact O-ND1 3.09Å
20D47Very low47.5Very low101 Ų101122.3 Ų122.354%0.5465%0.654SS.*THydrogen-bonded Turntrans-80.6-44.7-174.9-163.662.6000113.2T18 K22 H23 W24T18-D20 VanDerWaalsContact C-N 3.25Å; T18-D20 PolarHBondContact O-N 3.15Å; D20-K22 PolarHBondContact O-N 2.76Å; D20-H23 WeakPolarHBondContact O-CB 3.2Å; D20-H23 PolarHBondContact O-N 3.01Å; D20-W24 PolarHBondContact OD2-NE1 3.19Å; D20-W24 VanDerWaalsContact OD2-NE1 3.16Å
21E44.6Very low48.4Very low96 Ų96117.4 Ų117.445%0.44963%0.63SS.*Hα-helixtrans-51.9-36.2175.4-81.8-167.5103.600112.4H23 W24 Y25E21-H23 PolarHBondContact O-N 2.96Å; E21-W24 PolarHBondContact O-N 3.27Å; E21-W24 VanDerWaalsContact O-N 3.12Å; E21-Y25 HydrophobicContact CB-CD2 4.31Å; E21-Y25 HydrophobicContact CB-CE2 4.27Å; E21-Y25 VanDerWaalsContact O-CD2 3.26Å; E21-Y25 WeakPolarHBondContact O-CD2 3.17Å; E21-Y25 PolarHBondContact O-N 3Å
22K43.9Very low49.2Very low125 Ų125114.8 Ų114.854%0.54362%0.616SS.*Hα-helixtrans-62-23.4-179.9-64.4177.4-176.11720112.8G17 D20 R26G17-K22 PolarHBondContact O-NZ 3.27Å; D20-K22 PolarHBondContact O-N 2.76Å; K22-R26 WeakPolarHBondContact O-CB 3.22Å; K22-R26 PolarHBondContact O-N 2.77Å
23H46.8Very low50.2Low110 Ų110114.6 Ų114.651%0.50961%0.614SS.*Hα-helixtrans-79.6-42.8173.2-66.299000111.9L19 D20 E21 R26 L27L19-H23 PolarHBondContact O-CE1 3.24Å; L19-H23 PolarHBondContact O-ND1 3.2Å; L19-H23 VanDerWaalsContact O-ND1 3.09Å; D20-H23 WeakPolarHBondContact O-CB 3.2Å; D20-H23 PolarHBondContact O-N 3.01Å; E21-H23 PolarHBondContact O-N 2.96Å; H23-R26 PolarHBondContact O-N 3.01Å; H23-L27 WeakPolarHBondContact O-CB 3.25Å; H23-L27 PolarHBondContact O-N 3.32Å
24W45.8Very low51.3Low165 Ų165109.4 Ų109.463%0.62560%0.598SS**Hα-helixtrans-60.7-49.8177.1-67.2101.5000112.4D20 E21 R26 L27 V28D20-W24 PolarHBondContact OD2-NE1 3.19Å; D20-W24 VanDerWaalsContact OD2-NE1 3.16Å; E21-W24 PolarHBondContact O-N 3.27Å; E21-W24 VanDerWaalsContact O-N 3.12Å; W24-R26 VanDerWaalsContact C-N 3.29Å; W24-R26 PolarHBondContact O-N 2.95Å; W24-L27 PolarHBondContact O-N 3.37Å; W24-V28 PolarHBondContact O-N 3.11Å
25Y46.7Very low52.8Low153 Ų153110.1 Ų110.160%0.658%0.581SS**Hα-helixtrans-64.4-32.2176.7-72.4-69.4000112.9E21 N29E21-Y25 HydrophobicContact CB-CD2 4.31Å; E21-Y25 HydrophobicContact CB-CE2 4.27Å; E21-Y25 VanDerWaalsContact O-CD2 3.26Å; E21-Y25 WeakPolarHBondContact O-CD2 3.17Å; E21-Y25 PolarHBondContact O-N 3Å; Y25-N29 WeakPolarHBondContact O-CB 3.44Å; Y25-N29 PolarHBondContact O-N 2.7Å
26R53.5Low54.1Low197 Ų197107 Ų10774%0.74357%0.569SS**Hα-helixtrans-72.8-34176.3-164.6176.1-155.2166.96.6112.7K22 H23 W24 V28 G30K22-R26 WeakPolarHBondContact O-CB 3.22Å; K22-R26 PolarHBondContact O-N 2.77Å; H23-R26 PolarHBondContact O-N 3.01Å; W24-R26 VanDerWaalsContact C-N 3.29Å; W24-R26 PolarHBondContact O-N 2.95Å; R26-V28 VanDerWaalsContact C-N 3.35Å; R26-G30 PolarHBondContact O-N 3.14Å
27L54.2Low55.3Low106 Ų106107.1 Ų107.156%0.55556%0.562SS**Hα-helixtrans-68.4-34.6176.8-163.972.1000111.9H23 W24H23-L27 WeakPolarHBondContact O-CB 3.25Å; H23-L27 PolarHBondContact O-N 3.32Å; W24-L27 PolarHBondContact O-N 3.37Å
28V49.8Very low57Low98 Ų98111.3 Ų111.359%0.59457%0.571SS**Hα-helixtrans-79.1-45.7176.9179.90000111.7W24 R26 G30 M31W24-V28 PolarHBondContact O-N 3.11Å; R26-V28 VanDerWaalsContact C-N 3.35Å; V28-G30 PolarHBondContact O-N 3.3Å; V28-M31 PolarHBondContact O-N 3.46Å
29N54.6Low58.3Low143 Ų143113 Ų11377%0.76557%0.566SS**Hα-helixtrans-72.6-11179.2-76.18.5000114.1Y25Y25-N29 WeakPolarHBondContact O-CB 3.44Å; Y25-N29 PolarHBondContact O-N 2.7Å
30G52.8Low59.4Low61 Ų61112.2 Ų112.263%0.62956%0.559SS**THydrogen-bonded Turntrans-86.1-14.1176.700000115R26 V28R26-G30 PolarHBondContact O-N 3.14Å; V28-G30 PolarHBondContact O-N 3.3Å
31M62.2Low60.6Low50 Ų50111.4 Ų111.425%0.24655%0.552CS.*  trans-79132.2-176.9-69.5-177.86300111.8V28 E35 L36 R39V28-M31 PolarHBondContact O-N 3.46Å; M31-E35 HydrophobicContact CE-CB 3.83Å; M31-E35 WeakPolarHBondContact CE-O 3.48Å; M31-L36 HydrophobicContact CE-CB 4.46Å; M31-R39 HydrophobicContact CE-CB 4.23Å
32S67.9Low61.8Low62 Ų62111.5 Ų111.543%0.43456%0.555SS.*  trans-67.3157.7168.970.90000111.5G34 E35 L36S32-G34 PolarHBondContact O-N 2.85Å; S32-G34 VanDerWaalsContact O-N 3.1Å; S32-E35 WeakPolarHBondContact CB-OE2 3.38Å; S32-E35 PolarHBondContact N-OE2 2.78Å; S32-E35 PolarHBondContact O-N 2.91Å; S32-E35 VanDerWaalsContact O-N 3.12Å; S32-E35 WeakPolarHBondContact OG-CG 3.43Å; S32-E35 PolarHBondContact OG-N 3.11Å; S32-E35 PolarHBondContact OG-OE2 2.93Å; S32-L36 PolarHBondContact O-N 2.73Å
33A64.5Low63Low84 Ų84110.5 Ų110.569%0.69455%0.554SS**Hα-helixtrans-59.7-22.7176.700000113.3R37A33-R37 PolarHBondContact O-N 3.39Å
34G69.2Low63.7Low47 Ų47110.9 Ų110.949%0.48556%0.558SS.*Hα-helixtrans-73.3-48.417300000112.5S32 L36 R37 Q38S32-G34 PolarHBondContact O-N 2.85Å; S32-G34 VanDerWaalsContact O-N 3.1Å; G34-L36 VanDerWaalsContact C-N 3.33Å; G34-L36 PolarHBondContact O-N 3.47Å; G34-R37 WeakPolarHBondContact O-CB 3.39Å; G34-R37 PolarHBondContact O-N 2.67Å; G34-Q38 WeakPolarHBondContact O-CB 3.23Å; G34-Q38 PolarHBondContact O-N 3.33Å
35E74.1Confident64.4Low93 Ų93110.8 Ų110.844%0.43556%0.557SS.*Hα-helixtrans-65-36.4179.1-67.4159.5109.500112M31 S32 Q38 R39M31-E35 HydrophobicContact CE-CB 3.83Å; M31-E35 WeakPolarHBondContact CE-O 3.48Å; S32-E35 WeakPolarHBondContact CB-OE2 3.38Å; S32-E35 PolarHBondContact N-OE2 2.78Å; S32-E35 PolarHBondContact O-N 2.91Å; S32-E35 VanDerWaalsContact O-N 3.12Å; S32-E35 WeakPolarHBondContact OG-CG 3.43Å; S32-E35 PolarHBondContact OG-N 3.11Å; S32-E35 PolarHBondContact OG-OE2 2.93Å; E35-Q38 PolarHBondContact O-N 3.24Å; E35-R39 VanDerWaalsContact O-CB 3.3Å; E35-R39 WeakPolarHBondContact O-CB 3.44Å; E35-R39 PolarHBondContact O-N 3.21Å
36L75.2Confident64.7Low105 Ų105106.9 Ų106.955%0.5555%0.547SS..Hα-helixtrans-63.1-42.9173.8-17464.3000111.2M31 S32 G34 R39 Q40M31-L36 HydrophobicContact CE-CB 4.46Å; S32-L36 PolarHBondContact O-N 2.73Å; G34-L36 VanDerWaalsContact C-N 3.33Å; G34-L36 PolarHBondContact O-N 3.47Å; L36-R39 PolarHBondContact O-N 3.41Å; L36-Q40 WeakPolarHBondContact O-CB 3.44Å; L36-Q40 PolarHBondContact O-N 3.45Å
37R73.5Confident64.5Low175 Ų175104.6 Ų104.666%0.6655%0.545SS*.Hα-helixtrans-63.8-44.9174.8-125.6-179.5-177.485.7-0.4111.9A33 G34 R39 Q40 E41A33-R37 PolarHBondContact O-N 3.39Å; G34-R37 WeakPolarHBondContact O-CB 3.39Å; G34-R37 PolarHBondContact O-N 2.67Å; R37-R39 VanDerWaalsContact C-N 3.32Å; R37-R39 PolarHBondContact O-N 3.28Å; R37-Q40 PolarHBondContact O-N 2.88Å; R37-E41 PolarHBondContact O-N 3.44Å
38Q77.1Confident64.2Low128 Ų128108.3 Ų108.360%0.59856%0.561SS**Hα-helixtrans-61.6-40.7177.5-171.8-178.31100111.4G34 E35 E41 L42G34-Q38 WeakPolarHBondContact O-CB 3.23Å; G34-Q38 PolarHBondContact O-N 3.33Å; E35-Q38 PolarHBondContact O-N 3.24Å; Q38-E41 PolarHBondContact O-N 3.09Å; Q38-L42 WeakPolarHBondContact O-CB 3.33Å; Q38-L42 PolarHBondContact O-N 3.41Å
39R72.8Confident64.2Low139 Ų139106.9 Ų106.953%0.52556%0.56SS.*Hα-helixtrans-69-39.3176.8-162.9171.2-167.8161.14.6111.9M31 E35 L36 R37 L42 I43M31-R39 HydrophobicContact CE-CB 4.23Å; E35-R39 VanDerWaalsContact O-CB 3.3Å; E35-R39 WeakPolarHBondContact O-CB 3.44Å; E35-R39 PolarHBondContact O-N 3.21Å; L36-R39 PolarHBondContact O-N 3.41Å; R37-R39 VanDerWaalsContact C-N 3.32Å; R37-R39 PolarHBondContact O-N 3.28Å; R39-L42 PolarHBondContact O-N 3.2Å; R39-I43 HydrophobicContact CG-CD1 4.36Å; R39-I43 VanDerWaalsContact O-CG1 3.29Å; R39-I43 WeakPolarHBondContact O-CG1 3.42Å; R39-I43 PolarHBondContact O-N 3.47Å
40Q71.9Confident63.8Low119 Ų119107.4 Ų107.456%0.55656%0.559SS**Hα-helixtrans-62.3-44.8172.4-170.4174.426.700111.4L36 R37 L42 I43 M44L36-Q40 WeakPolarHBondContact O-CB 3.44Å; L36-Q40 PolarHBondContact O-N 3.45Å; R37-Q40 PolarHBondContact O-N 2.88Å; Q40-L42 PolarHBondContact O-N 3.02Å; Q40-I43 PolarHBondContact O-N 3.4Å; Q40-M44 WeakPolarHBondContact O-CG 3.4Å; Q40-M44 PolarHBondContact O-N 2.8Å
41E71.7Confident62.8Low84 Ų84108 Ų10839%0.39356%0.558SS.*Hα-helixtrans-61.6-39.8172.1-85.8-165-147.700112.9R37 Q38 I43 M44 R45R37-E41 PolarHBondContact O-N 3.44Å; Q38-E41 PolarHBondContact O-N 3.09Å; E41-I43 VanDerWaalsContact C-N 3.33Å; E41-I43 PolarHBondContact O-N 3Å; E41-M44 PolarHBondContact O-N 3.25Å; E41-R45 WeakPolarHBondContact O-CG 3.5Å; E41-R45 PolarHBondContact O-N 3.31Å; E41-R45 IonicContact OE2-CZ 3.12Å; E41-R45 IonicContact OE2-NH1 2.78Å; E41-R45 PolarHBondContact OE2-NH1 3.37Å; E41-R45 IonicContact OE2-NH2 3.27Å; E41-R45 PolarHBondContact OE2-NH2 3.43Å
42L69.3Low61.8Low98 Ų98111.2 Ų111.251%0.51358%0.583SS.*Hα-helixtrans-63.7-39.5177.4-131.687.1000111.9Q38 R39 Q40 N46Q38-L42 WeakPolarHBondContact O-CB 3.33Å; Q38-L42 PolarHBondContact O-N 3.41Å; R39-L42 PolarHBondContact O-N 3.2Å; Q40-L42 PolarHBondContact O-N 3.02Å; L42-N46 WeakPolarHBondContact O-CB 3.4Å; L42-N46 PolarHBondContact O-N 3.41Å; L42-N46 PolarHBondContact O-ND2 3.22Å; L42-N46 VanDerWaalsContact O-ND2 3.15Å
43I68.5Low60.1Low104 Ų104116.3 Ų116.353%0.53360%0.6SS.*Hα-helixtrans-69-45.1176.3-69.2164.1000110.1R39 Q40 E41 R45 N46 Q47R39-I43 HydrophobicContact CG-CD1 4.36Å; R39-I43 VanDerWaalsContact O-CG1 3.29Å; R39-I43 WeakPolarHBondContact O-CG1 3.42Å; R39-I43 PolarHBondContact O-N 3.47Å; Q40-I43 PolarHBondContact O-N 3.4Å; E41-I43 VanDerWaalsContact C-N 3.33Å; E41-I43 PolarHBondContact O-N 3Å; I43-R45 VanDerWaalsContact C-N 3.33Å; I43-R45 PolarHBondContact O-N 3Å; I43-N46 PolarHBondContact O-N 3.42Å; I43-N46 VanDerWaalsContact O-N 3.17Å; I43-Q47 PolarHBondContact O-N 2.99Å; I43-Q47 VanDerWaalsContact O-N 3.13Å
44M62Low59Low118 Ų118120 Ų12058%0.58161%0.606SS**Hα-helixtrans-63.4-36.2176.8-68.6-152.4-54.200112.7Q40 E41Q40-M44 WeakPolarHBondContact O-CG 3.4Å; Q40-M44 PolarHBondContact O-N 2.8Å; E41-M44 PolarHBondContact O-N 3.25Å
45R61.6Low57.6Low163 Ų163124.4 Ų124.462%0.61562%0.618SS**Hα-helixtrans-71.3-35.4172.1-69-173.3-175.298.87112.7E41 I43 Q47 M48E41-R45 WeakPolarHBondContact O-CG 3.5Å; E41-R45 PolarHBondContact O-N 3.31Å; E41-R45 IonicContact OE2-CZ 3.12Å; E41-R45 IonicContact OE2-NH1 2.78Å; E41-R45 PolarHBondContact OE2-NH1 3.37Å; E41-R45 IonicContact OE2-NH2 3.27Å; E41-R45 PolarHBondContact OE2-NH2 3.43Å; I43-R45 VanDerWaalsContact C-N 3.33Å; I43-R45 PolarHBondContact O-N 3Å; R45-Q47 VanDerWaalsContact C-N 3.3Å; R45-Q47 PolarHBondContact O-N 3.44Å; R45-M48 PolarHBondContact O-N 2.91Å
46N53.1Low55.6Low70 Ų70123.7 Ų123.737%0.37463%0.628SS.*Hα-helixtrans-70.3-18.4177.3-99-77.2000114.8L42 I43 M48 A49 M50L42-N46 WeakPolarHBondContact O-CB 3.4Å; L42-N46 PolarHBondContact O-N 3.41Å; L42-N46 PolarHBondContact O-ND2 3.22Å; L42-N46 VanDerWaalsContact O-ND2 3.15Å; I43-N46 PolarHBondContact O-N 3.42Å; I43-N46 VanDerWaalsContact O-N 3.17Å; N46-M48 PolarHBondContact O-N 3.07Å; N46-M48 VanDerWaalsContact O-N 3.11Å; N46-A49 PolarHBondContact O-N 3.29Å; N46-M50 PolarHBondContact O-N 2.81Å
47Q48.7Very low53.7Low150 Ų150128.4 Ų128.470%0.70165%0.647SS**THydrogen-bonded Turntrans-63.1-13.6174-76-174.8105.800113.8I43 R45I43-Q47 PolarHBondContact O-N 2.99Å; I43-Q47 VanDerWaalsContact O-N 3.13Å; R45-Q47 VanDerWaalsContact C-N 3.3Å; R45-Q47 PolarHBondContact O-N 3.44Å
48M47.9Very low51.7Low184 Ų184123.4 Ų123.491%0.90665%0.65SS**THydrogen-bonded Turntrans-97.9-4.5169.4-67.7-176.9172.800114R45 N46R45-M48 PolarHBondContact O-N 2.91Å; N46-M48 PolarHBondContact O-N 3.07Å; N46-M48 VanDerWaalsContact O-N 3.11Å
49A50Low49.8Very low68 Ų68126.2 Ų126.256%0.56266%0.663SS**THydrogen-bonded Turntrans-106.5-25.3-17900000113.3N46 A51N46-A49 PolarHBondContact O-N 3.29Å; A49-A51 PolarHBondContact O-N 3.41Å
50M45.9Very low48Very low154 Ų154128 Ų12876%0.75968%0.678SS**  trans-82.457.7177.8-73-65.2-166.400113.2N46N46-M50 PolarHBondContact O-N 2.81Å
51A32.6Very low45.9Very low73 Ų73132.5 Ų132.560%0.60369%0.689SS**  trans-74.1122.6154.900000108A49 Q53A49-A51 PolarHBondContact O-N 3.41Å; A51-Q53 PolarHBondContact O-N 2.96Å
52P39.3Very low44.2Very low117 Ų117134.7 Ų134.776%0.7670%0.703SS**  trans-6998.5179.227.5-33.4000109.8I54P52-I54 VanDerWaalsContact C-N 3.35Å; P52-I54 PolarHBondContact O-N 3.36Å
53Q32.8Very low42.3Very low169 Ų169139.1 Ų139.179%0.7972%0.721SS**  trans-69.592.5172.7-68.6-170.17.100109.5A51 L55A51-Q53 PolarHBondContact O-N 2.96Å; Q53-L55 PolarHBondContact O-N 3.45Å
54I42.2Very low40.4Very low161 Ų161137.4 Ų137.483%0.82673%0.729SS**  trans-69.282.1163.5-57.8175.9000107.2P52 A56P52-I54 VanDerWaalsContact C-N 3.35Å; P52-I54 PolarHBondContact O-N 3.36Å; I54-A56 VanDerWaalsContact C-N 3.34Å; I54-A56 PolarHBondContact O-N 3.15Å; I54-A56 VanDerWaalsContact O-N 3.08Å
55L38.8Very low39.1Very low140 Ų140138.9 Ų138.973%0.73375%0.745SS**  trans-8285.4175.6-159.7155.9000108.5Q53Q53-L55 PolarHBondContact O-N 3.45Å
56A33.3Very low38.4Very low79 Ų79136.7 Ų136.765%0.65375%0.752SS**  trans-58.8141.2169.300000110.2I54 G58I54-A56 VanDerWaalsContact C-N 3.34Å; I54-A56 PolarHBondContact O-N 3.15Å; I54-A56 VanDerWaalsContact O-N 3.08Å; A56-G58 PolarHBondContact O-N 3.4Å; A56-G58 VanDerWaalsContact O-N 3.07Å
57Q34.3Very low37.4Very low204 Ų204137.8 Ų137.895%0.95377%0.77SS**  trans-64.2111.1-178.6-71.5-177.8-42.100111.4
58G31.7Very low36.6Very low70 Ų70138.9 Ų138.972%0.72278%0.775SS**  trans-111.6134.3169.800000110.9A56 Q60A56-G58 PolarHBondContact O-N 3.4Å; A56-G58 VanDerWaalsContact O-N 3.07Å; G58-Q60 PolarHBondContact O-N 3.09Å
59Q37.6Very low35.8Very low187 Ų187140 Ų14087%0.87478%0.775SS**  trans-73.3121.4-170.8-59.2164.7-5500113.2
60Q34Very low34.9Very low176 Ų176142.6 Ų142.682%0.82278%0.776SS**  trans-150.6103.7148.5-67.3-59.3-54.300106.5G58G58-Q60 PolarHBondContact O-N 3.09Å
61R29.7Very low34.2Very low213 Ų213144.6 Ų144.680%0.80478%0.783SS**  76.5118.572.4-154-146.7172.1101.8-0.7113.8
62L34.8Very low34.2Very low131 Ų131149.9 Ų149.969%0.68679%0.787SS**  trans85.496.2167.7-54.8-177.5000120.7
63Q28.9Very low33.8Very low190 Ų190153 Ų15389%0.88879%0.79SS**  62.3120108.7-174.4176.673.400121
64G29.8Very low33.7Very low68 Ų68152.6 Ų152.670%0.70179%0.789SS**  trans164.655.8155.900000124.3
65V34.8Very low33.1Very low150 Ų150154.1 Ų154.191%0.90979%0.793SS**  trans69.7153.7145.8172.60000119.3
66P46.7Very low32.9Very low117 Ų117158.6 Ų158.676%0.7680%0.8SS**  trans-131.5175.2-156.244.4-29.1000118.2
67A31.4Very low32.8Very low92 Ų92163 Ų16376%0.7681%0.807SS**  trans-154.4116.1146.600000108.1
68Q32.2Very low33Very low174 Ų174160.5 Ų160.581%0.81380%0.8SS**  55.210685.6-72.6-159.4-31.700115.6
69F32Very low33.1Very low206 Ų206163.7 Ų163.790%0.90481%0.805SS**  -158.3152.8104-117.5-83.6000111.2
70E29.7Very low33.4Very low124 Ų124159.4 Ų159.458%0.57979%0.793SS**  trans-80.8146.4179.5-92-176.7111.400113R72E70-R72 IonicContact OE1-CZ 3.18Å; E70-R72 IonicContact OE1-NE 2.7Å; E70-R72 PolarHBondContact OE1-NE 3.29Å; E70-R72 IonicContact OE1-NH2 3.19Å; E70-R72 PolarHBondContact OE1-NH2 3.41Å; E70-R72 IonicContact OE2-NH2 2.78Å
71H32.7Very low33.5Very low195 Ų195157.2 Ų157.290%0.90379%0.794SS**  trans-141.491.9151.9-118.5-86.4000109.7
72R31.7Very low33.9Very low185 Ų185153 Ų15370%0.69879%0.792SS**  trans-79140.9164.3-55.1-175.4-156172.812.2108.4E70E70-R72 IonicContact OE1-CZ 3.18Å; E70-R72 IonicContact OE1-NE 2.7Å; E70-R72 PolarHBondContact OE1-NE 3.29Å; E70-R72 IonicContact OE1-NH2 3.19Å; E70-R72 PolarHBondContact OE1-NH2 3.41Å; E70-R72 IonicContact OE2-NH2 2.78Å
73F30.2Very low33.8Very low183 Ų183153.9 Ų153.980%0.80380%0.798SS**  -169.4119.8104.3-121.3-101.5000111.8
74M30.8Very low34.2Very low159 Ų159151.7 Ų151.778%0.78379%0.789SS**  trans41.893.3150.7-52.2-82.171.700118.6
75E30.4Very low34.6Very low193 Ų193154.4 Ų154.490%0.90279%0.792SS**PPolyproline II helixtrans-98.2153.1134.8-169161.6-161.200108.5
76R34.7Very low34.3Very low234 Ų234152.1 Ų152.188%0.88378%0.779SS**PPolyproline II helixtrans-99.7143-169.1173.7174.8-82.9149.6-6.9111L78R76-L78 PolarHBondContact O-N 3.36Å
77E30.2Very low33.6Very low171 Ų171151.6 Ų151.680%0.79978%0.777SS**PPolyproline II helixtrans-47.1129.9176.6-72.6170.7115.700112.3
78L38.1Very low33.6Very low153 Ų153154 Ų15480%0.80177%0.773SS**  54126.183.6-86.1100.9000114.5R76R76-L78 PolarHBondContact O-N 3.36Å
79V35.3Very low33.7Very low136 Ų136150.7 Ų150.782%0.82478%0.776SS**  -172.3139.2121.51410000109.7
80P43.3Very low34.2Very low97 Ų97150.3 Ų150.363%0.6377%0.768SS**  trans-89.6159.7172.836.8-34.8000112.6
81P37Very low34.7Very low130 Ų130154 Ų15484%0.84479%0.785SS**  trans-90.8105.4179.633.8-32.4000113.3
82T36.8Very low34.8Very low125 Ų125152.2 Ų152.277%0.76778%0.779SS**  trans-150.7113.6157.344.30000112.1
83D32.3Very low34.9Very low150 Ų150152.1 Ų152.180%0.80279%0.786SS**  trans-125.4120.4144.7-88.8-53.8000105.3
84M37.5Very low35.4Very low143 Ų143150.9 Ų150.970%0.70479%0.785SS**  70.6144.877.3-65.2-152.673.200112.1T86M84-T86 HydrophobicContact CE-CG2 3.97Å
85V38Very low35.7Very low126 Ų126144.6 Ų144.676%0.76476%0.761SS**  cis-138.2161.333.5173.60000113.3
86T30.4Very low36.3Very low102 Ų102141.3 Ų141.363%0.62676%0.757SS**  trans-53.6-179.2179.559.90000116.4M84M84-T86 HydrophobicContact CE-CG2 3.97Å
87S31.6Very low36.6Very low105 Ų105138.3 Ų138.373%0.73475%0.752SS**  cis-161.1170.539.6-61.40000117.1
88E30.6Very low37.4Very low143 Ų143137.8 Ų137.867%0.66875%0.754SS**  trans67.982.6155.2-154.4178.9146.200118.7R90E88-R90 HydrophobicContact CG-CG 4.29Å; E88-R90 PolarHBondContact O-N 3.09Å; E88-R90 IonicContact OE1-CZ 3.67Å; E88-R90 IonicContact OE1-NE 2.89Å; E88-R90 PolarHBondContact OE1-NE 3.06Å; E88-R90 IonicContact OE1-NH2 3.52Å
89A35.3Very low38.2Very low105 Ų105133.6 Ų133.687%0.86875%0.748SS**  trans-71.484.7163.200000111.8
90R41.8Very low38.8Very low198 Ų198133 Ų13375%0.74775%0.746SS**  trans-65.3140.4159.9-73.7-166174.5-153.7-4.7110.1E88 M92E88-R90 HydrophobicContact CG-CG 4.29Å; E88-R90 PolarHBondContact O-N 3.09Å; E88-R90 IonicContact OE1-CZ 3.67Å; E88-R90 IonicContact OE1-NE 2.89Å; E88-R90 PolarHBondContact OE1-NE 3.06Å; E88-R90 IonicContact OE1-NH2 3.52Å; R90-M92 PolarHBondContact O-N 3.41Å
91Q40.4Very low38.9Very low201 Ų201134.3 Ų134.394%0.93976%0.755SS**  trans-62.290.7-177.8-67.6176.2-15.800112H93Q91-H93 PolarHBondContact O-N 3.28Å
92M33.8Very low39.7Very low158 Ų158135.9 Ų135.978%0.77876%0.756SS**  trans-84.389.6164.9-68.8-129.3-70.300109.1R90 M94R90-M92 PolarHBondContact O-N 3.41Å; M92-M94 VanDerWaalsContact C-N 3.29Å; M92-M94 PolarHBondContact O-N 3.3Å
93H33.7Very low40.5Very low182 Ų182134.5 Ų134.584%0.84375%0.749SS**  trans-65.686173.9-167.8102.3000109.3Q91 G95Q91-H93 PolarHBondContact O-N 3.28Å; H93-G95 PolarHBondContact O-N 3.49Å
94M42.1Very low41.1Very low157 Ų157133.6 Ų133.677%0.77375%0.751SS**  trans-71.867.5179.7-73.3-61.8-67.200111.4M92M92-M94 VanDerWaalsContact C-N 3.29Å; M92-M94 PolarHBondContact O-N 3.3Å
95G36.9Very low41.2Very low28 Ų28135.5 Ų135.529%0.28976%0.758SS.*  trans-64.7137172.700000110.9H93 H97H93-G95 PolarHBondContact O-N 3.49Å; G95-H97 VanDerWaalsContact C-N 3.32Å; G95-H97 PolarHBondContact O-N 3.06Å; G95-H97 PolarHBondContact O-ND1 3.24Å; G95-H97 VanDerWaalsContact O-ND1 3.1Å
96P42.2Very low41.5Very low124 Ų124133.8 Ų133.881%0.80576%0.757SS**  trans-70.988.7174.829.9-34.1000109.7L98P96-L98 PolarHBondContact O-N 2.9Å
97H41.3Very low42.2Very low170 Ų170136.5 Ų136.579%0.78777%0.768SS**  trans-78.955-178.153.9-86.1000112.2G95G95-H97 VanDerWaalsContact C-N 3.32Å; G95-H97 PolarHBondContact O-N 3.06Å; G95-H97 PolarHBondContact O-ND1 3.24Å; G95-H97 VanDerWaalsContact O-ND1 3.1Å
98L47.9Very low42.7Very low161 Ų161138.2 Ų138.284%0.84377%0.773SS**PPolyproline II helixtrans-90152.6161.7-65.6179.7000109.7P96P96-L98 PolarHBondContact O-N 2.9Å
99G53.7Low43.3Very low65 Ų65139.2 Ų139.267%0.6778%0.782SS**PPolyproline II helixtrans-65172.1-168.100000115.5
100P49.1Very low43.7Very low122 Ų122140.7 Ų140.779%0.79278%0.783SS**PPolyproline II helixtrans-59.4140.9-173.224.4-34.6000112.6
101P44.9Very low43.7Very low126 Ų126134.3 Ų134.382%0.81878%0.779SS**PPolyproline II helixtrans-73.7136-173.629.5-35.2000112.4
102L53.9Low43.8Very low162 Ų162135.1 Ų135.185%0.84877%0.774SS**PPolyproline II helixtrans-93.1150.2164.5-69.2174000110
103P53Low44.1Very low97 Ų97134.5 Ų134.563%0.6378%0.779SS**PPolyproline II helixtrans-70.1149.7-169.127.3-35.5000113.5H105P103-H105 PolarHBondContact O-N 3.48Å
104P45.7Very low44.5Very low130 Ų130133.6 Ų133.684%0.84477%0.773SS**  trans-78.1110.8-174.330.6-34.7000112.4A106P104-A106 PolarHBondContact O-N 3.09Å
105H39.6Very low45Very low184 Ų184132 Ų13285%0.85278%0.775SS**  trans-81.6109.3162.4-76.1-82.7000109.9P103 N107P103-H105 PolarHBondContact O-N 3.48Å; H105-N107 PolarHBondContact O-N 3.29Å
106A44.4Very low45.2Very low89 Ų89133.5 Ų133.574%0.73679%0.79SS**  trans-71.7119.7176.500000111.3P104P104-A106 PolarHBondContact O-N 3.09Å
107N44.1Very low45.7Very low160 Ų160134.5 Ų134.586%0.85680%0.796SS**  trans170.376.1143.1-88-27.8000111.6H105H105-N107 PolarHBondContact O-N 3.29Å
108V41.4Very low46.1Very low141 Ų141131.1 Ų131.186%0.85580%0.797SS**  trans-136.1117.7162.1-175.70000108.8
109L44.3Very low45.7Very low163 Ų163127 Ų12785%0.85379%0.794SS**  trans-86.4129.9171.9-71.3164.2000109.2G111L109-G111 PolarHBondContact O-N 3.46Å
110P42.9Very low45.6Very low136 Ų136135.6 Ų135.688%0.88381%0.808SS**  trans-7694.3176.230.4-33.2000110.3
111G42.5Very low45.2Very low65 Ų65133.5 Ų133.567%0.6781%0.808SS**  trans-154.9136.7179.200000113.3L109L109-G111 PolarHBondContact O-N 3.46Å
112R42.6Very low45.6Very low217 Ų217136.9 Ų136.982%0.81981%0.81SS**  trans63.887.6-176.9-66.2-177.6161.5-154.3-6.1116
113T39.3Very low46Very low145 Ų145136.1 Ų136.189%0.8981%0.806SS**PPolyproline II helixtrans-73.4128.1142.640.60000109.4
114F42.9Very low46.4Very low163 Ų163137.3 Ų137.372%0.71581%0.814SS**PPolyproline II helixtrans-102.7139.5160.1-90.5-89.7000108
115P53.3Low47.4Very low125 Ų125136.1 Ų136.181%0.81281%0.809SS**PPolyproline II helixtrans-74.9129.1176.829.9-33000111.1
116G39.4Very low48.9Very low59 Ų59132 Ų13261%0.60879%0.79SS**PPolyproline II helixtrans-81152.8168.600000111.9A118G116-A118 VanDerWaalsContact C-N 3.34Å; G116-A118 PolarHBondContact O-N 3.17Å
117P53.8Low50.7Low145 Ų145131.4 Ų131.494%0.94278%0.779SS**SBendtrans-84.865.4-171.735.5-37.3000113.2
118A48.6Very low52.4Low98 Ų98129.6 Ų129.681%0.8177%0.767SS**  trans-156.3133.7167.100000111.8G116G116-A118 VanDerWaalsContact C-N 3.34Å; G116-A118 PolarHBondContact O-N 3.17Å
119G41Very low54.6Low75 Ų75129.3 Ų129.377%0.77376%0.756SS**SBendtrans117.3147173.800000114.2G121G119-G121 PolarHBondContact O-N 2.94Å
120Y50.3Low56.7Low246 Ų246124.2 Ų124.297%0.96573%0.732SS**  trans-60.5126.6179.3-78-106.2000110.9F122Y120-F122 VanDerWaalsContact C-N 3.3Å; Y120-F122 PolarHBondContact O-N 3.38Å
121G40.4Very low58.9Low77 Ų77119.6 Ų119.679%0.79470%0.701SS**  trans-73.174.9-17700000113.6G119 L123G119-G121 PolarHBondContact O-N 2.94Å; G121-L123 PolarHBondContact O-N 3.31Å
122F53.8Low61.3Low197 Ų197118.8 Ų118.886%0.86469%0.688SS**  trans-69107.6160.4-155.9-87000107.5Y120Y120-F122 VanDerWaalsContact C-N 3.3Å; Y120-F122 PolarHBondContact O-N 3.38Å
123L62.9Low63.8Low146 Ų146117.1 Ų117.176%0.76468%0.682SS**PPolyproline II helixtrans-60.2138.1179.3-70.5172.1000109.5G121 S125G121-L123 PolarHBondContact O-N 3.31Å; L123-S125 PolarHBondContact O-N 3.35Å; L123-S125 VanDerWaalsContact O-N 3.11Å
124P60.4Low66.4Low122 Ų122116.6 Ų116.679%0.79266%0.663SS**PPolyproline II helixtrans-61.6118.817226.6-33000108.4E126P124-E126 PolarHBondContact O-N 2.94Å
125S67.1Low68.9Low106 Ų106114.8 Ų114.874%0.74166%0.657SS**PPolyproline II helixtrans-57.4125.1176.449.80000110L123L123-S125 PolarHBondContact O-N 3.35Å; L123-S125 VanDerWaalsContact O-N 3.11Å
126E71.2Confident70.9Confident98 Ų98113.5 Ų113.546%0.45864%0.64SS.*PPolyproline II helixtrans-55.4130.4172.8-89.6-156.4129.700109.3P124 V131 R134P124-E126 PolarHBondContact O-N 2.94Å; E126-V131 HydrophobicContact CB-CG2 3.79Å; E126-R134 IonicContact OE1-NH2 2.77Å; E126-R134 PolarHBondContact OE1-NH2 2.94Å; E126-R134 IonicContact OE2-CZ 2.65Å; E126-R134 IonicContact OE2-NE 2.86Å; E126-R134 PolarHBondContact OE2-NE 3.4Å; E126-R134 IonicContact OE2-NH2 3.5Å; E126-R134 PolarHBondContact OE2-NH2 2.68Å
127P82.6Confident73.6Confident76 Ų76116.7 Ų116.749%0.49464%0.643SS.*PPolyproline II helixtrans-63141.117727.1-33.9000109.5E129 T130 V131P127-E129 WeakPolarHBondContact CB-OE2 3.46Å; P127-E129 PolarHBondContact O-N 3.42Å; P127-T130 WeakPolarHBondContact CD-OG1 3.42Å; P127-T130 HydrophobicContact CG-CG2 3.86Å; P127-T130 PolarHBondContact O-N 2.83Å; P127-T130 PolarHBondContact O-OG1 3.07Å; P127-V131 PolarHBondContact O-N 2.98Å
128M79.8Confident75.7Confident122 Ų122113.7 Ų113.760%0.60162%0.618SS**Hα-helixtrans-54.5-31.2-167.5-167.565.5-118.100112.7T130 V131 A132M128-T130 VanDerWaalsContact C-N 3.34Å; M128-T130 PolarHBondContact O-N 3.23Å; M128-V131 HydrophobicContact CE-CB 3.98Å; M128-V131 HydrophobicContact CE-CG1 3.96Å; M128-V131 PolarHBondContact O-N 2.96Å; M128-A132 VanDerWaalsContact O-CB 3.31Å; M128-A132 WeakPolarHBondContact O-CB 3.43Å; M128-A132 PolarHBondContact O-N 3.23Å
129E86.8Confident77.9Confident134 Ų134114.8 Ų114.863%0.62661%0.606SS**Hα-helixtrans-64.3-33.3177.8-58.671-155.200112.9P127 R133P127-E129 WeakPolarHBondContact CB-OE2 3.46Å; P127-E129 PolarHBondContact O-N 3.42Å; E129-R133 VanDerWaalsContact O-CB 3.31Å; E129-R133 WeakPolarHBondContact O-CB 3.38Å; E129-R133 PolarHBondContact O-N 3.23Å
130T88.3Confident80.6Confident56 Ų56116.9 Ų116.934%0.34459%0.594SS.*Hα-helixtrans-75.4-40.6176.457.60000111.4P127 M128 R133 R134P127-T130 WeakPolarHBondContact CD-OG1 3.42Å; P127-T130 HydrophobicContact CG-CG2 3.86Å; P127-T130 PolarHBondContact O-N 2.83Å; P127-T130 PolarHBondContact O-OG1 3.07Å; M128-T130 VanDerWaalsContact C-N 3.34Å; M128-T130 PolarHBondContact O-N 3.23Å; T130-R133 PolarHBondContact O-N 3.32Å; T130-R134 VanDerWaalsContact O-CB 3.31Å; T130-R134 WeakPolarHBondContact O-CB 3.18Å; T130-R134 PolarHBondContact O-N 2.97Å
131V90.7Very high82.8Confident39 Ų39111.7 Ų111.724%0.23658%0.578CS.*Hα-helixtrans-65-42.4173.9-179.80000110.8E126 P127 M128 R134 Q135E126-V131 HydrophobicContact CB-CG2 3.79Å; P127-V131 PolarHBondContact O-N 2.98Å; M128-V131 HydrophobicContact CE-CB 3.98Å; M128-V131 HydrophobicContact CE-CG1 3.96Å; M128-V131 PolarHBondContact O-N 2.96Å; V131-R134 WeakPolarHBondContact O-CB 3.28Å; V131-R134 PolarHBondContact O-N 2.9Å; V131-Q135 WeakPolarHBondContact O-CG 3.49Å; V131-Q135 PolarHBondContact O-N 2.99Å
132A93.2Very high85.4Confident48 Ų48111.9 Ų111.940%0.39756%0.561SS.*Hα-helixtrans-61.7-47.6175.200000111.7M128 R134 Q135 E136M128-A132 VanDerWaalsContact O-CB 3.31Å; M128-A132 WeakPolarHBondContact O-CB 3.43Å; M128-A132 PolarHBondContact O-N 3.23Å; A132-R134 VanDerWaalsContact C-N 3.31Å; A132-R134 PolarHBondContact O-N 3.09Å; A132-Q135 PolarHBondContact O-N 2.65Å; A132-E136 PolarHBondContact O-N 2.9Å
133R94.5Very high87.4Confident183 Ų183105.7 Ų105.769%0.69154%0.536SS*.Hα-helixtrans-62.4-36.6175.9-171.2-177.3-61.3-150.2-0.3112.5E129 T130 E136 L137E129-R133 VanDerWaalsContact O-CB 3.31Å; E129-R133 WeakPolarHBondContact O-CB 3.38Å; E129-R133 PolarHBondContact O-N 3.23Å; T130-R133 PolarHBondContact O-N 3.32Å; R133-E136 PolarHBondContact O-N 2.77Å; R133-L137 PolarHBondContact O-N 2.67Å
134R94.2Very high89Confident134 Ų134101.2 Ų101.251%0.50652%0.52SS..Hα-helixtrans-61.6-46.4173.9-173.6-166.8-63.9-84.33.7110.7E126 T130 V131 A132 L137 I138E126-R134 IonicContact OE1-NH2 2.77Å; E126-R134 PolarHBondContact OE1-NH2 2.94Å; E126-R134 IonicContact OE2-CZ 2.65Å; E126-R134 IonicContact OE2-NE 2.86Å; E126-R134 PolarHBondContact OE2-NE 3.4Å; E126-R134 IonicContact OE2-NH2 3.5Å; E126-R134 PolarHBondContact OE2-NH2 2.68Å; T130-R134 VanDerWaalsContact O-CB 3.31Å; T130-R134 WeakPolarHBondContact O-CB 3.18Å; T130-R134 PolarHBondContact O-N 2.97Å; V131-R134 WeakPolarHBondContact O-CB 3.28Å; V131-R134 PolarHBondContact O-N 2.9Å; A132-R134 VanDerWaalsContact C-N 3.31Å; A132-R134 PolarHBondContact O-N 3.09Å; R134-L137 PolarHBondContact O-N 3.25Å; R134-I138 HydrophobicContact CG-CD1 4.14Å; R134-I138 WeakPolarHBondContact O-CD1 3.36Å; R134-I138 VanDerWaalsContact O-CG1 3.3Å; R134-I138 WeakPolarHBondContact O-CG1 3.36Å; R134-I138 PolarHBondContact O-N 3.01Å; R134-I138 VanDerWaalsContact O-N 3.13Å
135Q95.3Very high90.7Very high124 Ų124103.1 Ų103.158%0.57951%0.512SS*.Hα-helixtrans-65.5-41.2176.2-69.9-176.234.400112.3V131 A132 L137 I138 H139V131-Q135 WeakPolarHBondContact O-CG 3.49Å; V131-Q135 PolarHBondContact O-N 2.99Å; A132-Q135 PolarHBondContact O-N 2.65Å; Q135-L137 VanDerWaalsContact C-N 3.33Å; Q135-L137 PolarHBondContact O-N 3.43Å; Q135-I138 PolarHBondContact O-N 2.61Å; Q135-H139 VanDerWaalsContact O-CB 3.29Å; Q135-H139 WeakPolarHBondContact O-CB 3.5Å; Q135-H139 PolarHBondContact O-N 2.84Å
136E95Very high92.1Very high99 Ų99104.7 Ų104.746%0.46351%0.509SS..Hα-helixtrans-58.6-43.6176-167.6-161.9162.500111.8A132 R133 H139 K140A132-E136 PolarHBondContact O-N 2.9Å; R133-E136 PolarHBondContact O-N 2.77Å; E136-H139 PolarHBondContact O-N 3.35Å; E136-K140 HydrophobicContact CG-CD 4.37Å; E136-K140 WeakPolarHBondContact O-CB 3.28Å; E136-K140 WeakPolarHBondContact O-CG 3.35Å; E136-K140 PolarHBondContact O-N 2.86Å; E136-K140 VanDerWaalsContact OE1-CE 3.32Å; E136-K140 WeakPolarHBondContact OE1-CE 3.34Å; E136-K140 IonicContact OE1-NZ 3.93Å; E136-K140 PolarHBondContact OE1-NZ 3.41Å
137L96.6Very high93.2Very high125 Ų125105.7 Ų105.765%0.65451%0.514SS*.Hα-helixtrans-64.5-45177.4-174.266.7000112R133 R134 Q135 H139 K140 Q141R133-L137 PolarHBondContact O-N 2.67Å; R134-L137 PolarHBondContact O-N 3.25Å; Q135-L137 VanDerWaalsContact C-N 3.33Å; Q135-L137 PolarHBondContact O-N 3.43Å; L137-H139 VanDerWaalsContact C-N 3.34Å; L137-K140 PolarHBondContact O-N 3.29Å; L137-Q141 WeakPolarHBondContact O-CB 3.25Å; L137-Q141 PolarHBondContact O-N 3.25Å
138I96.4Very high93.7Very high82 Ų82108.5 Ų108.542%0.42152%0.522SS..Hα-helixtrans-63.4-41.2176.6-67.9164.7000110.6R134 Q135 Q141 N142R134-I138 HydrophobicContact CG-CD1 4.14Å; R134-I138 WeakPolarHBondContact O-CD1 3.36Å; R134-I138 VanDerWaalsContact O-CG1 3.3Å; R134-I138 WeakPolarHBondContact O-CG1 3.36Å; R134-I138 PolarHBondContact O-N 3.01Å; R134-I138 VanDerWaalsContact O-N 3.13Å; Q135-I138 PolarHBondContact O-N 2.61Å; I138-Q141 PolarHBondContact O-N 3.21Å; I138-N142 WeakPolarHBondContact O-CB 3.05Å; I138-N142 PolarHBondContact O-N 3.45Å; I138-N142 PolarHBondContact O-ND2 3.25Å
139H96.3Very high94.4Very high122 Ų122105.8 Ų105.857%0.56551%0.51SS*.Hα-helixtrans-63.8-45.8177.4-174.967000111.6Q135 E136 L137 Q141 N142 I143Q135-H139 VanDerWaalsContact O-CB 3.29Å; Q135-H139 WeakPolarHBondContact O-CB 3.5Å; Q135-H139 PolarHBondContact O-N 2.84Å; E136-H139 PolarHBondContact O-N 3.35Å; L137-H139 VanDerWaalsContact C-N 3.34Å; H139-Q141 PolarHBondContact O-N 2.86Å; H139-N142 PolarHBondContact O-N 3.05Å; H139-I143 WeakPolarHBondContact O-CG1 3.44Å; H139-I143 PolarHBondContact O-N 3.41Å
140K97.2Very high94.7Very high119 Ų119102.2 Ų102.252%0.51750%0.503SS..Hα-helixtrans-61.4-39.9174.1-75.5173.4173.7175.60112.6E136 L137 I143 A144E136-K140 HydrophobicContact CG-CD 4.37Å; E136-K140 WeakPolarHBondContact O-CB 3.28Å; E136-K140 WeakPolarHBondContact O-CG 3.35Å; E136-K140 PolarHBondContact O-N 2.86Å; E136-K140 VanDerWaalsContact OE1-CE 3.32Å; E136-K140 WeakPolarHBondContact OE1-CE 3.34Å; E136-K140 IonicContact OE1-NZ 3.93Å; E136-K140 PolarHBondContact OE1-NZ 3.41Å; L137-K140 PolarHBondContact O-N 3.29Å; K140-I143 PolarHBondContact O-N 3.5Å; K140-A144 WeakPolarHBondContact O-CB 3.49Å; K140-A144 PolarHBondContact O-N 3.44Å
141Q96.7Very high95Very high136 Ų136104.7 Ų104.764%0.63651%0.513SS*.Hα-helixtrans-63.4-40.7174.2-171.7179.13200111.9L137 I138 H139 A144 R145L137-Q141 WeakPolarHBondContact O-CB 3.25Å; L137-Q141 PolarHBondContact O-N 3.25Å; I138-Q141 PolarHBondContact O-N 3.21Å; H139-Q141 PolarHBondContact O-N 2.86Å; Q141-A144 PolarHBondContact O-N 2.98Å; Q141-R145 WeakPolarHBondContact O-CB 3.46Å; Q141-R145 PolarHBondContact O-N 2.75Å
142N94.3Very high95.1Very high82 Ų82107.8 Ų107.844%0.43953%0.528SS..Hα-helixtrans-68-39.1177.3-76.3-32.6000112.8I138 H139 R145 M146I138-N142 WeakPolarHBondContact O-CB 3.05Å; I138-N142 PolarHBondContact O-N 3.45Å; I138-N142 PolarHBondContact O-ND2 3.25Å; H139-N142 PolarHBondContact O-N 3.05Å; N142-R145 PolarHBondContact O-N 3.33Å; N142-M146 WeakPolarHBondContact O-CB 3.21Å; N142-M146 PolarHBondContact O-N 3.21Å
143I96.4Very high95.1Very high66 Ų66110.8 Ų110.834%0.33853%0.533SS..Hα-helixtrans-60.9-52.9171.8-69.4167.2000110.1H139 K140 R145 M146 E147H139-I143 WeakPolarHBondContact O-CG1 3.44Å; H139-I143 PolarHBondContact O-N 3.41Å; K140-I143 PolarHBondContact O-N 3.5Å; I143-R145 PolarHBondContact O-N 3Å; I143-M146 WeakPolarHBondContact O-CA 3.38Å; I143-M146 WeakPolarHBondContact O-CB 3.33Å; I143-M146 PolarHBondContact O-N 3.05Å; I143-E147 HydrophobicContact CG2-CG 4.18Å; I143-E147 WeakPolarHBondContact O-CG 3.5Å; I143-E147 PolarHBondContact O-N 3.16Å
144A97Very high95.1Very high52 Ų52108.5 Ų108.543%0.4353%0.531SS..Hα-helixtrans-58.8-35.3-179.100000112.5K140 Q141 M148K140-A144 WeakPolarHBondContact O-CB 3.49Å; K140-A144 PolarHBondContact O-N 3.44Å; Q141-A144 PolarHBondContact O-N 2.98Å; A144-M148 VanDerWaalsContact O-CB 3.26Å; A144-M148 WeakPolarHBondContact O-CB 3.31Å; A144-M148 PolarHBondContact O-N 2.93Å
145R95.8Very high95Very high162 Ų162108.6 Ų108.661%0.61154%0.535SS*.Hα-helixtrans-68.5-38173.4-162.4179.681102.5-1112.5Q141 N142 I143 N149Q141-R145 WeakPolarHBondContact O-CB 3.46Å; Q141-R145 PolarHBondContact O-N 2.75Å; N142-R145 PolarHBondContact O-N 3.33Å; I143-R145 PolarHBondContact O-N 3Å; R145-N149 WeakPolarHBondContact O-CB 3.47Å; R145-N149 PolarHBondContact O-N 3.02Å; R145-N149 PolarHBondContact O-OD1 2.67Å
146M95Very high94.9Very high140 Ų140108.4 Ų108.469%0.6953%0.534SS*.Hα-helixtrans-67.1-46.2176.2-169.3-175.4-60.100111.3N142 I143 N149 A150N142-M146 WeakPolarHBondContact O-CB 3.21Å; N142-M146 PolarHBondContact O-N 3.21Å; I143-M146 WeakPolarHBondContact O-CA 3.38Å; I143-M146 WeakPolarHBondContact O-CB 3.33Å; I143-M146 PolarHBondContact O-N 3.05Å; M146-N149 PolarHBondContact O-N 2.9Å; M146-A150 WeakPolarHBondContact O-CB 3.28Å; M146-A150 PolarHBondContact O-N 2.85Å
147E94.4Very high94.5Very high119 Ų119108.8 Ų108.856%0.55654%0.539SS*.Hα-helixtrans-61.8-46.4176.1-68.7177.4158.100111.5I143 N149 A150 I151I143-E147 HydrophobicContact CG2-CG 4.18Å; I143-E147 WeakPolarHBondContact O-CG 3.5Å; I143-E147 PolarHBondContact O-N 3.16Å; E147-N149 VanDerWaalsContact C-N 3.35Å; E147-N149 PolarHBondContact O-N 3.25Å; E147-A150 PolarHBondContact O-N 3.22Å; E147-I151 WeakPolarHBondContact O-CB 3.28Å; E147-I151 WeakPolarHBondContact O-CD1 3.15Å; E147-I151 VanDerWaalsContact O-CG1 3.26Å; E147-I151 WeakPolarHBondContact O-CG1 3.43Å; E147-I151 PolarHBondContact O-N 3.4Å
148M94.7Very high94Very high135 Ų135107.8 Ų107.867%0.66553%0.53SS*.Hα-helixtrans-59.9-43176.3-177.6176.8176.800112.3A144 I151 L152A144-M148 VanDerWaalsContact O-CB 3.26Å; A144-M148 WeakPolarHBondContact O-CB 3.31Å; A144-M148 PolarHBondContact O-N 2.93Å; M148-I151 PolarHBondContact O-N 3.12Å; M148-L152 WeakPolarHBondContact O-CB 3.36Å; M148-L152 PolarHBondContact O-N 3.18Å
149N92.8Very high93.5Very high65 Ų65107 Ų10735%0.34853%0.527SS..Hα-helixtrans-66.9-39.2176.9-73.21000112R145 M146 E147 L152 H153R145-N149 WeakPolarHBondContact O-CB 3.47Å; R145-N149 PolarHBondContact O-N 3.02Å; R145-N149 PolarHBondContact O-OD1 2.67Å; M146-N149 PolarHBondContact O-N 2.9Å; E147-N149 VanDerWaalsContact C-N 3.35Å; E147-N149 PolarHBondContact O-N 3.25Å; N149-L152 PolarHBondContact O-N 3.03Å; N149-H153 PolarHBondContact O-CD2 3.34Å; N149-H153 VanDerWaalsContact O-CD2 3.28Å; N149-H153 PolarHBondContact O-N 2.68Å
150A94.5Very high92.7Very high58 Ų58103.9 Ų103.948%0.47952%0.523SS..Hα-helixtrans-63.6-44.1175.400000111.6M146 E147 L152 H153 Q154M146-A150 WeakPolarHBondContact O-CB 3.28Å; M146-A150 PolarHBondContact O-N 2.85Å; E147-A150 PolarHBondContact O-N 3.22Å; A150-L152 VanDerWaalsContact C-N 3.33Å; A150-L152 PolarHBondContact O-N 2.81Å; A150-H153 PolarHBondContact O-N 3.3Å; A150-Q154 VanDerWaalsContact O-CB 3.31Å; A150-Q154 WeakPolarHBondContact O-CB 3.43Å; A150-Q154 PolarHBondContact O-N 3.35Å
151I93.6Very high91.6Very high109 Ų109104.2 Ų104.256%0.55953%0.526SS*.Hα-helixtrans-62.9-39.6174.8-67.8163.1000111E147 M148 Q154 K155E147-I151 WeakPolarHBondContact O-CB 3.28Å; E147-I151 WeakPolarHBondContact O-CD1 3.15Å; E147-I151 VanDerWaalsContact O-CG1 3.26Å; E147-I151 WeakPolarHBondContact O-CG1 3.43Å; E147-I151 PolarHBondContact O-N 3.4Å; M148-I151 PolarHBondContact O-N 3.12Å; I151-Q154 PolarHBondContact O-N 2.61Å; I151-K155 WeakPolarHBondContact O-CB 3.38Å; I151-K155 PolarHBondContact O-N 2.85Å
152L93.6Very high90.4Very high103 Ų103102.7 Ų102.754%0.53952%0.518SS..Hα-helixtrans-63.3-49.7177.1-178.361.4000111.6M148 N149 A150 K155 E156M148-L152 WeakPolarHBondContact O-CB 3.36Å; M148-L152 PolarHBondContact O-N 3.18Å; N149-L152 PolarHBondContact O-N 3.03Å; A150-L152 VanDerWaalsContact C-N 3.33Å; A150-L152 PolarHBondContact O-N 2.81Å; L152-K155 PolarHBondContact O-N 2.99Å; L152-E156 WeakPolarHBondContact O-CB 3.22Å; L152-E156 PolarHBondContact O-N 3.25Å
153H93.6Very high89Confident111 Ų111105.7 Ų105.751%0.51453%0.528SS..Hα-helixtrans-67.9-33.7177.4-71.7-52.8000113N149 A150 K155 E156 L157N149-H153 PolarHBondContact O-CD2 3.34Å; N149-H153 VanDerWaalsContact O-CD2 3.28Å; N149-H153 PolarHBondContact O-N 2.68Å; A150-H153 PolarHBondContact O-N 3.3Å; H153-K155 VanDerWaalsContact C-N 3.34Å; H153-E156 IonicContact CE1-OE2 2.68Å; H153-E156 IonicContact CG-OE2 2.6Å; H153-E156 IonicContact ND1-OE2 2.67Å; H153-E156 PolarHBondContact ND1-OE2 2.82Å; H153-E156 PolarHBondContact O-N 3.45Å; H153-L157 VanDerWaalsContact O-CB 3.32Å; H153-L157 WeakPolarHBondContact O-CB 3.31Å; H153-L157 PolarHBondContact O-N 2.97Å
154Q93.9Very high87.3Confident136 Ų136104.6 Ų104.664%0.63653%0.533SS*.Hα-helixtrans-63-42.4171.7-176.8176.8-500111.1A150 I151 L157 E158A150-Q154 VanDerWaalsContact O-CB 3.31Å; A150-Q154 WeakPolarHBondContact O-CB 3.43Å; A150-Q154 PolarHBondContact O-N 3.35Å; I151-Q154 PolarHBondContact O-N 2.61Å; Q154-L157 PolarHBondContact O-N 3.27Å; Q154-E158 WeakPolarHBondContact O-CB 3.26Å; Q154-E158 PolarHBondContact O-N 3.19Å
155K92.6Very high85.3Confident136 Ų136109.2 Ų109.259%0.59155%0.549SS*.Hα-helixtrans-69.6-34.9176.3-173.4176.5-175.3-1790112.7I151 L152 H153 E158 N159I151-K155 WeakPolarHBondContact O-CB 3.38Å; I151-K155 PolarHBondContact O-N 2.85Å; L152-K155 PolarHBondContact O-N 2.99Å; H153-K155 VanDerWaalsContact C-N 3.34Å; K155-E158 PolarHBondContact O-N 3.25Å; K155-N159 WeakPolarHBondContact O-CB 3.42Å; K155-N159 PolarHBondContact O-N 2.69Å
156E91.7Very high83.3Confident119 Ų119109.1 Ų109.156%0.55656%0.558SS**Hα-helixtrans-62.9-46.4172.2-179.8175.2-145.200110.9L152 H153 N159 A160L152-E156 WeakPolarHBondContact O-CB 3.22Å; L152-E156 PolarHBondContact O-N 3.25Å; H153-E156 IonicContact CE1-OE2 2.68Å; H153-E156 IonicContact CG-OE2 2.6Å; H153-E156 IonicContact ND1-OE2 2.67Å; H153-E156 PolarHBondContact ND1-OE2 2.82Å; H153-E156 PolarHBondContact O-N 3.45Å; E156-N159 PolarHBondContact O-N 2.87Å; E156-A160 WeakPolarHBondContact O-CB 3.28Å; E156-A160 PolarHBondContact O-N 3.3Å
157L87.8Confident81.2Confident108 Ų108105.2 Ų105.257%0.56555%0.554SS**Hα-helixtrans-64.7-40.2175.7-171.266.8000112.1H153 Q154 A160 H161H153-L157 VanDerWaalsContact O-CB 3.32Å; H153-L157 WeakPolarHBondContact O-CB 3.31Å; H153-L157 PolarHBondContact O-N 2.97Å; Q154-L157 PolarHBondContact O-N 3.27Å; L157-A160 PolarHBondContact O-N 2.87Å; L157-H161 PolarHBondContact O-N 3.09Å; L157-H161 PolarHBondContact O-ND1 2.97Å
158E86.1Confident79.3Confident103 Ų103107.2 Ų107.248%0.48157%0.565SS.*Hα-helixtrans-62.6-43.7173.3-169.9-165.699.400111.5Q154 K155 H161 Q162Q154-E158 WeakPolarHBondContact O-CB 3.26Å; Q154-E158 PolarHBondContact O-N 3.19Å; K155-E158 PolarHBondContact O-N 3.25Å; E158-H161 PolarHBondContact O-N 2.9Å; E158-Q162 WeakPolarHBondContact O-CG 3.44Å; E158-Q162 PolarHBondContact O-N 3.43Å; E158-Q162 PolarHBondContact OE1-NE2 3.03Å
159N84.9Confident76.7Confident66 Ų66109 Ų10935%0.35357%0.572SS.*Hα-helixtrans-64.5-39.6177.4-169.3-51.3000111.4K155 E156 Q162 K163K155-N159 WeakPolarHBondContact O-CB 3.42Å; K155-N159 PolarHBondContact O-N 2.69Å; E156-N159 PolarHBondContact O-N 2.87Å; N159-Q162 PolarHBondContact O-N 3.13Å; N159-K163 WeakPolarHBondContact O-CB 2.97Å; N159-K163 WeakPolarHBondContact O-CG 3.5Å; N159-K163 PolarHBondContact O-N 3.45Å; N159-K163 WeakPolarHBondContact OD1-CD 3.28Å; N159-K163 WeakPolarHBondContact OD1-CE 3.48Å; N159-K163 PolarHBondContact OD1-NZ 2.86Å
160A79.1Confident74.3Confident57 Ų57113 Ų11347%0.47159%0.593SS.*Hα-helixtrans-63.1-42.9171.700000112E156 L157 K163 G164E156-A160 WeakPolarHBondContact O-CB 3.28Å; E156-A160 PolarHBondContact O-N 3.3Å; L157-A160 PolarHBondContact O-N 2.87Å; A160-K163 PolarHBondContact O-N 3.32Å; A160-G164 PolarHBondContact O-N 3.4Å
161H75.8Confident72.1Confident125 Ų125116.2 Ų116.258%0.57961%0.609SS**Hα-helixtrans-64.5-43.2174.6-79.476.5000112.2L157 E158 K163 G164 L165L157-H161 PolarHBondContact O-N 3.09Å; L157-H161 PolarHBondContact O-ND1 2.97Å; E158-H161 PolarHBondContact O-N 2.9Å; H161-K163 PolarHBondContact O-N 2.88Å; H161-G164 PolarHBondContact O-N 3.08Å; H161-L165 WeakPolarHBondContact O-CB 3.35Å; H161-L165 PolarHBondContact O-N 3.44Å
162Q71Confident69.5Low104 Ų104117.3 Ų117.349%0.48661%0.613SS.*Hα-helixtrans-62.3-41.4176.6-74169.411.500111.8E158 N159 L165 M166E158-Q162 WeakPolarHBondContact O-CG 3.44Å; E158-Q162 PolarHBondContact O-N 3.43Å; E158-Q162 PolarHBondContact OE1-NE2 3.03Å; N159-Q162 PolarHBondContact O-N 3.13Å; Q162-L165 PolarHBondContact O-N 3.02Å; Q162-M166 VanDerWaalsContact O-CG 3.29Å; Q162-M166 WeakPolarHBondContact O-CG 3.36Å; Q162-M166 PolarHBondContact O-N 3.21Å
163K65.1Low66.7Low145 Ų145118.3 Ų118.363%0.6363%0.629SS**Hα-helixtrans-65.3-40173.7-76.5168.2173.6158.50112.6N159 A160 H161 M166 G167N159-K163 WeakPolarHBondContact O-CB 2.97Å; N159-K163 WeakPolarHBondContact O-CG 3.5Å; N159-K163 PolarHBondContact O-N 3.45Å; N159-K163 WeakPolarHBondContact OD1-CD 3.28Å; N159-K163 WeakPolarHBondContact OD1-CE 3.48Å; N159-K163 PolarHBondContact OD1-NZ 2.86Å; A160-K163 PolarHBondContact O-N 3.32Å; H161-K163 PolarHBondContact O-N 2.88Å; K163-M166 PolarHBondContact O-N 3.24Å; K163-G167 PolarHBondContact O-N 2.92Å
164G59.8Low64.1Low44 Ų44122.6 Ų122.645%0.45464%0.642SS.*Hα-helixtrans-63.1-40.8172.900000112.7A160 H161 G167A160-G164 PolarHBondContact O-N 3.4Å; H161-G164 PolarHBondContact O-N 3.08Å; G164-G167 PolarHBondContact O-N 3.07Å; G164-G167 VanDerWaalsContact O-N 3.15Å
165L55.9Low61.3Low148 Ų148124.9 Ų124.978%0.77565%0.652SS**Hα-helixtrans-68.4-35.1179.3-147.477.6000112.7H161 Q162 G167H161-L165 WeakPolarHBondContact O-CB 3.35Å; H161-L165 PolarHBondContact O-N 3.44Å; Q162-L165 PolarHBondContact O-N 3.02Å; L165-G167 PolarHBondContact O-N 3.35Å
166M53.4Low58.5Low161 Ų161122.9 Ų122.979%0.79366%0.655SS**Hα-helixtrans-71.8-16.2173.2-70.5-71.8-65.100113.3Q162 K163Q162-M166 VanDerWaalsContact O-CG 3.29Å; Q162-M166 WeakPolarHBondContact O-CG 3.36Å; Q162-M166 PolarHBondContact O-N 3.21Å; K163-M166 PolarHBondContact O-N 3.24Å
167G50.3Low55.7Low58 Ų58124.6 Ų124.660%0.59867%0.668SS**THydrogen-bonded Turntrans-91.17.6179.300000115.1K163 G164 L165K163-G167 PolarHBondContact O-N 2.92Å; G164-G167 PolarHBondContact O-N 3.07Å; G164-G167 VanDerWaalsContact O-N 3.15Å; L165-G167 PolarHBondContact O-N 3.35Å
168M54.9Low53.8Low161 Ų161124.4 Ų124.479%0.79367%0.673SS**  trans-117.261.1179-66.3-159.773.900111.9
169E41.1Very low51.7Low173 Ų173127.6 Ų127.681%0.80869%0.69SS**  trans-76.8127.9167.556.4-158.2142.300111.2P171E169-P171 WeakPolarHBondContact O-CD 3.17Å
170N40.7Very low49.3Very low148 Ų148132.7 Ų132.779%0.79172%0.717SS**  trans-62.5123.8-165.2-80.3-17.8000114.1M172N170-M172 VanDerWaalsContact C-N 3.26Å; N170-M172 PolarHBondContact O-N 3.06Å
171P48.4Very low47.6Very low125 Ų125139.7 Ų139.781%0.81274%0.737SS**SBendtrans-80.970.5167.634.9-34.9000111E169E169-P171 WeakPolarHBondContact O-CD 3.17Å
172M39.3Very low45.5Very low133 Ų133146 Ų14666%0.65576%0.756SS**  trans-169.8114.6139.9-127.158.3-177.400112N170 Y174N170-M172 VanDerWaalsContact C-N 3.26Å; N170-M172 PolarHBondContact O-N 3.06Å; M172-Y174 HydrophobicContact CE-CD2 4.38Å; M172-Y174 HydrophobicContact CE-CE2 3.52Å; M172-Y174 HydrophobicContact CG-CD2 4.03Å; M172-Y174 HydrophobicContact CG-CE2 4.09Å
173S35Very low43.5Very low123 Ų123144.3 Ų144.386%0.8677%0.767SS**  trans-122100165.9-74.20000108.7
174Y39Very low42Very low202 Ų202147.7 Ų147.779%0.79278%0.775SS**PPolyproline II helixtrans-92.2136171-93.9-70000111.3M172M172-Y174 HydrophobicContact CE-CD2 4.38Å; M172-Y174 HydrophobicContact CE-CE2 3.52Å; M172-Y174 HydrophobicContact CG-CD2 4.03Å; M172-Y174 HydrophobicContact CG-CE2 4.09Å
175H34.8Very low41.1Very low183 Ų183153.2 Ų153.285%0.84779%0.789SS**PPolyproline II helixtrans-74.4143-170.3-157.689.2000112.2
176S33.7Very low40Very low95 Ų95157.6 Ų157.666%0.66480%0.796SS**PPolyproline II helixtrans-78.6144.7-178.5-45.80000112.7
177N33Very low39.5Very low154 Ų154156.9 Ų156.982%0.82479%0.792SS**  -171.9160.4130-99.8-51.7000111.9
178P47.8Very low39.2Very low104 Ų104159.4 Ų159.468%0.67580%0.798SS**  trans-103.2171-162.439.6-37.4000116
179M42Very low38.4Very low170 Ų170158.1 Ų158.184%0.83779%0.794SS**  trans68.6106.8160.1-68.6-93.7-80.700118.8
180L35.4Very low37.9Very low174 Ų174152.5 Ų152.591%0.91178%0.783SS**  -172.7156.7113.8-101.7166.5000113.3
181F43Very low37.8Very low204 Ų204154.1 Ų154.190%0.89579%0.785SS**  trans-101.7123.6-176.2-114.6-95000112.3
182R32Very low37Very low256 Ų256154 Ų15497%0.96678%0.778SS**  trans164.9150.2152-96.1168.3-173.2-142.24.1108.8
183G29.1Very low36.9Very low70 Ų70154.1 Ų154.172%0.72279%0.786SS**  cis151.6133.8-6.300000112.3
184R33.1Very low37Very low215 Ų215156.9 Ų156.981%0.81178%0.783SS**  trans63.6101.1176.3-75.1-172.9165.8-79.93.6119
185Q41Very low36.8Very low160 Ų160154.1 Ų154.175%0.74879%0.786SS**  33.5116.6100.9-176.2-168.752.300118.4
186R32.1Very low36.6Very low241 Ų241153.6 Ų153.691%0.90978%0.784SS**  trans-157116.2144.1-111.9-177.9-173.5163.91.9111.6
187M43Very low37.3Very low146 Ų146160 Ų16072%0.71979%0.794SS**  trans-87151143.3-64-61.8-6700106.2
188P45.8Very low37.5Very low110 Ų110158.4 Ų158.471%0.71479%0.791SS**  -135.1-179.365.934.7-16.9000114.1
189D36.5Very low36.9Very low134 Ų134158.3 Ų158.372%0.71779%0.793SS**  cis-175.4169.2-34.4-83.3-28.7000105.5
190G31Very low36.9Very low55 Ų55157.8 Ų157.857%0.56779%0.793SS**  cis170.9179.60.300000110
191H38Very low36.9Very low182 Ų182155.2 Ų155.284%0.84378%0.78SS**  trans65.3128.6179.3-54.4-65.1000117.1
192D33.3Very low36.4Very low123 Ų123154.9 Ų154.966%0.65878%0.782SS**  cis-160.9-177.7-12.5-134-59.3000111.8
193V36.3Very low36.8Very low135 Ų135148 Ų14882%0.81876%0.763SS**  trans83.8119.1175.3-168.90000116.7
194F37.2Very low37.6Very low182 Ų182152.6 Ų152.680%0.79877%0.766SS**  trans-78.1147.3178-80.1-125.1000112.9
195V34Very low37.9Very low144 Ų144147.1 Ų147.187%0.87376%0.76SS**  -157.3136.394.6173.70000108.5
196H32.3Very low37.9Very low172 Ų172145.9 Ų145.980%0.79676%0.759SS**PPolyproline II helixtrans-91.3134.1-173.9-124.7-83.3000113.7
197R46.8Very low37.9Very low230 Ų230140.6 Ų140.687%0.86876%0.758SS**PPolyproline II helixtrans-70.9144.7153.6-92.2-175.4176.3167.1-3.4109.6
198P38.3Very low38.1Very low119 Ų119139.5 Ų139.577%0.77376%0.755SS**PPolyproline II helixtrans-101.7131.8148.633.8-25.8000111
199S34.2Very low38.1Very low102 Ų102141.1 Ų141.171%0.71376%0.756SS**PPolyproline II helixtrans-77147149.156.90000107.4
200L43.3Very low37.9Very low159 Ų159142.3 Ų142.383%0.83276%0.76SS**SBend3394.786.5-163151.8000109.6
201D35.2Very low38.2Very low120 Ų120145.2 Ų145.264%0.64277%0.771SS**  -159.9125.352.9-178.534000111.2
202E31.6Very low38.3Very low198 Ų198141.6 Ų141.693%0.92577%0.772SS**  trans-143.4118.5158.5-171159.7-152.100109
203L40.6Very low38.2Very low110 Ų110140.5 Ų140.558%0.57678%0.775SS**  trans-85.6162-167.1-71.8113.7000113.7
204H45.2Very low38.4Very low168 Ų168139.7 Ų139.778%0.77877%0.772SS**  trans61.180.1155.8-53136.6000117.5
205S40.6Very low38.5Very low100 Ų100141.5 Ų141.570%0.69978%0.775SS**  177.8162.8109.2490000112.8
206N40.3Very low38.9Very low134 Ų134139.6 Ų139.672%0.71777%0.765SS**  trans61.565.2162.3-49.7-49.1000117.3I208N206-I208 PolarHBondContact O-N 3.13Å
207S32.7Very low39.4Very low129 Ų129137.4 Ų137.490%0.90277%0.766SS**  trans-86.397.3149.9-168.90000108.8
208I46.2Very low39.2Very low124 Ų124134.5 Ų134.564%0.63677%0.766SS**  trans-133.4137.2173.6-45.9179.4000107N206N206-I208 PolarHBondContact O-N 3.13Å
209L45.6Very low39.1Very low143 Ų143134.3 Ų134.375%0.74977%0.768SS**  trans70.1130.7-175.5-40180000112.2
210M34Very low39.3Very low160 Ų160134.8 Ų134.879%0.78877%0.772SS**  cis-139.7125.622.8-70.9-103.266.100112.8
211S37.3Very low38.8Very low116 Ų116135.8 Ų135.881%0.81178%0.777SS**  trans-146.3122.9140.156.10000108.1
212A38.9Very low39Very low105 Ų105138.7 Ų138.787%0.86879%0.786SS**  trans-88.8112.3-176.200000109.6
213S31.1Very low39.1Very low101 Ų101139.2 Ų139.271%0.70678%0.78SS**  trans-136.8125170.6-167.10000109.4Y215S213-Y215 PolarHBondContact O-N 2.71Å; S213-Y215 VanDerWaalsContact O-N 3.09Å
214P40.8Very low38.8Very low117 Ų117141.3 Ų141.376%0.7679%0.786SS**SBendtrans-84.780.5-175.333.6-34.1000111.2
215Y38.6Very low38.2Very low221 Ų221142.3 Ų142.387%0.86778%0.783SS**SBendtrans176.8153.6148.8-90-56.7000109.5S213S213-Y215 PolarHBondContact O-N 2.71Å; S213-Y215 VanDerWaalsContact O-N 3.09Å
216P44.3Very low37.8Very low103 Ų103141.5 Ų141.567%0.66979%0.79SS**  trans-82.2141.8-166.731.8-35.4000114.1I218P216-I218 PolarHBondContact O-N 3.2Å
217P41.2Very low37.7Very low126 Ų126142.8 Ų142.882%0.81879%0.785SS**  trans-76.9121.3173.130.8-33.2000111.4S219P217-S219 PolarHBondContact O-N 2.86Å
218I43Very low37.9Very low169 Ų169147 Ų14787%0.86778%0.782SS**  trans-84.398.4177-57.4175.3000109.5P216P216-I218 PolarHBondContact O-N 3.2Å
219S37.3Very low37.1Very low116 Ų116145.6 Ų145.681%0.81179%0.788SS**  trans-153.273.3170.7-162.80000112.9P217P217-S219 PolarHBondContact O-N 2.86Å
220S37.7Very low36.8Very low112 Ų112142.5 Ų142.578%0.78379%0.79SS**  trans-160.342.7175.654.60000115.6
221L33.6Very low37Very low179 Ų179146.6 Ų146.694%0.93780%0.797SS**  trans-117.868.3164.7-76.2-178.4000112.6
222H38.8Very low36.9Very low182 Ų182152.6 Ų152.684%0.84380%0.802SS**  trans-97.888.8161.7173.2-85.6000110.4
223R34.2Very low36.8Very low209 Ų209153.7 Ų153.779%0.78980%0.8SS**  trans177.1148.8155.7-106.9175.1158.6129.1-1.3109.3
224E32.6Very low36.8Very low154 Ų154153.3 Ų153.372%0.7280%0.803SS**  cis-144165.6-3.2-163.7160.7108.200112.3G226E224-G226 PolarHBondContact O-N 2.94Å; E224-G226 VanDerWaalsContact O-N 3.14Å
225R34.3Very low36.4Very low189 Ų189153.4 Ų153.471%0.71380%0.801SS**  trans-77.185-172.2-174.7-165.8-165165.49.1113.8R227R225-R227 PolarHBondContact O-N 2.99Å; R225-R227 VanDerWaalsContact O-N 3.09Å
226G32.3Very low36Very low82 Ų82151.1 Ų151.185%0.84580%0.798SS**  trans-65.3100.9168.400000113.2E224E224-G226 PolarHBondContact O-N 2.94Å; E224-G226 VanDerWaalsContact O-N 3.14Å
227R37.5Very low35.6Very low161 Ų161155.5 Ų155.561%0.60881%0.807SS**  trans-77.1159.9165.1-58-174.9-172.2-110.618.2108.8R225R225-R227 PolarHBondContact O-N 2.99Å; R225-R227 VanDerWaalsContact O-N 3.09Å
228R36Very low34.9Very low219 Ų219153.7 Ų153.783%0.82680%0.797SS**  cis-162.6167.223.7-145.9164.1-161.4161.80.7111.2
229A31Very low34.3Very low94 Ų94151.7 Ų151.778%0.77779%0.793SS**  trans-53.6147.9168.700000113.7
230G38.8Very low33.9Very low77 Ų77153.3 Ų153.379%0.79479%0.788SS**  trans-75.6158.2-179.400000115
231R37.2Very low33.3Very low247 Ų247153.1 Ų153.193%0.93278%0.778SS**  trans-140.5147.3162.8-76.1-170.6173.8-108.4-2.1109.5
232R36.3Very low33.1Very low242 Ų242152.5 Ų152.591%0.91377%0.77SS**  trans-77.5141.9175.5-55.7173.6-178.4131.2-2.8110.6
233P37.1Very low32.6Very low128 Ų128147.8 Ų147.883%0.83176%0.763SS**  trans-68.2163.3150.4-16.932.7000111.2
234A30.9Very low32.4Very low92 Ų92142.7 Ų142.776%0.7677%0.765SS**  trans-108136.6-16700000114.9
235V32Very low32.1Very low120 Ų120142 Ų14273%0.72777%0.766SS**  trans21.1144.2142.8-146.30000121.2
236H29.6Very low32Very low172 Ų172139.9 Ų139.980%0.79677%0.768SS**  trans82.399.1162.2-65-65.4000119.7
237K36.1Very low31.9Very low196 Ų196145.7 Ų145.785%0.85277%0.77SS**  -166.5113.8105.3-94.3174.3-177.6-177.10106.8
238S26.3Very low31.5Very low88 Ų88141 Ų14162%0.61577%0.772SS**  73.9124.273.973.90000113.7
239T30.9Very low31.2Very low126 Ų126139.1 Ų139.177%0.77377%0.773SS**  trans60.7148.9163.2440000117.9
240E27.8Very low31.1Very low151 Ų151141 Ų14171%0.70677%0.774SS**  cis-169.7153.1-14.6171.8174.4145.800111.5
241N26.6Very low30.7Very low107 Ų107144.8 Ų144.857%0.57277%0.772SS**  trans51.3135.1158.6-82.3-48.4000124.1
242Q29.2Very low30.3Very low167 Ų167140.5 Ų140.578%0.7877%0.767SS**  trans65.1154.5133.2-67.3173.252.200120.6
243A27.8Very low30.5Very low83 Ų83137.3 Ų137.369%0.68676%0.76SS**  cis-168.5171.2-21.700000110
244A29Very low29.9Very low101 Ų101136.5 Ų136.584%0.83576%0.758SS**  trans66.2168.5162.200000117.6
245N26.5Very low30Very low139 Ų139138 Ų13874%0.74376%0.757SS**  cis-170.7169.3-38.8-170.82.3000107.7
246L33.8Very low29.9Very low145 Ų145139.8 Ų139.876%0.75976%0.758SS**  trans72.4148.4169.9-47.9174.1000116.1
247K30.4Very low29.9Very low204 Ų204139.1 Ų139.189%0.88776%0.755SS**  cis117.5116.70.7-174.1-177.7175.4-175.90114.5
248G27.2Very low29.5Very low63 Ų63134.8 Ų134.865%0.64975%0.749SS**  trans153.8131.8175.100000108.8
249Q30.6Very low30.5Very low180 Ų180135.5 Ų135.584%0.84175%0.752SS**  62.1144.868.8-74.9-173.8-50.200113.7
250T29.1Very low30.2Very low132 Ų132138 Ų13881%0.8176%0.755SS**  cis-152-176.641.1-40.50000113.7
251E29.9Very low30.4Very low157 Ų157134.8 Ų134.873%0.73475%0.753SS**  trans-90.1173.4-180-57.5161.885.700114.6
252D28.7Very low30.6Very low158 Ų158135.7 Ų135.785%0.84576%0.763SS**  -173.8-175.9116.2-134.4-48.2000115
253K39.8Very low30.5Very low174 Ų174133.3 Ų133.376%0.75777%0.765SS**  trans-136.8164-165.7-59.5167.4177.8166.60116.2
254S25.6Very low30.6Very low112 Ų112132.3 Ų132.378%0.78376%0.763SS**  trans-178.7144.6143.1-82.70000110.7
255V32.8Very low30.7Very low124 Ų124136.2 Ų136.275%0.75276%0.764SS**  cis83127.243.2171.80000111.7
256E29Very low31.1Very low157 Ų157136 Ų13673%0.73476%0.758SS**  cis-142.1-155.52.9-133.6169.990.100109.7
257Q30.6Very low31.2Very low158 Ų158136.3 Ų136.374%0.73875%0.754SS**  cis-159.8-159.78.2-148.6158.555.900112.2
258S28.2Very low31.4Very low105 Ų105133.5 Ų133.573%0.73474%0.744SS**  trans-152.4165.7168.7-56.10000109.1
259P46.5Very low31.7Very low103 Ų103136.3 Ų136.367%0.66974%0.743SS**  -160.7-171.37144.7-21.9000118.2
260E25.3Very low31.7Very low179 Ų179136.2 Ų136.284%0.83674%0.742SS**  trans56.3168.4154.2-73.7168.598.500121.6
261A31.1Very low31.9Very low82 Ų82134 Ų13468%0.67874%0.738SS**  cis-173-177.9-4000000108
262T30.3Very low32.3Very low126 Ų126135.9 Ų135.977%0.77374%0.744SS**  cis-155.8169.88.359.90000110.5
263S27.7Very low32.3Very low118 Ų118132.1 Ų132.183%0.82574%0.742SS**  trans56.9155.6151.8-1170000122.7
264G29.9Very low31.9Very low62 Ų62131.3 Ų131.364%0.63975%0.746SS**  cis164.8163.7-8.100000114.3
265E31.7Very low32.4Very low182 Ų182130.5 Ų130.585%0.8575%0.746SS**  trans68.4150.3158.2-71.2173.2130.800119.8
266E33.9Very low32.2Very low134 Ų134127.8 Ų127.863%0.62674%0.743SS**  cis-164.6164.6-955.7172.2142.100114.7
267K37.3Very low32.3Very low153 Ų153129.7 Ų129.767%0.66575%0.752SS**  trans64.5126.7153-74.3-162.3-174.4860122.1
268E34.6Very low32.5Very low145 Ų145129.6 Ų129.668%0.67875%0.751SS**  82.4144.871.4-80.8-170.9119.800113.9
269L33Very low32.5Very low122 Ų122129.7 Ų129.764%0.63975%0.751SS**  cis-159.9155.117.2-118.7155.2000111.1
270E30.9Very low31.6Very low177 Ų177127.2 Ų127.283%0.82774%0.743SS**  trans34.8160.3146.2-85.3-178.5167.300123.4
271A34Very low31.8Very low86 Ų86125.4 Ų125.471%0.71175%0.745SS**  cis-173.1171.65.100000109.1
272K37.3Very low31.7Very low197 Ų197126.4 Ų126.486%0.85775%0.747SS**  cis177.1115.7-20.8171.5-158169.9-171.50111.1
273G29.2Very low31.9Very low78 Ų78128.7 Ų128.780%0.80475%0.746SS**  trans74.7176.715900000118.4
274D31Very low32Very low158 Ų158128.5 Ų128.585%0.84574%0.74SS**  cis-167.4154.4-17.4-175.132.1000111.2
275A35.3Very low32Very low95 Ų95132.4 Ų132.479%0.78574%0.741SS**  trans54.5157.9167.900000119.9
276G30.2Very low31.9Very low66 Ų66130.4 Ų130.468%0.6873%0.732SS**  cis162.6156.6-8.400000112.4
277E30.6Very low31.7Very low198 Ų198131 Ų13193%0.92574%0.735SS**  trans63.2160.8162.3-80-178.7148.200118.9
278E33.6Very low31.3Very low156 Ų156129.9 Ų129.973%0.72974%0.741SS**  cis-162.2166-20.9-164.2-104.9136.100109.6
279C29.1Very low31.3Very low107 Ų107131.3 Ų131.372%0.72375%0.745SS**  trans53.7163.9168.3-111.20000120.7
280G27.4Very low31.2Very low50 Ų50131.7 Ų131.752%0.51575%0.752SS.*  cis165.3166.4-8.200000114.3
281T29.1Very low31.3Very low142 Ų142129.8 Ų129.887%0.87175%0.748SS**  trans69.8160.4172.383.20000116.9
282S29.4Very low31Very low103 Ų103131.4 Ų131.472%0.7275%0.754SS**  cis-173.7-177.6-32.464.70000108.7
283K34.2Very low30.9Very low174 Ų174130.3 Ų130.376%0.75775%0.752SS**  cis-171.3143.81.7-143.3-176.8-177.9178.90112
284T31Very low31.2Very low113 Ų113133.6 Ų133.669%0.69375%0.75SS**  trans60.6153.3144.737.60000122.4
285H29.3Very low31.1Very low144 Ų144129.7 Ų129.767%0.66774%0.74SS**  cis-166.4155.8-1.8-145.9-154.4000115.6
286H29.8Very low30.8Very low140 Ų140131.7 Ų131.765%0.64874%0.743SS**  trans62.9165.6145.9-87.14.9000125.4
287Q28.9Very low30.7Very low148 Ų148132.5 Ų132.569%0.69275%0.751SS**  -177.4167.9-51.8-167.6160.430.500112.5
288T28.6Very low30.6Very low129 Ų129129.2 Ų129.279%0.79175%0.75SS**  trans91.3134.7164.470.20000117
289K35.4Very low30.4Very low175 Ų175132.3 Ų132.376%0.76176%0.755SS**  cis111.2146.20.7-157.5-174.9179.6-162.30116.5
290T31.1Very low30.6Very low129 Ų129136.3 Ų136.379%0.79176%0.76SS**  trans101.6129.5170.966.80000115.6
291D32.2Very low30.4Very low138 Ų138138.8 Ų138.874%0.73877%0.769SS**  cis95.5127.24.9-156.12.9000117.2
292S27.7Very low30.3Very low120 Ų120143 Ų14384%0.83977%0.771SS**  trans179.1156167.7-810000115
293E35.1Very low30.5Very low174 Ų174147.4 Ų147.481%0.81378%0.777SS**  trans-99.2-150.8-178.2-55.3-175.878.500113.8
294L35.3Very low30.2Very low146 Ų146147.9 Ų147.976%0.76478%0.782SS**  cis-168.5-179.114-135.7166.8000111.7
295A30.8Very low30Very low76 Ų76145.8 Ų145.863%0.62878%0.783SS**  trans105.199.1144.300000123.3
296T28.6Very low30Very low138 Ų138148 Ų14885%0.84779%0.793SS**  48104.4127.4610000124.9
297G26.9Very low29.9Very low83 Ų83146.3 Ų146.386%0.85680%0.803SS**  65.5133.5110.100000124.8
298S29Very low29.8Very low129 Ų129142 Ų14290%0.90280%0.799SS**  trans-165.5-169.5149.4-160.30000113.3
299R30.7Very low30Very low221 Ų221143.5 Ų143.583%0.83480%0.801SS**  trans-121.8162.8-163.8-64.1174.7169162.9-5.7116.2
300K32.4Very low29.8Very low191 Ų191145.3 Ų145.383%0.8380%0.803SS**  trans80.1119.3141.6-90.4-177176.3-170.90121.5
301S23.8Very low29.9Very low101 Ų101148.6 Ų148.671%0.70681%0.806SS**  74.1122.3117.6-163.70000121.3
302Y26.1Very low29.5Very low231 Ų231148.4 Ų148.491%0.90681%0.81SS**  trans-133.3138.3144.9-121.2-92.9000108.9
303K34Very low29.4Very low196 Ų196148.5 Ų148.585%0.85281%0.81SS**  trans-162.1111.1178.7-173.3-156.5177.7-162.70111.2
304E27.1Very low29Very low184 Ų184144.9 Ų144.986%0.8681%0.81SS**  trans-164.8143.9174.2-170163.7-145.200107.6
305G27.1Very low28.6Very low69 Ų69142.7 Ų142.771%0.71181%0.812SS**  cis-155.6118.3-7.500000111.2
306E29.2Very low28.5Very low191 Ų191143.5 Ų143.589%0.89382%0.819SS**  trans-1.2122143.5-175172.3-177.100121.3
307A28.9Very low28.6Very low103 Ų103145.4 Ų145.485%0.85182%0.818SS**  trans-167.8142.4133.700000109.3
308G27Very low28.8Very low58 Ų58148.2 Ų148.260%0.59881%0.814SS**  cis131.5130.4-300000111.9
309L32.4Very low28.9Very low160 Ų160145.3 Ų145.384%0.83880%0.804SS**  trans70.5146.7176.2-63105000116
310R30.8Very low28.7Very low213 Ų213141.1 Ų141.180%0.80481%0.807SS**  cis-168.9149.7-7.449.9-168.6-174-138.44.3112.9
311K32.7Very low28.7Very low198 Ų198137.1 Ų137.186%0.86180%0.804SS**  trans21.3145139.4-61.8179170.6178.70120
312T24.2Very low28.8Very low134 Ų134139.8 Ų139.882%0.82281%0.81SS**  cis-153.3167.426.8-44.40000112.3
313C26.1Very low29Very low122 Ų122136.5 Ų136.582%0.82481%0.805SS**  trans-75.6161.7-178.7-310000116.2
314A26.6Very low28.8Very low99 Ų99132.7 Ų132.782%0.81880%0.798SS**  -170.9142.8119.500000115
315A27.4Very low29.2Very low99 Ų99132 Ų13282%0.81880%0.801SS**  trans65.6102149.400000123.5
316A28Very low29.2Very low94 Ų94132.7 Ų132.778%0.77781%0.808SS**  94.1138.1118.300000122.6
317Q31Very low29.3Very low177 Ų177128.6 Ų128.683%0.82781%0.806SS**  trans66.4141165.4-65.1-163.2-57.900117.8
318D31Very low29.4Very low142 Ų142129.5 Ų129.576%0.75981%0.806SS**  cis-156.3172.1-14.7-133.2-49.4000110.3
319G29.9Very low29.6Very low68 Ų68133.7 Ų133.770%0.70182%0.815SS**  trans94.8113.2162.400000118.2
320C27.6Very low29.6Very low133 Ų133132.1 Ų132.190%0.89981%0.807SS**  trans-92170.3161.5-126.30000109.5
321S32.3Very low29.9Very low108 Ų108130.6 Ų130.676%0.75581%0.806SS**  cis-161.61478.350.30000110.7
322D25.2Very low29.7Very low156 Ų156130.6 Ų130.683%0.83481%0.81SS**  trans-146.7151.5152.3-163.54.2000109.5
323M29.6Very low30.8Very low163 Ų163131.2 Ų131.280%0.80381%0.807SS**  trans-137.6107.2-169.4-110.6-9180.600111.6
324T31.3Very low31.7Very low115 Ų115131.6 Ų131.671%0.70681%0.807SS**  trans-92.2165.5171.747.40000112.5
325N34.9Very low31.9Very low171 Ų171130.3 Ų130.391%0.91480%0.803SS**  trans-53.6145.2-169.1-56.4-60.7000115.5
326G27.3Very low32.3Very low83 Ų83135.1 Ų135.186%0.85681%0.809SS**  trans-144.5144.6166.200000111.2
327A30.2Very low32.2Very low104 Ų104136.9 Ų136.986%0.8681%0.814SS**  trans-127.6156.8-172.600000112.7
328S32.3Very low32.2Very low123 Ų123134.3 Ų134.386%0.8682%0.816SS**  trans-162.5176158.155.20000111.4
329N31.1Very low32.3Very low145 Ų145131.6 Ų131.678%0.77581%0.813SS**  trans-111.4170.5-150.4-902.8000116.8
330D32.9Very low32.2Very low127 Ų127136.8 Ų136.868%0.67982%0.817SS**  trans77.697.4146.6-76-51.7000121.7
331K36.3Very low32.4Very low181 Ų181139 Ų13979%0.78781%0.814SS**  trans16.2126.5130.7-62.5168.2179.2168.30119.2
332E29.2Very low32.3Very low198 Ų198140.5 Ų140.593%0.92581%0.809SS**  -145.8159.2106.9-123.8177.3-174.800111.4
333I47.5Very low32.5Very low148 Ų148140.1 Ų140.176%0.75980%0.8SS**  trans-146.7131.1-163-81.2178.4000107.1
334P44.2Very low32.6Very low130 Ų130142.3 Ų142.384%0.84481%0.805SS**  -149149.483.337.5-18.5000117.7
335G30.1Very low32.8Very low71 Ų71144.9 Ų144.973%0.73281%0.813SS**  trans-175.773.9176.100000116.7
336Q36.3Very low32.7Very low200 Ų200146.3 Ų146.394%0.93581%0.807SS**  trans72151.9165.5-54.8-176.73.900118.5
337C26.1Very low33.2Very low132 Ų132148.1 Ų148.189%0.89280%0.803SS**  trans-120.8147.3-173.6-54.70000111.1
338S31.9Very low33.3Very low122 Ų122147.6 Ų147.685%0.85379%0.794SS**  -169.4150.3110.6-163.10000110.7
339A31.7Very low33.5Very low85 Ų85148.7 Ų148.770%0.70280%0.795SS**  trans-102.6147.3169.500000109.9
340F28.3Very low33.6Very low178 Ų178145.7 Ų145.778%0.78180%0.798SS**  trans-161.7144.8131.7-128.9-104.8000109.9
341Q31.6Very low33.5Very low179 Ų179143.5 Ų143.584%0.83681%0.806SS**  trans-81.9-166.4161-68.5-172.7-4.600109.3
342E29.9Very low33.3Very low139 Ų139140 Ų14065%0.6581%0.81SS**  trans64.4105.2150.9-171.1-159.5-12000116.9
343K30.9Very low33.5Very low149 Ų149138.4 Ų138.465%0.64881%0.807SS**  -167.7139.7120.1-110.7108.5-114.4141.20110.7
344F31.5Very low33Very low209 Ų209138.3 Ų138.392%0.91781%0.814SS**  trans-72.4148.4165.6-78.4-112.2000109.8
345I33.8Very low32.3Very low168 Ų168135.7 Ų135.786%0.86281%0.811SS**  trans-110.4126.3166.7-64.6179.1000108.8
346Y33.8Very low32.6Very low202 Ų202140.6 Ų140.679%0.79282%0.816SS**  trans-126.9135.1179-161.5-78.5000108.2
347P37.9Very low33Very low120 Ų120136.6 Ų136.678%0.77981%0.808SS**  trans-117.3117.916833.8-22.2000111.7
348S32.4Very low33.4Very low94 Ų94139.3 Ų139.366%0.65780%0.801SS**  trans-157.4112.7163.1-171.60000113.6
349T37Very low33.6Very low146 Ų146140 Ų14090%0.89680%0.8SS**  trans172.5125.6154.819.50000103.2
350G32.7Very low34Very low81 Ų81144.3 Ų144.384%0.83580%0.803SS**  cis103.4122.23300000107.9
351G31.4Very low34.6Very low81 Ų81141.4 Ų141.484%0.83580%0.802SS**  cis170.5156.7-4.500000109.8
352A30.5Very low34.8Very low107 Ų107139 Ų13988%0.88480%0.799SS**  trans-151.2152.3176.400000113
353L34.4Very low35.6Very low165 Ų165138.6 Ų138.686%0.86481%0.808SS**  trans-83.8151.1-169.1-53.5167.3000113
354T35.7Very low35.6Very low147 Ų147134.7 Ų134.790%0.90281%0.811SS**  179.7144.7113.4360000112.9
355G30.3Very low36.1Very low75 Ų75133.2 Ų133.277%0.77381%0.812SS**  trans78.293.2141.100000120.1
356M37.5Very low36Very low173 Ų173128.6 Ų128.685%0.85281%0.807SS**  trans-90.8150.3148.3-71.7-67.3-71.300109.2
357P43.2Very low36.5Very low117 Ų117129 Ų12976%0.7681%0.813SS**  -143.2128.9105.435.5-21000115.8
358Y35.2Very low36.5Very low188 Ų188131 Ų13174%0.73782%0.816SS**  trans38.399.3131.6-154-87000120.1
359V35.6Very low36.8Very low137 Ų137132.5 Ų132.583%0.8382%0.824SS**  trans-147.1140.2147.1-121.70000111.3
360F40.1Very low36.9Very low175 Ų175132.2 Ų132.277%0.76882%0.822SS**  trans-90.5144.4170.6-103.3-95.1000110.7
361P41.3Very low37.1Very low117 Ų117130.9 Ų130.976%0.7681%0.808SS**  trans-114.2141.3146.9-1.122.2000112.2
362V36.8Very low37.6Very low129 Ų129133.1 Ų133.178%0.78281%0.808SS**  trans-76.2146.9167.7169.20000108.9G364V362-G364 PolarHBondContact O-N 2.85Å
363P46.3Very low38.3Very low130 Ų130133.5 Ų133.584%0.84480%0.801SS**  trans-60.8133.8-179.624.2-36000112.9
364G31.2Very low38.3Very low68 Ų68133 Ų13370%0.70180%0.799SS**  trans-144.5144.5170.200000110.1V362 G366V362-G364 PolarHBondContact O-N 2.85Å; G364-G366 PolarHBondContact O-N 2.91Å
365N41.5Very low38.9Very low177 Ų177133.3 Ų133.395%0.94780%0.795SS**  trans-62.1131.3-175.5-67.61.7000111.7
366G32.4Very low39.6Very low72 Ų72139.4 Ų139.474%0.74280%0.8SS**  trans-156121173.900000111.3G364G364-G366 PolarHBondContact O-N 2.91Å
367F44.1Very low40.1Very low209 Ų209139.7 Ų139.792%0.91780%0.804SS**  trans-75.9130.5178.1-77.3-110.2000111
368L37.3Very low39.9Very low163 Ų163142.3 Ų142.385%0.85381%0.812SS**  trans-142.5148.8155-77.1-177.5000109.6
369P39.3Very low39.8Very low126 Ų126136.2 Ų136.282%0.81881%0.806SS**PPolyproline II helixtrans-81.6138.7-172.532.1-35000112.9
370T37.7Very low40.2Very low140 Ų140138.7 Ų138.786%0.85981%0.809SS**PPolyproline II helixtrans-79.7131.2174.7-390000110.8
371G37Very low40.5Very low52 Ų52135.4 Ų135.454%0.53680%0.796SS.*PPolyproline II helixtrans-66.4165.5166.200000112.1P373G371-P373 WeakPolarHBondContact O-CD 3.22Å
372P42Very low40.9Very low129 Ų129135 Ų13584%0.83879%0.791SS**PPolyproline II helixtrans-71.7118.6-166.627.6-34.9000113.4
373P44.6Very low41.9Very low115 Ų115133.2 Ų133.275%0.74778%0.782SS**PPolyproline II helixtrans-75.8149.1156.634.1-32.4000109.6G371G371-P373 WeakPolarHBondContact O-CD 3.22Å
374N34.4Very low42.7Very low154 Ų154131.9 Ų131.982%0.82477%0.765SS**PPolyproline II helixtrans-65147.7-174.9-69.1-82.5000113.4F376N374-F376 PolarHBondContact O-N 3.49Å
375L49.7Very low45.2Very low154 Ų154132 Ų13281%0.80675%0.749SS**  trans-9.9109.5148.8-58168.5000114.9
376F44.5Very low47.5Very low202 Ų202123.7 Ų123.789%0.88671%0.705SS**SBendtrans-177.7135.4132.8-89.1-58.2000108.8N374N374-F376 PolarHBondContact O-N 3.49Å
377L47.8Very low50.3Low179 Ų179128 Ų12894%0.93770%0.698SS**  trans54.867.3174.8-56.5174.6000115.2
378N38.3Very low52.7Low172 Ų172125.6 Ų125.692%0.9269%0.688SS**  trans-98.4143.5152.1-171.123.9000109.2
379G34.8Very low55.5Low60 Ų60118.9 Ų118.962%0.61965%0.651SS**  trans143.283.1-170.100000110E381G379-E381 PolarHBondContact O-N 2.95Å
380E43.6Very low58.2Low189 Ų189116.5 Ų116.588%0.88363%0.634SS**  trans-72.961.8164.3-166.7-170.8163.900109.2V382E380-V382 PolarHBondContact O-N 3.42Å; E380-V382 VanDerWaalsContact O-N 3.13Å
381E46Very low61.1Low106 Ų106111.5 Ų111.550%0.49560%0.603SS.*  trans-75.4100171.6-163.6171.1-109.100106.2G379 R450G379-E381 PolarHBondContact O-N 2.95Å; E381-R450 IonicContact OE2-CZ 2.7Å; E381-R450 IonicContact OE2-NH1 2.86Å; E381-R450 PolarHBondContact OE2-NH1 3.16Å; E381-R450 IonicContact OE2-NH2 3.69Å; E381-R450 PolarHBondContact OE2-NH2 3.37Å
382V49.4Very low64Low110 Ų110112.3 Ų112.367%0.66760%0.595SS**  trans-40.5128.3165.5175.20000106.8E380 E384E380-V382 PolarHBondContact O-N 3.42Å; E380-V382 VanDerWaalsContact O-N 3.13Å; V382-E384 VanDerWaalsContact C-N 3.32Å; V382-E384 PolarHBondContact O-N 3.12Å
383P57.4Low66.6Low90 Ų90109 Ų10958%0.58457%0.571SS**  trans-60.899-173.823.6-33.6000109.1D385P383-D385 PolarHBondContact O-N 3.41Å
384E63.3Low69.1Low102 Ų102103.6 Ų103.648%0.47754%0.536SS..  trans-58125.8178.9-66-169146.900107.5V382 I386 W389V382-E384 VanDerWaalsContact C-N 3.32Å; V382-E384 PolarHBondContact O-N 3.12Å; E384-I386 PolarHBondContact O-N 2.73Å; E384-W389 PolarHBondContact OE2-NE1 2.82Å
385D83.8Confident72.1Confident71 Ų7199.4 Ų99.438%0.3851%0.509SS..  trans-59.2102.517917710.3000108.1P383 R387 K388P383-D385 PolarHBondContact O-N 3.41Å; D385-R387 PolarHBondContact O-N 3.37Å; D385-R387 WeakPolarHBondContact OD1-CB 3.49Å; D385-K388 HydrophobicContact CB-CD 4.06Å; D385-K388 HydrophobicContact CB-CG 4.36Å; D385-K388 WeakPolarHBondContact O-CB 3.41Å; D385-K388 PolarHBondContact O-N 3.29Å; D385-K388 WeakPolarHBondContact OD2-CE 3.49Å; D385-K388 IonicContact OD2-NZ 3.41Å; D385-K388 PolarHBondContact OD2-NZ 3.26Å
386I90.3Very high74.4Confident3 Ų395.9 Ų95.92%0.01549%0.491CS..G310 helixtrans-48.7-34.7-170.5-56.4-178.7000110.4E384 K388 W389 G418 L421 P422 V447 R450 M451E384-I386 PolarHBondContact O-N 2.73Å; I386-K388 PolarHBondContact O-N 3.48Å; I386-W389 HydrophobicContact CG2-CD2 4.25Å; I386-W389 HydrophobicContact CG2-CE3 3.78Å; I386-W389 HydrophobicContact CG2-CZ3 4.13Å; I386-W389 VanDerWaalsContact O-CB 3.28Å; I386-W389 WeakPolarHBondContact O-CB 3.41Å; I386-W389 PolarHBondContact O-N 3.4Å; I386-G418 CarbonylContact C-O 3.5Å; I386-G418 CarbonylContact O-C 3.54Å; I386-G418 WeakPolarHBondContact O-CA 3.3Å; I386-L421 HydrophobicContact CG2-CD2 4.17Å; I386-P422 HydrophobicContact CG2-CG 4.23Å; I386-V447 HydrophobicContact CD1-CG1 4.23Å; I386-R450 HydrophobicContact CD1-CB 3.48Å; I386-R450 VanDerWaalsContact CD1-CB 3.48Å; I386-R450 HydrophobicContact CG1-CB 3.98Å; I386-M451 HydrophobicContact CD1-CB 4.4Å; I386-M451 HydrophobicContact CD1-CE 3.92Å; I386-M451 HydrophobicContact CD1-SD 3.85Å
387R91.4Very high76.9Confident161 Ų16187.1 Ų87.161%0.60845%0.452SS*.G310 helixtrans-53.8-20.6178.3-60.5175.2177.6-162.8-3.4114.5D385 G418 E419D385-R387 PolarHBondContact O-N 3.37Å; D385-R387 WeakPolarHBondContact OD1-CB 3.49Å; R387-G418 WeakPolarHBondContact CA-O 2.95Å; R387-G418 PolarHBondContact N-O 3.47Å; R387-E419 HydrophobicContact CB-CG 4.38Å; R387-E419 WeakPolarHBondContact O-CG 3.49Å
388K93.4Very high79.3Confident160 Ų16078.6 Ų78.670%0.69641%0.408SS*.G310 helixtrans-94.4-8.3179.8-59.7174.7-173.3153.40113.6D385 I386D385-K388 HydrophobicContact CB-CD 4.06Å; D385-K388 HydrophobicContact CB-CG 4.36Å; D385-K388 WeakPolarHBondContact O-CB 3.41Å; D385-K388 PolarHBondContact O-N 3.29Å; D385-K388 WeakPolarHBondContact OD2-CE 3.49Å; D385-K388 IonicContact OD2-NZ 3.41Å; D385-K388 PolarHBondContact OD2-NZ 3.26Å; I386-K388 PolarHBondContact O-N 3.48Å
389W95.9Very high82.1Confident22 Ų2272.3 Ų72.38%0.08338%0.377CS..  trans-67132.2177.4-73-6.6000110.9E384 I386 D393 V394 F397 G418 L421 R450E384-W389 PolarHBondContact OE2-NE1 2.82Å; I386-W389 HydrophobicContact CG2-CD2 4.25Å; I386-W389 HydrophobicContact CG2-CE3 3.78Å; I386-W389 HydrophobicContact CG2-CZ3 4.13Å; I386-W389 VanDerWaalsContact O-CB 3.28Å; I386-W389 WeakPolarHBondContact O-CB 3.41Å; I386-W389 PolarHBondContact O-N 3.4Å; W389-D393 HydrophobicContact CB-CB 3.91Å; W389-D393 HydrophobicContact CG-CB 4.08Å; W389-V394 HydrophobicContact CB-CG2 4.28Å; W389-V394 HydrophobicContact CE3-CG2 4.44Å; W389-F397 HydrophobicContact CE3-CB 4.45Å; W389-F397 HydrophobicContact CH2-CB 4.21Å; W389-F397 HydrophobicContact CH2-CD1 4.46Å; W389-F397 AromaticContact CH2-CD2 3.62Å; W389-F397 HydrophobicContact CH2-CD2 3.62Å; W389-F397 HydrophobicContact CH2-CE2 4.02Å; W389-F397 AromaticContact CH2-CG 3.85Å; W389-F397 HydrophobicContact CH2-CG 3.85Å; W389-F397 HydrophobicContact CZ3-CB 3.84Å; W389-F397 AromaticContact CZ3-CD1 3.78Å; W389-F397 HydrophobicContact CZ3-CD1 3.78Å; W389-F397 AromaticContact CZ3-CD2 3.79Å; W389-F397 HydrophobicContact CZ3-CD2 3.79Å; W389-F397 HydrophobicContact CZ3-CE1 4.23Å; W389-F397 HydrophobicContact CZ3-CE2 4.23Å; W389-F397 AromaticContact CZ3-CG 3.53Å; W389-F397 HydrophobicContact CZ3-CG 3.53Å; W389-F397 HydrophobicContact CZ3-CZ 4.42Å; W389-G418 WeakPolarHBondContact O-CA 3.45Å; W389-G418 PolarHBondContact O-N 3.36Å; W389-L421 HydrophobicContact CE3-CD2 4.16Å; W389-L421 HydrophobicContact CZ3-CD2 4.12Å; W389-R450 HydrophobicContact CH2-CG 4.18Å
390T97.3Very high85Confident75 Ų7573.5 Ų73.546%0.4638%0.376SS..  trans-75167.8169.972.30000110.6N392 D393 V394T390-N392 PolarHBondContact O-N 3.29Å; T390-N392 VanDerWaalsContact O-N 3.07Å; T390-N392 PolarHBondContact OG1-N 2.93Å; T390-D393 VanDerWaalsContact CB-OD2 3.28Å; T390-D393 WeakPolarHBondContact CB-OD2 3.31Å; T390-D393 WeakPolarHBondContact CG2-OD2 3.45Å; T390-D393 PolarHBondContact N-OD2 2.94Å; T390-D393 PolarHBondContact O-N 3.42Å; T390-D393 VanDerWaalsContact OG1-CG 3.29Å; T390-D393 PolarHBondContact OG1-N 3.05Å; T390-D393 PolarHBondContact OG1-OD2 3.35Å; T390-V394 PolarHBondContact O-N 3.44Å
391V97.9Very high87.4Confident35 Ų3564.9 Ų64.921%0.21234%0.336CS..Hα-helixtrans-51.4-31.1169.6-175.60000112.2Y395 K412 M415 I416 D417V391-Y395 WeakPolarHBondContact O-CB 3.33Å; V391-Y395 PolarHBondContact O-N 2.6Å; V391-K412 HydrophobicContact CG1-CB 4.24Å; V391-K412 HydrophobicContact CG1-CG 4.08Å; V391-M415 HydrophobicContact CG2-CB 4.48Å; V391-I416 WeakPolarHBondContact CA-O 3.44Å; V391-D417 HydrophobicContact CG2-CB 3.98Å
392N97.9Very high89.6Confident69 Ų6964.4 Ų64.437%0.36934%0.342SS..Hα-helixtrans-76.8-31.1178.1-162.277.9000112.7T390 Y395 N396 K412T390-N392 PolarHBondContact O-N 3.29Å; T390-N392 VanDerWaalsContact O-N 3.07Å; T390-N392 PolarHBondContact OG1-N 2.93Å; N392-Y395 WeakPolarHBondContact O-CB 3.3Å; N392-Y395 PolarHBondContact O-N 3.41Å; N392-N396 PolarHBondContact ND2-ND2 2.95Å; N392-N396 WeakPolarHBondContact O-CB 3.33Å; N392-N396 PolarHBondContact O-N 3Å; N392-N396 PolarHBondContact O-ND2 3.27Å; N392-K412 PolarHBondContact OD1-NZ 3.28Å
393D97.1Very high91.6Very high61 Ų6163.7 Ų63.733%0.32634%0.338SS..Hα-helixtrans-76.7-36.2177-50.1-49.2000110.6W389 T390 N396 F397W389-D393 HydrophobicContact CB-CB 3.91Å; W389-D393 HydrophobicContact CG-CB 4.08Å; T390-D393 VanDerWaalsContact CB-OD2 3.28Å; T390-D393 WeakPolarHBondContact CB-OD2 3.31Å; T390-D393 WeakPolarHBondContact CG2-OD2 3.45Å; T390-D393 PolarHBondContact N-OD2 2.94Å; T390-D393 PolarHBondContact O-N 3.42Å; T390-D393 VanDerWaalsContact OG1-CG 3.29Å; T390-D393 PolarHBondContact OG1-N 3.05Å; T390-D393 PolarHBondContact OG1-OD2 3.35Å; D393-N396 PolarHBondContact O-N 3.42Å; D393-F397 VanDerWaalsContact O-CB 3.31Å; D393-F397 WeakPolarHBondContact O-CB 3.31Å; D393-F397 PolarHBondContact O-N 3.18Å
394V97.4Very high93.4Very high0 Ų059.4 Ų59.40%031%0.31CS..Hα-helixtrans-59.6-47.4165.9177.50000110.8W389 T390 N396 F397 I398 F411 I416 L421W389-V394 HydrophobicContact CB-CG2 4.28Å; W389-V394 HydrophobicContact CE3-CG2 4.44Å; T390-V394 PolarHBondContact O-N 3.44Å; V394-N396 VanDerWaalsContact C-N 3.33Å; V394-N396 PolarHBondContact O-N 3.27Å; V394-F397 PolarHBondContact O-N 3.01Å; V394-I398 HydrophobicContact CG1-CG1 4.24Å; V394-I398 WeakPolarHBondContact O-CG1 3.46Å; V394-I398 PolarHBondContact O-N 3.44Å; V394-F411 HydrophobicContact CG1-CB 4.33Å; V394-F411 HydrophobicContact CG1-CD1 3.9Å; V394-I416 WeakPolarHBondContact CB-O 3.38Å; V394-I416 HydrophobicContact CG1-CG2 4.33Å; V394-I416 WeakPolarHBondContact CG2-O 3.43Å; V394-L421 HydrophobicContact CG1-CD1 4.37Å; V394-L421 HydrophobicContact CG1-CD2 4.1Å; V394-L421 HydrophobicContact CG2-CB 4.42Å; V394-L421 HydrophobicContact CG2-CD2 4.04Å
395Y97.9Very high95Very high67 Ų6758 Ų5826%0.26331%0.311SS..Hα-helixtrans-55.6-45.9174.4174.3-83.2000112.1V391 N392 S399 A408 Q409 K412V391-Y395 WeakPolarHBondContact O-CB 3.33Å; V391-Y395 PolarHBondContact O-N 2.6Å; N392-Y395 WeakPolarHBondContact O-CB 3.3Å; N392-Y395 PolarHBondContact O-N 3.41Å; Y395-S399 VanDerWaalsContact O-CB 3.25Å; Y395-S399 WeakPolarHBondContact O-CB 3.44Å; Y395-S399 PolarHBondContact O-N 3.05Å; Y395-S399 PolarHBondContact O-OG 2.9Å; Y395-A408 VanDerWaalsContact CD2-C 3.47Å; Y395-A408 HydrophobicContact CD2-CB 3.87Å; Y395-A408 VanDerWaalsContact CD2-O 3.23Å; Y395-A408 WeakPolarHBondContact CD2-O 3.29Å; Y395-A408 HydrophobicContact CE2-CB 3.9Å; Y395-A408 HydrophobicContact CG-CB 4.35Å; Y395-Q409 HydrophobicContact CE2-CB 4.33Å; Y395-K412 HydrophobicContact CD2-CB 3.81Å; Y395-K412 HydrophobicContact CD2-CD 3.61Å; Y395-K412 HydrophobicContact CD2-CG 4.38Å; Y395-K412 HydrophobicContact CE2-CD 4.22Å; Y395-K412 HydrophobicContact CG-CD 3.96Å
396N97.6Very high95.5Very high80 Ų8060.6 Ų60.643%0.42832%0.322SS..Hα-helixtrans-64.3-43.4177.9-69.2-26.4000111.6N392 D393 V394 S399 S400N392-N396 PolarHBondContact ND2-ND2 2.95Å; N392-N396 WeakPolarHBondContact O-CB 3.33Å; N392-N396 PolarHBondContact O-N 3Å; N392-N396 PolarHBondContact O-ND2 3.27Å; D393-N396 PolarHBondContact O-N 3.42Å; V394-N396 VanDerWaalsContact C-N 3.33Å; V394-N396 PolarHBondContact O-N 3.27Å; N396-S399 WeakPolarHBondContact O-CB 3.48Å; N396-S399 PolarHBondContact O-N 3.44Å; N396-S400 PolarHBondContact O-N 3.01Å
397F96.4Very high95.9Very high17 Ų1761.5 Ų61.58%0.07533%0.325CS..Hα-helixtrans-60.3-50.9176167.7-107.1000111.9W389 D393 V394 S399 S400 I401 L421 Q446 V447 R450W389-F397 HydrophobicContact CE3-CB 4.45Å; W389-F397 HydrophobicContact CH2-CB 4.21Å; W389-F397 HydrophobicContact CH2-CD1 4.46Å; W389-F397 AromaticContact CH2-CD2 3.62Å; W389-F397 HydrophobicContact CH2-CD2 3.62Å; W389-F397 HydrophobicContact CH2-CE2 4.02Å; W389-F397 AromaticContact CH2-CG 3.85Å; W389-F397 HydrophobicContact CH2-CG 3.85Å; W389-F397 HydrophobicContact CZ3-CB 3.84Å; W389-F397 AromaticContact CZ3-CD1 3.78Å; W389-F397 HydrophobicContact CZ3-CD1 3.78Å; W389-F397 AromaticContact CZ3-CD2 3.79Å; W389-F397 HydrophobicContact CZ3-CD2 3.79Å; W389-F397 HydrophobicContact CZ3-CE1 4.23Å; W389-F397 HydrophobicContact CZ3-CE2 4.23Å; W389-F397 AromaticContact CZ3-CG 3.53Å; W389-F397 HydrophobicContact CZ3-CG 3.53Å; W389-F397 HydrophobicContact CZ3-CZ 4.42Å; D393-F397 VanDerWaalsContact O-CB 3.31Å; D393-F397 WeakPolarHBondContact O-CB 3.31Å; D393-F397 PolarHBondContact O-N 3.18Å; V394-F397 PolarHBondContact O-N 3.01Å; F397-S399 VanDerWaalsContact C-N 3.3Å; F397-S399 PolarHBondContact O-N 3.48Å; F397-S400 WeakPolarHBondContact O-CB 3.24Å; F397-S400 PolarHBondContact O-N 3.49Å; F397-S400 VanDerWaalsContact O-N 3.11Å; F397-S400 PolarHBondContact O-OG 3.45Å; F397-I401 HydrophobicContact CD1-CD1 4.43Å; F397-I401 HydrophobicContact CE1-CD1 3.97Å; F397-I401 HydrophobicContact CE2-CD1 4.28Å; F397-I401 HydrophobicContact CZ-CD1 3.91Å; F397-I401 PolarHBondContact O-N 2.99Å; F397-L421 HydrophobicContact CD1-CD2 4.07Å; F397-L421 HydrophobicContact CE1-CD2 4.06Å; F397-Q446 HydrophobicContact CE2-CB 4.15Å; F397-Q446 HydrophobicContact CZ-CB 3.69Å; F397-V447 HydrophobicContact CE1-CG2 3.71Å; F397-V447 HydrophobicContact CZ-CG2 4.01Å; F397-R450 HydrophobicContact CE2-CG 4.23Å
398I97.3Very high96.1Very high0 Ų053.8 Ų53.80%030%0.296CS..Hα-helixtrans-63.3-37.9177.3-58.8-61.7000110.9V394 S400 I401 C404 A408 F411 I443V394-I398 HydrophobicContact CG1-CG1 4.24Å; V394-I398 WeakPolarHBondContact O-CG1 3.46Å; V394-I398 PolarHBondContact O-N 3.44Å; I398-S400 VanDerWaalsContact C-N 3.29Å; I398-S400 PolarHBondContact O-N 3.34Å; I398-I401 HydrophobicContact CD1-CD1 4.39Å; I398-I401 PolarHBondContact O-N 2.91Å; I398-C404 HydrophobicContact CG2-CB 4.44Å; I398-A408 HydrophobicContact CB-CB 4.08Å; I398-A408 HydrophobicContact CG2-CB 3.95Å; I398-F411 HydrophobicContact CD1-CD1 4.25Å; I398-F411 HydrophobicContact CD1-CE1 3.97Å; I398-F411 HydrophobicContact CD1-CE2 4.39Å; I398-F411 HydrophobicContact CD1-CZ 4.04Å; I398-F411 HydrophobicContact CG1-CD1 3.99Å; I398-F411 HydrophobicContact CG1-CD2 4.25Å; I398-F411 HydrophobicContact CG1-CE1 4.22Å; I398-F411 HydrophobicContact CG1-CE2 4.45Å; I398-F411 HydrophobicContact CG1-CG 4.01Å; I398-F411 HydrophobicContact CG1-CZ 4.44Å; I398-F411 HydrophobicContact CG2-CD2 4.36Å; I398-I443 HydrophobicContact CD1-CB 4.36Å; I398-I443 HydrophobicContact CD1-CD1 3.93Å; I398-I443 HydrophobicContact CD1-CG1 3.82Å; I398-I443 HydrophobicContact CD1-CG2 3.61Å; I398-I443 HydrophobicContact CG2-CD1 4.29Å
399S97.1Very high96.3Very high41 Ų4150.1 Ų50.129%0.28728%0.281SS..Hα-helixtrans-61.3-34.1173.7-62.20000113.2Y395 N396 F397 I401 A408Y395-S399 VanDerWaalsContact O-CB 3.25Å; Y395-S399 WeakPolarHBondContact O-CB 3.44Å; Y395-S399 PolarHBondContact O-N 3.05Å; Y395-S399 PolarHBondContact O-OG 2.9Å; N396-S399 WeakPolarHBondContact O-CB 3.48Å; N396-S399 PolarHBondContact O-N 3.44Å; F397-S399 VanDerWaalsContact C-N 3.3Å; F397-S399 PolarHBondContact O-N 3.48Å; S399-I401 VanDerWaalsContact C-N 3.32Å; S399-I401 PolarHBondContact O-N 2.92Å; S399-A408 WeakPolarHBondContact OG-CB 3.38Å
400S96.1Very high96.4Very high85 Ų8550.8 Ų50.859%0.59429%0.288SS*.Hα-helixtrans-72.6-20178.579.90000114.1N396 F397 I398 P402N396-S400 PolarHBondContact O-N 3.01Å; F397-S400 WeakPolarHBondContact O-CB 3.24Å; F397-S400 PolarHBondContact O-N 3.49Å; F397-S400 VanDerWaalsContact O-N 3.11Å; F397-S400 PolarHBondContact O-OG 3.45Å; I398-S400 VanDerWaalsContact C-N 3.29Å; I398-S400 PolarHBondContact O-N 3.34Å; S400-P402 WeakPolarHBondContact O-CD 3.47Å
401I95.1Very high96.4Very high7 Ų747.2 Ų47.24%0.03627%0.266CS..SBendtrans-80.4121.7-175.2-63168.5000109.8F397 I398 S399 T403 C404 K442 I443 Q446F397-I401 HydrophobicContact CD1-CD1 4.43Å; F397-I401 HydrophobicContact CE1-CD1 3.97Å; F397-I401 HydrophobicContact CE2-CD1 4.28Å; F397-I401 HydrophobicContact CZ-CD1 3.91Å; F397-I401 PolarHBondContact O-N 2.99Å; I398-I401 HydrophobicContact CD1-CD1 4.39Å; I398-I401 PolarHBondContact O-N 2.91Å; S399-I401 VanDerWaalsContact C-N 3.32Å; S399-I401 PolarHBondContact O-N 2.92Å; I401-T403 PolarHBondContact O-N 3.17Å; I401-C404 HydrophobicContact CB-CB 3.91Å; I401-C404 HydrophobicContact CG2-CB 3.87Å; I401-C404 VanDerWaalsContact CG2-SG 3.54Å; I401-C404 PolarHBondContact O-N 2.94Å; I401-K442 HydrophobicContact CG2-CB 4.41Å; I401-I443 HydrophobicContact CD1-CG1 4.02Å; I401-Q446 HydrophobicContact CD1-CB 4.01Å; I401-Q446 HydrophobicContact CD1-CG 4Å; I401-Q446 HydrophobicContact CG1-CG 4.23Å
402P92.3Very high96.4Very high97 Ų9748.8 Ų48.863%0.6327%0.27SS*.THydrogen-bonded Turntrans-58.2128-178.8-27.135.9000112.9S400 C404 K442S400-P402 WeakPolarHBondContact O-CD 3.47Å; P402-C404 VanDerWaalsContact C-N 3.34Å; P402-K442 PolarHBondContact O-NZ 2.9Å
403T91.6Very high96.4Very high94 Ų9450.3 Ų50.358%0.57728%0.278SS*.THydrogen-bonded Turntrans65.322.7-172.893.50000115.8I401 K442I401-T403 PolarHBondContact O-N 3.17Å; T403-K442 PolarHBondContact OG1-NZ 3.5Å
404C95.2Very high96.4Very high0 Ų052 Ų520%028%0.283CS..THydrogen-bonded Turntrans-122.7-6.7174.7-61.40000114.4I398 I401 P402 E406 Y407 I443I398-C404 HydrophobicContact CG2-CB 4.44Å; I401-C404 HydrophobicContact CB-CB 3.91Å; I401-C404 HydrophobicContact CG2-CB 3.87Å; I401-C404 VanDerWaalsContact CG2-SG 3.54Å; I401-C404 PolarHBondContact O-N 2.94Å; P402-C404 VanDerWaalsContact C-N 3.34Å; C404-E406 PolarHBondContact O-N 3.38Å; C404-Y407 PolarHBondContact O-N 3.4Å; C404-I443 HydrophobicContact CB-CD1 4.24Å; C404-I443 HydrophobicContact CB-CG1 4.42Å
405S95.6Very high96.4Very high72 Ų7258.1 Ų58.150%0.50331%0.314SS..G310 helixtrans-60.4-27.5-178.752.80000114.5Y407 A408S405-Y407 PolarHBondContact O-N 2.91Å; S405-A408 WeakPolarHBondContact O-CB 3.29Å; S405-A408 PolarHBondContact O-N 3.13Å; S405-A408 VanDerWaalsContact O-N 3.15Å
406E95.9Very high96.4Very high127 Ų12755.3 Ų55.359%0.59330%0.303SS*.G310 helixtrans-60.4-26.3173.766-176.1-179.500113.2C404C404-E406 PolarHBondContact O-N 3.38Å
407Y96.8Very high96.4Very high21 Ų2153.9 Ų53.98%0.08230%0.296CS..G310 helixtrans-93.5-8.7178.3-51.3-78.7000113.5C404 S405 Q409 T410 F411 L435 P439C404-Y407 PolarHBondContact O-N 3.4Å; S405-Y407 PolarHBondContact O-N 2.91Å; Y407-Q409 VanDerWaalsContact C-N 3.26Å; Y407-Q409 PolarHBondContact O-N 3.38Å; Y407-T410 VanDerWaalsContact O-CB 3.31Å; Y407-T410 WeakPolarHBondContact O-CB 3.5Å; Y407-T410 PolarHBondContact O-N 3.41Å; Y407-F411 WeakPolarHBondContact O-CD2 3.32Å; Y407-F411 PolarHBondContact O-N 2.86Å; Y407-L435 HydrophobicContact CD1-CB 4.46Å; Y407-L435 HydrophobicContact CD1-CD1 3.53Å; Y407-L435 HydrophobicContact CD1-CG 3.55Å; Y407-L435 HydrophobicContact CD2-CG 4.18Å; Y407-L435 HydrophobicContact CE1-CB 4.42Å; Y407-L435 HydrophobicContact CE1-CD1 4.27Å; Y407-L435 HydrophobicContact CE1-CG 3.95Å; Y407-L435 HydrophobicContact CG-CD1 3.85Å; Y407-L435 HydrophobicContact CG-CD2 4.34Å; Y407-L435 HydrophobicContact CG-CG 3.69Å; Y407-P439 HydrophobicContact CD2-CB 4.02Å; Y407-P439 HydrophobicContact CD2-CG 4.47Å; Y407-P439 HydrophobicContact CE2-CB 3.61Å; Y407-P439 HydrophobicContact CE2-CG 3.59Å
408A97.1Very high96.3Very high0 Ų053.1 Ų53.10%029%0.292CS..Hα-helixtrans-59.2-39.7-175.500000111.9Y395 I398 S399 S405 T410 F411 K412Y395-A408 VanDerWaalsContact CD2-C 3.47Å; Y395-A408 HydrophobicContact CD2-CB 3.87Å; Y395-A408 VanDerWaalsContact CD2-O 3.23Å; Y395-A408 WeakPolarHBondContact CD2-O 3.29Å; Y395-A408 HydrophobicContact CE2-CB 3.9Å; Y395-A408 HydrophobicContact CG-CB 4.35Å; I398-A408 HydrophobicContact CB-CB 4.08Å; I398-A408 HydrophobicContact CG2-CB 3.95Å; S399-A408 WeakPolarHBondContact OG-CB 3.38Å; S405-A408 WeakPolarHBondContact O-CB 3.29Å; S405-A408 PolarHBondContact O-N 3.13Å; S405-A408 VanDerWaalsContact O-N 3.15Å; A408-T410 VanDerWaalsContact C-N 3.34Å; A408-T410 PolarHBondContact O-N 2.88Å; A408-F411 PolarHBondContact O-N 3.11Å; A408-K412 PolarHBondContact O-N 3.39Å
409Q97.6Very high96.2Very high83 Ų8359.2 Ų59.239%0.38832%0.321SS..Hα-helixtrans-62.6-39.8175.4-1705942.900111.7Y395 Y407 F411 K412 D413Y395-Q409 HydrophobicContact CE2-CB 4.33Å; Y407-Q409 VanDerWaalsContact C-N 3.26Å; Y407-Q409 PolarHBondContact O-N 3.38Å; Q409-F411 VanDerWaalsContact C-N 3.33Å; Q409-F411 PolarHBondContact O-N 3.36Å; Q409-K412 CarbonylContact O-C 3.43Å; Q409-K412 WeakPolarHBondContact O-CA 3.46Å; Q409-K412 WeakPolarHBondContact O-CB 3.45Å; Q409-K412 PolarHBondContact O-N 3.18Å; Q409-D413 PolarHBondContact NE2-OD1 2.93Å; Q409-D413 PolarHBondContact O-N 2.98Å
410T97.4Very high96.2Very high36 Ų3660 Ų6022%0.22132%0.324CS..Hα-helixtrans-59.5-40.9175.8-42.40000112.3Y407 A408 K412 D413 H414 L433Y407-T410 VanDerWaalsContact O-CB 3.31Å; Y407-T410 WeakPolarHBondContact O-CB 3.5Å; Y407-T410 PolarHBondContact O-N 3.41Å; A408-T410 VanDerWaalsContact C-N 3.34Å; A408-T410 PolarHBondContact O-N 2.88Å; T410-K412 VanDerWaalsContact C-N 3.28Å; T410-K412 PolarHBondContact O-N 3.43Å; T410-D413 PolarHBondContact O-N 3.44Å; T410-H414 WeakPolarHBondContact O-CB 3.13Å; T410-H414 PolarHBondContact O-CD2 3.27Å; T410-H414 VanDerWaalsContact O-CD2 3.22Å; T410-H414 PolarHBondContact O-N 3.15Å; T410-L433 HydrophobicContact CG2-CB 4.3Å; T410-L433 HydrophobicContact CG2-CD2 4.21Å
411F97.8Very high96.2Very high0 Ų056.2 Ų56.20%030%0.297CS..Hα-helixtrans-63.2-35.5174.4-81.6-111.7000111.9V394 I398 Y407 A408 Q409 M415 I416 L421 L424 L429 L433 L435 I443V394-F411 HydrophobicContact CG1-CB 4.33Å; V394-F411 HydrophobicContact CG1-CD1 3.9Å; I398-F411 HydrophobicContact CD1-CD1 4.25Å; I398-F411 HydrophobicContact CD1-CE1 3.97Å; I398-F411 HydrophobicContact CD1-CE2 4.39Å; I398-F411 HydrophobicContact CD1-CZ 4.04Å; I398-F411 HydrophobicContact CG1-CD1 3.99Å; I398-F411 HydrophobicContact CG1-CD2 4.25Å; I398-F411 HydrophobicContact CG1-CE1 4.22Å; I398-F411 HydrophobicContact CG1-CE2 4.45Å; I398-F411 HydrophobicContact CG1-CG 4.01Å; I398-F411 HydrophobicContact CG1-CZ 4.44Å; I398-F411 HydrophobicContact CG2-CD2 4.36Å; Y407-F411 WeakPolarHBondContact O-CD2 3.32Å; Y407-F411 PolarHBondContact O-N 2.86Å; A408-F411 PolarHBondContact O-N 3.11Å; Q409-F411 VanDerWaalsContact C-N 3.33Å; Q409-F411 PolarHBondContact O-N 3.36Å; F411-M415 PolarHBondContact O-N 2.58Å; F411-I416 HydrophobicContact CB-CB 4.42Å; F411-I416 HydrophobicContact CB-CD1 4.44Å; F411-I416 HydrophobicContact CD1-CB 4.09Å; F411-I416 HydrophobicContact CD1-CD1 3.75Å; F411-I416 HydrophobicContact CD1-CG1 4.48Å; F411-I416 HydrophobicContact CD1-CG2 3.93Å; F411-I416 HydrophobicContact CE1-CD1 4.2Å; F411-I416 HydrophobicContact CE1-CG2 4.49Å; F411-I416 HydrophobicContact CG-CD1 4.13Å; F411-I416 WeakPolarHBondContact O-CB 3.4Å; F411-I416 PolarHBondContact O-N 3.1Å; F411-L421 HydrophobicContact CD1-CD1 4.25Å; F411-L421 HydrophobicContact CE1-CD1 3.73Å; F411-L424 HydrophobicContact CE1-CD1 3.78Å; F411-L424 HydrophobicContact CZ-CD1 4.45Å; F411-L429 HydrophobicContact CE1-CD2 4.4Å; F411-L429 HydrophobicContact CZ-CD2 3.82Å; F411-L433 HydrophobicContact CD2-CD1 4.29Å; F411-L433 HydrophobicContact CE1-CD1 4.23Å; F411-L433 HydrophobicContact CE2-CD1 3.91Å; F411-L433 HydrophobicContact CZ-CD1 3.88Å; F411-L435 HydrophobicContact CE2-CD1 4.21Å; F411-L435 HydrophobicContact CE2-CD2 4.12Å; F411-L435 HydrophobicContact CZ-CD2 4.47Å; F411-I443 HydrophobicContact CE2-CD1 4.17Å; F411-I443 HydrophobicContact CZ-CD1 4.11Å; F411-I443 HydrophobicContact CZ-CG2 4.19Å
412K97.6Very high96.2Very high67 Ų6757.8 Ų57.829%0.29131%0.307SS..Hα-helixtrans-75.1-38.5177.9-176163.5-177.1165.90113.1V391 N392 Y395 A408 Q409 T410 H414 M415V391-K412 HydrophobicContact CG1-CB 4.24Å; V391-K412 HydrophobicContact CG1-CG 4.08Å; N392-K412 PolarHBondContact OD1-NZ 3.28Å; Y395-K412 HydrophobicContact CD2-CB 3.81Å; Y395-K412 HydrophobicContact CD2-CD 3.61Å; Y395-K412 HydrophobicContact CD2-CG 4.38Å; Y395-K412 HydrophobicContact CE2-CD 4.22Å; Y395-K412 HydrophobicContact CG-CD 3.96Å; A408-K412 PolarHBondContact O-N 3.39Å; Q409-K412 CarbonylContact O-C 3.43Å; Q409-K412 WeakPolarHBondContact O-CA 3.46Å; Q409-K412 WeakPolarHBondContact O-CB 3.45Å; Q409-K412 PolarHBondContact O-N 3.18Å; T410-K412 VanDerWaalsContact C-N 3.28Å; T410-K412 PolarHBondContact O-N 3.43Å; K412-H414 VanDerWaalsContact C-N 3.34Å; K412-M415 WeakPolarHBondContact O-CE 3.45Å; K412-M415 PolarHBondContact O-N 2.85Å; K412-M415 VanDerWaalsContact O-N 3.09Å
413D97.8Very high96.3Very high101 Ų10159.4 Ų59.454%0.5431%0.31SS..Hα-helixtrans-67.1-36.3176.1-63.3-23.6000111.4Q409 T410 M415Q409-D413 PolarHBondContact NE2-OD1 2.93Å; Q409-D413 PolarHBondContact O-N 2.98Å; T410-D413 PolarHBondContact O-N 3.44Å; D413-M415 PolarHBondContact O-N 2.88Å
414H97.3Very high96.5Very high96 Ų9656.2 Ų56.244%0.44429%0.29SS..THydrogen-bonded Turntrans-80.86.1171.9-75.9-112000113.9T410 K412 I416 L433T410-H414 WeakPolarHBondContact O-CB 3.13Å; T410-H414 PolarHBondContact O-CD2 3.27Å; T410-H414 VanDerWaalsContact O-CD2 3.22Å; T410-H414 PolarHBondContact O-N 3.15Å; K412-H414 VanDerWaalsContact C-N 3.34Å; H414-I416 HydrophobicContact CB-CD1 4.08Å; H414-I416 HydrophobicContact CB-CG1 3.91Å; H414-I416 PolarHBondContact O-N 3.06Å; H414-L433 HydrophobicContact CB-CD2 3.89Å; H414-L433 VanDerWaalsContact CG-CD2 3.41Å; H414-L433 WeakPolarHBondContact ND1-CD2 3.49Å
415M97Very high96.5Very high130 Ų13057.9 Ų57.964%0.6430%0.301SS*.THydrogen-bonded Turntrans53.735.8178.7-58.6-66.515400114.3V391 F411 K412 D413 D417V391-M415 HydrophobicContact CG2-CB 4.48Å; F411-M415 PolarHBondContact O-N 2.58Å; K412-M415 WeakPolarHBondContact O-CE 3.45Å; K412-M415 PolarHBondContact O-N 2.85Å; K412-M415 VanDerWaalsContact O-N 3.09Å; D413-M415 PolarHBondContact O-N 2.88Å; M415-D417 PolarHBondContact O-N 3.33Å
416I97.8Very high96.5Very high7 Ų757.2 Ų57.24%0.03629%0.29CS..  trans-75.8112.1-177.6-58.3-179.9000109.5V391 V394 F411 H414 T420 L421 L424 L433V391-I416 WeakPolarHBondContact CA-O 3.44Å; V394-I416 WeakPolarHBondContact CB-O 3.38Å; V394-I416 HydrophobicContact CG1-CG2 4.33Å; V394-I416 WeakPolarHBondContact CG2-O 3.43Å; F411-I416 HydrophobicContact CB-CB 4.42Å; F411-I416 HydrophobicContact CB-CD1 4.44Å; F411-I416 HydrophobicContact CD1-CB 4.09Å; F411-I416 HydrophobicContact CD1-CD1 3.75Å; F411-I416 HydrophobicContact CD1-CG1 4.48Å; F411-I416 HydrophobicContact CD1-CG2 3.93Å; F411-I416 HydrophobicContact CE1-CD1 4.2Å; F411-I416 HydrophobicContact CE1-CG2 4.49Å; F411-I416 HydrophobicContact CG-CD1 4.13Å; F411-I416 WeakPolarHBondContact O-CB 3.4Å; F411-I416 PolarHBondContact O-N 3.1Å; H414-I416 HydrophobicContact CB-CD1 4.08Å; H414-I416 HydrophobicContact CB-CG1 3.91Å; H414-I416 PolarHBondContact O-N 3.06Å; I416-T420 HydrophobicContact CG2-CG2 4.22Å; I416-L421 HydrophobicContact CG2-CB 4.06Å; I416-L424 HydrophobicContact CD1-CD1 4Å; I416-L424 HydrophobicContact CG2-CD1 4.06Å; I416-L433 HydrophobicContact CD1-CD1 3.54Å; I416-L433 HydrophobicContact CD1-CD2 3.92Å; I416-L433 HydrophobicContact CD1-CG 4.35Å
417D97.1Very high96.5Very high51 Ų5156.8 Ų56.827%0.27329%0.288SS..  trans-99.5-175.7176.864.310.9000112.6V391 M415 E419 T420 L421V391-D417 HydrophobicContact CG2-CB 3.98Å; M415-D417 PolarHBondContact O-N 3.33Å; D417-E419 VanDerWaalsContact C-N 3.32Å; D417-E419 PolarHBondContact O-N 3.12Å; D417-E419 PolarHBondContact OD1-N 3.44Å; D417-T420 PolarHBondContact O-N 3.38Å; D417-T420 WeakPolarHBondContact OD1-CB 3.36Å; D417-T420 PolarHBondContact OD1-N 3.07Å; D417-T420 PolarHBondContact OD1-OG1 3.44Å; D417-L421 VanDerWaalsContact O-CB 3.22Å; D417-L421 WeakPolarHBondContact O-CB 3.39Å; D417-L421 PolarHBondContact O-N 2.81Å
418G95.8Very high96.6Very high0 Ų059.5 Ų59.50%030%0.301CS..THydrogen-bonded Turntrans-65.8-25.9179.400000115.6I386 R387 W389 P422I386-G418 CarbonylContact C-O 3.5Å; I386-G418 CarbonylContact O-C 3.54Å; I386-G418 WeakPolarHBondContact O-CA 3.3Å; R387-G418 WeakPolarHBondContact CA-O 2.95Å; R387-G418 PolarHBondContact N-O 3.47Å; W389-G418 WeakPolarHBondContact O-CA 3.45Å; W389-G418 PolarHBondContact O-N 3.36Å; G418-P422 WeakPolarHBondContact O-CD 3.17Å; G418-P422 VanDerWaalsContact O-CG 3.24Å; G418-P422 WeakPolarHBondContact O-CG 3.43Å
419E95.1Very high96.6Very high129 Ų12959.6 Ų59.660%0.60330%0.302SS*.THydrogen-bonded Turntrans-79.5-35.7174.6-59.8-158.2140.200111.2R387 D417 P422R387-E419 HydrophobicContact CB-CG 4.38Å; R387-E419 WeakPolarHBondContact O-CG 3.49Å; D417-E419 VanDerWaalsContact C-N 3.32Å; D417-E419 PolarHBondContact O-N 3.12Å; D417-E419 PolarHBondContact OD1-N 3.44Å; E419-P422 WeakPolarHBondContact O-CD 3.39Å
420T96.3Very high96.6Very high56 Ų5658.2 Ų58.234%0.34430%0.297SS..THydrogen-bonded Turntrans-80.5-41.2-178.4-53.50000113.1I416 D417 L423 L424I416-T420 HydrophobicContact CG2-CG2 4.22Å; D417-T420 PolarHBondContact O-N 3.38Å; D417-T420 WeakPolarHBondContact OD1-CB 3.36Å; D417-T420 PolarHBondContact OD1-N 3.07Å; D417-T420 PolarHBondContact OD1-OG1 3.44Å; T420-L423 WeakPolarHBondContact O-CA 3.26Å; T420-L423 WeakPolarHBondContact O-CB 3.37Å; T420-L423 PolarHBondContact O-N 3.46Å; T420-L424 HydrophobicContact CG2-CD2 4.34Å
421L96.4Very high96.5Very high6 Ų662.9 Ų62.93%0.03132%0.321CS..G310 helixtrans-52.6-41.5-178.7176.267.3000114.1I386 W389 V394 F397 F411 I416 D417 L423 L424 V447I386-L421 HydrophobicContact CG2-CD2 4.17Å; W389-L421 HydrophobicContact CE3-CD2 4.16Å; W389-L421 HydrophobicContact CZ3-CD2 4.12Å; V394-L421 HydrophobicContact CG1-CD1 4.37Å; V394-L421 HydrophobicContact CG1-CD2 4.1Å; V394-L421 HydrophobicContact CG2-CB 4.42Å; V394-L421 HydrophobicContact CG2-CD2 4.04Å; F397-L421 HydrophobicContact CD1-CD2 4.07Å; F397-L421 HydrophobicContact CE1-CD2 4.06Å; F411-L421 HydrophobicContact CD1-CD1 4.25Å; F411-L421 HydrophobicContact CE1-CD1 3.73Å; I416-L421 HydrophobicContact CG2-CB 4.06Å; D417-L421 VanDerWaalsContact O-CB 3.22Å; D417-L421 WeakPolarHBondContact O-CB 3.39Å; D417-L421 PolarHBondContact O-N 2.81Å; L421-L423 PolarHBondContact O-N 3.2Å; L421-L424 HydrophobicContact CD1-CD1 4.13Å; L421-V447 HydrophobicContact CD1-CG2 3.85Å; L421-V447 HydrophobicContact CD2-CG2 3.89Å; L421-V447 HydrophobicContact CG-CG1 4.44Å; L421-V447 HydrophobicContact CG-CG2 3.77Å
422P94.3Very high96.4Very high40 Ų4067 Ų6726%0.2635%0.345SS..G310 helixtrans-57.3-26.8170.2-2935.6000116.2I386 G418 E419 M451I386-P422 HydrophobicContact CG2-CG 4.23Å; G418-P422 WeakPolarHBondContact O-CD 3.17Å; G418-P422 VanDerWaalsContact O-CG 3.24Å; G418-P422 WeakPolarHBondContact O-CG 3.43Å; E419-P422 WeakPolarHBondContact O-CD 3.39Å; P422-M451 HydrophobicContact CB-CE 3.53Å; P422-M451 HydrophobicContact CB-SD 4.28Å; P422-M451 HydrophobicContact CG-CE 3.8Å; P422-M451 HydrophobicContact CG-SD 4.23Å
423L94.7Very high96.3Very high131 Ų13164.4 Ų64.469%0.68634%0.335SS*.G310 helixtrans-95.9-2.5-169.1-54.5177.2000113T420 L421 S425T420-L423 WeakPolarHBondContact O-CA 3.26Å; T420-L423 WeakPolarHBondContact O-CB 3.37Å; T420-L423 PolarHBondContact O-N 3.46Å; L421-L423 PolarHBondContact O-N 3.2Å; L423-S425 PolarHBondContact O-N 2.96Å
424L95.9Very high96.2Very high28 Ų2862.3 Ų62.315%0.14734%0.337CS..  trans-74.1108179.2-57.6177.8000111F411 I416 T420 L421 H428 L429 L433F411-L424 HydrophobicContact CE1-CD1 3.78Å; F411-L424 HydrophobicContact CZ-CD1 4.45Å; I416-L424 HydrophobicContact CD1-CD1 4Å; I416-L424 HydrophobicContact CG2-CD1 4.06Å; T420-L424 HydrophobicContact CG2-CD2 4.34Å; L421-L424 HydrophobicContact CD1-CD1 4.13Å; L424-H428 HydrophobicContact CD2-CB 4.2Å; L424-L429 HydrophobicContact CB-CD2 3.96Å; L424-L429 HydrophobicContact CB-CG 4.42Å; L424-L429 HydrophobicContact CD1-CD2 3.7Å; L424-L429 HydrophobicContact CG-CD2 4.42Å; L424-L433 HydrophobicContact CD1-CD1 4.44Å
425S95.1Very high96.2Very high34 Ų3458 Ų5824%0.23832%0.317CS..  trans-69.8169.4164.853.80000111.3L423 E427 H428 L429L423-S425 PolarHBondContact O-N 2.96Å; S425-E427 VanDerWaalsContact C-N 3.33Å; S425-E427 WeakPolarHBondContact CB-OE1 3.44Å; S425-E427 PolarHBondContact O-N 3.48Å; S425-E427 WeakPolarHBondContact OG-CG 3.5Å; S425-E427 PolarHBondContact OG-OE1 2.93Å; S425-H428 PolarHBondContact O-N 2.85Å; S425-H428 PolarHBondContact OG-CE1 2.7Å; S425-H428 PolarHBondContact OG-ND1 3.4Å; S425-L429 PolarHBondContact O-N 3.36Å
426E95.6Very high96.2Very high59 Ų5958.5 Ų58.528%0.27632%0.316SS..Hα-helixtrans-64.1-38.3-177.9-169153.5111.100112.2H428 L429 L430 L437 L441 R444E426-H428 VanDerWaalsContact C-N 3.32Å; E426-H428 PolarHBondContact O-N 2.87Å; E426-L429 PolarHBondContact O-N 3.43Å; E426-L429 VanDerWaalsContact O-N 3.15Å; E426-L430 HydrophobicContact CG-CD1 3.99Å; E426-L430 HydrophobicContact CG-CG 4.3Å; E426-L430 WeakPolarHBondContact O-CG 3.43Å; E426-L430 PolarHBondContact O-N 3.46Å; E426-L437 HydrophobicContact CG-CD1 4.43Å; E426-L441 WeakPolarHBondContact OE2-CD2 3.19Å; E426-R444 IonicContact OE2-CZ 3.77Å; E426-R444 IonicContact OE2-NH1 3.64Å; E426-R444 PolarHBondContact OE2-NH1 2.78Å
427E96.6Very high96.2Very high117 Ų11762.5 Ų62.555%0.54734%0.337SS..Hα-helixtrans-60-37.6174.873.7-137.2128.700112.4S425 L429 L430 D431S425-E427 VanDerWaalsContact C-N 3.33Å; S425-E427 WeakPolarHBondContact CB-OE1 3.44Å; S425-E427 PolarHBondContact O-N 3.48Å; S425-E427 WeakPolarHBondContact OG-CG 3.5Å; S425-E427 PolarHBondContact OG-OE1 2.93Å; E427-L429 VanDerWaalsContact C-N 3.34Å; E427-L429 PolarHBondContact O-N 2.92Å; E427-L430 PolarHBondContact O-N 2.86Å; E427-D431 WeakPolarHBondContact O-CB 3.42Å; E427-D431 PolarHBondContact O-N 3.28Å
428H97.6Very high96.1Very high79 Ų7962.1 Ų62.137%0.36635%0.345SS..Iπ-helixtrans-64.9-39.5175.9-62.8164.7000111.3L424 S425 E426 T432 L433L424-H428 HydrophobicContact CD2-CB 4.2Å; S425-H428 PolarHBondContact O-N 2.85Å; S425-H428 PolarHBondContact OG-CE1 2.7Å; S425-H428 PolarHBondContact OG-ND1 3.4Å; E426-H428 VanDerWaalsContact C-N 3.32Å; E426-H428 PolarHBondContact O-N 2.87Å; H428-T432 VanDerWaalsContact O-CB 3.28Å; H428-T432 WeakPolarHBondContact O-CB 3.49Å; H428-T432 PolarHBondContact O-N 2.92Å; H428-L433 PolarHBondContact O-N 3.24Å
429L97.3Very high96.2Very high2 Ų262.8 Ų62.81%0.0135%0.349CS..Iπ-helixtrans-69.7-42.8177.4-59.6-172.7000112F411 L424 S425 E426 E427 L433 G434 L435 A440 R444F411-L429 HydrophobicContact CE1-CD2 4.4Å; F411-L429 HydrophobicContact CZ-CD2 3.82Å; L424-L429 HydrophobicContact CB-CD2 3.96Å; L424-L429 HydrophobicContact CB-CG 4.42Å; L424-L429 HydrophobicContact CD1-CD2 3.7Å; L424-L429 HydrophobicContact CG-CD2 4.42Å; S425-L429 PolarHBondContact O-N 3.36Å; E426-L429 PolarHBondContact O-N 3.43Å; E426-L429 VanDerWaalsContact O-N 3.15Å; E427-L429 VanDerWaalsContact C-N 3.34Å; E427-L429 PolarHBondContact O-N 2.92Å; L429-L433 HydrophobicContact CD2-CD1 3.78Å; L429-G434 PolarHBondContact O-N 2.9Å; L429-L435 HydrophobicContact CB-CD2 4.43Å; L429-L435 WeakPolarHBondContact O-CB 3.26Å; L429-L435 PolarHBondContact O-N 2.83Å; L429-A440 HydrophobicContact CB-CB 3.8Å; L429-A440 HydrophobicContact CD1-CB 3.93Å; L429-R444 HydrophobicContact CD1-CG 3.54Å
430L97.4Very high96.3Very high53 Ų5356.7 Ų56.728%0.27732%0.321SS..Iπ-helixtrans-74.1-56.2-178.1-64.1178.1000112.2E426 E427 G434 L435 L437 A440E426-L430 HydrophobicContact CG-CD1 3.99Å; E426-L430 HydrophobicContact CG-CG 4.3Å; E426-L430 WeakPolarHBondContact O-CG 3.43Å; E426-L430 PolarHBondContact O-N 3.46Å; E427-L430 PolarHBondContact O-N 2.86Å; L430-G434 WeakPolarHBondContact O-CA 3.43Å; L430-G434 PolarHBondContact O-N 2.78Å; L430-L435 WeakPolarHBondContact CD2-O 3.39Å; L430-L437 HydrophobicContact CD1-CD1 4.38Å; L430-L437 HydrophobicContact CD2-CB 4.3Å; L430-L437 HydrophobicContact CD2-CD1 4.4Å; L430-A440 HydrophobicContact CD2-CB 4.12Å
431D96.7Very high96.3Very high135 Ų13557.8 Ų57.872%0.72232%0.324SS*.Iπ-helixtrans-91.9-32.7-165.3-58-33.5000112.8E427E427-D431 WeakPolarHBondContact O-CB 3.42Å; E427-D431 PolarHBondContact O-N 3.28Å
432T95.6Very high96.3Very high85 Ų8561.5 Ų61.552%0.52134%0.34SS..Iπ-helixtrans-92.7-38.7-178.6-51.80000112.4H428H428-T432 VanDerWaalsContact O-CB 3.28Å; H428-T432 WeakPolarHBondContact O-CB 3.49Å; H428-T432 PolarHBondContact O-N 2.92Å
433L95.5Very high96.4Very high14 Ų1459.7 Ų59.77%0.07333%0.328CS..SBendtrans-100.9-5.1179.7-56.6179.5000113.8T410 F411 H414 I416 L424 H428 L429 L435T410-L433 HydrophobicContact CG2-CB 4.3Å; T410-L433 HydrophobicContact CG2-CD2 4.21Å; F411-L433 HydrophobicContact CD2-CD1 4.29Å; F411-L433 HydrophobicContact CE1-CD1 4.23Å; F411-L433 HydrophobicContact CE2-CD1 3.91Å; F411-L433 HydrophobicContact CZ-CD1 3.88Å; H414-L433 HydrophobicContact CB-CD2 3.89Å; H414-L433 VanDerWaalsContact CG-CD2 3.41Å; H414-L433 WeakPolarHBondContact ND1-CD2 3.49Å; I416-L433 HydrophobicContact CD1-CD1 3.54Å; I416-L433 HydrophobicContact CD1-CD2 3.92Å; I416-L433 HydrophobicContact CD1-CG 4.35Å; L424-L433 HydrophobicContact CD1-CD1 4.44Å; H428-L433 PolarHBondContact O-N 3.24Å; L429-L433 HydrophobicContact CD2-CD1 3.78Å; L433-L435 VanDerWaalsContact C-N 3.29Å; L433-L435 HydrophobicContact CB-CD1 3.6Å; L433-L435 WeakPolarHBondContact O-CD1 3.41Å; L433-L435 PolarHBondContact O-N 2.98Å
434G95.6Very high96.4Very high56 Ų5658.3 Ų58.358%0.57731%0.314SS*.  trans69.918.5174.900000115.2L429 L430L429-G434 PolarHBondContact O-N 2.9Å; L430-G434 WeakPolarHBondContact O-CA 3.43Å; L430-G434 PolarHBondContact O-N 2.78Å
435L97Very high96.3Very high7 Ų760 Ų604%0.03733%0.328CS..  trans-70.7147.8178.6-82.963.9000110.8Y407 F411 L429 L430 L433 P439 A440 I443Y407-L435 HydrophobicContact CD1-CB 4.46Å; Y407-L435 HydrophobicContact CD1-CD1 3.53Å; Y407-L435 HydrophobicContact CD1-CG 3.55Å; Y407-L435 HydrophobicContact CD2-CG 4.18Å; Y407-L435 HydrophobicContact CE1-CB 4.42Å; Y407-L435 HydrophobicContact CE1-CD1 4.27Å; Y407-L435 HydrophobicContact CE1-CG 3.95Å; Y407-L435 HydrophobicContact CG-CD1 3.85Å; Y407-L435 HydrophobicContact CG-CD2 4.34Å; Y407-L435 HydrophobicContact CG-CG 3.69Å; F411-L435 HydrophobicContact CE2-CD1 4.21Å; F411-L435 HydrophobicContact CE2-CD2 4.12Å; F411-L435 HydrophobicContact CZ-CD2 4.47Å; L429-L435 HydrophobicContact CB-CD2 4.43Å; L429-L435 WeakPolarHBondContact O-CB 3.26Å; L429-L435 PolarHBondContact O-N 2.83Å; L430-L435 WeakPolarHBondContact CD2-O 3.39Å; L433-L435 VanDerWaalsContact C-N 3.29Å; L433-L435 HydrophobicContact CB-CD1 3.6Å; L433-L435 WeakPolarHBondContact O-CD1 3.41Å; L433-L435 PolarHBondContact O-N 2.98Å; L435-P439 HydrophobicContact CD2-CB 4.3Å; L435-P439 HydrophobicContact CG-CB 4.47Å; L435-A440 HydrophobicContact CB-CB 4.23Å; L435-A440 HydrophobicContact CD2-CB 4.44Å; L435-I443 HydrophobicContact CD2-CD1 3.5Å
436K97.3Very high96.2Very high140 Ų14061.1 Ų61.161%0.60933%0.33SS*.  trans-73.6152.5163.7-66.2158.5-169.8152.40109.6G438 P439 A440K436-G438 VanDerWaalsContact C-N 3.26Å; K436-G438 PolarHBondContact O-N 3.24Å; K436-G438 VanDerWaalsContact O-N 3.14Å; K436-P439 HydrophobicContact CB-CG 4.36Å; K436-P439 WeakPolarHBondContact O-CD 3.5Å; K436-A440 PolarHBondContact O-N 3.48Å
437L96.8Very high96.1Very high90 Ų9058.8 Ų58.847%0.47132%0.319SS..Hα-helixtrans-53.1-38-178-174.963.6000113.9E426 L430 A440 L441E426-L437 HydrophobicContact CG-CD1 4.43Å; L430-L437 HydrophobicContact CD1-CD1 4.38Å; L430-L437 HydrophobicContact CD2-CB 4.3Å; L430-L437 HydrophobicContact CD2-CD1 4.4Å; L437-A440 PolarHBondContact O-N 2.86Å; L437-L441 HydrophobicContact CD1-CD1 3.95Å; L437-L441 HydrophobicContact CD1-CG 3.98Å; L437-L441 HydrophobicContact CD2-CD1 4.47Å; L437-L441 HydrophobicContact CG-CD1 3.8Å; L437-L441 HydrophobicContact CG-CG 4.26Å; L437-L441 WeakPolarHBondContact O-CB 3.32Å; L437-L441 VanDerWaalsContact O-CG 3.28Å; L437-L441 WeakPolarHBondContact O-CG 3.31Å; L437-L441 PolarHBondContact O-N 2.89Å
438G96.8Very high95.7Very high43 Ų4355.5 Ų55.544%0.44331%0.309SS..Hα-helixtrans-59.3-61.1176.200000113.4K436 A440 L441 K442K436-G438 VanDerWaalsContact C-N 3.26Å; K436-G438 PolarHBondContact O-N 3.24Å; K436-G438 VanDerWaalsContact O-N 3.14Å; G438-A440 VanDerWaalsContact C-N 3.33Å; G438-A440 PolarHBondContact O-N 3.32Å; G438-L441 PolarHBondContact O-N 2.93Å; G438-K442 WeakPolarHBondContact O-CG 3.47Å; G438-K442 PolarHBondContact O-N 3.44Å
439P97.1Very high95.3Very high15 Ų1559.8 Ų59.810%0.09732%0.322CS..Hα-helixtrans-51.2-44.8170.2-31.135.3000114.5Y407 L435 K436 K442 I443Y407-P439 HydrophobicContact CD2-CB 4.02Å; Y407-P439 HydrophobicContact CD2-CG 4.47Å; Y407-P439 HydrophobicContact CE2-CB 3.61Å; Y407-P439 HydrophobicContact CE2-CG 3.59Å; L435-P439 HydrophobicContact CD2-CB 4.3Å; L435-P439 HydrophobicContact CG-CB 4.47Å; K436-P439 HydrophobicContact CB-CG 4.36Å; K436-P439 WeakPolarHBondContact O-CD 3.5Å; P439-K442 WeakPolarHBondContact O-CB 3.32Å; P439-K442 PolarHBondContact O-N 3.48Å; P439-I443 WeakPolarHBondContact O-CD1 3.05Å; P439-I443 WeakPolarHBondContact O-CG1 3.4Å; P439-I443 PolarHBondContact O-N 2.88Å
440A97.2Very high94.9Very high0 Ų063.5 Ų63.50%034%0.336CS..Hα-helixtrans-59.7-50.6179.200000111.9L429 L430 L435 K436 L437 G438 K442 I443 R444L429-A440 HydrophobicContact CB-CB 3.8Å; L429-A440 HydrophobicContact CD1-CB 3.93Å; L430-A440 HydrophobicContact CD2-CB 4.12Å; L435-A440 HydrophobicContact CB-CB 4.23Å; L435-A440 HydrophobicContact CD2-CB 4.44Å; K436-A440 PolarHBondContact O-N 3.48Å; L437-A440 PolarHBondContact O-N 2.86Å; G438-A440 VanDerWaalsContact C-N 3.33Å; G438-A440 PolarHBondContact O-N 3.32Å; A440-K442 PolarHBondContact O-N 3.39Å; A440-I443 PolarHBondContact O-N 2.8Å; A440-R444 WeakPolarHBondContact O-CG 3.49Å; A440-R444 PolarHBondContact O-N 3.3Å
441L96.7Very high94.2Very high80 Ų8064.5 Ų64.542%0.41934%0.34SS..Hα-helixtrans-62.6-38.7177-71.6172000112.6E426 L437 G438 S445E426-L441 WeakPolarHBondContact OE2-CD2 3.19Å; L437-L441 HydrophobicContact CD1-CD1 3.95Å; L437-L441 HydrophobicContact CD1-CG 3.98Å; L437-L441 HydrophobicContact CD2-CD1 4.47Å; L437-L441 HydrophobicContact CG-CD1 3.8Å; L437-L441 HydrophobicContact CG-CG 4.26Å; L437-L441 WeakPolarHBondContact O-CB 3.32Å; L437-L441 VanDerWaalsContact O-CG 3.28Å; L437-L441 WeakPolarHBondContact O-CG 3.31Å; L437-L441 PolarHBondContact O-N 2.89Å; G438-L441 PolarHBondContact O-N 2.93Å; L441-S445 VanDerWaalsContact O-CB 3.28Å; L441-S445 WeakPolarHBondContact O-CB 3.36Å; L441-S445 PolarHBondContact O-N 2.89Å
442K95.9Very high93.1Very high84 Ų8461.1 Ų61.137%0.36534%0.337SS..Hα-helixtrans-58.5-47.9173.6-79.1178.9171-171.70111.7I401 P402 T403 G438 P439 A440 S445 Q446I401-K442 HydrophobicContact CG2-CB 4.41Å; P402-K442 PolarHBondContact O-NZ 2.9Å; T403-K442 PolarHBondContact OG1-NZ 3.5Å; G438-K442 WeakPolarHBondContact O-CG 3.47Å; G438-K442 PolarHBondContact O-N 3.44Å; P439-K442 WeakPolarHBondContact O-CB 3.32Å; P439-K442 PolarHBondContact O-N 3.48Å; A440-K442 PolarHBondContact O-N 3.39Å; K442-S445 PolarHBondContact O-N 3.21Å; K442-Q446 WeakPolarHBondContact O-CG 3.43Å; K442-Q446 PolarHBondContact O-N 2.91Å
443I95.8Very high91.2Very high2 Ų260.2 Ų60.21%0.0133%0.334CS..Hα-helixtrans-66.3-49.3-178.5-69.5159.6000110.1I398 I401 C404 F411 L435 P439 A440 S445 Q446 V447I398-I443 HydrophobicContact CD1-CB 4.36Å; I398-I443 HydrophobicContact CD1-CD1 3.93Å; I398-I443 HydrophobicContact CD1-CG1 3.82Å; I398-I443 HydrophobicContact CD1-CG2 3.61Å; I398-I443 HydrophobicContact CG2-CD1 4.29Å; I401-I443 HydrophobicContact CD1-CG1 4.02Å; C404-I443 HydrophobicContact CB-CD1 4.24Å; C404-I443 HydrophobicContact CB-CG1 4.42Å; F411-I443 HydrophobicContact CE2-CD1 4.17Å; F411-I443 HydrophobicContact CZ-CD1 4.11Å; F411-I443 HydrophobicContact CZ-CG2 4.19Å; L435-I443 HydrophobicContact CD2-CD1 3.5Å; P439-I443 WeakPolarHBondContact O-CD1 3.05Å; P439-I443 WeakPolarHBondContact O-CG1 3.4Å; P439-I443 PolarHBondContact O-N 2.88Å; A440-I443 PolarHBondContact O-N 2.8Å; I443-S445 VanDerWaalsContact C-N 3.26Å; I443-S445 PolarHBondContact O-N 2.95Å; I443-Q446 PolarHBondContact O-N 3.42Å; I443-Q446 VanDerWaalsContact O-N 3.09Å; I443-V447 HydrophobicContact CG2-CG2 4.24Å; I443-V447 WeakPolarHBondContact O-CG2 3.29Å; I443-V447 PolarHBondContact O-N 3.42Å
444R94.6Very high89Confident101 Ų10166.1 Ų66.138%0.38136%0.363SS..Hα-helixtrans-55-40.5175.3-67.8-178.670.5-131.5-6.9112.4E426 L429 A440 S448E426-R444 IonicContact OE2-CZ 3.77Å; E426-R444 IonicContact OE2-NH1 3.64Å; E426-R444 PolarHBondContact OE2-NH1 2.78Å; L429-R444 HydrophobicContact CD1-CG 3.54Å; A440-R444 WeakPolarHBondContact O-CG 3.49Å; A440-R444 PolarHBondContact O-N 3.3Å; R444-S448 VanDerWaalsContact O-CB 3.28Å; R444-S448 WeakPolarHBondContact O-CB 3.38Å; R444-S448 PolarHBondContact O-N 2.89Å; R444-S448 PolarHBondContact O-OG 3.09Å
445S93.6Very high86.8Confident65 Ų6569.9 Ų69.946%0.45537%0.367SS..Hα-helixtrans-63.3-49175-174.40000112.2L441 K442 I443 S448 R449L441-S445 VanDerWaalsContact O-CB 3.28Å; L441-S445 WeakPolarHBondContact O-CB 3.36Å; L441-S445 PolarHBondContact O-N 2.89Å; K442-S445 PolarHBondContact O-N 3.21Å; I443-S445 VanDerWaalsContact C-N 3.26Å; I443-S445 PolarHBondContact O-N 2.95Å; S445-S448 PolarHBondContact O-N 3.44Å; S445-R449 WeakPolarHBondContact O-CG 3.41Å; S445-R449 PolarHBondContact O-N 2.96Å
446Q93.2Very high84.5Confident57 Ų5776.4 Ų76.427%0.26639%0.392SS..Hα-helixtrans-66.9-40.6-178.5-65.9-76.146.700112.6F397 I401 K442 I443 R449 R450F397-Q446 HydrophobicContact CE2-CB 4.15Å; F397-Q446 HydrophobicContact CZ-CB 3.69Å; I401-Q446 HydrophobicContact CD1-CB 4.01Å; I401-Q446 HydrophobicContact CD1-CG 4Å; I401-Q446 HydrophobicContact CG1-CG 4.23Å; K442-Q446 WeakPolarHBondContact O-CG 3.43Å; K442-Q446 PolarHBondContact O-N 2.91Å; I443-Q446 PolarHBondContact O-N 3.42Å; I443-Q446 VanDerWaalsContact O-N 3.09Å; Q446-R449 PolarHBondContact O-N 3.44Å; Q446-R450 WeakPolarHBondContact O-CG 3.45Å; Q446-R450 PolarHBondContact O-N 3.28Å
447V93.5Very high82Confident9 Ų975.9 Ų75.96%0.05539%0.394CS..Hα-helixtrans-60.7-45.9172.6173.60000110.3I386 F397 L421 I443 R449 R450 M451I386-V447 HydrophobicContact CD1-CG1 4.23Å; F397-V447 HydrophobicContact CE1-CG2 3.71Å; F397-V447 HydrophobicContact CZ-CG2 4.01Å; L421-V447 HydrophobicContact CD1-CG2 3.85Å; L421-V447 HydrophobicContact CD2-CG2 3.89Å; L421-V447 HydrophobicContact CG-CG1 4.44Å; L421-V447 HydrophobicContact CG-CG2 3.77Å; I443-V447 HydrophobicContact CG2-CG2 4.24Å; I443-V447 WeakPolarHBondContact O-CG2 3.29Å; I443-V447 PolarHBondContact O-N 3.42Å; V447-R449 VanDerWaalsContact C-N 3.3Å; V447-R449 PolarHBondContact O-N 2.82Å; V447-R450 PolarHBondContact O-N 3.49Å; V447-M451 HydrophobicContact CG1-CE 3.61Å; V447-M451 WeakPolarHBondContact O-CB 3.37Å; V447-M451 PolarHBondContact O-N 3.09Å
448S89.8Confident79.7Confident48 Ų4877.5 Ų77.534%0.33640%0.402SS..Hα-helixtrans-62.3-34.1177.6-58.60000113.3R444 S445R444-S448 VanDerWaalsContact O-CB 3.28Å; R444-S448 WeakPolarHBondContact O-CB 3.38Å; R444-S448 PolarHBondContact O-N 2.89Å; R444-S448 PolarHBondContact O-OG 3.09Å; S445-S448 PolarHBondContact O-N 3.44Å
449R88.8Confident77.3Confident170 Ų17082.6 Ų82.664%0.64242%0.419SS*.Hα-helixtrans-69.6-46.1174.4-71175.472.5-127.9-2.6111.7S445 Q446 V447 M451 G452S445-R449 WeakPolarHBondContact O-CG 3.41Å; S445-R449 PolarHBondContact O-N 2.96Å; Q446-R449 PolarHBondContact O-N 3.44Å; V447-R449 VanDerWaalsContact C-N 3.3Å; V447-R449 PolarHBondContact O-N 2.82Å; R449-M451 VanDerWaalsContact C-N 3.29Å; R449-M451 PolarHBondContact O-N 3.42Å; R449-G452 PolarHBondContact O-N 3.02Å
450R87.3Confident74.4Confident79 Ų7988.2 Ų88.230%0.29845%0.448SS..Hα-helixtrans-61.8-34.3176.8-76.9-75.1-166.2-171.45.8112.4E381 I386 W389 F397 Q446 V447 G452E381-R450 IonicContact OE2-CZ 2.7Å; E381-R450 IonicContact OE2-NH1 2.86Å; E381-R450 PolarHBondContact OE2-NH1 3.16Å; E381-R450 IonicContact OE2-NH2 3.69Å; E381-R450 PolarHBondContact OE2-NH2 3.37Å; I386-R450 HydrophobicContact CD1-CB 3.48Å; I386-R450 VanDerWaalsContact CD1-CB 3.48Å; I386-R450 HydrophobicContact CG1-CB 3.98Å; W389-R450 HydrophobicContact CH2-CG 4.18Å; F397-R450 HydrophobicContact CE2-CG 4.23Å; Q446-R450 WeakPolarHBondContact O-CG 3.45Å; Q446-R450 PolarHBondContact O-N 3.28Å; V447-R450 PolarHBondContact O-N 3.49Å; R450-G452 PolarHBondContact O-N 3.39Å; R450-G452 VanDerWaalsContact O-N 3.16Å
451M83.9Confident72Confident75 Ų7594.3 Ų94.337%0.36949%0.487SS..THydrogen-bonded Turntrans-65.2-15.5-179.3-148.678.367.100114.5I386 P422 V447 R449 S453I386-M451 HydrophobicContact CD1-CB 4.4Å; I386-M451 HydrophobicContact CD1-CE 3.92Å; I386-M451 HydrophobicContact CD1-SD 3.85Å; P422-M451 HydrophobicContact CB-CE 3.53Å; P422-M451 HydrophobicContact CB-SD 4.28Å; P422-M451 HydrophobicContact CG-CE 3.8Å; P422-M451 HydrophobicContact CG-SD 4.23Å; V447-M451 HydrophobicContact CG1-CE 3.61Å; V447-M451 WeakPolarHBondContact O-CB 3.37Å; V447-M451 PolarHBondContact O-N 3.09Å; R449-M451 VanDerWaalsContact C-N 3.29Å; R449-M451 PolarHBondContact O-N 3.42Å; M451-S453 VanDerWaalsContact C-N 3.29Å; M451-S453 PolarHBondContact O-N 3.49Å; M451-S453 VanDerWaalsContact O-N 3.12Å
452G72.7Confident69.3Low64 Ų6497.8 Ų97.866%0.6651%0.506SS*.  trans66.712.8170.700000117.3R449 R450R449-G452 PolarHBondContact O-N 3.02Å; R450-G452 PolarHBondContact O-N 3.39Å; R450-G452 VanDerWaalsContact O-N 3.16Å
453S56.9Low66.5Low65 Ų6599 Ų9946%0.45553%0.525SS..SBendtrans-148.8125.2-178.8-1650000117M451 M455M451-S453 VanDerWaalsContact C-N 3.29Å; M451-S453 PolarHBondContact O-N 3.49Å; M451-S453 VanDerWaalsContact O-N 3.12Å; S453-M455 VanDerWaalsContact C-N 3.29Å; S453-M455 PolarHBondContact O-N 3.35Å
454M49.1Very low63.7Low138 Ų138102.9 Ų102.968%0.6857%0.565SS**SBendtrans48.2-37.3147.3-67.2171.557.100122.3Y456 M457M454-Y456 PolarHBondContact O-N 2.85Å; M454-M457 PolarHBondContact O-N 3.15Å
455M49.1Very low60.9Low135 Ų135103 Ų10367%0.66559%0.588SS**G310 helixtrans-71.2-25.8-163-59.6-58.6-77.400114.4S453 M457 L458S453-M455 VanDerWaalsContact C-N 3.29Å; S453-M455 PolarHBondContact O-N 3.35Å; M455-M457 VanDerWaalsContact C-N 3.3Å; M455-M457 PolarHBondContact O-N 3.26Å; M455-L458 PolarHBondContact O-N 3.48Å; M455-L458 HydrophobicContact SD-CD1 4.07Å
456Y48.6Very low58.4Low144 Ų144104.2 Ų104.257%0.56560%0.602SS**G310 helixtrans-75.3-13.7-176.569.5-96.4000114.5M454M454-Y456 PolarHBondContact O-N 2.85Å
457M44.7Very low55.6Low130 Ų130110 Ų11064%0.6463%0.633SS**G310 helixtrans-93.4-11.3175.4-67.4-166.7-67.400113.7M454 M455 N459M454-M457 PolarHBondContact O-N 3.15Å; M455-M457 VanDerWaalsContact C-N 3.3Å; M455-M457 PolarHBondContact O-N 3.26Å; M457-N459 VanDerWaalsContact C-N 3.32Å; M457-N459 PolarHBondContact O-N 3.27Å
458L48.4Very low52.8Low124 Ų124118.4 Ų118.465%0.64967%0.672SS**THydrogen-bonded Turntrans-77.6-16.8-178.1-71.7170.6000113.7M455M455-L458 PolarHBondContact O-N 3.48Å; M455-L458 HydrophobicContact SD-CD1 4.07Å
459N45.9Very low49.9Very low150 Ų150121 Ų12180%0.80270%0.697SS**THydrogen-bonded Turntrans-122.316.9-174-70.2-44.5000114.1M457M457-N459 VanDerWaalsContact C-N 3.32Å; M457-N459 PolarHBondContact O-N 3.27Å
460L37.1Very low47.2Very low132 Ų132118 Ų11869%0.69171%0.708SS**SBendtrans-139.2119.6174.1-153.777.6000111.1L462L460-L462 PolarHBondContact O-N 3.14Å; L460-L462 VanDerWaalsContact O-N 3.09Å
461P46.5Very low44.5Very low128 Ų128119.7 Ų119.783%0.83173%0.732SS**  trans-8486.5-172.833-35.1000111.8
462L39.3Very low41.9Very low153 Ų153125.5 Ų125.580%0.80176%0.758SS**  trans-144142.2166.7-160.558.1000114.6L460L460-L462 PolarHBondContact O-N 3.14Å; L460-L462 VanDerWaalsContact O-N 3.09Å
463S36.8Very low40.3Very low110 Ų110132 Ų13277%0.76977%0.768SS**  trans-32.3124-178.7-51.40000116.5
464G38.2Very low39.4Very low83 Ų83135.1 Ų135.186%0.85679%0.787SS**PPolyproline II helixtrans-68.9132.716900000112.4
465A36.5Very low38.5Very low104 Ų104132 Ų13286%0.8679%0.79SS**PPolyproline II helixtrans-96.1136.8162.900000109.2
466A39.2Very low37.6Very low91 Ų91133 Ų13375%0.75280%0.798SS**PPolyproline II helixtrans-84.2143.8-176.600000112.3
467L36.3Very low37Very low177 Ų177137.8 Ų137.893%0.92782%0.816SS**  trans-115.9146.5151.5-79.1176.4000109.4
468Q33.5Very low36.4Very low187 Ų187137 Ų13787%0.87482%0.822SS**  trans-96.9126.4-163.1-61.7168.59.500110.3A470Q468-A470 PolarHBondContact O-N 3.45Å
469A29.4Very low36.6Very low103 Ų103136.4 Ų136.485%0.85183%0.826SS**  trans-76.5110.616200000108.5
470A30.8Very low35.9Very low105 Ų105138.8 Ų138.887%0.86883%0.833SS**  trans-66.9144169.900000110.1Q468Q468-A470 PolarHBondContact O-N 3.45Å
471S31.8Very low35.9Very low116 Ų116141.6 Ų141.681%0.81184%0.844SS**  trans-125.8123.8-178.2178.20000109.4
472E29.4Very low35.1Very low196 Ų196139.2 Ų139.292%0.91684%0.843SS**  trans-117.2161.4170.8-69.1-148.186.500111.5
473K38Very low34.8Very low201 Ų201137.4 Ų137.487%0.87484%0.843SS**  trans-90.3159.5-155.4-99.1-173.4165-1770115.2
474P38.4Very low35.7Very low130 Ų130137.4 Ų137.484%0.84484%0.841SS**  trans-82.1158.3173.135.5-35.4000113
475G30.3Very low35.5Very low73 Ų73139.6 Ų139.675%0.75384%0.837SS**  trans-161.6137.8169.200000111.7
476D30.3Very low35.4Very low155 Ų155140.5 Ų140.583%0.82983%0.828SS**  trans-52.5144.4-170.3-65.5-90000117
477R35.5Very low35Very low246 Ų246141.5 Ų141.593%0.92883%0.828SS**  -151160.3101.9-74.9-141.4169.478.14.2111.4
478S32Very low34.7Very low112 Ų112138.9 Ų138.978%0.78382%0.815SS**  trans-114.2-173.3-169.5-136.50000111.2
479P52.8Low34.8Very low113 Ų113135.8 Ų135.873%0.73481%0.814SS**  -122.1172.9-121.538.6-21.2000115.2
480E31.1Very low35Very low200 Ų200139.2 Ų139.294%0.93581%0.812SS**  trans-149.9177.8153.4-129.2177.7149.700113
481M37.3Very low35.1Very low190 Ų190142.7 Ų142.794%0.93682%0.816SS**  trans-97.2145.3-149.5-157.270.2162.600114.8
482G31.1Very low35.4Very low78 Ų78145.2 Ų145.280%0.80482%0.817SS**  trans-177.8106.6171.200000114.9
483S32.2Very low36Very low115 Ų115142.8 Ų142.880%0.80482%0.815SS**  trans-162158.7175.9-166.10000107.7
484P54.8Low35.7Very low110 Ų110138 Ų13871%0.71481%0.813SS**  cis-128.9-168.65.843.4-28.2000113.5
485V35.1Very low35.5Very low130 Ų130137.3 Ų137.379%0.78881%0.812SS**  -162.9146.6118.51390000109.9
486N33.4Very low36.2Very low123 Ų123139.5 Ų139.566%0.65881%0.812SS**  trans-106.6145177.7175.441000110.3
487C31.1Very low36.3Very low111 Ų111143.5 Ų143.575%0.7582%0.816SS**  trans-125.986.3174.4-67.60000110.9
488N31.2Very low36.1Very low122 Ų122138.5 Ų138.565%0.65281%0.808SS**  trans-79.7160.8152.8-72.2-28.9000109.1
489S33.9Very low36.7Very low122 Ų122138.6 Ų138.685%0.85381%0.806SS**  trans-139.3125.8164.6-65.10000108.3
490E33.9Very low35.6Very low176 Ų176141 Ų14182%0.82281%0.807SS**  trans-109119.2-175-67170.889.500109M492E490-M492 PolarHBondContact O-N 3.47Å
491D33.4Very low36Very low178 Ų178138.3 Ų138.395%0.95280%0.804SS**  trans-77.6111.7171.9-103.5-59.9000109.9
492M38.3Very low35.9Very low169 Ų169136.5 Ų136.583%0.83380%0.796SS**  trans-108.4124.3177.1-76.6-146.576.100112.2E490E490-M492 PolarHBondContact O-N 3.47Å
493V42.5Very low36Very low145 Ų145141.4 Ų141.488%0.87980%0.796SS**  trans-80122.2174.8-73.40000112.1
494A31.3Very low36Very low100 Ų100141.4 Ų141.483%0.82680%0.796SS**  trans-154.2135.1165.100000111.7
495S34.5Very low34.9Very low116 Ų116141.7 Ų141.781%0.81180%0.795SS**  trans-108.8137.6175.8159.90000111.1
496P43.9Very low34.7Very low118 Ų118144.5 Ų144.577%0.76680%0.8SS**  trans-99.8175.6154.3-4.825.9000112
497R32.8Very low34.5Very low240 Ų240146.2 Ų146.291%0.90680%0.803SS**  trans-102164.2-168.7-65.4173.4172.2149.4-3.5114.2
498D31.1Very low34.6Very low141 Ų141149.5 Ų149.575%0.75481%0.813SS**  trans-33.3151.8148.6-105.2-64.2000113.9E500D498-E500 PolarHBondContact OD1-N 2.96Å
499P45.3Very low34.7Very low114 Ų114151.1 Ų151.174%0.7482%0.816SS**  -137.2154.75239.1-23000117.5
500E29Very low34.6Very low164 Ų164154.5 Ų154.577%0.76682%0.818SS**  -178.8144.8105.1-98.1-170.9164.900113.7D498D498-E500 PolarHBondContact OD1-N 2.96Å
501V39Very low34.7Very low142 Ų142150.6 Ų150.686%0.86182%0.816SS**  trans-103.81111791750000110.3
502I36.5Very low34.7Very low152 Ų152151.3 Ų151.378%0.77981%0.814SS**  trans-122.2143.9164.9-61.8-175.6000109.8
503K33.5Very low34.6Very low182 Ų182150.9 Ų150.979%0.79182%0.815SS**  trans-111.9126.7-161.9173.7-171.4-179.9-175.80110.3
504S31.4Very low34.3Very low115 Ų115149.2 Ų149.280%0.80481%0.81SS**  trans-124145.8170.3-64.20000110.9
505T30.7Very low34.5Very low115 Ų115149.9 Ų149.971%0.70681%0.808SS**  trans-152.897.3-174.7-600000110.1
506E31.4Very low35.4Very low190 Ų190150.1 Ų150.189%0.88881%0.807SS**  trans-138.1107.1169.5-62.9-178.2115.500104.6
507H30.6Very low35.8Very low158 Ų158149.9 Ų149.973%0.73181%0.805SS**  69.479.758.2-150.386.2000112H509H507-H509 AromaticContact NE2-ND1 3.97Å
508L32.6Very low36.1Very low180 Ų180143.4 Ų143.494%0.94280%0.797SS**  trans-104.4129.2169.6-107.2166.5000108.6
509H33.4Very low36.6Very low156 Ų156140.9 Ų140.972%0.72280%0.796SS**  trans-152.188.9-166-159.7-147.5000111.4H507H507-H509 AromaticContact NE2-ND1 3.97Å
510E31.6Very low36.3Very low193 Ų193140.6 Ų140.690%0.90280%0.797SS**  trans-169.3114.1163.9-106163.3168.500105.4
511A35.8Very low37Very low94 Ų94137.3 Ų137.378%0.77779%0.792SS**  cis90.784.533.900000114.3
512E34.3Very low37.3Very low194 Ų194137.7 Ų137.791%0.90778%0.784SS**  trans-147.7163.7146.6-123.5-171.4116.600111.9
513N35.5Very low37.8Very low159 Ų159137.8 Ų137.885%0.8578%0.783SS**  trans-109.6141.3-164.2-73.5-85000113.8
514S35.6Very low38.4Very low111 Ų111137.2 Ų137.278%0.77681%0.812SS**  trans-160.7109.5147.158.60000114.6
515S36.4Very low38.7Very low113 Ų113138.3 Ų138.379%0.7981%0.812SS**  trans61.8121.9144.8-550000122.8
516P52.9Low39.1Very low122 Ų122139.5 Ų139.579%0.79282%0.818SS**  trans-80.6-174.4155.639.4-36.2000110.4
517P52.6Low39.6Very low112 Ų112136.7 Ų136.773%0.72781%0.814SS**  cis-132177.114.338-15.6000114.9
518S38Very low40.1Very low104 Ų104135.5 Ų135.573%0.72782%0.819SS**  -178.5159.173.2-57.90000113.3
519A41.7Very low40.6Very low89 Ų89132.7 Ų132.774%0.73681%0.811SS**  trans35.6141.5141.500000121.3
520S40.2Very low41Very low108 Ų108131.1 Ų131.176%0.75582%0.817SS**  cis-169.9-174.6-4.5-940000108.3
521S42.9Very low41.7Very low95 Ų95126.7 Ų126.766%0.66481%0.811SS**  trans19.8139.1145.4-81.40000119.7
522E45.4Very low42.2Very low150 Ų150129.2 Ų129.270%0.70181%0.814SS**  cis178.3171.830.3-120.7158.679.200106.4
523M48Very low42.8Very low154 Ų154123.8 Ų123.876%0.75981%0.806SS**  cis-159.1164.3-2.9-158.8177.1-126.900108.5
524A44.7Very low43.5Very low169 Ų169120.6 Ų120.6100%1.39780%0.802SS**  trans570156.600000118

Retrieved 524 of 524 residues in 293.4 ms (Link to these results)