A0A061IQY7_CRIGR Loading...

Pre B cell leukemia homeobox 4

AlphaFold DB , UniProt , Accession A0A061IQY7, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Pbx4, Length 379 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
1M51.4Low54.3Low250 Ų250155 Ų155100%1.23288%0.876SS**  0109.70-80.7-162.3166.400108.9
2A46.2Very low54.2Low105 Ų105152.3 Ų152.387%0.86887%0.87SS**  trans177.5125.1155.700000106.9
3A48.3Very low54.8Low96 Ų96147.1 Ų147.179%0.79386%0.856SS**PPolyproline II helixtrans-82.7155.9-172.200000112.9
4P56.3Low54.7Low129 Ų129145.6 Ų145.684%0.83885%0.854SS**PPolyproline II helixtrans-88.9135.9158.12.417.3000110.9
5L56.4Low54.7Low174 Ų174152.1 Ų152.191%0.91186%0.858SS**PPolyproline II helixtrans-61.6130.1-175.6-69.3149.2000112.6
6R57.8Low54.8Low239 Ų239157.3 Ų157.390%0.90286%0.86SS**PPolyproline II helixtrans-80.9137.1167-126.1179.1178.3-173.7-1.1109
7P61.1Low54.6Low119 Ų119155.3 Ų155.377%0.77386%0.856SS**PPolyproline II helixtrans-65.4142.1173-12.326.5000110.3
8A61.5Low54.7Low90 Ų90151.5 Ų151.574%0.74485%0.849SS**PPolyproline II helixtrans-61140.5177.600000111.5
9P51.8Low54.4Low126 Ų126150.2 Ų150.282%0.81885%0.847SS**PPolyproline II helixtrans-70133172.627.7-30.2000110.3
10Q55.8Low54.3Low190 Ų190147.4 Ų147.489%0.88884%0.844SS**PPolyproline II helixtrans-59.8136.3173-68.6179.3-15.100110.3
11Q51.3Low54.4Low187 Ų187144.2 Ų144.287%0.87484%0.836SS**PPolyproline II helixtrans-63.7139176-69.6-168.3-2600110.9
12P52.7Low54.4Low123 Ų123138.2 Ų138.280%0.79982%0.815SS**PPolyproline II helixtrans-71.4132.5176.128-30.2000110.3
13A62.3Low54.9Low84 Ų84142 Ų14269%0.69482%0.82SS**PPolyproline II helixtrans-54.5148.3172.800000111.5R15A13-R15 PolarHBondContact O-N 3.46Å; A13-R15 VanDerWaalsContact O-N 3.16Å
14P53Low55.1Low127 Ų127139.5 Ų139.583%0.82580%0.803SS**PPolyproline II helixtrans-63.4121.5-178.425.3-31.9000110.1R16P14-R16 PolarHBondContact O-N 3.32Å
15R54.1Low55.3Low243 Ų243144.6 Ų144.692%0.91781%0.806SS**PPolyproline II helixtrans-61.7124.8172.3-68.5-174.1178.9-144.50.3108.5A13A13-R15 PolarHBondContact O-N 3.46Å; A13-R15 VanDerWaalsContact O-N 3.16Å
16R57.1Low55.8Low235 Ų235141.1 Ų141.189%0.88779%0.788SS**PPolyproline II helixtrans-54.7134.2165.4-80.2-178.1174.5-179.7-1.9108.7P14 A18P14-R16 PolarHBondContact O-N 3.32Å; R16-A18 PolarHBondContact O-N 3.16Å
17P50.7Low56.8Low123 Ų123134.9 Ų134.980%0.79978%0.777SS**PPolyproline II helixtrans-64.2136172.623.3-26.3000109.3
18A56.3Low57.9Low87 Ų87132.4 Ų132.472%0.71976%0.762SS**PPolyproline II helixtrans-60144.9172.600000109.7R16 A20R16-A18 PolarHBondContact O-N 3.16Å; A18-A20 PolarHBondContact O-N 3.16Å; A18-A20 VanDerWaalsContact O-N 3.16Å
19P48.9Very low59Low126 Ų126133 Ų13382%0.81875%0.753SS**PPolyproline II helixtrans-59.5124.7176.224.5-30.8000108.6A21P19-A21 PolarHBondContact O-N 3.3Å
20A52.8Low60.5Low94 Ų94130.3 Ų130.378%0.77773%0.734SS**PPolyproline II helixtrans-54.5128.617400000108.8A18A18-A20 PolarHBondContact O-N 3.16Å; A18-A20 VanDerWaalsContact O-N 3.16Å
21A56.6Low61.7Low82 Ų82126.2 Ų126.268%0.67872%0.718SS**PPolyproline II helixtrans-53.7134.6168.300000108.4P19 L23P19-A21 PolarHBondContact O-N 3.3Å; A21-L23 PolarHBondContact O-N 2.63Å
22P52.4Low63.3Low123 Ų123123.5 Ų123.580%0.79971%0.705SS**  trans-67.4100.7-178.721.9-23.7000108.8G24P22-G24 PolarHBondContact O-N 2.98Å
23L55.5Low64.7Low185 Ų185124.1 Ų124.197%0.96970%0.697SS**  trans-70.281.5160.7-80.6167.1000107.3A21A21-L23 PolarHBondContact O-N 2.63Å
24G52.2Low65.5Low43 Ų43124.7 Ų124.744%0.44369%0.688SS.*  trans174.299.8176.500000109.5P22 D26P22-G24 PolarHBondContact O-N 2.98Å; G24-D26 PolarHBondContact O-N 2.95Å
25R60.6Low66.9Low237 Ų237124.9 Ų124.989%0.89468%0.679SS**  trans-58.9108.1141.1-82.9-177.6171.3-173.6-3.7104.1T27R25-T27 PolarHBondContact O-N 2.83Å
26D67.4Low68.2Low100 Ų100115.7 Ų115.754%0.53566%0.655SS.*  trans-54.1129.4-169.6-106-44.1000108.4G24 S28 D29 V30G24-D26 PolarHBondContact O-N 2.95Å; D26-S28 PolarHBondContact O-N 3.12Å; D26-D29 WeakPolarHBondContact O-CB 3.36Å; D26-D29 PolarHBondContact O-N 3.03Å; D26-V30 PolarHBondContact O-N 3.39Å
27T79.3Confident69.1Low109 Ų109109.2 Ų109.267%0.66964%0.637SS**Hα-helixtrans-52.4-27.5172.644.50000110.9R25 V30 L31R25-T27 PolarHBondContact O-N 2.83Å; T27-V30 PolarHBondContact O-N 2.93Å; T27-L31 WeakPolarHBondContact O-CB 3.19Å; T27-L31 WeakPolarHBondContact O-CG 3.22Å; T27-L31 PolarHBondContact O-N 3.12Å
28S83.6Confident70.2Confident67 Ų67108.9 Ų108.947%0.46963%0.633SS.*Hα-helixtrans-59.9-44.9170.4-1610000113.6D26 V30 L31 Q32D26-S28 PolarHBondContact O-N 3.12Å; S28-V30 VanDerWaalsContact C-N 3.33Å; S28-V30 PolarHBondContact O-N 3.49Å; S28-L31 PolarHBondContact O-N 3.46Å; S28-Q32 VanDerWaalsContact O-CB 3.24Å; S28-Q32 WeakPolarHBondContact O-CB 3.49Å; S28-Q32 PolarHBondContact O-N 3.28Å
29D84.3Confident71.3Confident102 Ų102111.6 Ų111.655%0.54564%0.635SS.*Hα-helixtrans-65.3-39.9177.9-74-26.2000111.3D26 Q32 Q33D26-D29 WeakPolarHBondContact O-CB 3.36Å; D26-D29 PolarHBondContact O-N 3.03Å; D29-Q32 PolarHBondContact O-N 3.45Å; D29-Q33 VanDerWaalsContact O-CB 3.25Å; D29-Q33 WeakPolarHBondContact O-CB 3.31Å; D29-Q33 PolarHBondContact O-N 3.48Å
30V83.1Confident72.9Confident70 Ų70108 Ų10842%0.42461%0.608SS.*Hα-helixtrans-66.4-44177179.50000110.5D26 T27 S28 Q33 I34D26-V30 PolarHBondContact O-N 3.39Å; T27-V30 PolarHBondContact O-N 2.93Å; S28-V30 VanDerWaalsContact C-N 3.33Å; S28-V30 PolarHBondContact O-N 3.49Å; V30-Q33 PolarHBondContact O-N 2.96Å; V30-I34 HydrophobicContact CG1-CD1 3.93Å; V30-I34 VanDerWaalsContact O-CG1 3.23Å; V30-I34 WeakPolarHBondContact O-CG1 3.24Å; V30-I34 PolarHBondContact O-N 2.96Å
31L81.3Confident74.4Confident103 Ų103106 Ų10654%0.53959%0.588SS.*Hα-helixtrans-63.7-42.2176.1-75.3170000111.6T27 S28 Q33 I34 M35T27-L31 WeakPolarHBondContact O-CB 3.19Å; T27-L31 WeakPolarHBondContact O-CG 3.22Å; T27-L31 PolarHBondContact O-N 3.12Å; S28-L31 PolarHBondContact O-N 3.46Å; L31-Q33 VanDerWaalsContact C-N 3.31Å; L31-Q33 PolarHBondContact O-N 3.26Å; L31-I34 PolarHBondContact O-N 3.47Å; L31-M35 VanDerWaalsContact O-CG 3.32Å; L31-M35 WeakPolarHBondContact O-CG 3.41Å; L31-M35 PolarHBondContact O-N 3.22Å
32Q84.9Confident75.7Confident131 Ų131108.2 Ų108.261%0.61259%0.588SS**Hα-helixtrans-65.5-37.4177.2-168.7142.415.500111.6S28 D29 M35 A36S28-Q32 VanDerWaalsContact O-CB 3.24Å; S28-Q32 WeakPolarHBondContact O-CB 3.49Å; S28-Q32 PolarHBondContact O-N 3.28Å; D29-Q32 PolarHBondContact O-N 3.45Å; Q32-M35 PolarHBondContact O-N 3.26Å; Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.39Å
33Q81.8Confident77.3Confident136 Ų136108 Ų10864%0.63658%0.58SS**Hα-helixtrans-67.1-37.1172.9-165.3169.134.200112.1D29 V30 L31 A36 I37D29-Q33 VanDerWaalsContact O-CB 3.25Å; D29-Q33 WeakPolarHBondContact O-CB 3.31Å; D29-Q33 PolarHBondContact O-N 3.48Å; V30-Q33 PolarHBondContact O-N 2.96Å; L31-Q33 VanDerWaalsContact C-N 3.31Å; L31-Q33 PolarHBondContact O-N 3.26Å; Q33-A36 PolarHBondContact O-N 2.96Å; Q33-I37 VanDerWaalsContact O-CG1 3.3Å; Q33-I37 WeakPolarHBondContact O-CG1 3.49Å; Q33-I37 PolarHBondContact O-N 3.21Å
34I80.2Confident78.8Confident96 Ų96103.9 Ų103.949%0.49256%0.556SS.*Hα-helixtrans-67.3-43.6174.6-69.8164.5000111.1V30 L31 A36 I37V30-I34 HydrophobicContact CG1-CD1 3.93Å; V30-I34 VanDerWaalsContact O-CG1 3.23Å; V30-I34 WeakPolarHBondContact O-CG1 3.24Å; V30-I34 PolarHBondContact O-N 2.96Å; L31-I34 PolarHBondContact O-N 3.47Å; I34-A36 VanDerWaalsContact C-N 3.29Å; I34-A36 PolarHBondContact O-N 3.5Å; I34-I37 WeakPolarHBondContact O-CB 3.39Å; I34-I37 PolarHBondContact O-N 2.87Å
35M82.3Confident80.1Confident130 Ų130103.9 Ų103.964%0.6455%0.551SS**Hα-helixtrans-63.6-34.8175.9-70.7176.462.600112.1L31 Q32 I37 T38L31-M35 VanDerWaalsContact O-CG 3.32Å; L31-M35 WeakPolarHBondContact O-CG 3.41Å; L31-M35 PolarHBondContact O-N 3.22Å; Q32-M35 PolarHBondContact O-N 3.26Å; M35-I37 PolarHBondContact O-N 3.43Å; M35-T38 PolarHBondContact O-N 3.3Å; M35-T38 PolarHBondContact O-OG1 3.25Å
36A80.1Confident81.2Confident50 Ų5097.5 Ų97.541%0.41353%0.532SS..Hα-helixtrans-72.6-13.8174.200000113.9Q32 Q33 I34 Q40Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.39Å; Q33-A36 PolarHBondContact O-N 2.96Å; I34-A36 VanDerWaalsContact C-N 3.29Å; I34-A36 PolarHBondContact O-N 3.5Å; A36-Q40 PolarHBondContact O-NE2 3Å
37I77.8Confident82Confident99 Ų9995.6 Ų95.651%0.50853%0.53SS..Hα-helixtrans-78.2-29.9172.4-67.2164000110.5Q33 I34 M35 D39 Q40Q33-I37 VanDerWaalsContact O-CG1 3.3Å; Q33-I37 WeakPolarHBondContact O-CG1 3.49Å; Q33-I37 PolarHBondContact O-N 3.21Å; I34-I37 WeakPolarHBondContact O-CB 3.39Å; I34-I37 PolarHBondContact O-N 2.87Å; M35-I37 PolarHBondContact O-N 3.43Å; I37-D39 VanDerWaalsContact C-N 3.25Å; I37-D39 PolarHBondContact O-N 2.92Å; I37-Q40 WeakPolarHBondContact O-CB 3.43Å; I37-Q40 PolarHBondContact O-N 3.38Å
38T74Confident82.1Confident117 Ų11796.6 Ų96.672%0.71852%0.522SS*.Hα-helixtrans-67.5-24.9176.119.30000113.6M35M35-T38 PolarHBondContact O-N 3.3Å; M35-T38 PolarHBondContact O-OG1 3.25Å
39D77.9Confident82.1Confident143 Ų14399.3 Ų99.377%0.76553%0.525SS*.THydrogen-bonded Turntrans-91.2-1177.5-59.7-37.1000113.3I37I37-D39 VanDerWaalsContact C-N 3.25Å; I37-D39 PolarHBondContact O-N 2.92Å
40Q82.2Confident82.1Confident52 Ų52100.4 Ų100.424%0.24353%0.527CS..  trans-78.3132.6-179-113.9154.575.500111.5A36 I37 E44A36-Q40 PolarHBondContact O-NE2 3Å; I37-Q40 WeakPolarHBondContact O-CB 3.43Å; I37-Q40 PolarHBondContact O-N 3.38Å; Q40-E44 HydrophobicContact CG-CB 4.46Å
41S85.3Confident82.3Confident52 Ų52100.1 Ų100.136%0.36453%0.532SS..  trans-65.9149.217170.60000110.9D43 E44 A45S41-D43 PolarHBondContact O-N 3.24Å; S41-E44 PolarHBondContact O-N 3.48Å; S41-E44 WeakPolarHBondContact OG-CB 3.48Å; S41-E44 VanDerWaalsContact OG-CG 3.25Å; S41-E44 WeakPolarHBondContact OG-CG 3.21Å; S41-E44 PolarHBondContact OG-N 3.22Å; S41-A45 PolarHBondContact O-N 3.04Å; S41-A45 VanDerWaalsContact O-N 3.1Å
42L84.3Confident82.3Confident128 Ų128101.1 Ų101.167%0.6754%0.537SS*.Hα-helixtrans-56.8-36.6176.5-177.862.8000111.3A45 Q46L42-A45 PolarHBondContact O-N 2.97Å; L42-Q46 WeakPolarHBondContact O-CB 3.22Å; L42-Q46 VanDerWaalsContact O-CG 3.22Å; L42-Q46 WeakPolarHBondContact O-CG 3.39Å; L42-Q46 PolarHBondContact O-N 3.27Å
43D85.7Confident82.2Confident119 Ų11998.1 Ų98.164%0.63653%0.525SS*.Hα-helixtrans-68.1-41.7178.9-70.7-23.3000112.4S41 Q46 A47S41-D43 PolarHBondContact O-N 3.24Å; D43-Q46 PolarHBondContact O-N 3.37Å; D43-A47 WeakPolarHBondContact O-CB 3.12Å; D43-A47 PolarHBondContact O-N 3.24Å
44E85.8Confident82.4Confident98 Ų9895.7 Ų95.746%0.45852%0.522SS..Hα-helixtrans-63.9-41.5175-79.4173.9-150.300112.2Q40 S41 Q46 A47 R48Q40-E44 HydrophobicContact CG-CB 4.46Å; S41-E44 PolarHBondContact O-N 3.48Å; S41-E44 WeakPolarHBondContact OG-CB 3.48Å; S41-E44 VanDerWaalsContact OG-CG 3.25Å; S41-E44 WeakPolarHBondContact OG-CG 3.21Å; S41-E44 PolarHBondContact OG-N 3.22Å; E44-Q46 VanDerWaalsContact C-N 3.35Å; E44-A47 PolarHBondContact O-N 3.4Å; E44-R48 WeakPolarHBondContact O-CG 3.35Å; E44-R48 PolarHBondContact O-N 2.95Å
45A80.9Confident82.8Confident42 Ų4296.1 Ų96.135%0.34752%0.522SS..Hα-helixtrans-64.1-40.917600000111.5S41 L42 R48 K49S41-A45 PolarHBondContact O-N 3.04Å; S41-A45 VanDerWaalsContact O-N 3.1Å; L42-A45 PolarHBondContact O-N 2.97Å; A45-R48 PolarHBondContact O-N 3.49Å; A45-K49 WeakPolarHBondContact O-CB 3.3Å; A45-K49 PolarHBondContact O-N 3.32Å
46Q82.7Confident83.2Confident103 Ų103101.8 Ų101.848%0.48154%0.536SS..Hα-helixtrans-65.4-41.1175.3-74.4-179.815.800112.3L42 D43 E44 K49 H50L42-Q46 WeakPolarHBondContact O-CB 3.22Å; L42-Q46 VanDerWaalsContact O-CG 3.22Å; L42-Q46 WeakPolarHBondContact O-CG 3.39Å; L42-Q46 PolarHBondContact O-N 3.27Å; D43-Q46 PolarHBondContact O-N 3.37Å; E44-Q46 VanDerWaalsContact C-N 3.35Å; Q46-K49 WeakPolarHBondContact O-CB 3.24Å; Q46-K49 PolarHBondContact O-N 3.05Å; Q46-H50 WeakPolarHBondContact O-CB 3.25Å; Q46-H50 PolarHBondContact O-N 3.38Å
47A84.6Confident83.6Confident61 Ų61104.5 Ų104.550%0.50454%0.542SS..Hα-helixtrans-62.8-43.9176.300000111.9D43 E44 H50 A51D43-A47 WeakPolarHBondContact O-CB 3.12Å; D43-A47 PolarHBondContact O-N 3.24Å; E44-A47 PolarHBondContact O-N 3.4Å; A47-H50 WeakPolarHBondContact O-CB 3.45Å; A47-H50 PolarHBondContact O-N 3.49Å; A47-A51 PolarHBondContact O-N 2.89Å
48R82.4Confident84Confident130 Ų130102.3 Ų102.349%0.49153%0.528SS..Hα-helixtrans-63.9-42.7175.5-70.9177.4-170.5174.76.6112.3E44 A45 H50 A51 L52E44-R48 WeakPolarHBondContact O-CG 3.35Å; E44-R48 PolarHBondContact O-N 2.95Å; A45-R48 PolarHBondContact O-N 3.49Å; R48-H50 VanDerWaalsContact C-N 3.29Å; R48-H50 PolarHBondContact O-N 2.99Å; R48-A51 PolarHBondContact O-N 2.88Å; R48-L52 PolarHBondContact O-N 3.33Å
49K81.8Confident84.5Confident124 Ų124101.3 Ų101.354%0.53953%0.526SS..Hα-helixtrans-58.3-42.2171.9172.9-172.9165.2-174.20111.3A45 Q46 N53A45-K49 WeakPolarHBondContact O-CB 3.3Å; A45-K49 PolarHBondContact O-N 3.32Å; Q46-K49 WeakPolarHBondContact O-CB 3.24Å; Q46-K49 PolarHBondContact O-N 3.05Å; K49-N53 WeakPolarHBondContact O-CB 3.38Å; K49-N53 PolarHBondContact O-N 2.89Å; K49-N53 PolarHBondContact O-ND2 3.42Å
50H84.9Confident84.9Confident125 Ų12597.2 Ų97.258%0.57951%0.512SS*.Hα-helixtrans-65.9-45.8178.4-171.255.3000111.8Q46 A47 R48 L52 N53 C54Q46-H50 WeakPolarHBondContact O-CB 3.25Å; Q46-H50 PolarHBondContact O-N 3.38Å; A47-H50 WeakPolarHBondContact O-CB 3.45Å; A47-H50 PolarHBondContact O-N 3.49Å; R48-H50 VanDerWaalsContact C-N 3.29Å; R48-H50 PolarHBondContact O-N 2.99Å; H50-L52 VanDerWaalsContact C-N 3.34Å; H50-L52 PolarHBondContact O-N 3.02Å; H50-N53 WeakPolarHBondContact O-CA 3.24Å; H50-N53 WeakPolarHBondContact O-CB 3.22Å; H50-N53 PolarHBondContact O-N 3.37Å; H50-C54 VanDerWaalsContact CE1-SG 3.53Å; H50-C54 PolarHBondContact O-N 2.92Å; H50-C54 PolarHBondContact O-SG 2.77Å; H50-C54 VanDerWaalsContact O-SG 3.4Å
51A86.8Confident85.1Confident64 Ų6499.1 Ų99.153%0.52952%0.523SS..Hα-helixtrans-57.8-44.1175.900000112.6A47 R48 N53 C54 H55A47-A51 PolarHBondContact O-N 2.89Å; R48-A51 PolarHBondContact O-N 2.88Å; A51-N53 VanDerWaalsContact C-N 3.34Å; A51-N53 PolarHBondContact O-N 2.93Å; A51-C54 PolarHBondContact O-N 3.44Å; A51-H55 PolarHBondContact O-N 3.35Å
52L82.2Confident85.2Confident124 Ų12498.8 Ų98.865%0.64952%0.516SS*.Hα-helixtrans-63.2-38.6173.7-80.8162.1000112.4R48 H50 C54 H55R48-L52 PolarHBondContact O-N 3.33Å; H50-L52 VanDerWaalsContact C-N 3.34Å; H50-L52 PolarHBondContact O-N 3.02Å; L52-C54 VanDerWaalsContact C-N 3.32Å; L52-C54 PolarHBondContact O-N 2.94Å; L52-H55 WeakPolarHBondContact O-CB 3.4Å; L52-H55 PolarHBondContact O-N 3.36Å
53N82Confident85.3Confident67 Ų6796.3 Ų96.336%0.35851%0.509SS..Hα-helixtrans-67.3-31.5177.3-82.1-19.5000113.3K49 H50 A51 K58K49-N53 WeakPolarHBondContact O-CB 3.38Å; K49-N53 PolarHBondContact O-N 2.89Å; K49-N53 PolarHBondContact O-ND2 3.42Å; H50-N53 WeakPolarHBondContact O-CA 3.24Å; H50-N53 WeakPolarHBondContact O-CB 3.22Å; H50-N53 PolarHBondContact O-N 3.37Å; A51-N53 VanDerWaalsContact C-N 3.34Å; A51-N53 PolarHBondContact O-N 2.93Å; N53-K58 PolarHBondContact OD1-NZ 3.3Å
54C86Confident85.4Confident86 Ų8694.3 Ų94.358%0.58150%0.501SS*.THydrogen-bonded Turntrans-87.7-1.9178.6-65.30000113.6H50 A51 L52 R56H50-C54 VanDerWaalsContact CE1-SG 3.53Å; H50-C54 PolarHBondContact O-N 2.92Å; H50-C54 PolarHBondContact O-SG 2.77Å; H50-C54 VanDerWaalsContact O-SG 3.4Å; A51-C54 PolarHBondContact O-N 3.44Å; L52-C54 VanDerWaalsContact C-N 3.32Å; L52-C54 PolarHBondContact O-N 2.94Å; C54-R56 PolarHBondContact O-N 3.38Å
55H88.3Confident85.5Confident105 Ų10593.7 Ų93.749%0.48650%0.5SS..  trans-67.5129.9-176.5-168.2-91.2000112.3A51 L52 M57 K58A51-H55 PolarHBondContact O-N 3.35Å; L52-H55 WeakPolarHBondContact O-CB 3.4Å; L52-H55 PolarHBondContact O-N 3.36Å; H55-M57 PolarHBondContact ND1-N 3.44Å; H55-M57 PolarHBondContact O-N 3.26Å; H55-M57 VanDerWaalsContact O-N 3.12Å; H55-K58 WeakPolarHBondContact O-CB 3.48Å; H55-K58 PolarHBondContact O-N 3.1Å
56R91.3Very high85.8Confident248 Ų24892.8 Ų92.894%0.93649%0.491SS*.THydrogen-bonded Turntrans-55.7-34.6-175.1-72.3-18072.9176.72.9114C54 K58C54-R56 PolarHBondContact O-N 3.38Å; R56-K58 VanDerWaalsContact C-N 3.34Å
57M88.7Confident85.9Confident108 Ų10892.7 Ų92.753%0.53249%0.49SS..THydrogen-bonded Turntrans-83.4-4.9-179.8-61.9-170.969.600114.3H55 S59 A60 L61H55-M57 PolarHBondContact ND1-N 3.44Å; H55-M57 PolarHBondContact O-N 3.26Å; H55-M57 VanDerWaalsContact O-N 3.12Å; M57-S59 VanDerWaalsContact C-N 3.29Å; M57-S59 PolarHBondContact O-N 3.48Å; M57-A60 PolarHBondContact O-N 2.87Å; M57-L61 HydrophobicContact CB-CD1 4.11Å; M57-L61 HydrophobicContact CB-CG 4.45Å; M57-L61 PolarHBondContact O-N 2.85Å
58K85.4Confident86Confident53 Ų5394.2 Ų94.223%0.2349%0.489CS..Hα-helixtrans-53.6-47.8-175.7173.2172.7173.4168.50111.5N53 H55 R56 L61 F62 R171N53-K58 PolarHBondContact OD1-NZ 3.3Å; H55-K58 WeakPolarHBondContact O-CB 3.48Å; H55-K58 PolarHBondContact O-N 3.1Å; R56-K58 VanDerWaalsContact C-N 3.34Å; K58-L61 PolarHBondContact O-N 2.83Å; K58-F62 HydrophobicContact CG-CD2 4.2Å; K58-F62 WeakPolarHBondContact O-CB 3.44Å; K58-F62 PolarHBondContact O-N 3.35Å; K58-R171 PolarHBondContact NZ-O 3.11Å
59S84.6Confident86Confident96 Ų9691.3 Ų91.367%0.67148%0.48SS*.Hα-helixtrans-61.5-47.2-178.6176.40000112.3M57 F62 S63M57-S59 VanDerWaalsContact C-N 3.29Å; M57-S59 PolarHBondContact O-N 3.48Å; S59-F62 PolarHBondContact O-N 3.02Å; S59-S63 PolarHBondContact O-N 3.48Å
60A87.1Confident85.8Confident57 Ų5786.5 Ų86.547%0.47147%0.466SS..Hα-helixtrans-63.7-45.817900000112.3M57 F62 S63 V64M57-A60 PolarHBondContact O-N 2.87Å; A60-F62 PolarHBondContact O-N 3.22Å; A60-S63 PolarHBondContact O-N 3.25Å; A60-V64 WeakPolarHBondContact O-CG2 3.4Å; A60-V64 PolarHBondContact O-N 3.45Å; A60-V64 VanDerWaalsContact O-N 3.12Å
61L86.6Confident85.6Confident91 Ų9186.7 Ų86.748%0.47647%0.465SS..Hα-helixtrans-63-41.8177.1-73.5167.2000111.8M57 K58 S63 V64 L65M57-L61 HydrophobicContact CB-CD1 4.11Å; M57-L61 HydrophobicContact CB-CG 4.45Å; M57-L61 PolarHBondContact O-N 2.85Å; K58-L61 PolarHBondContact O-N 2.83Å; L61-S63 VanDerWaalsContact C-N 3.33Å; L61-S63 PolarHBondContact O-N 3.39Å; L61-V64 PolarHBondContact O-N 2.84Å; L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 VanDerWaalsContact O-CG 3.24Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 3.07Å
62F87.2Confident85.1Confident46 Ų4687.7 Ų87.720%0.20247%0.465CS..Hα-helixtrans-59.6-43.7175.3-113.2-104.6000112.2K58 S59 A60 L65 C66 S170 R173 P174K58-F62 HydrophobicContact CG-CD2 4.2Å; K58-F62 WeakPolarHBondContact O-CB 3.44Å; K58-F62 PolarHBondContact O-N 3.35Å; S59-F62 PolarHBondContact O-N 3.02Å; A60-F62 PolarHBondContact O-N 3.22Å; F62-L65 PolarHBondContact O-N 3.06Å; F62-C66 WeakPolarHBondContact O-CB 3.41Å; F62-C66 PolarHBondContact O-N 3.5Å; F62-C66 PolarHBondContact O-SG 3.18Å; F62-C66 VanDerWaalsContact O-SG 3.33Å; F62-S170 WeakPolarHBondContact CE1-O 3.44Å; F62-R173 VanDerWaalsContact CE1-O 3.22Å; F62-R173 WeakPolarHBondContact CE1-O 3.43Å; F62-P174 HydrophobicContact CD1-CB 4.47Å; F62-P174 HydrophobicContact CE1-CB 4.47Å; F62-P174 HydrophobicContact CE1-CG 4.38Å; F62-P174 HydrophobicContact CZ-CG 4.48Å
63S85.9Confident84.3Confident76 Ų7683.7 Ų83.753%0.53145%0.449SS..Hα-helixtrans-61.1-48.7179.4-177.50000111.6S59 A60 L61 L65 C66 E67S59-S63 PolarHBondContact O-N 3.48Å; A60-S63 PolarHBondContact O-N 3.25Å; L61-S63 VanDerWaalsContact C-N 3.33Å; L61-S63 PolarHBondContact O-N 3.39Å; S63-L65 PolarHBondContact O-N 2.62Å; S63-C66 PolarHBondContact O-N 2.95Å; S63-E67 PolarHBondContact O-N 2.88Å
64V89.3Confident83.2Confident76 Ų7685.2 Ų85.246%0.46146%0.455SS..Hα-helixtrans-62.6-43.2177.6174.70000111.4A60 L61 C66 E67 I68A60-V64 WeakPolarHBondContact O-CG2 3.4Å; A60-V64 PolarHBondContact O-N 3.45Å; A60-V64 VanDerWaalsContact O-N 3.12Å; L61-V64 PolarHBondContact O-N 2.84Å; V64-C66 PolarHBondContact O-N 3.02Å; V64-E67 PolarHBondContact O-N 3.37Å; V64-I68 HydrophobicContact CG1-CD1 3.77Å; V64-I68 HydrophobicContact CG1-CG1 4.32Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 3.17Å
65L87.6Confident81.8Confident86 Ų8685.5 Ų85.545%0.4546%0.458SS..Hα-helixtrans-64.6-40.1177.8-71.1170.9000112.2L61 F62 S63 E67 K69 P174L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 VanDerWaalsContact O-CG 3.24Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 3.07Å; F62-L65 PolarHBondContact O-N 3.06Å; S63-L65 PolarHBondContact O-N 2.62Å; L65-E67 VanDerWaalsContact C-N 3.32Å; L65-K69 VanDerWaalsContact O-CB 3.24Å; L65-K69 WeakPolarHBondContact O-CB 3.47Å; L65-K69 PolarHBondContact O-N 3.25Å; L65-P174 HydrophobicContact CB-CB 3.93Å; L65-P174 HydrophobicContact CB-CG 3.66Å; L65-P174 HydrophobicContact CD1-CG 3.81Å; L65-P174 HydrophobicContact CG-CG 4.37Å
66C86.1Confident80.5Confident22 Ų2287.1 Ų87.115%0.14947%0.469CS..Hα-helixtrans-62.5-39.1173.1-76.50000111.8F62 S63 V64 G70F62-C66 WeakPolarHBondContact O-CB 3.41Å; F62-C66 PolarHBondContact O-N 3.5Å; F62-C66 PolarHBondContact O-SG 3.18Å; F62-C66 VanDerWaalsContact O-SG 3.33Å; S63-C66 PolarHBondContact O-N 2.95Å; V64-C66 PolarHBondContact O-N 3.02Å; C66-G70 PolarHBondContact O-N 3.43Å
67E85.7Confident78.9Confident101 Ų10179.5 Ų79.547%0.47244%0.444SS..Hα-helixtrans-68.2-46.7177.8-169.9-176.5168.400112S63 V64 L65 K69 G70 K71S63-E67 PolarHBondContact O-N 2.88Å; V64-E67 PolarHBondContact O-N 3.37Å; L65-E67 VanDerWaalsContact C-N 3.32Å; E67-K69 VanDerWaalsContact C-N 3.34Å; E67-K69 PolarHBondContact O-N 3.01Å; E67-G70 PolarHBondContact O-N 3.49Å; E67-K71 HydrophobicContact CG-CD 4.37Å; E67-K71 WeakPolarHBondContact O-CG 3.35Å; E67-K71 PolarHBondContact O-N 3.05Å; E67-K71 WeakPolarHBondContact OE1-CE 3.31Å; E67-K71 IonicContact OE1-NZ 2.66Å; E67-K71 PolarHBondContact OE1-NZ 3.01Å
68I86.1Confident76.9Confident94 Ų9482.3 Ų82.348%0.48246%0.456SS..Hα-helixtrans-58-49.8175-68.3168.1000109.5V64 G70 K71 T72V64-I68 HydrophobicContact CG1-CD1 3.77Å; V64-I68 HydrophobicContact CG1-CG1 4.32Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 3.17Å; I68-G70 VanDerWaalsContact C-N 3.31Å; I68-G70 PolarHBondContact O-N 2.87Å; I68-K71 PolarHBondContact O-N 3.33Å; I68-T72 PolarHBondContact O-N 3.37Å; I68-T72 PolarHBondContact O-OG1 2.91Å
69K83Confident74.9Confident68 Ų6888.9 Ų88.930%0.29649%0.487SS..Hα-helixtrans-59.4-42.4178.3-171-175178.7-164.40111.8L65 E67 T72 A73 P174 E179L65-K69 VanDerWaalsContact O-CB 3.24Å; L65-K69 WeakPolarHBondContact O-CB 3.47Å; L65-K69 PolarHBondContact O-N 3.25Å; E67-K69 VanDerWaalsContact C-N 3.34Å; E67-K69 PolarHBondContact O-N 3.01Å; K69-T72 PolarHBondContact O-N 2.66Å; K69-A73 VanDerWaalsContact O-CB 3.3Å; K69-A73 WeakPolarHBondContact O-CB 3.32Å; K69-A73 PolarHBondContact O-N 3.49Å; K69-P174 PolarHBondContact NZ-O 3.43Å; K69-E179 WeakPolarHBondContact CE-OE2 3.39Å; K69-E179 IonicContact NZ-OE1 2.98Å; K69-E179 PolarHBondContact NZ-OE1 3.19Å; K69-E179 IonicContact NZ-OE2 2.76Å; K69-E179 PolarHBondContact NZ-OE2 2.9Å
70G77.4Confident73.1Confident23 Ų2391.3 Ų91.324%0.23749%0.488CS..Hα-helixtrans-61.9-45.1176.800000112.7C66 E67 I68 A73 M74C66-G70 PolarHBondContact O-N 3.43Å; E67-G70 PolarHBondContact O-N 3.49Å; I68-G70 VanDerWaalsContact C-N 3.31Å; I68-G70 PolarHBondContact O-N 2.87Å; G70-A73 PolarHBondContact O-N 3.01Å; G70-M74 WeakPolarHBondContact O-CB 3.38Å; G70-M74 WeakPolarHBondContact O-CG 3.3Å; G70-M74 PolarHBondContact O-N 3.3Å
71K80.4Confident71Confident130 Ų13096.9 Ų96.957%0.56550%0.504SS*.Hα-helixtrans-63.9-42177.3-71.7174.3-176.8170.40111.9E67 I68 S75E67-K71 HydrophobicContact CG-CD 4.37Å; E67-K71 WeakPolarHBondContact O-CG 3.35Å; E67-K71 PolarHBondContact O-N 3.05Å; E67-K71 WeakPolarHBondContact OE1-CE 3.31Å; E67-K71 IonicContact OE1-NZ 2.66Å; E67-K71 PolarHBondContact OE1-NZ 3.01Å; I68-K71 PolarHBondContact O-N 3.33Å; K71-S75 WeakPolarHBondContact O-CB 3.38Å; K71-S75 PolarHBondContact O-N 2.93Å
72T75.9Confident69Low85 Ų85101.5 Ų101.552%0.52152%0.523SS..Hα-helixtrans-67.6-40.8177.3-51.40000112I68 K69I68-T72 PolarHBondContact O-N 3.37Å; I68-T72 PolarHBondContact O-OG1 2.91Å; K69-T72 PolarHBondContact O-N 2.66Å
73A66.8Low67.1Low39 Ų39106.3 Ų106.332%0.32255%0.551SS.*Hα-helixtrans-70.6-43.1179.300000112.7K69 G70 S75 I76 Q77K69-A73 VanDerWaalsContact O-CB 3.3Å; K69-A73 WeakPolarHBondContact O-CB 3.32Å; K69-A73 PolarHBondContact O-N 3.49Å; G70-A73 PolarHBondContact O-N 3.01Å; A73-S75 VanDerWaalsContact C-N 3.29Å; A73-S75 PolarHBondContact O-N 2.89Å; A73-I76 PolarHBondContact O-N 3.48Å; A73-I76 VanDerWaalsContact O-N 3.1Å; A73-Q77 PolarHBondContact O-N 3.2Å; A73-Q77 PolarHBondContact O-OE1 2.97Å
74M57.5Low65.8Low99 Ų99106.9 Ų106.949%0.48855%0.553SS.*Hα-helixtrans-67.2-29.4179.5-65.7-92.573.300112.7G70 I76 Q77G70-M74 WeakPolarHBondContact O-CB 3.38Å; G70-M74 WeakPolarHBondContact O-CG 3.3Å; G70-M74 PolarHBondContact O-N 3.3Å; M74-I76 PolarHBondContact O-N 2.8Å; M74-Q77 PolarHBondContact O-N 3.46Å
75S57.9Low64.4Low92 Ų92109.2 Ų109.264%0.64357%0.57SS**THydrogen-bonded Turntrans-65-18.5173.2-172.50000113.5K71 A73K71-S75 WeakPolarHBondContact O-CB 3.38Å; K71-S75 PolarHBondContact O-N 2.93Å; A73-S75 VanDerWaalsContact C-N 3.29Å; A73-S75 PolarHBondContact O-N 2.89Å
76I59.7Low63.9Low139 Ų139107.4 Ų107.471%0.71356%0.561SS**THydrogen-bonded Turntrans-98-22.2-179.4-61.1169.2000111.2A73 M74A73-I76 PolarHBondContact O-N 3.48Å; A73-I76 VanDerWaalsContact O-N 3.1Å; M74-I76 PolarHBondContact O-N 2.8Å
77Q57.9Low63.8Low89 Ų89110 Ų11042%0.41658%0.583SS.*  trans-112.522.1-168.2-82.3169.4-57.800114.7A73 M74 H79A73-Q77 PolarHBondContact O-N 3.2Å; A73-Q77 PolarHBondContact O-OE1 2.97Å; M74-Q77 PolarHBondContact O-N 3.46Å; Q77-H79 PolarHBondContact O-N 3.42Å
78Q46.9Very low63.8Low167 Ų167109.9 Ų109.978%0.7858%0.583SS**  trans-65.415.2-175.9-147.6176.6-22.600115.7
79H44.3Very low63.9Low190 Ų190106.6 Ų106.688%0.8857%0.566SS**  trans-125.575.6168.9-80.64.3000109.5Q77Q77-H79 PolarHBondContact O-N 3.42Å
80Q46.2Very low64.1Low148 Ų148108.6 Ų108.669%0.69258%0.579SS**  trans-117.277.5153.2-162.4160.959.100105.3E82Q80-E82 PolarHBondContact O-N 2.89Å
81E42.7Very low64.8Low174 Ų174115.9 Ų115.981%0.81360%0.6SS**  trans-51.9123.9164.6-171.1170.818000106.4D83E81-D83 PolarHBondContact O-N 3.18Å
82E43.9Very low65.3Low187 Ų187109.9 Ų109.987%0.87457%0.574SS**  trans-62.9103.1177.4-155-154-173.900106.8Q80Q80-E82 PolarHBondContact O-N 2.89Å
83D48.8Very low66Low147 Ų147107.8 Ų107.879%0.78656%0.559SS**PPolyproline II helixtrans-57.6125.2-174.5-121-39.8000108.2E81E81-D83 PolarHBondContact O-N 3.18Å
84P57.6Low67.2Low88 Ų88110.3 Ų110.357%0.57157%0.567SS**PPolyproline II helixtrans-53.1150.2179.3-22.530.3000110.8D86P84-D86 PolarHBondContact O-N 3.28Å
85P61Low68.8Low125 Ų125108.1 Ų108.181%0.81256%0.557SS**PPolyproline II helixtrans-52.1123.6176.521.1-31.8000109.2A87P85-A87 VanDerWaalsContact C-N 3.34Å; P85-A87 PolarHBondContact O-N 3.5Å
86D75.6Confident70.4Confident49 Ų49103.8 Ų103.826%0.26253%0.526SS..  trans-61.487.5-164-1756.8000112.5P84 Q88 L89 L90 R196P84-D86 PolarHBondContact O-N 3.28Å; D86-Q88 PolarHBondContact O-N 3.46Å; D86-L89 HydrophobicContact CB-CB 4.04Å; D86-L89 WeakPolarHBondContact O-CB 3.32Å; D86-L89 PolarHBondContact O-N 2.96Å; D86-L89 VanDerWaalsContact OD2-CB 3.32Å; D86-L89 WeakPolarHBondContact OD2-CB 3.29Å; D86-L90 PolarHBondContact O-N 3.4Å; D86-L90 VanDerWaalsContact O-N 3.13Å; D86-R196 VanDerWaalsContact CG-CZ 3.41Å; D86-R196 IonicContact OD1-CZ 3.68Å; D86-R196 IonicContact OD1-NH1 2.76Å; D86-R196 PolarHBondContact OD1-NH1 2.91Å; D86-R196 IonicContact OD1-NH2 2.63Å; D86-R196 PolarHBondContact OD1-NH2 3.33Å; D86-R196 IonicContact OD2-CZ 3.75Å; D86-R196 IonicContact OD2-NE 3.24Å; D86-R196 IonicContact OD2-NH1 2.79Å; D86-R196 PolarHBondContact OD2-NH1 3.46Å; D86-R196 IonicContact OD2-NH2 3.95Å; D86-R196 PolarHBondContact OD2-NH2 2.85Å
87A83.6Confident71.9Confident75 Ų75100.5 Ų100.562%0.6251%0.51SS*.Hα-helixtrans-57.8-29.7-170.100000112.9P85 R91P85-A87 VanDerWaalsContact C-N 3.34Å; P85-A87 PolarHBondContact O-N 3.5Å; A87-R91 WeakPolarHBondContact O-CB 3.26Å; A87-R91 PolarHBondContact O-N 3.23Å
88Q85.8Confident73.3Confident100 Ų100100.4 Ų100.447%0.46752%0.524SS..Hα-helixtrans-71.1-39.8175.5176.2179.23.600112D86 R91 L92D86-Q88 PolarHBondContact O-N 3.46Å; Q88-R91 PolarHBondContact O-N 2.95Å; Q88-L92 HydrophobicContact CG-CD1 4.41Å; Q88-L92 WeakPolarHBondContact O-CG 3.23Å; Q88-L92 PolarHBondContact O-N 3.33Å
89L88.6Confident75.1Confident25 Ų2594 Ų9413%0.13150%0.495CS..Hα-helixtrans-65.4-44176.9-170.670.5000110.8D86 R91 L92 D93 T192 R196 K199D86-L89 HydrophobicContact CB-CB 4.04Å; D86-L89 WeakPolarHBondContact O-CB 3.32Å; D86-L89 PolarHBondContact O-N 2.96Å; D86-L89 VanDerWaalsContact OD2-CB 3.32Å; D86-L89 WeakPolarHBondContact OD2-CB 3.29Å; L89-R91 VanDerWaalsContact C-N 3.32Å; L89-R91 PolarHBondContact O-N 3.31Å; L89-L92 WeakPolarHBondContact O-CB 3.45Å; L89-L92 PolarHBondContact O-N 2.85Å; L89-L92 VanDerWaalsContact O-N 3.13Å; L89-D93 PolarHBondContact O-N 3.21Å; L89-T192 HydrophobicContact CD2-CG2 4.1Å; L89-R196 HydrophobicContact CD1-CB 3.97Å; L89-R196 HydrophobicContact CD1-CG 4.39Å; L89-K199 HydrophobicContact CD1-CD 3.76Å
90L88.3Confident77Confident109 Ų10986.3 Ų86.357%0.57147%0.466SS*.Hα-helixtrans-61-40.6175.8-173.868.4000112D86 L92 D93 N94D86-L90 PolarHBondContact O-N 3.4Å; D86-L90 VanDerWaalsContact O-N 3.13Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.39Å; L90-D93 PolarHBondContact O-N 3.39Å; L90-N94 PolarHBondContact O-N 2.9Å; L90-N94 PolarHBondContact O-ND2 3.5Å
91R91.2Very high78.7Confident176 Ų17679.3 Ų79.366%0.66443%0.433SS*.Hα-helixtrans-60.8-42.7174.4177.9-179.1170.1-169.8-3.8111.8A87 Q88 L89 N94 M95A87-R91 WeakPolarHBondContact O-CB 3.26Å; A87-R91 PolarHBondContact O-N 3.23Å; Q88-R91 PolarHBondContact O-N 2.95Å; L89-R91 VanDerWaalsContact C-N 3.32Å; L89-R91 PolarHBondContact O-N 3.31Å; R91-N94 PolarHBondContact O-N 3.45Å; R91-M95 PolarHBondContact O-N 3.27Å
92L91.6Very high80.6Confident5 Ų571.7 Ų71.73%0.02640%0.399CS..Hα-helixtrans-66.1-40.9177.3-71169.5000111.6Q88 L89 L90 N94 M95 L96 R196 K199 Q200 C203Q88-L92 HydrophobicContact CG-CD1 4.41Å; Q88-L92 WeakPolarHBondContact O-CG 3.23Å; Q88-L92 PolarHBondContact O-N 3.33Å; L89-L92 WeakPolarHBondContact O-CB 3.45Å; L89-L92 PolarHBondContact O-N 2.85Å; L89-L92 VanDerWaalsContact O-N 3.13Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.39Å; L92-N94 PolarHBondContact O-N 3.21Å; L92-M95 WeakPolarHBondContact O-CB 3.41Å; L92-M95 PolarHBondContact O-N 2.95Å; L92-M95 VanDerWaalsContact O-N 3.16Å; L92-L96 WeakPolarHBondContact O-CG 3.47Å; L92-L96 PolarHBondContact O-N 2.97Å; L92-R196 HydrophobicContact CD1-CG 4Å; L92-K199 HydrophobicContact CB-CB 3.98Å; L92-K199 HydrophobicContact CB-CD 4.49Å; L92-K199 HydrophobicContact CD1-CB 4.12Å; L92-Q200 HydrophobicContact CD1-CB 4.12Å; L92-Q200 HydrophobicContact CD2-CB 4.46Å; L92-C203 HydrophobicContact CD2-CB 4.16Å
93D90.6Very high81.7Confident40 Ų4072.4 Ų72.421%0.21439%0.394CS..Hα-helixtrans-59.6-47.4174.9-79.3-37.2000112.3L89 L90 M95 L96 L97 K199L89-D93 PolarHBondContact O-N 3.21Å; L90-D93 PolarHBondContact O-N 3.39Å; D93-M95 VanDerWaalsContact C-N 3.26Å; D93-M95 PolarHBondContact O-N 3.48Å; D93-L96 PolarHBondContact O-N 3.2Å; D93-L97 WeakPolarHBondContact O-CB 3.46Å; D93-L97 VanDerWaalsContact O-CG 3.24Å; D93-L97 WeakPolarHBondContact O-CG 3.45Å; D93-L97 PolarHBondContact O-N 3.25Å; D93-K199 VanDerWaalsContact OD1-CD 3.29Å; D93-K199 WeakPolarHBondContact OD1-CD 3.37Å; D93-K199 WeakPolarHBondContact OD1-CE 3.22Å; D93-K199 IonicContact OD1-NZ 2.76Å; D93-K199 PolarHBondContact OD1-NZ 3.47Å; D93-K199 IonicContact OD2-NZ 2.71Å; D93-K199 PolarHBondContact OD2-NZ 3.04Å
94N92.4Very high81.9Confident92 Ų9270.3 Ų70.349%0.49239%0.388SS..Hα-helixtrans-60.5-37.6175.6-73-41.7000112.1L90 R91 L92 A98L90-N94 PolarHBondContact O-N 2.9Å; L90-N94 PolarHBondContact O-ND2 3.5Å; R91-N94 PolarHBondContact O-N 3.45Å; L92-N94 PolarHBondContact O-N 3.21Å; N94-A98 WeakPolarHBondContact O-CB 3.44Å; N94-A98 PolarHBondContact O-N 2.78Å
95M89.9Confident81.3Confident54 Ų5475.9 Ų75.927%0.26641%0.407SS..Hα-helixtrans-66.6-45.9176.8-166.5-177.1-48.600111.9R91 L92 D93 A98 E99 C203 M207R91-M95 PolarHBondContact O-N 3.27Å; L92-M95 WeakPolarHBondContact O-CB 3.41Å; L92-M95 PolarHBondContact O-N 2.95Å; L92-M95 VanDerWaalsContact O-N 3.16Å; D93-M95 VanDerWaalsContact C-N 3.26Å; D93-M95 PolarHBondContact O-N 3.48Å; M95-A98 PolarHBondContact O-N 2.93Å; M95-E99 PolarHBondContact O-N 3.49Å; M95-C203 HydrophobicContact SD-CB 3.58Å; M95-C203 VanDerWaalsContact SD-CB 3.58Å; M95-M207 HydrophobicContact CG-CE 4.33Å; M95-M207 HydrophobicContact SD-CE 4.12Å
96L91.9Very high80.3Confident1 Ų178.6 Ų78.61%0.00541%0.406CS..Hα-helixtrans-67.1-36.3177.7-67.8178.1000112L92 D93 G100 V101 S102 Y144 K199 T202 C203L92-L96 WeakPolarHBondContact O-CG 3.47Å; L92-L96 PolarHBondContact O-N 2.97Å; D93-L96 PolarHBondContact O-N 3.2Å; L96-G100 PolarHBondContact O-N 3.1Å; L96-V101 HydrophobicContact CB-CB 4.27Å; L96-V101 HydrophobicContact CD2-CB 4.02Å; L96-V101 HydrophobicContact CD2-CG1 3.94Å; L96-V101 WeakPolarHBondContact O-CA 3.39Å; L96-V101 PolarHBondContact O-N 3.39Å; L96-S102 WeakPolarHBondContact CB-OG 3.25Å; L96-S102 PolarHBondContact O-N 3.36Å; L96-S102 VanDerWaalsContact O-N 3.11Å; L96-Y144 HydrophobicContact CD1-CE1 4.5Å; L96-Y144 HydrophobicContact CD1-CE2 3.91Å; L96-K199 HydrophobicContact CD1-CB 3.84Å; L96-K199 HydrophobicContact CD1-CD 4.37Å; L96-K199 HydrophobicContact CD1-CG 3.72Å; L96-T202 HydrophobicContact CD2-CG2 3.59Å; L96-C203 VanDerWaalsContact CD2-SG 3.51Å
97L91.3Very high78.7Confident70 Ų7088.4 Ų88.437%0.36644%0.439SS..Hα-helixtrans-63.5-45.1174.1-76.9166.3000111.5D93 E99 G100 P104D93-L97 WeakPolarHBondContact O-CB 3.46Å; D93-L97 VanDerWaalsContact O-CG 3.24Å; D93-L97 WeakPolarHBondContact O-CG 3.45Å; D93-L97 PolarHBondContact O-N 3.25Å; L97-E99 VanDerWaalsContact C-N 3.3Å; L97-E99 PolarHBondContact O-N 3.33Å; L97-G100 WeakPolarHBondContact O-CA 3.29Å; L97-G100 PolarHBondContact O-N 3.27Å; L97-P104 HydrophobicContact CD2-CG 4.5Å
98A86.8Confident76.4Confident87 Ų8787.4 Ų87.472%0.71944%0.437SS*.Hα-helixtrans-61.8-37.4-18000000112.7N94 M95 G100N94-A98 WeakPolarHBondContact O-CB 3.44Å; N94-A98 PolarHBondContact O-N 2.78Å; M95-A98 PolarHBondContact O-N 2.93Å; A98-G100 PolarHBondContact O-N 2.91Å
99E85.5Confident74.2Confident33 Ų3394.6 Ų94.615%0.15446%0.459CS..THydrogen-bonded Turntrans-84.55.1177.1-63.5-72.9167.700112.2M95 L97 V101 R141 V206 M207 R210M95-E99 PolarHBondContact O-N 3.49Å; L97-E99 VanDerWaalsContact C-N 3.3Å; L97-E99 PolarHBondContact O-N 3.33Å; E99-V101 HydrophobicContact CB-CG2 4.18Å; E99-V101 PolarHBondContact O-N 2.61Å; E99-R141 PolarHBondContact O-NH2 3.04Å; E99-V206 HydrophobicContact CB-CG1 3.93Å; E99-V206 HydrophobicContact CG-CG1 3.69Å; E99-M207 HydrophobicContact CG-CE 4.23Å; E99-R210 IonicContact OE1-NH1 3.08Å; E99-R210 PolarHBondContact OE1-NH1 3.4Å
100G82.9Confident72Confident28 Ų2897.3 Ų97.329%0.28949%0.493SS..THydrogen-bonded Turntrans65.317.7-179.900000114.3L96 L97 A98 R141L96-G100 PolarHBondContact O-N 3.1Å; L97-G100 WeakPolarHBondContact O-CA 3.29Å; L97-G100 PolarHBondContact O-N 3.27Å; A98-G100 PolarHBondContact O-N 2.91Å; G100-R141 VanDerWaalsContact C-CZ 3.46Å; G100-R141 VanDerWaalsContact O-CD 3.27Å; G100-R141 WeakPolarHBondContact O-CD 3.19Å; G100-R141 PolarHBondContact O-NE 3.29Å; G100-R141 PolarHBondContact O-NH1 2.9Å; G100-R141 PolarHBondContact O-NH2 3.41Å
101V83.3Confident69.4Low0 Ų096.7 Ų96.70%050%0.504CS..SBendtrans-78.6-44.7179.9178.20000111.6L96 E99 L137 R141 Y144 H145 T202 V206L96-V101 HydrophobicContact CB-CB 4.27Å; L96-V101 HydrophobicContact CD2-CB 4.02Å; L96-V101 HydrophobicContact CD2-CG1 3.94Å; L96-V101 WeakPolarHBondContact O-CA 3.39Å; L96-V101 PolarHBondContact O-N 3.39Å; E99-V101 HydrophobicContact CB-CG2 4.18Å; E99-V101 PolarHBondContact O-N 2.61Å; V101-L137 HydrophobicContact CG2-CD1 4.07Å; V101-R141 HydrophobicContact CB-CG 4.15Å; V101-R141 HydrophobicContact CG1-CG 4.14Å; V101-R141 HydrophobicContact CG2-CG 3.93Å; V101-Y144 HydrophobicContact CG1-CD1 3.94Å; V101-Y144 HydrophobicContact CG1-CG 4.13Å; V101-H145 PolarHBondContact O-CE1 3.26Å; V101-T202 HydrophobicContact CG1-CG2 3.77Å; V101-V206 HydrophobicContact CG2-CG2 3.85Å
102S81.1Confident67.3Low14 Ų1493.5 Ų93.510%0.09852%0.515CS..SBendtrans-85.9137.6166-64.30000108.7L96L96-S102 WeakPolarHBondContact CB-OG 3.25Å; L96-S102 PolarHBondContact O-N 3.36Å; L96-S102 VanDerWaalsContact O-N 3.11Å
103R67.5Low64.7Low203 Ų20397.8 Ų97.877%0.76655%0.551SS**PPolyproline II helixtrans-84.4145.9167.4-70.8-174174.9-179.10.7108.8E105R103-E105 PolarHBondContact O-N 3.06Å
104P52.8Low62.3Low102 Ų10299.2 Ų99.266%0.66258%0.575SS**PPolyproline II helixtrans-58.3123.3156.4-9.824.3000106L97 K106L97-P104 HydrophobicContact CD2-CG 4.5Å; P104-K106 PolarHBondContact O-N 3.36Å
105E45.9Very low59.6Low205 Ų205101.5 Ų101.596%0.95859%0.593SS**  trans-59.787.1168.5-101.8-165.1123.200108.3R103R103-E105 PolarHBondContact O-N 3.06Å
106K40.8Very low57Low182 Ų182105.5 Ų105.579%0.79162%0.621SS**  trans-104.887.5166.5-145.5176.8-173.4-178.20106.1P104 G108P104-K106 PolarHBondContact O-N 3.36Å; K106-G108 PolarHBondContact O-N 3.35Å
107R41.9Very low54.2Low255 Ų255110.2 Ų110.296%0.96266%0.659SS**  trans-49108.8156.7-174.9177.7-174.3-137.52.4107
108G35Very low51.4Low55 Ų55113.5 Ų113.557%0.56768%0.683SS**SBendtrans125.5101.1172.500000115K106K106-G108 PolarHBondContact O-N 3.35Å
109R38.9Very low49.4Very low251 Ų251115.4 Ų115.495%0.94769%0.688SS**  trans55.4106.4137.1-150172.6-134.8-101.81.1117.6
110G43.1Very low47.2Very low81 Ų81118 Ų11884%0.83572%0.723SS**  trans41.9102.4141.800000118.4
111A32.6Very low45.1Very low96 Ų96119.6 Ų119.679%0.79374%0.74SS**  trans-153.8103.1145.600000108.8A113A111-A113 PolarHBondContact O-N 2.91Å; A111-A113 VanDerWaalsContact O-N 3.09Å
112A46.9Very low43.2Very low109 Ų109126 Ų12690%0.90178%0.783SS**  trans-63102.7159.300000107.5G114A112-G114 PolarHBondContact O-N 2.71Å
113A38.1Very low41.8Very low95 Ų95129 Ų12979%0.78580%0.802SS**  trans-85.987.1168.600000107.9A111 T115A111-A113 PolarHBondContact O-N 2.91Å; A111-A113 VanDerWaalsContact O-N 3.09Å; A113-T115 PolarHBondContact O-N 2.79Å
114G39.5Very low41Very low70 Ų70125.3 Ų125.372%0.72280%0.798SS**  trans-65119.316500000109.3A112A112-G114 PolarHBondContact O-N 2.71Å
115T36.4Very low40.9Very low141 Ų141126 Ų12687%0.86580%0.796SS**  trans-88.7110.3163.938.20000108.3A113A113-T115 PolarHBondContact O-N 2.79Å
116T34.3Very low41.5Very low138 Ų138120 Ų12085%0.84777%0.774SS**PPolyproline II helixtrans-57.7125.3172.642.40000111.2
117A33.9Very low42.5Very low99 Ų99114.8 Ų114.882%0.81876%0.76SS**PPolyproline II helixtrans-88.1131.7171.500000110.6
118T31.9Very low43.4Very low140 Ų140107.6 Ų107.686%0.85974%0.739SS**PPolyproline II helixtrans-87.5129.1163.6-480000108.5
119P44.5Very low45Very low127 Ų127106.1 Ų106.183%0.82572%0.722SS**PPolyproline II helixtrans-91.8125.9-174.733.2-29000111.4
120G39.3Very low46.8Very low86 Ų8699.1 Ų99.189%0.88770%0.7SS**  trans177.681.7174.700000113.4
121G38.6Very low48.9Very low63 Ų6398.6 Ų98.665%0.64968%0.684SS**SBendtrans155.3126.3171.500000112
122C44.7Very low51.4Low134 Ų13497.9 Ų97.991%0.90567%0.666SS**  trans-47126.8-174.3-63.10000113.1
123P50.8Low53.5Low78 Ų7894.1 Ų94.151%0.50663%0.629SS.*  trans-108.8-10.9-145.47.615000115.9S127P123-S127 WeakPolarHBondContact O-CB 3.39Å; P123-S127 PolarHBondContact O-N 2.91Å
124N51.5Low55.9Low125 Ų12599 Ų9967%0.66863%0.627SS**Hα-helixtrans-78.3-36.4-153.2-69.2-4.6000114.8I128N124-I128 WeakPolarHBondContact O-CD1 3.37Å; N124-I128 VanDerWaalsContact O-CG1 3.22Å; N124-I128 WeakPolarHBondContact O-CG1 3.42Å
125D51.1Low58.4Low116 Ų11698.5 Ų98.562%0.6262%0.616SS**Hα-helixtrans-87.2-22.3-175.2-138.7-32.6000113.6R217D125-R217 PolarHBondContact O-NH1 3.47Å; D125-R217 PolarHBondContact O-NH2 3.09Å; D125-R217 IonicContact OD1-NH2 3.88Å; D125-R217 PolarHBondContact OD1-NH2 2.77Å; D125-R217 VanDerWaalsContact OD1-NH2 3.08Å
126T58Low61.1Low80 Ų8094.6 Ų94.649%0.49159%0.587SS.*Hα-helixtrans-94.5-33.4-179.7-41.30000111.3A129 H130T126-A129 PolarHBondContact O-N 2.91Å; T126-H130 PolarHBondContact O-CD2 2.76Å; T126-H130 PolarHBondContact O-N 3.49Å
127S62Low63.9Low72 Ų7288.7 Ų88.750%0.50355%0.55SS..Hα-helixtrans-64.9-44175.5-176.80000112.1P123 A129 H130 S131P123-S127 WeakPolarHBondContact O-CB 3.39Å; P123-S127 PolarHBondContact O-N 2.91Å; S127-A129 PolarHBondContact O-N 3.32Å; S127-H130 PolarHBondContact O-N 3.42Å; S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 3.34Å
128I61.2Low66.7Low103 Ų10387.2 Ų87.253%0.52853%0.534SS..Hα-helixtrans-62.6-44.8177.9-64.4168.5000110.5N124 H130 S131 D132N124-I128 WeakPolarHBondContact O-CD1 3.37Å; N124-I128 VanDerWaalsContact O-CG1 3.22Å; N124-I128 WeakPolarHBondContact O-CG1 3.42Å; I128-H130 PolarHBondContact O-N 2.93Å; I128-S131 WeakPolarHBondContact O-CB 3.42Å; I128-S131 PolarHBondContact O-N 2.92Å; I128-S131 VanDerWaalsContact O-N 3.15Å; I128-D132 PolarHBondContact O-N 3.47Å
129A67.6Low69.7Low25 Ų2583.9 Ų83.921%0.20751%0.509CS..Hα-helixtrans-66.6-34.9178.400000113.6T126 S127 Y133T126-A129 PolarHBondContact O-N 2.91Å; S127-A129 PolarHBondContact O-N 3.32Å; A129-Y133 WeakPolarHBondContact O-CB 3.38Å; A129-Y133 PolarHBondContact O-N 3.49Å
130H77.8Confident72.2Confident103 Ų10379.3 Ų79.348%0.47748%0.477SS..Hα-helixtrans-70.2-34.8172-82.4-62.6000112.3T126 S127 I128 R134T126-H130 PolarHBondContact O-CD2 2.76Å; T126-H130 PolarHBondContact O-N 3.49Å; S127-H130 PolarHBondContact O-N 3.42Å; I128-H130 PolarHBondContact O-N 2.93Å; H130-R134 VanDerWaalsContact O-CB 3.24Å; H130-R134 WeakPolarHBondContact O-CB 3.33Å; H130-R134 PolarHBondContact O-N 3.37Å
131S85.3Confident74.8Confident71 Ų7179.2 Ų79.250%0.49745%0.45SS..Hα-helixtrans-62.7-48.3172.1-176.60000111.1S127 I128 Y133 R134 A135S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 3.34Å; I128-S131 WeakPolarHBondContact O-CB 3.42Å; I128-S131 PolarHBondContact O-N 2.92Å; I128-S131 VanDerWaalsContact O-N 3.15Å; S131-Y133 PolarHBondContact O-N 3.3Å; S131-R134 PolarHBondContact O-N 3.04Å; S131-A135 WeakPolarHBondContact O-CB 3.27Å; S131-A135 PolarHBondContact O-N 3.34Å
132D86.7Confident77.5Confident81 Ų8183.1 Ų83.143%0.43345%0.451SS..Hα-helixtrans-64.8-41.6179.1-69.8-14.8000112.3I128 A135 K136I128-D132 PolarHBondContact O-N 3.47Å; D132-A135 PolarHBondContact O-N 3.24Å; D132-K136 WeakPolarHBondContact O-CB 3.29Å; D132-K136 WeakPolarHBondContact O-CG 3.4Å; D132-K136 PolarHBondContact O-N 3.25Å
133Y89.6Confident80Confident30 Ų3080.6 Ų80.612%0.11843%0.428CS..Hα-helixtrans-61.6-46173.5175-96.2000111.1A129 S131 K136 L137 L209 L213 L214A129-Y133 WeakPolarHBondContact O-CB 3.38Å; A129-Y133 PolarHBondContact O-N 3.49Å; S131-Y133 PolarHBondContact O-N 3.3Å; Y133-K136 PolarHBondContact O-N 3.01Å; Y133-L137 HydrophobicContact CE1-CD2 4.06Å; Y133-L137 VanDerWaalsContact O-CB 3.23Å; Y133-L137 WeakPolarHBondContact O-CB 3.25Å; Y133-L137 PolarHBondContact O-N 2.94Å; Y133-L209 HydrophobicContact CD2-CD2 3.99Å; Y133-L209 HydrophobicContact CD2-CG 3.8Å; Y133-L209 HydrophobicContact CE2-CD2 3.9Å; Y133-L209 HydrophobicContact CE2-CG 3.8Å; Y133-L213 HydrophobicContact CD2-CB 4.26Å; Y133-L213 HydrophobicContact CD2-CD1 4.25Å; Y133-L214 HydrophobicContact CD2-CD1 4.05Å; Y133-L214 HydrophobicContact CD2-CG 4.21Å; Y133-L214 HydrophobicContact CE1-CD1 4.12Å; Y133-L214 HydrophobicContact CE2-CD1 3.63Å; Y133-L214 HydrophobicContact CE2-CG 4.24Å; Y133-L214 HydrophobicContact CG-CD1 4.48Å
134R89.3Confident82.2Confident198 Ų19877.3 Ų77.375%0.74741%0.405SS*.Hα-helixtrans-64.7-40.5179-173.5179-176.7173.21.9112H130 S131 S138H130-R134 VanDerWaalsContact O-CB 3.24Å; H130-R134 WeakPolarHBondContact O-CB 3.33Å; H130-R134 PolarHBondContact O-N 3.37Å; S131-R134 PolarHBondContact O-N 3.04Å; R134-S138 WeakPolarHBondContact O-CB 3.4Å; R134-S138 PolarHBondContact O-N 3.33Å
135A91.7Very high84.3Confident58 Ų5874.9 Ų74.948%0.47939%0.39SS..Hα-helixtrans-64.3-49176.700000111.3S131 D132 L137 S138 Q139S131-A135 WeakPolarHBondContact O-CB 3.27Å; S131-A135 PolarHBondContact O-N 3.34Å; D132-A135 PolarHBondContact O-N 3.24Å; A135-L137 PolarHBondContact O-N 3.11Å; A135-S138 WeakPolarHBondContact O-CB 3.4Å; A135-S138 PolarHBondContact O-N 2.72Å; A135-Q139 PolarHBondContact O-N 3.34Å
136K92.9Very high86.4Confident60 Ų6071.5 Ų71.526%0.26138%0.375SS..Hα-helixtrans-64-39176.8-73.7174.9174.6-176.50112.4D132 Y133 Q139 I140 L209 L213 L337D132-K136 WeakPolarHBondContact O-CB 3.29Å; D132-K136 WeakPolarHBondContact O-CG 3.4Å; D132-K136 PolarHBondContact O-N 3.25Å; Y133-K136 PolarHBondContact O-N 3.01Å; K136-Q139 WeakPolarHBondContact O-CB 3.37Å; K136-Q139 PolarHBondContact O-N 3.48Å; K136-I140 WeakPolarHBondContact O-CG1 3.28Å; K136-I140 PolarHBondContact O-N 2.75Å; K136-L209 HydrophobicContact CB-CD1 3.72Å; K136-L209 HydrophobicContact CB-CD2 3.88Å; K136-L209 HydrophobicContact CB-CG 4.48Å; K136-L209 HydrophobicContact CD-CD1 3.84Å; K136-L209 HydrophobicContact CG-CD1 4.4Å; K136-L213 HydrophobicContact CD-CD1 4.01Å; K136-L337 HydrophobicContact CD-CD2 3.62Å; K136-L337 HydrophobicContact CG-CD2 4.07Å
137L93.1Very high88.2Confident13 Ų1370.3 Ų70.37%0.06836%0.364CS..Hα-helixtrans-62.8-44.7173.5-175.461.2000110.3V101 Y133 A135 Q139 I140 R141 V206 L209V101-L137 HydrophobicContact CG2-CD1 4.07Å; Y133-L137 HydrophobicContact CE1-CD2 4.06Å; Y133-L137 VanDerWaalsContact O-CB 3.23Å; Y133-L137 WeakPolarHBondContact O-CB 3.25Å; Y133-L137 PolarHBondContact O-N 2.94Å; A135-L137 PolarHBondContact O-N 3.11Å; L137-Q139 VanDerWaalsContact C-N 3.28Å; L137-Q139 PolarHBondContact O-N 2.77Å; L137-I140 PolarHBondContact O-N 2.91Å; L137-I140 VanDerWaalsContact O-N 3.17Å; L137-R141 VanDerWaalsContact O-CG 3.29Å; L137-R141 WeakPolarHBondContact O-CG 3.32Å; L137-R141 PolarHBondContact O-N 3.24Å; L137-V206 HydrophobicContact CD1-CG1 4.3Å; L137-V206 HydrophobicContact CD1-CG2 4.09Å; L137-L209 HydrophobicContact CB-CD2 4.07Å
138S93.3Very high89.7Confident69 Ų6968.1 Ų68.148%0.48335%0.346SS..Hα-helixtrans-58.5-38.8175-167.30000112.5R134 A135 R141 Q142R134-S138 WeakPolarHBondContact O-CB 3.4Å; R134-S138 PolarHBondContact O-N 3.33Å; A135-S138 WeakPolarHBondContact O-CB 3.4Å; A135-S138 PolarHBondContact O-N 2.72Å; S138-R141 WeakPolarHBondContact O-CB 3.33Å; S138-R141 PolarHBondContact O-N 3.05Å; S138-Q142 PolarHBondContact O-N 2.98Å
139Q95.9Very high91.4Very high70 Ų7069.5 Ų69.533%0.32735%0.351SS..Hα-helixtrans-63.5-45.8174.8-172.4-178.25.400111.7A135 K136 L137 R141 Q142 I143A135-Q139 PolarHBondContact O-N 3.34Å; K136-Q139 WeakPolarHBondContact O-CB 3.37Å; K136-Q139 PolarHBondContact O-N 3.48Å; L137-Q139 VanDerWaalsContact C-N 3.28Å; L137-Q139 PolarHBondContact O-N 2.77Å; Q139-R141 VanDerWaalsContact C-N 3.27Å; Q139-R141 PolarHBondContact O-N 2.86Å; Q139-Q142 PolarHBondContact O-N 3.38Å; Q139-I143 HydrophobicContact CG-CD1 4.04Å; Q139-I143 WeakPolarHBondContact O-CG1 3.17Å; Q139-I143 PolarHBondContact O-N 3.13Å
140I95.5Very high92.7Very high30 Ų3074 Ų7415%0.15437%0.365CS..Hα-helixtrans-57.6-42.9174.5-66.5170.2000110.4K136 L137 Q142 I143 Y144 T202 A205 V206 L209K136-I140 WeakPolarHBondContact O-CG1 3.28Å; K136-I140 PolarHBondContact O-N 2.75Å; L137-I140 PolarHBondContact O-N 2.91Å; L137-I140 VanDerWaalsContact O-N 3.17Å; I140-Q142 PolarHBondContact O-N 3.13Å; I140-I143 PolarHBondContact O-N 2.91Å; I140-Y144 WeakPolarHBondContact O-CB 3.41Å; I140-Y144 PolarHBondContact O-N 2.9Å; I140-T202 HydrophobicContact CG2-CG2 3.85Å; I140-A205 HydrophobicContact CD1-CB 4.14Å; I140-V206 HydrophobicContact CD1-CG2 4.47Å; I140-V206 HydrophobicContact CG2-CG2 4Å; I140-L209 HydrophobicContact CD1-CB 4.29Å; I140-L209 HydrophobicContact CD1-CD2 3.82Å
141R94.8Very high93.5Very high85 Ų8573.1 Ų73.132%0.32136%0.359SS..Hα-helixtrans-60.4-46.5176.5-63.4-173.5-173.5173.6-5.9112.2E99 G100 V101 L137 S138 Q139 Y144 H145E99-R141 PolarHBondContact O-NH2 3.04Å; G100-R141 VanDerWaalsContact C-CZ 3.46Å; G100-R141 VanDerWaalsContact O-CD 3.27Å; G100-R141 WeakPolarHBondContact O-CD 3.19Å; G100-R141 PolarHBondContact O-NE 3.29Å; G100-R141 PolarHBondContact O-NH1 2.9Å; G100-R141 PolarHBondContact O-NH2 3.41Å; V101-R141 HydrophobicContact CB-CG 4.15Å; V101-R141 HydrophobicContact CG1-CG 4.14Å; V101-R141 HydrophobicContact CG2-CG 3.93Å; L137-R141 VanDerWaalsContact O-CG 3.29Å; L137-R141 WeakPolarHBondContact O-CG 3.32Å; L137-R141 PolarHBondContact O-N 3.24Å; S138-R141 WeakPolarHBondContact O-CB 3.33Å; S138-R141 PolarHBondContact O-N 3.05Å; Q139-R141 VanDerWaalsContact C-N 3.27Å; Q139-R141 PolarHBondContact O-N 2.86Å; R141-Y144 PolarHBondContact O-N 3.41Å; R141-H145 PolarHBondContact O-N 3.07Å; R141-H145 VanDerWaalsContact O-N 3.12Å; R141-H145 PolarHBondContact O-ND1 3.24Å
142Q95.8Very high93.9Very high145 Ų14573.9 Ų73.968%0.67835%0.354SS*.Hα-helixtrans-63.3-44.2-179.3-174.9178.2-4.900111.3S138 Q139 I140 H145 S146S138-Q142 PolarHBondContact O-N 2.98Å; Q139-Q142 PolarHBondContact O-N 3.38Å; I140-Q142 PolarHBondContact O-N 3.13Å; Q142-H145 PolarHBondContact O-N 2.65Å; Q142-S146 VanDerWaalsContact O-CB 3.29Å; Q142-S146 WeakPolarHBondContact O-CB 3.36Å; Q142-S146 PolarHBondContact O-N 2.77Å
143I95.9Very high94.3Very high81 Ų8173.8 Ų73.842%0.41535%0.351SS..Hα-helixtrans-61.6-47.7177.3-66.1167.4000110.3Q139 I140 H145 S146 E147Q139-I143 HydrophobicContact CG-CD1 4.04Å; Q139-I143 WeakPolarHBondContact O-CG1 3.17Å; Q139-I143 PolarHBondContact O-N 3.13Å; I140-I143 PolarHBondContact O-N 2.91Å; I143-H145 PolarHBondContact O-N 2.84Å; I143-S146 PolarHBondContact O-N 3.36Å; I143-E147 HydrophobicContact CG2-CG 4.18Å; I143-E147 WeakPolarHBondContact O-CB 3.43Å; I143-E147 WeakPolarHBondContact O-CG 3.34Å; I143-E147 PolarHBondContact O-N 2.91Å
144Y96.7Very high94.6Very high9 Ų974.4 Ų74.44%0.03536%0.362CS..Hα-helixtrans-54.9-50.9178.7170.3-106.8000112.4L96 V101 I140 R141 E147 L148 L198 K199 T202L96-Y144 HydrophobicContact CD1-CE1 4.5Å; L96-Y144 HydrophobicContact CD1-CE2 3.91Å; V101-Y144 HydrophobicContact CG1-CD1 3.94Å; V101-Y144 HydrophobicContact CG1-CG 4.13Å; I140-Y144 WeakPolarHBondContact O-CB 3.41Å; I140-Y144 PolarHBondContact O-N 2.9Å; R141-Y144 PolarHBondContact O-N 3.41Å; Y144-E147 PolarHBondContact O-N 3.04Å; Y144-L148 HydrophobicContact CE1-CD2 4.27Å; Y144-L148 VanDerWaalsContact O-CB 3.25Å; Y144-L148 WeakPolarHBondContact O-CB 3.42Å; Y144-L148 PolarHBondContact O-N 3.49Å; Y144-L198 HydrophobicContact CD2-CD2 4.21Å; Y144-L198 HydrophobicContact CD2-CG 4.03Å; Y144-L198 HydrophobicContact CE2-CD2 4.19Å; Y144-L198 HydrophobicContact CE2-CG 4.14Å; Y144-K199 HydrophobicContact CE2-CG 3.94Å; Y144-T202 HydrophobicContact CD2-CG2 3.99Å; Y144-T202 WeakPolarHBondContact CD2-OG1 3.38Å; Y144-T202 HydrophobicContact CG-CG2 4.08Å
145H95.5Very high94.9Very high74 Ų7465.9 Ų65.934%0.34333%0.333SS..Hα-helixtrans-68.3-39.8-179.7-67.487.8000112.3V101 R141 Q142 I143 E147 L148 E149V101-H145 PolarHBondContact O-CE1 3.26Å; R141-H145 PolarHBondContact O-N 3.07Å; R141-H145 VanDerWaalsContact O-N 3.12Å; R141-H145 PolarHBondContact O-ND1 3.24Å; Q142-H145 PolarHBondContact O-N 2.65Å; I143-H145 PolarHBondContact O-N 2.84Å; H145-E147 PolarHBondContact O-N 3.43Å; H145-L148 PolarHBondContact O-N 3.13Å; H145-E149 WeakPolarHBondContact O-CB 3.24Å; H145-E149 PolarHBondContact O-N 3.32Å
146S96.4Very high95.1Very high44 Ų4468.8 Ų68.831%0.30833%0.331SS..Hα-helixtrans-57.5-48.5174.9153.40000111.5Q142 I143 K150Q142-S146 VanDerWaalsContact O-CB 3.29Å; Q142-S146 WeakPolarHBondContact O-CB 3.36Å; Q142-S146 PolarHBondContact O-N 2.77Å; I143-S146 PolarHBondContact O-N 3.36Å; S146-K150 WeakPolarHBondContact O-CG 3.46Å; S146-K150 PolarHBondContact O-N 3.08Å
147E95.9Very high95.3Very high55 Ų5571.3 Ų71.326%0.25734%0.344SS..Hα-helixtrans-70.1-40.7-178.8-67-57.9109.100111.1I143 Y144 H145 E149 K150 Y151 L198I143-E147 HydrophobicContact CG2-CG 4.18Å; I143-E147 WeakPolarHBondContact O-CB 3.43Å; I143-E147 WeakPolarHBondContact O-CG 3.34Å; I143-E147 PolarHBondContact O-N 2.91Å; Y144-E147 PolarHBondContact O-N 3.04Å; H145-E147 PolarHBondContact O-N 3.43Å; E147-E149 PolarHBondContact O-N 2.97Å; E147-K150 PolarHBondContact O-N 2.77Å; E147-K150 IonicContact OE1-NZ 2.8Å; E147-K150 PolarHBondContact OE1-NZ 3Å; E147-Y151 HydrophobicContact CB-CD2 4.45Å; E147-Y151 HydrophobicContact CB-CE2 4.11Å; E147-Y151 WeakPolarHBondContact O-CD2 3.32Å; E147-Y151 PolarHBondContact O-N 3.39Å; E147-L198 HydrophobicContact CB-CD1 3.95Å; E147-L198 HydrophobicContact CB-CD2 4.19Å
148L93.9Very high95.5Very high26 Ų2675.7 Ų75.714%0.13636%0.363CS..Hα-helixtrans-58.2-47.1176.5-175.366.5000111.5Y144 H145 K150 Y151 E152 Q195 L198Y144-L148 HydrophobicContact CE1-CD2 4.27Å; Y144-L148 VanDerWaalsContact O-CB 3.25Å; Y144-L148 WeakPolarHBondContact O-CB 3.42Å; Y144-L148 PolarHBondContact O-N 3.49Å; H145-L148 PolarHBondContact O-N 3.13Å; L148-K150 VanDerWaalsContact C-N 3.33Å; L148-K150 PolarHBondContact O-N 2.68Å; L148-Y151 PolarHBondContact O-N 2.84Å; L148-E152 HydrophobicContact CG-CG 4.47Å; L148-E152 WeakPolarHBondContact O-CG 3.24Å; L148-E152 PolarHBondContact O-N 2.9Å; L148-Q195 HydrophobicContact CD1-CG 4.14Å; L148-L198 HydrophobicContact CB-CD2 3.97Å; L148-L198 HydrophobicContact CD1-CD2 4.19Å
149E95.2Very high95.6Very high133 Ų13373.3 Ų73.362%0.62135%0.346SS*.Hα-helixtrans-61.3-40.4178.9-175.2172.1-155.100112.1H145 E147 E152 Q153H145-E149 WeakPolarHBondContact O-CB 3.24Å; H145-E149 PolarHBondContact O-N 3.32Å; E147-E149 PolarHBondContact O-N 2.97Å; E149-E152 PolarHBondContact O-N 3.49Å; E149-Q153 WeakPolarHBondContact O-CB 3.44Å; E149-Q153 PolarHBondContact O-N 2.98Å
150K95Very high95.7Very high118 Ų11873.7 Ų73.751%0.51335%0.353SS..Hα-helixtrans-61.9-45.1174.4-69.7170.6-167.1171.80111.8S146 E147 L148 Q153 A154S146-K150 WeakPolarHBondContact O-CG 3.46Å; S146-K150 PolarHBondContact O-N 3.08Å; E147-K150 PolarHBondContact O-N 2.77Å; E147-K150 IonicContact OE1-NZ 2.8Å; E147-K150 PolarHBondContact OE1-NZ 3Å; L148-K150 VanDerWaalsContact C-N 3.33Å; L148-K150 PolarHBondContact O-N 2.68Å; K150-Q153 PolarHBondContact O-N 2.92Å; K150-A154 WeakPolarHBondContact O-CB 3.46Å; K150-A154 PolarHBondContact O-N 3.34Å
151Y94.5Very high95.7Very high86 Ų8678.1 Ų78.134%0.33737%0.373SS..Hα-helixtrans-66.8-40.6179-70.1-57.7000112.2E147 L148 A154 C155 I194 L198E147-Y151 HydrophobicContact CB-CD2 4.45Å; E147-Y151 HydrophobicContact CB-CE2 4.11Å; E147-Y151 WeakPolarHBondContact O-CD2 3.32Å; E147-Y151 PolarHBondContact O-N 3.39Å; L148-Y151 PolarHBondContact O-N 2.84Å; Y151-A154 PolarHBondContact O-N 2.7Å; Y151-C155 VanDerWaalsContact O-CB 3.32Å; Y151-C155 WeakPolarHBondContact O-CB 3.42Å; Y151-C155 PolarHBondContact O-N 3.19Å; Y151-I194 HydrophobicContact CD1-CG2 3.78Å; Y151-I194 HydrophobicContact CD2-CG2 4.36Å; Y151-I194 HydrophobicContact CE1-CG2 3.79Å; Y151-I194 HydrophobicContact CE2-CG2 4.37Å; Y151-I194 HydrophobicContact CG-CG2 4.09Å; Y151-L198 HydrophobicContact CD2-CD2 3.92Å; Y151-L198 HydrophobicContact CE2-CD1 4.48Å; Y151-L198 HydrophobicContact CE2-CD2 4.1Å
152E93.5Very high95.8Very high86 Ų8674.8 Ų74.840%0.40236%0.362SS..Hα-helixtrans-63.9-42.5175.6-74-179.8-179.900111.8L148 E149 C155 R156L148-E152 HydrophobicContact CG-CG 4.47Å; L148-E152 WeakPolarHBondContact O-CG 3.24Å; L148-E152 PolarHBondContact O-N 2.9Å; E149-E152 PolarHBondContact O-N 3.49Å; E152-C155 WeakPolarHBondContact O-CB 3.46Å; E152-C155 PolarHBondContact O-N 3.44Å; E152-R156 WeakPolarHBondContact O-CG 3.29Å; E152-R156 PolarHBondContact O-N 3.35Å; E152-R156 IonicContact OE2-NH1 3.13Å
153Q96.3Very high95.7Very high79 Ų7969 Ų6937%0.36934%0.336SS..Hα-helixtrans-63.2-47.5175.6-176.361.819.500111.3E149 K150 C155 R156 E157E149-Q153 WeakPolarHBondContact O-CB 3.44Å; E149-Q153 PolarHBondContact O-N 2.98Å; K150-Q153 PolarHBondContact O-N 2.92Å; Q153-C155 VanDerWaalsContact C-N 3.28Å; Q153-C155 PolarHBondContact O-N 2.75Å; Q153-R156 PolarHBondContact O-N 3.35Å; Q153-E157 WeakPolarHBondContact CG-OE1 3.37Å; Q153-E157 PolarHBondContact NE2-OE1 3.18Å; Q153-E157 WeakPolarHBondContact O-CG 3.34Å; Q153-E157 PolarHBondContact O-N 3.01Å
154A95.1Very high95.7Very high43 Ų4369.2 Ų69.236%0.35534%0.338SS..Hα-helixtrans-60.1-38.2176.200000112.1K150 Y151 F158K150-A154 WeakPolarHBondContact O-CB 3.46Å; K150-A154 PolarHBondContact O-N 3.34Å; Y151-A154 PolarHBondContact O-N 2.7Å; A154-F158 WeakPolarHBondContact O-CB 3.41Å; A154-F158 PolarHBondContact O-N 3.49Å
155C95.9Very high95.6Very high19 Ų1973 Ų7313%0.12836%0.358CS..Hα-helixtrans-61.7-47.9174.4-176.90000112Y151 E152 Q153 T159 F191Y151-C155 VanDerWaalsContact O-CB 3.32Å; Y151-C155 WeakPolarHBondContact O-CB 3.42Å; Y151-C155 PolarHBondContact O-N 3.19Å; E152-C155 WeakPolarHBondContact O-CB 3.46Å; E152-C155 PolarHBondContact O-N 3.44Å; Q153-C155 VanDerWaalsContact C-N 3.28Å; Q153-C155 PolarHBondContact O-N 2.75Å; C155-T159 WeakPolarHBondContact O-CB 3.34Å; C155-T159 PolarHBondContact O-N 3.49Å; C155-T159 PolarHBondContact O-OG1 2.84Å; C155-F191 HydrophobicContact CB-CB 4.44Å; C155-F191 HydrophobicContact CB-CD1 3.57Å; C155-F191 HydrophobicContact CB-CD2 3.8Å; C155-F191 HydrophobicContact CB-CE1 3.63Å; C155-F191 HydrophobicContact CB-CE2 3.86Å; C155-F191 HydrophobicContact CB-CG 3.67Å; C155-F191 HydrophobicContact CB-CZ 3.79Å; C155-F191 WeakPolarHBondContact SG-CD2 3.38Å; C155-F191 VanDerWaalsContact SG-CG 3.51Å
156R95.5Very high95.5Very high119 Ų11970 Ų7045%0.44935%0.345SS..Hα-helixtrans-61.1-47.7177.6-73.3-172.2-65.7-95.34.6111.7E152 Q153 T160E152-R156 WeakPolarHBondContact O-CG 3.29Å; E152-R156 PolarHBondContact O-N 3.35Å; E152-R156 IonicContact OE2-NH1 3.13Å; Q153-R156 PolarHBondContact O-N 3.35Å; R156-T160 VanDerWaalsContact O-CB 3.28Å; R156-T160 WeakPolarHBondContact O-CB 2.96Å; R156-T160 PolarHBondContact O-N 3.04Å; R156-T160 PolarHBondContact O-OG1 3.16Å
157E97Very high95.3Very high114 Ų11474.9 Ų74.953%0.53336%0.357SS..Hα-helixtrans-63.5-48.6-179.8-73.3175.7-171.800111.6Q153 T160 H161Q153-E157 WeakPolarHBondContact CG-OE1 3.37Å; Q153-E157 PolarHBondContact NE2-OE1 3.18Å; Q153-E157 WeakPolarHBondContact O-CG 3.34Å; Q153-E157 PolarHBondContact O-N 3.01Å; E157-T160 PolarHBondContact O-N 3.28Å; E157-H161 WeakPolarHBondContact O-CB 3.36Å; E157-H161 PolarHBondContact O-N 2.87Å
158F97.3Very high95Very high105 Ų10577.9 Ų77.946%0.46137%0.37SS..Hα-helixtrans-63.4-45.8180-174.3-107.4000111.8A154 T160 H161 V162 I187 F191A154-F158 WeakPolarHBondContact O-CB 3.41Å; A154-F158 PolarHBondContact O-N 3.49Å; F158-T160 VanDerWaalsContact C-N 3.31Å; F158-T160 PolarHBondContact O-N 2.66Å; F158-H161 PolarHBondContact O-N 3.43Å; F158-V162 HydrophobicContact CD1-CG2 4.3Å; F158-V162 HydrophobicContact CD2-CG2 4.49Å; F158-V162 HydrophobicContact CE1-CG2 3.93Å; F158-V162 HydrophobicContact CE2-CG2 4.12Å; F158-V162 HydrophobicContact CZ-CG2 3.83Å; F158-V162 WeakPolarHBondContact O-CG2 3.46Å; F158-V162 PolarHBondContact O-N 2.92Å; F158-I187 HydrophobicContact CD1-CD1 3.93Å; F158-I187 HydrophobicContact CD1-CG1 4.2Å; F158-I187 HydrophobicContact CD1-CG2 3.77Å; F158-I187 HydrophobicContact CE1-CD1 3.66Å; F158-I187 HydrophobicContact CE1-CG1 3.8Å; F158-I187 HydrophobicContact CE1-CG2 4.18Å; F158-F191 HydrophobicContact CB-CZ 4.48Å; F158-F191 HydrophobicContact CD1-CE2 4.18Å
159T96.5Very high94.8Very high19 Ų1979.6 Ų79.612%0.11738%0.378CS..Hα-helixtrans-60.3-42.8176.5-59.70000111.2C155 T163 V184C155-T159 WeakPolarHBondContact O-CB 3.34Å; C155-T159 PolarHBondContact O-N 3.49Å; C155-T159 PolarHBondContact O-OG1 2.84Å; T159-T163 VanDerWaalsContact O-CB 3.27Å; T159-T163 WeakPolarHBondContact O-CB 3.49Å; T159-T163 PolarHBondContact O-N 3.37Å; T159-T163 PolarHBondContact O-OG1 2.99Å; T159-V184 HydrophobicContact CG2-CG1 3.86Å; T159-V184 HydrophobicContact CG2-CG2 4.22Å
160T96.9Very high94.4Very high77 Ų7775.5 Ų75.547%0.47236%0.364SS..Hα-helixtrans-62.9-46.2176.7-60.30000111R156 E157 F158 T163 N164R156-T160 VanDerWaalsContact O-CB 3.28Å; R156-T160 WeakPolarHBondContact O-CB 2.96Å; R156-T160 PolarHBondContact O-N 3.04Å; R156-T160 PolarHBondContact O-OG1 3.16Å; E157-T160 PolarHBondContact O-N 3.28Å; F158-T160 VanDerWaalsContact C-N 3.31Å; F158-T160 PolarHBondContact O-N 2.66Å; T160-T163 PolarHBondContact O-N 2.9Å; T160-N164 WeakPolarHBondContact O-CB 3.39Å; T160-N164 VanDerWaalsContact O-CG 3.23Å; T160-N164 PolarHBondContact O-N 2.89Å; T160-N164 PolarHBondContact O-ND2 2.88Å
161H96.8Very high93.9Very high124 Ų12477.6 Ų77.657%0.57437%0.369SS*.Hα-helixtrans-61.2-48.1179.3-174.469000111.9E157 F158 T163 N164 L165E157-H161 WeakPolarHBondContact O-CB 3.36Å; E157-H161 PolarHBondContact O-N 2.87Å; F158-H161 PolarHBondContact O-N 3.43Å; H161-T163 PolarHBondContact O-N 3.38Å; H161-N164 PolarHBondContact O-N 3.39Å; H161-L165 WeakPolarHBondContact O-CB 3.42Å; H161-L165 PolarHBondContact O-N 3.5Å
162V95.9Very high93.2Very high15 Ų1578 Ų789%0.09138%0.38CS..Hα-helixtrans-62.9-43.7177.5171.80000111.2F158 N164 L165 L166 M183 I187F158-V162 HydrophobicContact CD1-CG2 4.3Å; F158-V162 HydrophobicContact CD2-CG2 4.49Å; F158-V162 HydrophobicContact CE1-CG2 3.93Å; F158-V162 HydrophobicContact CE2-CG2 4.12Å; F158-V162 HydrophobicContact CZ-CG2 3.83Å; F158-V162 WeakPolarHBondContact O-CG2 3.46Å; F158-V162 PolarHBondContact O-N 2.92Å; V162-N164 PolarHBondContact O-N 2.88Å; V162-L165 PolarHBondContact O-N 3.25Å; V162-L166 HydrophobicContact CG1-CD1 3.8Å; V162-L166 HydrophobicContact CG1-CG 4.29Å; V162-L166 WeakPolarHBondContact O-CB 3.35Å; V162-L166 VanDerWaalsContact O-CG 3.29Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 3.45Å; V162-M183 HydrophobicContact CG1-CE 3.76Å; V162-I187 HydrophobicContact CB-CD1 3.97Å; V162-I187 HydrophobicContact CG1-CD1 3.91Å; V162-I187 HydrophobicContact CG2-CD1 3.91Å
163T94.6Very high92.8Very high23 Ų2379.4 Ų79.414%0.14138%0.382CS..Hα-helixtrans-61.9-44.5178.6-58.30000111.2T159 T160 H161 L166 R167 M180T159-T163 VanDerWaalsContact O-CB 3.27Å; T159-T163 WeakPolarHBondContact O-CB 3.49Å; T159-T163 PolarHBondContact O-N 3.37Å; T159-T163 PolarHBondContact O-OG1 2.99Å; T160-T163 PolarHBondContact O-N 2.9Å; H161-T163 PolarHBondContact O-N 3.38Å; T163-L166 PolarHBondContact O-N 2.85Å; T163-R167 WeakPolarHBondContact O-CB 3.43Å; T163-R167 VanDerWaalsContact O-CG 3.29Å; T163-R167 WeakPolarHBondContact O-CG 3.39Å; T163-R167 PolarHBondContact O-N 3.1Å; T163-M180 HydrophobicContact CG2-SD 3.94Å
164N95.9Very high92.1Very high85 Ų8577.2 Ų77.246%0.45538%0.375SS..Hα-helixtrans-64.7-42.8177.4-71.5-19.5000111.7T160 H161 V162 L166 R167 E168T160-N164 WeakPolarHBondContact O-CB 3.39Å; T160-N164 VanDerWaalsContact O-CG 3.23Å; T160-N164 PolarHBondContact O-N 2.89Å; T160-N164 PolarHBondContact O-ND2 2.88Å; H161-N164 PolarHBondContact O-N 3.39Å; V162-N164 PolarHBondContact O-N 2.88Å; N164-L166 PolarHBondContact O-N 2.96Å; N164-R167 PolarHBondContact O-N 3.09Å; N164-E168 PolarHBondContact O-N 3.28Å
165L94.8Very high91.6Very high89 Ų8976 Ų7647%0.46636%0.362SS..Hα-helixtrans-60.1-46.4176.2179.363.6000111.6H161 V162 R167 E168 Q169H161-L165 WeakPolarHBondContact O-CB 3.42Å; H161-L165 PolarHBondContact O-N 3.5Å; V162-L165 PolarHBondContact O-N 3.25Å; L165-R167 PolarHBondContact O-N 3.34Å; L165-E168 PolarHBondContact O-N 3.21Å; L165-Q169 WeakPolarHBondContact O-CG 3.34Å; L165-Q169 PolarHBondContact O-N 3.39Å
166L93Very high91.1Very high11 Ų1176.3 Ų76.36%0.05837%0.365CS..Hα-helixtrans-66-37.2179-70.1172.2000112.3V162 T163 N164 E168 Q169 S170 M180 M183V162-L166 HydrophobicContact CG1-CD1 3.8Å; V162-L166 HydrophobicContact CG1-CG 4.29Å; V162-L166 WeakPolarHBondContact O-CB 3.35Å; V162-L166 VanDerWaalsContact O-CG 3.29Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 3.45Å; T163-L166 PolarHBondContact O-N 2.85Å; N164-L166 PolarHBondContact O-N 2.96Å; L166-E168 VanDerWaalsContact C-N 3.35Å; L166-Q169 PolarHBondContact O-N 3.11Å; L166-S170 WeakPolarHBondContact O-CB 3.21Å; L166-S170 PolarHBondContact O-N 3.2Å; L166-M180 HydrophobicContact CB-CG 4.34Å; L166-M180 HydrophobicContact CD1-CB 4.19Å; L166-M180 HydrophobicContact CD1-CG 3.96Å; L166-M183 HydrophobicContact CD1-CB 4.11Å; L166-M183 HydrophobicContact CD1-CE 3.85Å; L166-M183 HydrophobicContact CD1-CG 4.42Å; L166-M183 HydrophobicContact CD1-SD 3.61Å; L166-M183 HydrophobicContact CD2-CE 4.16Å; L166-M183 HydrophobicContact CD2-SD 3.72Å; L166-M183 HydrophobicContact CG-CE 4.36Å; L166-M183 HydrophobicContact CG-SD 4.25Å
167R91.1Very high90.6Very high147 Ų14774.4 Ų74.456%0.55537%0.37SS*.Hα-helixtrans-63.1-39.6172.1-76.7176.8177.9-174.3-0.5112.2T163 N164 L165 S170 M180T163-R167 WeakPolarHBondContact O-CB 3.43Å; T163-R167 VanDerWaalsContact O-CG 3.29Å; T163-R167 WeakPolarHBondContact O-CG 3.39Å; T163-R167 PolarHBondContact O-N 3.1Å; N164-R167 PolarHBondContact O-N 3.09Å; L165-R167 PolarHBondContact O-N 3.34Å; R167-S170 PolarHBondContact O-N 3.26Å; R167-S170 PolarHBondContact O-OG 2.98Å; R167-M180 HydrophobicContact CG-SD 4.11Å
168E90.6Very high90Very high117 Ų11777.3 Ų77.355%0.54738%0.376SS..Hα-helixtrans-71.3-39.5177.3-162.957.2-153.900111.1N164 L165 L166 S170 R171N164-E168 PolarHBondContact O-N 3.28Å; L165-E168 PolarHBondContact O-N 3.21Å; L166-E168 VanDerWaalsContact C-N 3.35Å; E168-S170 VanDerWaalsContact C-N 3.3Å; E168-S170 PolarHBondContact O-N 2.77Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.25Å; E168-R171 VanDerWaalsContact O-N 3.17Å; E168-R171 WeakPolarHBondContact OE1-CD 3.25Å; E168-R171 IonicContact OE1-NE 2.63Å; E168-R171 VanDerWaalsContact OE2-CD 3.26Å; E168-R171 WeakPolarHBondContact OE2-CD 2.97Å
169Q88.8Confident89.4Confident62 Ų6275 Ų7529%0.2937%0.367SS..Hα-helixtrans-62.1-36.2172.4-72.5-160.7-6.500112.6L165 L166 R171 V172 R173 V175L165-Q169 WeakPolarHBondContact O-CG 3.34Å; L165-Q169 PolarHBondContact O-N 3.39Å; L166-Q169 PolarHBondContact O-N 3.11Å; Q169-R171 PolarHBondContact O-N 3.37Å; Q169-R171 VanDerWaalsContact O-N 3.07Å; Q169-V172 VanDerWaalsContact O-CG2 3.29Å; Q169-V172 WeakPolarHBondContact O-CG2 3.32Å; Q169-V172 PolarHBondContact O-N 2.96Å; Q169-R173 HydrophobicContact CB-CG 4.42Å; Q169-R173 WeakPolarHBondContact O-CG 3.5Å; Q169-R173 PolarHBondContact O-N 2.95Å; Q169-V175 HydrophobicContact CB-CG2 4.29Å
170S86.6Confident89Confident48 Ų4876 Ų7634%0.33637%0.37SS..Hα-helixtrans-64.5-13.2178.780.20000113.2F62 L166 R167 E168 R173F62-S170 WeakPolarHBondContact CE1-O 3.44Å; L166-S170 WeakPolarHBondContact O-CB 3.21Å; L166-S170 PolarHBondContact O-N 3.2Å; R167-S170 PolarHBondContact O-N 3.26Å; R167-S170 PolarHBondContact O-OG 2.98Å; E168-S170 VanDerWaalsContact C-N 3.3Å; E168-S170 PolarHBondContact O-N 2.77Å; S170-R173 WeakPolarHBondContact CA-O 3.44Å
171R84.4Confident88.7Confident161 Ų16178.4 Ų78.461%0.60838%0.376SS*.Hα-helixtrans-77.9-28.7173.8-58.6174.170.198.80.4112.8K58 E168 Q169K58-R171 PolarHBondContact NZ-O 3.11Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.25Å; E168-R171 VanDerWaalsContact O-N 3.17Å; E168-R171 WeakPolarHBondContact OE1-CD 3.25Å; E168-R171 IonicContact OE1-NE 2.63Å; E168-R171 VanDerWaalsContact OE2-CD 3.26Å; E168-R171 WeakPolarHBondContact OE2-CD 2.97Å; Q169-R171 PolarHBondContact O-N 3.37Å; Q169-R171 VanDerWaalsContact O-N 3.07Å
172V80.4Confident88.3Confident96 Ų9675 Ų7558%0.58236%0.36SS*.Hα-helixtrans-112.9-18.1-170.8-640000113.9Q169Q169-V172 VanDerWaalsContact O-CG2 3.29Å; Q169-V172 WeakPolarHBondContact O-CG2 3.32Å; Q169-V172 PolarHBondContact O-N 2.96Å
173R84.6Confident88.1Confident114 Ų11477.1 Ų77.143%0.4337%0.37SS..SBendtrans-146154.9174.359.6178.5-114.2-171.8-3.8111.8F62 Q169 S170 V175F62-R173 VanDerWaalsContact CE1-O 3.22Å; F62-R173 WeakPolarHBondContact CE1-O 3.43Å; Q169-R173 HydrophobicContact CB-CG 4.42Å; Q169-R173 WeakPolarHBondContact O-CG 3.5Å; Q169-R173 PolarHBondContact O-N 2.95Å; S170-R173 WeakPolarHBondContact CA-O 3.44Å; R173-V175 HydrophobicContact CG-CG2 4.09Å; R173-V175 PolarHBondContact O-N 3.48Å
174P81.8Confident88Confident34 Ų3477.4 Ų77.422%0.22137%0.372CS..  trans-61.9109.5175.9-21.132.8000111.7F62 L65 K69F62-P174 HydrophobicContact CD1-CB 4.47Å; F62-P174 HydrophobicContact CE1-CB 4.47Å; F62-P174 HydrophobicContact CE1-CG 4.38Å; F62-P174 HydrophobicContact CZ-CG 4.48Å; L65-P174 HydrophobicContact CB-CB 3.93Å; L65-P174 HydrophobicContact CB-CG 3.66Å; L65-P174 HydrophobicContact CD1-CG 3.81Å; L65-P174 HydrophobicContact CG-CG 4.37Å; K69-P174 PolarHBondContact NZ-O 3.43Å
175V85.6Confident87.7Confident16 Ų1675.3 Ų75.310%0.09737%0.371CS..  trans-123.6123170.6-178.40000106.7Q169 R173Q169-V175 HydrophobicContact CB-CG2 4.29Å; R173-V175 HydrophobicContact CG-CG2 4.09Å; R173-V175 PolarHBondContact O-N 3.48Å
176S85Confident87.5Confident27 Ų2775.6 Ų75.619%0.18937%0.371CS..  trans-83.4146.5-179.3178.70000110.6R178 E179 M180S176-R178 PolarHBondContact O-N 3.26Å; S176-R178 PolarHBondContact OG-N 3.45Å; S176-E179 PolarHBondContact N-OE2 3Å; S176-E179 WeakPolarHBondContact O-CB 3.44Å; S176-E179 PolarHBondContact O-N 3.38Å; S176-M180 PolarHBondContact O-N 3.45Å
177S85.3Confident87.5Confident78 Ų7876 Ų7655%0.54537%0.372SS..Hα-helixtrans-55.5-36.7174-53.50000112.1E179 M180 E181S177-E179 VanDerWaalsContact C-N 3.31Å; S177-E179 PolarHBondContact O-N 3.41Å; S177-M180 WeakPolarHBondContact O-CB 3.42Å; S177-M180 PolarHBondContact O-N 3.24Å; S177-E181 WeakPolarHBondContact O-CG 3.47Å; S177-E181 PolarHBondContact O-N 3.4Å
178R84.2Confident87.6Confident176 Ų17673.2 Ų73.266%0.66437%0.366SS*.Hα-helixtrans-63.8-33.6176.5-66.8-174179.8-138.5-0.3113.3S176 H182S176-R178 PolarHBondContact O-N 3.26Å; S176-R178 PolarHBondContact OG-N 3.45Å; R178-H182 VanDerWaalsContact O-CB 3.31Å; R178-H182 WeakPolarHBondContact O-CB 3.35Å; R178-H182 PolarHBondContact O-N 3.22Å
179E85.1Confident87.6Confident56 Ų5669.6 Ų69.626%0.26236%0.36SS..Hα-helixtrans-69.6-40.7177.2-179.3-178.2-177.800110.6K69 S176 S177 H182 M183K69-E179 WeakPolarHBondContact CE-OE2 3.39Å; K69-E179 IonicContact NZ-OE1 2.98Å; K69-E179 PolarHBondContact NZ-OE1 3.19Å; K69-E179 IonicContact NZ-OE2 2.76Å; K69-E179 PolarHBondContact NZ-OE2 2.9Å; S176-E179 PolarHBondContact N-OE2 3Å; S176-E179 WeakPolarHBondContact O-CB 3.44Å; S176-E179 PolarHBondContact O-N 3.38Å; S177-E179 VanDerWaalsContact C-N 3.31Å; S177-E179 PolarHBondContact O-N 3.41Å; E179-H182 PolarHBondContact O-N 3.19Å; E179-M183 WeakPolarHBondContact O-CG 3.39Å; E179-M183 PolarHBondContact O-N 3.45Å
180M88.7Confident87.8Confident40 Ų4074.1 Ų74.120%0.19738%0.379CS..Hα-helixtrans-63.6-46.2174.3-179.717759.400111.4T163 L166 R167 S176 S177 H182 M183 V184T163-M180 HydrophobicContact CG2-SD 3.94Å; L166-M180 HydrophobicContact CB-CG 4.34Å; L166-M180 HydrophobicContact CD1-CB 4.19Å; L166-M180 HydrophobicContact CD1-CG 3.96Å; R167-M180 HydrophobicContact CG-SD 4.11Å; S176-M180 PolarHBondContact O-N 3.45Å; S177-M180 WeakPolarHBondContact O-CB 3.42Å; S177-M180 PolarHBondContact O-N 3.24Å; M180-H182 PolarHBondContact O-N 2.94Å; M180-M183 PolarHBondContact O-N 3.5Å; M180-V184 WeakPolarHBondContact O-CG2 3.35Å; M180-V184 PolarHBondContact O-N 2.72Å
181E89.7Confident88.1Confident127 Ų12773.7 Ų73.759%0.59337%0.371SS*.Hα-helixtrans-59.1-45.3174.5-73.2164.3-166.700111.7S177 M183 V184 G185S177-E181 WeakPolarHBondContact O-CG 3.47Å; S177-E181 PolarHBondContact O-N 3.4Å; E181-M183 PolarHBondContact O-N 3.39Å; E181-V184 PolarHBondContact O-N 3.04Å; E181-G185 PolarHBondContact O-N 2.79Å
182H88.9Confident88.4Confident52 Ų5268.6 Ų68.624%0.24136%0.358CS..Hα-helixtrans-62.4-43.2177.5178.7-95.7000112.2R178 E179 M180 V184 G185 M186R178-H182 VanDerWaalsContact O-CB 3.31Å; R178-H182 WeakPolarHBondContact O-CB 3.35Å; R178-H182 PolarHBondContact O-N 3.22Å; E179-H182 PolarHBondContact O-N 3.19Å; M180-H182 PolarHBondContact O-N 2.94Å; H182-V184 PolarHBondContact O-N 3.02Å; H182-G185 PolarHBondContact O-N 2.96Å; H182-M186 VanDerWaalsContact CE1-SD 3.56Å; H182-M186 WeakPolarHBondContact O-CG 3.35Å; H182-M186 PolarHBondContact O-N 3.16Å
183M90.2Very high89Confident60 Ų6066.5 Ų66.530%0.29635%0.351SS..Hα-helixtrans-60.3-45.8174.4-77.9-171.257.500112V162 L166 E179 M180 E181 G185 M186 I187V162-M183 HydrophobicContact CG1-CE 3.76Å; L166-M183 HydrophobicContact CD1-CB 4.11Å; L166-M183 HydrophobicContact CD1-CE 3.85Å; L166-M183 HydrophobicContact CD1-CG 4.42Å; L166-M183 HydrophobicContact CD1-SD 3.61Å; L166-M183 HydrophobicContact CD2-CE 4.16Å; L166-M183 HydrophobicContact CD2-SD 3.72Å; L166-M183 HydrophobicContact CG-CE 4.36Å; L166-M183 HydrophobicContact CG-SD 4.25Å; E179-M183 WeakPolarHBondContact O-CG 3.39Å; E179-M183 PolarHBondContact O-N 3.45Å; M180-M183 PolarHBondContact O-N 3.5Å; E181-M183 PolarHBondContact O-N 3.39Å; M183-G185 VanDerWaalsContact C-N 3.3Å; M183-G185 PolarHBondContact O-N 2.97Å; M183-M186 HydrophobicContact CB-CE 4.42Å; M183-M186 HydrophobicContact CG-CE 3.99Å; M183-M186 PolarHBondContact O-N 3.04Å; M183-I187 VanDerWaalsContact O-CG1 3.25Å; M183-I187 WeakPolarHBondContact O-CG1 3.49Å; M183-I187 PolarHBondContact O-N 3.26Å; M183-I187 VanDerWaalsContact O-N 3.11Å
184V93.3Very high89.4Confident29 Ų2963.9 Ų63.918%0.17635%0.345CS..Hα-helixtrans-62.1-38.9174.9171.80000111.1T159 M180 E181 H182 I187 H188T159-V184 HydrophobicContact CG2-CG1 3.86Å; T159-V184 HydrophobicContact CG2-CG2 4.22Å; M180-V184 WeakPolarHBondContact O-CG2 3.35Å; M180-V184 PolarHBondContact O-N 2.72Å; E181-V184 PolarHBondContact O-N 3.04Å; H182-V184 PolarHBondContact O-N 3.02Å; V184-I187 WeakPolarHBondContact O-CB 3.4Å; V184-I187 PolarHBondContact O-N 2.76Å; V184-H188 WeakPolarHBondContact CG1-CE1 3.27Å; V184-H188 WeakPolarHBondContact CG1-ND1 3.39Å; V184-H188 PolarHBondContact O-N 3.07Å; V184-H188 PolarHBondContact O-ND1 3.32Å
185G90.6Very high89.9Confident42 Ų4265.2 Ų65.243%0.43335%0.348SS..Hα-helixtrans-61.6-45.5175.300000112.7E181 H182 M183 I187 H188 G189E181-G185 PolarHBondContact O-N 2.79Å; H182-G185 PolarHBondContact O-N 2.96Å; M183-G185 VanDerWaalsContact C-N 3.3Å; M183-G185 PolarHBondContact O-N 2.97Å; G185-I187 VanDerWaalsContact C-N 3.27Å; G185-I187 PolarHBondContact O-N 2.91Å; G185-H188 PolarHBondContact O-N 3.46Å; G185-G189 PolarHBondContact O-N 2.87Å
186M90.5Very high90.2Very high95 Ų9567.4 Ų67.447%0.46835%0.354SS..Hα-helixtrans-58.9-40.2174.3-70.9-170.1-65.700111.8H182 M183 G189 K190H182-M186 VanDerWaalsContact CE1-SD 3.56Å; H182-M186 WeakPolarHBondContact O-CG 3.35Å; H182-M186 PolarHBondContact O-N 3.16Å; M183-M186 HydrophobicContact CB-CE 4.42Å; M183-M186 HydrophobicContact CG-CE 3.99Å; M183-M186 PolarHBondContact O-N 3.04Å; M186-G189 PolarHBondContact O-N 3.37Å; M186-K190 WeakPolarHBondContact O-CG 3.38Å; M186-K190 PolarHBondContact O-N 3.49Å
187I92.6Very high90.7Very high18 Ų1872.1 Ų72.19%0.09237%0.373CS..Hα-helixtrans-60.3-53.1176.7-67.2171.5000110.1F158 V162 M183 V184 G185 G189 K190 F191F158-I187 HydrophobicContact CD1-CD1 3.93Å; F158-I187 HydrophobicContact CD1-CG1 4.2Å; F158-I187 HydrophobicContact CD1-CG2 3.77Å; F158-I187 HydrophobicContact CE1-CD1 3.66Å; F158-I187 HydrophobicContact CE1-CG1 3.8Å; F158-I187 HydrophobicContact CE1-CG2 4.18Å; V162-I187 HydrophobicContact CB-CD1 3.97Å; V162-I187 HydrophobicContact CG1-CD1 3.91Å; V162-I187 HydrophobicContact CG2-CD1 3.91Å; M183-I187 VanDerWaalsContact O-CG1 3.25Å; M183-I187 WeakPolarHBondContact O-CG1 3.49Å; M183-I187 PolarHBondContact O-N 3.26Å; M183-I187 VanDerWaalsContact O-N 3.11Å; V184-I187 WeakPolarHBondContact O-CB 3.4Å; V184-I187 PolarHBondContact O-N 2.76Å; G185-I187 VanDerWaalsContact C-N 3.27Å; G185-I187 PolarHBondContact O-N 2.91Å; I187-G189 VanDerWaalsContact C-N 3.27Å; I187-G189 PolarHBondContact O-N 2.98Å; I187-K190 PolarHBondContact O-N 3.48Å; I187-K190 VanDerWaalsContact O-N 3.08Å; I187-F191 HydrophobicContact CG2-CD2 3.58Å; I187-F191 HydrophobicContact CG2-CE2 3.51Å; I187-F191 VanDerWaalsContact O-CD2 3.24Å; I187-F191 WeakPolarHBondContact O-CD2 3.44Å; I187-F191 PolarHBondContact O-N 3.05Å
188H92.5Very high91.1Very high89 Ų8969.3 Ų69.341%0.41235%0.352SS..Hα-helixtrans-58.8-38.1177.8-7388000112.4V184 G185 K190 F191 T192V184-H188 WeakPolarHBondContact CG1-CE1 3.27Å; V184-H188 WeakPolarHBondContact CG1-ND1 3.39Å; V184-H188 PolarHBondContact O-N 3.07Å; V184-H188 PolarHBondContact O-ND1 3.32Å; G185-H188 PolarHBondContact O-N 3.46Å; H188-K190 PolarHBondContact O-N 3.29Å; H188-F191 PolarHBondContact O-N 3.48Å; H188-T192 WeakPolarHBondContact O-CB 3.45Å; H188-T192 PolarHBondContact O-N 3.35Å; H188-T192 PolarHBondContact O-OG1 3.28Å
189G90.9Very high91.7Very high42 Ų4261.2 Ų61.243%0.43332%0.322SS..Hα-helixtrans-60.6-43.5174.100000112.8G185 M186 I187 T192 A193G185-G189 PolarHBondContact O-N 2.87Å; M186-G189 PolarHBondContact O-N 3.37Å; I187-G189 VanDerWaalsContact C-N 3.27Å; I187-G189 PolarHBondContact O-N 2.98Å; G189-T192 PolarHBondContact O-N 2.98Å; G189-A193 PolarHBondContact O-N 3.33Å; G189-A193 VanDerWaalsContact O-N 3.13Å
190K92Very high92.2Very high156 Ų15661.6 Ų61.668%0.67832%0.324SS*.Hα-helixtrans-65.4-41.9175.3-64.1-61.4177.3-174.60112.1M186 I187 H188 T192 A193 I194M186-K190 WeakPolarHBondContact O-CG 3.38Å; M186-K190 PolarHBondContact O-N 3.49Å; I187-K190 PolarHBondContact O-N 3.48Å; I187-K190 VanDerWaalsContact O-N 3.08Å; H188-K190 PolarHBondContact O-N 3.29Å; K190-T192 VanDerWaalsContact C-N 3.34Å; K190-T192 PolarHBondContact O-N 3.42Å; K190-A193 WeakPolarHBondContact O-CB 3.32Å; K190-A193 PolarHBondContact O-N 3.18Å; K190-I194 WeakPolarHBondContact O-CG1 3.29Å; K190-I194 PolarHBondContact O-N 3.28Å; K190-I194 VanDerWaalsContact O-N 3.1Å
191F93.6Very high92.5Very high40 Ų4062.1 Ų62.118%0.17533%0.331CS..Hα-helixtrans-66.3-35.8176.5-81-74.6000112.7C155 F158 I187 H188 A193 I194 Q195C155-F191 HydrophobicContact CB-CB 4.44Å; C155-F191 HydrophobicContact CB-CD1 3.57Å; C155-F191 HydrophobicContact CB-CD2 3.8Å; C155-F191 HydrophobicContact CB-CE1 3.63Å; C155-F191 HydrophobicContact CB-CE2 3.86Å; C155-F191 HydrophobicContact CB-CG 3.67Å; C155-F191 HydrophobicContact CB-CZ 3.79Å; C155-F191 WeakPolarHBondContact SG-CD2 3.38Å; C155-F191 VanDerWaalsContact SG-CG 3.51Å; F158-F191 HydrophobicContact CB-CZ 4.48Å; F158-F191 HydrophobicContact CD1-CE2 4.18Å; I187-F191 HydrophobicContact CG2-CD2 3.58Å; I187-F191 HydrophobicContact CG2-CE2 3.51Å; I187-F191 VanDerWaalsContact O-CD2 3.24Å; I187-F191 WeakPolarHBondContact O-CD2 3.44Å; I187-F191 PolarHBondContact O-N 3.05Å; H188-F191 PolarHBondContact O-N 3.48Å; F191-A193 VanDerWaalsContact C-N 3.3Å; F191-A193 PolarHBondContact O-N 3.3Å; F191-I194 HydrophobicContact CD1-CD1 4.24Å; F191-I194 HydrophobicContact CE1-CD1 4.49Å; F191-I194 PolarHBondContact O-N 3.15Å; F191-Q195 WeakPolarHBondContact O-CB 3.36Å; F191-Q195 PolarHBondContact O-N 3.37Å
192T91.5Very high92.8Very high53 Ų5356.5 Ų56.533%0.32531%0.306SS..Hα-helixtrans-60.9-40.7173.2-56.90000111.1L89 H188 G189 K190 Q195 R196L89-T192 HydrophobicContact CD2-CG2 4.1Å; H188-T192 WeakPolarHBondContact O-CB 3.45Å; H188-T192 PolarHBondContact O-N 3.35Å; H188-T192 PolarHBondContact O-OG1 3.28Å; G189-T192 PolarHBondContact O-N 2.98Å; K190-T192 VanDerWaalsContact C-N 3.34Å; K190-T192 PolarHBondContact O-N 3.42Å; T192-Q195 PolarHBondContact O-N 2.87Å; T192-R196 PolarHBondContact O-N 3.12Å
193A91.6Very high93.1Very high53 Ų5354.3 Ų54.344%0.43830%0.296SS..Hα-helixtrans-63.8-41.2174.400000112.7G189 K190 F191 R196 Q197G189-A193 PolarHBondContact O-N 3.33Å; G189-A193 VanDerWaalsContact O-N 3.13Å; K190-A193 WeakPolarHBondContact O-CB 3.32Å; K190-A193 PolarHBondContact O-N 3.18Å; F191-A193 VanDerWaalsContact C-N 3.3Å; F191-A193 PolarHBondContact O-N 3.3Å; A193-R196 WeakPolarHBondContact O-CB 3.43Å; A193-R196 PolarHBondContact O-N 3.09Å; A193-Q197 PolarHBondContact O-N 2.91Å; A193-Q197 VanDerWaalsContact O-N 3.09Å
194I93.1Very high93.3Very high59 Ų5956.3 Ų56.330%0.30331%0.305SS..Hα-helixtrans-63.2-45.7174.7-65168.2000110.5Y151 K190 F191 R196 Q197 L198Y151-I194 HydrophobicContact CD1-CG2 3.78Å; Y151-I194 HydrophobicContact CD2-CG2 4.36Å; Y151-I194 HydrophobicContact CE1-CG2 3.79Å; Y151-I194 HydrophobicContact CE2-CG2 4.37Å; Y151-I194 HydrophobicContact CG-CG2 4.09Å; K190-I194 WeakPolarHBondContact O-CG1 3.29Å; K190-I194 PolarHBondContact O-N 3.28Å; K190-I194 VanDerWaalsContact O-N 3.1Å; F191-I194 HydrophobicContact CD1-CD1 4.24Å; F191-I194 HydrophobicContact CE1-CD1 4.49Å; F191-I194 PolarHBondContact O-N 3.15Å; I194-R196 VanDerWaalsContact C-N 3.3Å; I194-R196 PolarHBondContact O-N 3.41Å; I194-Q197 WeakPolarHBondContact O-CB 3.29Å; I194-Q197 PolarHBondContact O-N 3.12Å; I194-Q197 VanDerWaalsContact O-N 3.11Å; I194-L198 PolarHBondContact O-N 3.41Å
195Q92.4Very high93.4Very high61 Ų6156.1 Ų56.129%0.28531%0.306SS..Hα-helixtrans-60.3-40.5177.7-174.9179.3-6.600111.5L148 F191 T192 Q197 L198 K199L148-Q195 HydrophobicContact CD1-CG 4.14Å; F191-Q195 WeakPolarHBondContact O-CB 3.36Å; F191-Q195 PolarHBondContact O-N 3.37Å; T192-Q195 PolarHBondContact O-N 2.87Å; Q195-Q197 PolarHBondContact O-N 3.15Å; Q195-L198 PolarHBondContact O-N 3.12Å; Q195-K199 HydrophobicContact CG-CD 4.49Å; Q195-K199 VanDerWaalsContact NE2-NZ 3.14Å; Q195-K199 WeakPolarHBondContact O-CG 3.3Å; Q195-K199 PolarHBondContact O-N 3.22Å
196R92.9Very high93.6Very high62 Ų6254.2 Ų54.223%0.23429%0.286CS..Hα-helixtrans-58.1-48.1172.7-174.8-158.8-55.8-79.318.7111.4D86 L89 L92 T192 A193 I194 L198 K199 Q200D86-R196 VanDerWaalsContact CG-CZ 3.41Å; D86-R196 IonicContact OD1-CZ 3.68Å; D86-R196 IonicContact OD1-NH1 2.76Å; D86-R196 PolarHBondContact OD1-NH1 2.91Å; D86-R196 IonicContact OD1-NH2 2.63Å; D86-R196 PolarHBondContact OD1-NH2 3.33Å; D86-R196 IonicContact OD2-CZ 3.75Å; D86-R196 IonicContact OD2-NE 3.24Å; D86-R196 IonicContact OD2-NH1 2.79Å; D86-R196 PolarHBondContact OD2-NH1 3.46Å; D86-R196 IonicContact OD2-NH2 3.95Å; D86-R196 PolarHBondContact OD2-NH2 2.85Å; L89-R196 HydrophobicContact CD1-CB 3.97Å; L89-R196 HydrophobicContact CD1-CG 4.39Å; L92-R196 HydrophobicContact CD1-CG 4Å; T192-R196 PolarHBondContact O-N 3.12Å; A193-R196 WeakPolarHBondContact O-CB 3.43Å; A193-R196 PolarHBondContact O-N 3.09Å; I194-R196 VanDerWaalsContact C-N 3.3Å; I194-R196 PolarHBondContact O-N 3.41Å; R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 2.75Å; R196-K199 PolarHBondContact O-N 3.4Å; R196-Q200 WeakPolarHBondContact O-CB 3.36Å; R196-Q200 PolarHBondContact O-N 3.35Å
197Q94.7Very high93.6Very high126 Ų12653.2 Ų53.259%0.58928%0.281SS*.Hα-helixtrans-62.3-41.2-179.1-172.51753.600111.8A193 I194 Q195 Q200 S201A193-Q197 PolarHBondContact O-N 2.91Å; A193-Q197 VanDerWaalsContact O-N 3.09Å; I194-Q197 WeakPolarHBondContact O-CB 3.29Å; I194-Q197 PolarHBondContact O-N 3.12Å; I194-Q197 VanDerWaalsContact O-N 3.11Å; Q195-Q197 PolarHBondContact O-N 3.15Å; Q197-Q200 PolarHBondContact O-N 3.41Å; Q197-S201 PolarHBondContact O-N 2.98Å; Q197-S201 PolarHBondContact O-OG 3.36Å
198L95.1Very high93.6Very high19 Ų1955 Ų5510%0.09929%0.293CS..Hα-helixtrans-61.3-46.1174.5177.663.9000111.9Y144 E147 L148 Y151 I194 Q195 R196 Q200 S201 T202Y144-L198 HydrophobicContact CD2-CD2 4.21Å; Y144-L198 HydrophobicContact CD2-CG 4.03Å; Y144-L198 HydrophobicContact CE2-CD2 4.19Å; Y144-L198 HydrophobicContact CE2-CG 4.14Å; E147-L198 HydrophobicContact CB-CD1 3.95Å; E147-L198 HydrophobicContact CB-CD2 4.19Å; L148-L198 HydrophobicContact CB-CD2 3.97Å; L148-L198 HydrophobicContact CD1-CD2 4.19Å; Y151-L198 HydrophobicContact CD2-CD2 3.92Å; Y151-L198 HydrophobicContact CE2-CD1 4.48Å; Y151-L198 HydrophobicContact CE2-CD2 4.1Å; I194-L198 PolarHBondContact O-N 3.41Å; Q195-L198 PolarHBondContact O-N 3.12Å; R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 2.75Å; L198-Q200 VanDerWaalsContact C-N 3.35Å; L198-Q200 PolarHBondContact O-N 2.96Å; L198-S201 PolarHBondContact O-OG 2.76Å; L198-T202 WeakPolarHBondContact O-CB 3.48Å; L198-T202 PolarHBondContact O-N 3.12Å; L198-T202 PolarHBondContact O-OG1 3.41Å
199K95.2Very high93.5Very high7 Ų751.3 Ų51.33%0.0328%0.276CS..Hα-helixtrans-65.2-39.6178.4-70.4179.9-175.3172.50111.8L89 L92 D93 L96 Y144 Q195 R196 T202 C203L89-K199 HydrophobicContact CD1-CD 3.76Å; L92-K199 HydrophobicContact CB-CB 3.98Å; L92-K199 HydrophobicContact CB-CD 4.49Å; L92-K199 HydrophobicContact CD1-CB 4.12Å; D93-K199 VanDerWaalsContact OD1-CD 3.29Å; D93-K199 WeakPolarHBondContact OD1-CD 3.37Å; D93-K199 WeakPolarHBondContact OD1-CE 3.22Å; D93-K199 IonicContact OD1-NZ 2.76Å; D93-K199 PolarHBondContact OD1-NZ 3.47Å; D93-K199 IonicContact OD2-NZ 2.71Å; D93-K199 PolarHBondContact OD2-NZ 3.04Å; L96-K199 HydrophobicContact CD1-CB 3.84Å; L96-K199 HydrophobicContact CD1-CD 4.37Å; L96-K199 HydrophobicContact CD1-CG 3.72Å; Y144-K199 HydrophobicContact CE2-CG 3.94Å; Q195-K199 HydrophobicContact CG-CD 4.49Å; Q195-K199 VanDerWaalsContact NE2-NZ 3.14Å; Q195-K199 WeakPolarHBondContact O-CG 3.3Å; Q195-K199 PolarHBondContact O-N 3.22Å; R196-K199 PolarHBondContact O-N 3.4Å; K199-T202 PolarHBondContact O-N 3.49Å; K199-C203 WeakPolarHBondContact O-CB 3.47Å; K199-C203 PolarHBondContact O-N 2.89Å; K199-C203 PolarHBondContact O-SG 3.24Å
200Q95.4Very high93.4Very high64 Ų6454.2 Ų54.230%0.29927%0.274SS..Hα-helixtrans-61.2-52.7176.4-179.564.542.100111.6L92 R196 Q197 L198 T202 C203 E204L92-Q200 HydrophobicContact CD1-CB 4.12Å; L92-Q200 HydrophobicContact CD2-CB 4.46Å; R196-Q200 WeakPolarHBondContact O-CB 3.36Å; R196-Q200 PolarHBondContact O-N 3.35Å; Q197-Q200 PolarHBondContact O-N 3.41Å; L198-Q200 VanDerWaalsContact C-N 3.35Å; L198-Q200 PolarHBondContact O-N 2.96Å; Q200-T202 VanDerWaalsContact C-N 3.26Å; Q200-T202 PolarHBondContact O-N 2.95Å; Q200-C203 WeakPolarHBondContact O-CB 3.49Å; Q200-C203 PolarHBondContact O-N 2.71Å; Q200-C203 VanDerWaalsContact O-N 3.16Å; Q200-E204 PolarHBondContact NE2-OE1 3.26Å; Q200-E204 WeakPolarHBondContact O-CG 3.45Å; Q200-E204 PolarHBondContact O-N 3.29Å
201S95.6Very high93Very high50 Ų5049.9 Ų49.935%0.3526%0.264SS..Hα-helixtrans-63-35179.866.30000112.1Q197 L198 E204 A205Q197-S201 PolarHBondContact O-N 2.98Å; Q197-S201 PolarHBondContact O-OG 3.36Å; L198-S201 PolarHBondContact O-OG 2.76Å; S201-E204 PolarHBondContact O-N 2.96Å; S201-A205 WeakPolarHBondContact O-CB 3.31Å; S201-A205 PolarHBondContact O-N 2.93Å
202T96.6Very high92.6Very high10 Ų1054 Ų546%0.06128%0.278CS..Hα-helixtrans-65.6-44.9174.5-56.10000111.4L96 V101 I140 Y144 L198 K199 Q200 E204 A205 V206L96-T202 HydrophobicContact CD2-CG2 3.59Å; V101-T202 HydrophobicContact CG1-CG2 3.77Å; I140-T202 HydrophobicContact CG2-CG2 3.85Å; Y144-T202 HydrophobicContact CD2-CG2 3.99Å; Y144-T202 WeakPolarHBondContact CD2-OG1 3.38Å; Y144-T202 HydrophobicContact CG-CG2 4.08Å; L198-T202 WeakPolarHBondContact O-CB 3.48Å; L198-T202 PolarHBondContact O-N 3.12Å; L198-T202 PolarHBondContact O-OG1 3.41Å; K199-T202 PolarHBondContact O-N 3.49Å; Q200-T202 VanDerWaalsContact C-N 3.26Å; Q200-T202 PolarHBondContact O-N 2.95Å; T202-E204 VanDerWaalsContact C-N 3.33Å; T202-E204 PolarHBondContact O-N 3.42Å; T202-A205 PolarHBondContact O-N 3.45Å; T202-V206 WeakPolarHBondContact O-CG2 3.34Å; T202-V206 PolarHBondContact O-N 3.33Å
203C95.1Very high92.1Very high5 Ų554 Ų543%0.03428%0.275CS..Hα-helixtrans-58.8-45174.5-72.30000111.4L92 M95 L96 K199 Q200 A205 V206 M207L92-C203 HydrophobicContact CD2-CB 4.16Å; M95-C203 HydrophobicContact SD-CB 3.58Å; M95-C203 VanDerWaalsContact SD-CB 3.58Å; L96-C203 VanDerWaalsContact CD2-SG 3.51Å; K199-C203 WeakPolarHBondContact O-CB 3.47Å; K199-C203 PolarHBondContact O-N 2.89Å; K199-C203 PolarHBondContact O-SG 3.24Å; Q200-C203 WeakPolarHBondContact O-CB 3.49Å; Q200-C203 PolarHBondContact O-N 2.71Å; Q200-C203 VanDerWaalsContact O-N 3.16Å; C203-A205 VanDerWaalsContact C-N 3.35Å; C203-A205 PolarHBondContact O-N 2.89Å; C203-V206 PolarHBondContact O-N 3.39Å; C203-M207 VanDerWaalsContact O-CG 3.3Å; C203-M207 WeakPolarHBondContact O-CG 3.47Å; C203-M207 PolarHBondContact O-N 3.34Å
204E94.9Very high91.2Very high103 Ų10353.4 Ų53.448%0.48127%0.265SS..Hα-helixtrans-62.2-40.4177.1-72.6171.5-170.300112.6Q200 S201 T202 M207 T208Q200-E204 PolarHBondContact NE2-OE1 3.26Å; Q200-E204 WeakPolarHBondContact O-CG 3.45Å; Q200-E204 PolarHBondContact O-N 3.29Å; S201-E204 PolarHBondContact O-N 2.96Å; T202-E204 VanDerWaalsContact C-N 3.33Å; T202-E204 PolarHBondContact O-N 3.42Å; E204-M207 PolarHBondContact O-N 3.31Å; E204-T208 VanDerWaalsContact O-CB 3.29Å; E204-T208 WeakPolarHBondContact O-CB 3.4Å; E204-T208 PolarHBondContact O-N 3.46Å; E204-T208 PolarHBondContact O-OG1 3.01Å
205A95Very high90Very high25 Ų2553.6 Ų53.621%0.20727%0.266CS..Hα-helixtrans-61.7-43.6174.700000111.6I140 S201 T202 C203 T208 L209I140-A205 HydrophobicContact CD1-CB 4.14Å; S201-A205 WeakPolarHBondContact O-CB 3.31Å; S201-A205 PolarHBondContact O-N 2.93Å; T202-A205 PolarHBondContact O-N 3.45Å; C203-A205 VanDerWaalsContact C-N 3.35Å; C203-A205 PolarHBondContact O-N 2.89Å; A205-T208 PolarHBondContact O-N 3.41Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.43Å
206V93.9Very high88.4Confident1 Ų153.9 Ų53.91%0.00628%0.279CS..Hα-helixtrans-64.3-45.7176.3176.40000111.4E99 V101 L137 I140 T202 C203 T208 L209 R210E99-V206 HydrophobicContact CB-CG1 3.93Å; E99-V206 HydrophobicContact CG-CG1 3.69Å; V101-V206 HydrophobicContact CG2-CG2 3.85Å; L137-V206 HydrophobicContact CD1-CG1 4.3Å; L137-V206 HydrophobicContact CD1-CG2 4.09Å; I140-V206 HydrophobicContact CD1-CG2 4.47Å; I140-V206 HydrophobicContact CG2-CG2 4Å; T202-V206 WeakPolarHBondContact O-CG2 3.34Å; T202-V206 PolarHBondContact O-N 3.33Å; C203-V206 PolarHBondContact O-N 3.39Å; V206-T208 VanDerWaalsContact C-N 3.31Å; V206-T208 PolarHBondContact O-N 3.29Å; V206-L209 WeakPolarHBondContact O-CB 3.35Å; V206-L209 PolarHBondContact O-N 3.05Å; V206-R210 WeakPolarHBondContact O-CB 3.43Å; V206-R210 PolarHBondContact O-N 2.93Å
207M91.3Very high86.7Confident74 Ų7457.5 Ų57.537%0.36529%0.293SS..Hα-helixtrans-63.6-39178.6-68.8-57.3126.500111.7M95 E99 C203 E204 R210 S211M95-M207 HydrophobicContact CG-CE 4.33Å; M95-M207 HydrophobicContact SD-CE 4.12Å; E99-M207 HydrophobicContact CG-CE 4.23Å; C203-M207 VanDerWaalsContact O-CG 3.3Å; C203-M207 WeakPolarHBondContact O-CG 3.47Å; C203-M207 PolarHBondContact O-N 3.34Å; E204-M207 PolarHBondContact O-N 3.31Å; M207-R210 PolarHBondContact O-N 3.44Å; M207-S211 WeakPolarHBondContact O-CB 3.34Å; M207-S211 PolarHBondContact O-N 2.99Å
208T92Very high84.9Confident56 Ų5659.5 Ų59.534%0.34430%0.295SS..Hα-helixtrans-64.7-43.8174.6-61.60000111.3E204 A205 V206 R210 S211 R212E204-T208 VanDerWaalsContact O-CB 3.29Å; E204-T208 WeakPolarHBondContact O-CB 3.4Å; E204-T208 PolarHBondContact O-N 3.46Å; E204-T208 PolarHBondContact O-OG1 3.01Å; A205-T208 PolarHBondContact O-N 3.41Å; V206-T208 VanDerWaalsContact C-N 3.31Å; V206-T208 PolarHBondContact O-N 3.29Å; T208-R210 PolarHBondContact O-N 3.13Å; T208-S211 PolarHBondContact O-N 2.96Å; T208-R212 HydrophobicContact CG2-CG 4.43Å; T208-R212 VanDerWaalsContact CG2-CZ 3.49Å; T208-R212 WeakPolarHBondContact O-CB 3.29Å; T208-R212 WeakPolarHBondContact O-CG 3.36Å; T208-R212 PolarHBondContact O-N 3.09Å
209L90.8Very high83Confident12 Ų1267.1 Ų67.16%0.06333%0.327CS..Hα-helixtrans-61-45.3177.3-17865.9000111.3Y133 K136 L137 I140 A205 V206 R212 L213Y133-L209 HydrophobicContact CD2-CD2 3.99Å; Y133-L209 HydrophobicContact CD2-CG 3.8Å; Y133-L209 HydrophobicContact CE2-CD2 3.9Å; Y133-L209 HydrophobicContact CE2-CG 3.8Å; K136-L209 HydrophobicContact CB-CD1 3.72Å; K136-L209 HydrophobicContact CB-CD2 3.88Å; K136-L209 HydrophobicContact CB-CG 4.48Å; K136-L209 HydrophobicContact CD-CD1 3.84Å; K136-L209 HydrophobicContact CG-CD1 4.4Å; L137-L209 HydrophobicContact CB-CD2 4.07Å; I140-L209 HydrophobicContact CD1-CB 4.29Å; I140-L209 HydrophobicContact CD1-CD2 3.82Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.43Å; V206-L209 WeakPolarHBondContact O-CB 3.35Å; V206-L209 PolarHBondContact O-N 3.05Å; L209-R212 PolarHBondContact O-N 3.11Å; L209-L213 HydrophobicContact CD1-CD1 3.42Å; L209-L213 VanDerWaalsContact CD1-CD1 3.42Å; L209-L213 HydrophobicContact CD1-CG 4.11Å; L209-L213 HydrophobicContact CG-CD1 4.28Å; L209-L213 WeakPolarHBondContact O-CB 3.29Å; L209-L213 PolarHBondContact O-N 2.78Å
210R87.9Confident81.2Confident102 Ų10276.8 Ų76.839%0.38536%0.364SS..Hα-helixtrans-61.7-47.5176.1179.7168.9178.1167.6-1111.5E99 V206 M207 T208 R212 L214 D215E99-R210 IonicContact OE1-NH1 3.08Å; E99-R210 PolarHBondContact OE1-NH1 3.4Å; V206-R210 WeakPolarHBondContact O-CB 3.43Å; V206-R210 PolarHBondContact O-N 2.93Å; M207-R210 PolarHBondContact O-N 3.44Å; T208-R210 PolarHBondContact O-N 3.13Å; R210-R212 PolarHBondContact O-N 2.91Å; R210-L214 HydrophobicContact CB-CD1 4.48Å; R210-L214 HydrophobicContact CG-CB 4.46Å; R210-L214 HydrophobicContact CG-CD1 3.99Å; R210-L214 WeakPolarHBondContact O-CA 3.3Å; R210-L214 VanDerWaalsContact O-CB 3.32Å; R210-L214 WeakPolarHBondContact O-CB 3.45Å; R210-L214 PolarHBondContact O-N 3.42Å; R210-D215 PolarHBondContact O-N 3.35Å; R210-D215 VanDerWaalsContact O-N 3.14Å
211S85.5Confident80Confident66 Ų6684.8 Ų84.846%0.46239%0.391SS..Iπ-helixtrans-58.9-46.1177.8179.50000112M207 T208 D215 A216M207-S211 WeakPolarHBondContact O-CB 3.34Å; M207-S211 PolarHBondContact O-N 2.99Å; T208-S211 PolarHBondContact O-N 2.96Å; S211-D215 CarbonylContact O-C 3.59Å; S211-D215 PolarHBondContact O-N 2.81Å; S211-A216 PolarHBondContact O-N 2.86Å
212R84.3Confident79.3Confident127 Ų12789.2 Ų89.248%0.47941%0.411SS..Iπ-helixtrans-72.8-37.1-176.8-71.8179.8-176167.93.4114.2T208 L209 R210 A216T208-R212 HydrophobicContact CG2-CG 4.43Å; T208-R212 VanDerWaalsContact CG2-CZ 3.49Å; T208-R212 WeakPolarHBondContact O-CB 3.29Å; T208-R212 WeakPolarHBondContact O-CG 3.36Å; T208-R212 PolarHBondContact O-N 3.09Å; L209-R212 PolarHBondContact O-N 3.11Å; R210-R212 PolarHBondContact O-N 2.91Å; R212-A216 VanDerWaalsContact O-CB 3.23Å; R212-A216 WeakPolarHBondContact O-CB 3.48Å
213L81.3Confident78.9Confident51 Ų5191.4 Ų91.427%0.26742%0.42SS..Iπ-helixtrans-104.2-31.9-171.2-62.4-176000113.8Y133 K136 L209Y133-L213 HydrophobicContact CD2-CB 4.26Å; Y133-L213 HydrophobicContact CD2-CD1 4.25Å; K136-L213 HydrophobicContact CD-CD1 4.01Å; L209-L213 HydrophobicContact CD1-CD1 3.42Å; L209-L213 VanDerWaalsContact CD1-CD1 3.42Å; L209-L213 HydrophobicContact CD1-CG 4.11Å; L209-L213 HydrophobicContact CG-CD1 4.28Å; L209-L213 WeakPolarHBondContact O-CB 3.29Å; L209-L213 PolarHBondContact O-N 2.78Å
214L73.3Confident78.6Confident41 Ų4194 Ų9422%0.21544%0.438CS..Iπ-helixtrans-99.8-42.7-178.3-63.5167.7000111.5Y133 R210 R218Y133-L214 HydrophobicContact CD2-CD1 4.05Å; Y133-L214 HydrophobicContact CD2-CG 4.21Å; Y133-L214 HydrophobicContact CE1-CD1 4.12Å; Y133-L214 HydrophobicContact CE2-CD1 3.63Å; Y133-L214 HydrophobicContact CE2-CG 4.24Å; Y133-L214 HydrophobicContact CG-CD1 4.48Å; R210-L214 HydrophobicContact CB-CD1 4.48Å; R210-L214 HydrophobicContact CG-CB 4.46Å; R210-L214 HydrophobicContact CG-CD1 3.99Å; R210-L214 WeakPolarHBondContact O-CA 3.3Å; R210-L214 VanDerWaalsContact O-CB 3.32Å; R210-L214 WeakPolarHBondContact O-CB 3.45Å; R210-L214 PolarHBondContact O-N 3.42Å; L214-R218 PolarHBondContact O-N 3.37Å
215D66.8Low78.3Confident63 Ų6397 Ų9734%0.33745%0.449SS..Iπ-helixtrans-91.2-32.1-174.5-62.5-37.5000113.9R210 S211 R217 R218R210-D215 PolarHBondContact O-N 3.35Å; R210-D215 VanDerWaalsContact O-N 3.14Å; S211-D215 CarbonylContact O-C 3.59Å; S211-D215 PolarHBondContact O-N 2.81Å; D215-R217 PolarHBondContact O-N 3.47Å; D215-R218 CarbonylContact O-C 3.09Å; D215-R218 WeakPolarHBondContact O-CA 3.39Å; D215-R218 PolarHBondContact O-N 2.84Å; D215-R218 IonicContact OD1-CZ 2.77Å; D215-R218 IonicContact OD1-NH1 2.9Å; D215-R218 PolarHBondContact OD1-NH1 3.03Å
216A59.3Low78.1Confident67 Ų67101.7 Ų101.755%0.55447%0.467SS*.THydrogen-bonded Turntrans-62.6-27.5171.600000112.5S211 R212S211-A216 PolarHBondContact O-N 2.86Å; R212-A216 VanDerWaalsContact O-CB 3.23Å; R212-A216 WeakPolarHBondContact O-CB 3.48Å
217R56.3Low78Confident139 Ų139101.7 Ų101.753%0.52547%0.467SS..THydrogen-bonded Turntrans-78.6-29.8170-94.7-175.5174.6-161.5-2.4112.6D125 D215 K219D125-R217 PolarHBondContact O-NH1 3.47Å; D125-R217 PolarHBondContact O-NH2 3.09Å; D125-R217 IonicContact OD1-NH2 3.88Å; D125-R217 PolarHBondContact OD1-NH2 2.77Å; D125-R217 VanDerWaalsContact OD1-NH2 3.08Å; D215-R217 PolarHBondContact O-N 3.47Å; R217-K219 PolarHBondContact O-N 2.95Å
218R58.3Low78.1Confident167 Ų167100.2 Ų100.263%0.6346%0.462SS*.SBendtrans-79.656.7162.7-65.7-172.4-163.4116.6-1.1110.3L214 D215 R220L214-R218 PolarHBondContact O-N 3.37Å; D215-R218 CarbonylContact O-C 3.09Å; D215-R218 WeakPolarHBondContact O-CA 3.39Å; D215-R218 PolarHBondContact O-N 2.84Å; D215-R218 IonicContact OD1-CZ 2.77Å; D215-R218 IonicContact OD1-NH1 2.9Å; D215-R218 PolarHBondContact OD1-NH1 3.03Å; R218-R220 PolarHBondContact O-N 3.24Å
219K53.9Low78.1Confident180 Ų180101.1 Ų101.178%0.78346%0.463SS*.  trans-51.4110.1166.2-141.6168.5-170.9174.20106R217 R221R217-K219 PolarHBondContact O-N 2.95Å; K219-R221 VanDerWaalsContact C-N 3.28Å; K219-R221 PolarHBondContact O-N 3.05Å
220R58Low78.2Confident210 Ų210101.7 Ų101.779%0.79247%0.466SS*.  trans-57.798.6178.7-164.6-173.6-162.1178.38.5105.4R218 N222R218-R220 PolarHBondContact O-N 3.24Å; R220-N222 PolarHBondContact O-N 3.02Å
221R69.2Low78.5Confident231 Ų23196.8 Ų96.887%0.87245%0.448SS*.  trans-65.7107.3176.8-87.1173.370.9-172.12104.9K219K219-R221 VanDerWaalsContact C-N 3.28Å; K219-R221 PolarHBondContact O-N 3.05Å
222N81.1Confident78.9Confident143 Ų14394.2 Ų94.277%0.76543%0.429SS*.PPolyproline II helixtrans-54.4143.1165.7-67.8-32.8000107R220R220-N222 PolarHBondContact O-N 3.02Å
223F87.9Confident79.4Confident57 Ų5793 Ų9325%0.2543%0.429CS..PPolyproline II helixtrans-57.1150170.6-68.5-16.3000109.3A227 L231 I258 Q262 W266F223-A227 HydrophobicContact CB-CB 4.04Å; F223-L231 HydrophobicContact CD2-CD1 3.85Å; F223-L231 HydrophobicContact CE2-CD1 3.91Å; F223-I258 HydrophobicContact CD1-CG2 4.2Å; F223-I258 HydrophobicContact CD2-CD1 4.4Å; F223-I258 HydrophobicContact CE1-CG2 4.36Å; F223-I258 HydrophobicContact CE2-CD1 4.09Å; F223-I258 HydrophobicContact CZ-CD1 4.34Å; F223-Q262 HydrophobicContact CE1-CB 4.19Å; F223-Q262 HydrophobicContact CE1-CG 4.28Å; F223-Q262 HydrophobicContact CZ-CB 3.79Å; F223-Q262 HydrophobicContact CZ-CG 4.28Å; F223-W266 AromaticContact CD2-CD1 3.66Å; F223-W266 HydrophobicContact CD2-CG 4.48Å; F223-W266 HydrophobicContact CE2-CB 3.95Å; F223-W266 AromaticContact CE2-CD1 3.34Å; F223-W266 AromaticContact CE2-CG 3.89Å; F223-W266 HydrophobicContact CE2-CG 3.89Å
224S88.8Confident79.9Confident60 Ų6092.5 Ų92.542%0.4242%0.423SS..PPolyproline II helixtrans-58158.1173.465.30000109.6Q226 A227 T228S224-Q226 PolarHBondContact O-N 3.07Å; S224-A227 PolarHBondContact O-N 3.42Å; S224-A227 VanDerWaalsContact OG-CB 3.23Å; S224-A227 WeakPolarHBondContact OG-CB 3.37Å; S224-A227 PolarHBondContact OG-N 3.44Å; S224-T228 PolarHBondContact O-N 2.96Å; S224-T228 PolarHBondContact O-OG1 3.42Å
225K89Confident80.8Confident165 Ų16590.6 Ų90.672%0.71741%0.413SS*.Hα-helixtrans-55.2-45.7175.8-170.3-176.2179.6-163.60110.5T228 E229K225-T228 PolarHBondContact O-N 3.5Å; K225-E229 WeakPolarHBondContact CE-OE1 3.42Å; K225-E229 IonicContact NZ-OE1 3.9Å; K225-E229 WeakPolarHBondContact O-CB 3.35Å; K225-E229 WeakPolarHBondContact O-CG 3.37Å; K225-E229 PolarHBondContact O-N 3.03Å
226Q91.4Very high82Confident124 Ų12488 Ų8858%0.57940%0.399SS*.Hα-helixtrans-57.6-49.5175.3-176.2-176.98.500112.8S224 T228 E229 V230S224-Q226 PolarHBondContact O-N 3.07Å; Q226-T228 VanDerWaalsContact C-N 3.27Å; Q226-T228 PolarHBondContact O-N 2.7Å; Q226-E229 PolarHBondContact O-N 2.86Å; Q226-V230 WeakPolarHBondContact O-CG2 3.45Å; Q226-V230 PolarHBondContact O-N 2.68Å
227A91.2Very high83.4Confident0 Ų088.6 Ų88.60%040%0.399CS..Hα-helixtrans-60.9-40178.300000111.7F223 S224 L231 G256 I258F223-A227 HydrophobicContact CB-CB 4.04Å; S224-A227 PolarHBondContact O-N 3.42Å; S224-A227 VanDerWaalsContact OG-CB 3.23Å; S224-A227 WeakPolarHBondContact OG-CB 3.37Å; S224-A227 PolarHBondContact OG-N 3.44Å; A227-L231 WeakPolarHBondContact O-CB 3.35Å; A227-L231 WeakPolarHBondContact O-CD1 3.32Å; A227-L231 WeakPolarHBondContact O-CG 3.29Å; A227-L231 PolarHBondContact O-N 2.94Å; A227-G256 VanDerWaalsContact CB-O 3.28Å; A227-G256 WeakPolarHBondContact CB-O 3.27Å; A227-I258 HydrophobicContact CB-CG2 4.17Å
228T93.2Very high84.9Confident44 Ų4485.5 Ų85.527%0.2739%0.39SS..Hα-helixtrans-69.2-38.8178.5-53.70000111.8S224 K225 Q226 N232S224-T228 PolarHBondContact O-N 2.96Å; S224-T228 PolarHBondContact O-OG1 3.42Å; K225-T228 PolarHBondContact O-N 3.5Å; Q226-T228 VanDerWaalsContact C-N 3.27Å; Q226-T228 PolarHBondContact O-N 2.7Å; T228-N232 VanDerWaalsContact O-CB 3.32Å; T228-N232 WeakPolarHBondContact O-CB 3.23Å; T228-N232 PolarHBondContact O-N 2.7Å; T228-N232 PolarHBondContact O-ND2 3.43Å
229E93.2Very high86.3Confident75 Ų7580.2 Ų80.235%0.3537%0.374SS..Hα-helixtrans-62.7-51.2175.6-78.5168.617400111.2K225 Q226 L231 N232 E233K225-E229 WeakPolarHBondContact CE-OE1 3.42Å; K225-E229 IonicContact NZ-OE1 3.9Å; K225-E229 WeakPolarHBondContact O-CB 3.35Å; K225-E229 WeakPolarHBondContact O-CG 3.37Å; K225-E229 PolarHBondContact O-N 3.03Å; Q226-E229 PolarHBondContact O-N 2.86Å; E229-L231 VanDerWaalsContact C-N 3.28Å; E229-L231 PolarHBondContact O-N 2.87Å; E229-N232 PolarHBondContact O-N 3.01Å; E229-E233 VanDerWaalsContact O-CB 3.29Å; E229-E233 WeakPolarHBondContact O-CB 3.42Å; E229-E233 PolarHBondContact O-N 2.82Å
230V93.1Very high87.7Confident23 Ų2377.6 Ų77.614%0.13938%0.379CS..Hα-helixtrans-56-42.9178168.50000111.7Q226 Y234 L252 K255Q226-V230 WeakPolarHBondContact O-CG2 3.45Å; Q226-V230 PolarHBondContact O-N 2.68Å; V230-Y234 PolarHBondContact O-N 3.4Å; V230-L252 HydrophobicContact CG1-CD2 3.59Å; V230-K255 HydrophobicContact CG1-CB 3.77Å; V230-K255 HydrophobicContact CG1-CD 4.42Å; V230-K255 HydrophobicContact CG2-CB 4.2Å
231L94.6Very high89.1Confident0 Ų072.2 Ų72.20%037%0.366CS..Hα-helixtrans-71.1-41.3179.3-67.2170.8000112.7F223 A227 E229 F235 L252 I258 V263 W266 F267F223-L231 HydrophobicContact CD2-CD1 3.85Å; F223-L231 HydrophobicContact CE2-CD1 3.91Å; A227-L231 WeakPolarHBondContact O-CB 3.35Å; A227-L231 WeakPolarHBondContact O-CD1 3.32Å; A227-L231 WeakPolarHBondContact O-CG 3.29Å; A227-L231 PolarHBondContact O-N 2.94Å; E229-L231 VanDerWaalsContact C-N 3.28Å; E229-L231 PolarHBondContact O-N 2.87Å; L231-F235 VanDerWaalsContact O-CB 3.3Å; L231-F235 WeakPolarHBondContact O-CB 3.49Å; L231-F235 PolarHBondContact O-N 3.34Å; L231-L252 HydrophobicContact CD2-CB 4.32Å; L231-I258 HydrophobicContact CD1-CD1 3.77Å; L231-I258 HydrophobicContact CD2-CD1 4.43Å; L231-I258 HydrophobicContact CG-CD1 4.42Å; L231-V263 HydrophobicContact CD2-CG1 3.97Å; L231-V263 HydrophobicContact CD2-CG2 4.22Å; L231-W266 HydrophobicContact CB-CD2 4.04Å; L231-W266 HydrophobicContact CB-CE3 3.88Å; L231-W266 HydrophobicContact CB-CH2 3.7Å; L231-W266 HydrophobicContact CB-CZ2 3.83Å; L231-W266 HydrophobicContact CB-CZ3 3.73Å; L231-W266 HydrophobicContact CD1-CB 4.29Å; L231-W266 HydrophobicContact CD1-CD2 3.74Å; L231-W266 HydrophobicContact CD1-CE3 4.23Å; L231-W266 HydrophobicContact CD1-CG 3.75Å; L231-W266 HydrophobicContact CD2-CE3 4.43Å; L231-W266 HydrophobicContact CG-CD2 4.39Å; L231-W266 HydrophobicContact CG-CE3 4.43Å; L231-F267 HydrophobicContact CD2-CD2 4.33Å; L231-F267 HydrophobicContact CD2-CE2 3.57Å; L231-F267 HydrophobicContact CD2-CZ 4.32Å
232N93.1Very high90Very high11 Ų1162.1 Ų62.16%0.05933%0.33CS..Hα-helixtrans-68.3-41177.5-79.9-35.2000111.7T228 E229 Y234 F235 Y236 W266 K270 Y288T228-N232 VanDerWaalsContact O-CB 3.32Å; T228-N232 WeakPolarHBondContact O-CB 3.23Å; T228-N232 PolarHBondContact O-N 2.7Å; T228-N232 PolarHBondContact O-ND2 3.43Å; E229-N232 PolarHBondContact O-N 3.01Å; N232-Y234 VanDerWaalsContact C-N 3.35Å; N232-Y234 PolarHBondContact O-N 2.97Å; N232-F235 PolarHBondContact O-N 3.27Å; N232-Y236 HydrophobicContact CB-CD2 4.08Å; N232-Y236 HydrophobicContact CB-CE2 4.03Å; N232-Y236 WeakPolarHBondContact O-CB 3.36Å; N232-Y236 WeakPolarHBondContact O-CD2 3.44Å; N232-Y236 PolarHBondContact O-N 3.31Å; N232-W266 VanDerWaalsContact OD1-CH2 3.31Å; N232-W266 WeakPolarHBondContact OD1-CH2 3.27Å; N232-W266 WeakPolarHBondContact OD1-CZ2 3.02Å; N232-K270 PolarHBondContact OD1-NZ 3.48Å; N232-Y288 HydrophobicContact CB-CE1 3.89Å; N232-Y288 HydrophobicContact CB-CE2 4.06Å; N232-Y288 PolarHBondContact ND2-OH 3.12Å
233E93.7Very high90.5Very high103 Ų10362 Ų6248%0.48132%0.32SS..Hα-helixtrans-57.3-48.3177.5-177-17818000110.9E229 S237E229-E233 VanDerWaalsContact O-CB 3.29Å; E229-E233 WeakPolarHBondContact O-CB 3.42Å; E229-E233 PolarHBondContact O-N 2.82Å; E233-S237 WeakPolarHBondContact O-CB 3.48Å; E233-S237 PolarHBondContact O-N 3.19Å; E233-S237 PolarHBondContact O-OG 3.5Å
234Y93.1Very high90.7Very high39 Ų3959.8 Ų59.815%0.15331%0.311CS..Hα-helixtrans-64.4-45.8175.3-174.4-87.1000112.1V230 N232 Y236 S237 H238 P244 T248 L252 F267V230-Y234 PolarHBondContact O-N 3.4Å; N232-Y234 VanDerWaalsContact C-N 3.35Å; N232-Y234 PolarHBondContact O-N 2.97Å; Y234-Y236 PolarHBondContact O-N 3.41Å; Y234-S237 WeakPolarHBondContact CA-OG 3.47Å; Y234-S237 PolarHBondContact O-N 3.49Å; Y234-S237 PolarHBondContact O-OG 2.89Å; Y234-H238 AromaticContact CD2-CE1 3.83Å; Y234-H238 AromaticContact CD2-ND1 3.8Å; Y234-H238 HydrophobicContact CE1-CB 4.3Å; Y234-H238 AromaticContact CE2-CE1 3.52Å; Y234-H238 AromaticContact CE2-ND1 3.68Å; Y234-H238 AromaticContact CE2-NE2 3.9Å; Y234-H238 AromaticContact CZ-CG 3.93Å; Y234-H238 AromaticContact CZ-ND1 3.89Å; Y234-H238 WeakPolarHBondContact O-CB 3.18Å; Y234-H238 PolarHBondContact O-N 2.93Å; Y234-H238 PolarHBondContact O-ND1 2.83Å; Y234-P244 HydrophobicContact CD1-CB 4.49Å; Y234-P244 HydrophobicContact CE1-CB 3.66Å; Y234-P244 HydrophobicContact CE1-CG 4.19Å; Y234-T248 HydrophobicContact CD2-CG2 4.09Å; Y234-T248 HydrophobicContact CE1-CG2 4.43Å; Y234-T248 HydrophobicContact CE2-CG2 3.4Å; Y234-L252 HydrophobicContact CD1-CD1 4.05Å; Y234-L252 HydrophobicContact CD2-CD1 4.31Å; Y234-L252 HydrophobicContact CD2-CD2 4.41Å; Y234-L252 HydrophobicContact CG-CD1 3.89Å; Y234-L252 HydrophobicContact CG-CD2 4.24Å; Y234-F267 AromaticContact CD1-CE1 3.7Å; Y234-F267 HydrophobicContact CD1-CE1 3.7Å; Y234-F267 AromaticContact CD1-CZ 3.54Å; Y234-F267 HydrophobicContact CD1-CZ 3.54Å; Y234-F267 HydrophobicContact CE1-CE1 4.28Å; Y234-F267 HydrophobicContact CE1-CZ 4.32Å; Y234-F267 HydrophobicContact CG-CZ 4.3Å
235F92.3Very high90.9Very high1 Ų159.9 Ų59.90%0.00431%0.311CS..Hα-helixtrans-60.5-43.7-178.6-175.2-89.8000112.5L231 N232 H238 L239 P242 W266 F267 K270 R271 Y274L231-F235 VanDerWaalsContact O-CB 3.3Å; L231-F235 WeakPolarHBondContact O-CB 3.49Å; L231-F235 PolarHBondContact O-N 3.34Å; N232-F235 PolarHBondContact O-N 3.27Å; F235-H238 CarbonylContact O-C 3.58Å; F235-H238 PolarHBondContact O-N 3.17Å; F235-L239 HydrophobicContact CD1-CD2 4.14Å; F235-L239 HydrophobicContact CE1-CD2 3.76Å; F235-L239 PolarHBondContact O-N 2.98Å; F235-P242 HydrophobicContact CD2-CB 3.9Å; F235-P242 HydrophobicContact CE2-CB 3.71Å; F235-P242 HydrophobicContact CE2-CG 4.32Å; F235-P242 HydrophobicContact CZ-CB 4.38Å; F235-W266 HydrophobicContact CB-CH2 4.3Å; F235-W266 HydrophobicContact CB-CZ3 4.15Å; F235-W266 HydrophobicContact CD2-CZ3 4.35Å; F235-W266 HydrophobicContact CG-CZ3 4.44Å; F235-F267 HydrophobicContact CB-CE1 3.94Å; F235-F267 AromaticContact CD2-CD1 3.83Å; F235-F267 HydrophobicContact CD2-CD1 3.83Å; F235-F267 AromaticContact CD2-CE1 3.85Å; F235-F267 HydrophobicContact CD2-CE1 3.85Å; F235-F267 HydrophobicContact CG-CE1 4.42Å; F235-K270 HydrophobicContact CD1-CG 4Å; F235-K270 HydrophobicContact CD2-CB 4.27Å; F235-K270 HydrophobicContact CD2-CG 3.7Å; F235-K270 HydrophobicContact CE1-CG 3.9Å; F235-K270 HydrophobicContact CE2-CB 4.04Å; F235-K270 HydrophobicContact CE2-CG 3.59Å; F235-K270 HydrophobicContact CG-CG 3.91Å; F235-K270 HydrophobicContact CZ-CB 4.48Å; F235-K270 HydrophobicContact CZ-CG 3.7Å; F235-R271 HydrophobicContact CE2-CG 3.81Å; F235-R271 HydrophobicContact CZ-CG 4.44Å; F235-Y274 HydrophobicContact CE1-CD2 4.06Å; F235-Y274 HydrophobicContact CE1-CG 4.07Å; F235-Y274 HydrophobicContact CZ-CG 4.13Å
236Y90.5Very high91.1Very high10 Ų1056.8 Ų56.84%0.03930%0.3CS..Hα-helixtrans-78-31.1-178-68.3-53.5000112.9N232 Y234 H238 L239 K270 E284 A285 Y288N232-Y236 HydrophobicContact CB-CD2 4.08Å; N232-Y236 HydrophobicContact CB-CE2 4.03Å; N232-Y236 WeakPolarHBondContact O-CB 3.36Å; N232-Y236 WeakPolarHBondContact O-CD2 3.44Å; N232-Y236 PolarHBondContact O-N 3.31Å; Y234-Y236 PolarHBondContact O-N 3.41Å; Y236-H238 PolarHBondContact O-N 3.02Å; Y236-L239 HydrophobicContact CD1-CD1 4.28Å; Y236-L239 HydrophobicContact CD1-CD2 4.09Å; Y236-L239 HydrophobicContact CD1-CG 4.36Å; Y236-K270 PolarHBondContact OH-NZ 2.96Å; Y236-E284 HydrophobicContact CE2-CB 4.3Å; Y236-E284 PolarHBondContact OH-OE2 3.18Å; Y236-A285 HydrophobicContact CD1-CB 3.54Å; Y236-A285 HydrophobicContact CE1-CB 3.88Å; Y236-A285 HydrophobicContact CG-CB 4.19Å; Y236-Y288 AromaticContact CD2-CD2 3.42Å; Y236-Y288 HydrophobicContact CD2-CD2 3.42Å; Y236-Y288 VanDerWaalsContact CD2-CD2 3.42Å; Y236-Y288 HydrophobicContact CD2-CE2 4.07Å; Y236-Y288 AromaticContact CD2-CG 3.73Å; Y236-Y288 HydrophobicContact CD2-CG 3.73Å; Y236-Y288 AromaticContact CE2-CD2 3.53Å; Y236-Y288 HydrophobicContact CE2-CD2 3.53Å; Y236-Y288 AromaticContact CE2-CE2 3.82Å; Y236-Y288 HydrophobicContact CE2-CE2 3.82Å; Y236-Y288 HydrophobicContact CE2-CG 4.3Å
237S88.9Confident91.1Very high78 Ų7858.2 Ų58.255%0.54531%0.306SS..Hα-helixtrans-70.1-20.6170.653.30000113.4E233 Y234E233-S237 WeakPolarHBondContact O-CB 3.48Å; E233-S237 PolarHBondContact O-N 3.19Å; E233-S237 PolarHBondContact O-OG 3.5Å; Y234-S237 WeakPolarHBondContact CA-OG 3.47Å; Y234-S237 PolarHBondContact O-N 3.49Å; Y234-S237 PolarHBondContact O-OG 2.89Å
238H89.5Confident91.2Very high75 Ų7559.9 Ų59.935%0.34732%0.317SS..THydrogen-bonded Turntrans-120.840.1-178.2-60.874.9000112.5Y234 F235 Y236 S240 N241 P242Y234-H238 AromaticContact CD2-CE1 3.83Å; Y234-H238 AromaticContact CD2-ND1 3.8Å; Y234-H238 HydrophobicContact CE1-CB 4.3Å; Y234-H238 AromaticContact CE2-CE1 3.52Å; Y234-H238 AromaticContact CE2-ND1 3.68Å; Y234-H238 AromaticContact CE2-NE2 3.9Å; Y234-H238 AromaticContact CZ-CG 3.93Å; Y234-H238 AromaticContact CZ-ND1 3.89Å; Y234-H238 WeakPolarHBondContact O-CB 3.18Å; Y234-H238 PolarHBondContact O-N 2.93Å; Y234-H238 PolarHBondContact O-ND1 2.83Å; F235-H238 CarbonylContact O-C 3.58Å; F235-H238 PolarHBondContact O-N 3.17Å; Y236-H238 PolarHBondContact O-N 3.02Å; H238-S240 VanDerWaalsContact C-N 3.26Å; H238-S240 PolarHBondContact O-N 3.21Å; H238-N241 CarbonylContact O-C 3.41Å; H238-N241 PolarHBondContact O-N 3.35Å; H238-N241 VanDerWaalsContact O-N 3.12Å; H238-P242 WeakPolarHBondContact O-CA 3.45Å; H238-P242 WeakPolarHBondContact O-CD 3.22Å
239L87.4Confident91.3Very high56 Ų5659.8 Ų59.829%0.29331%0.312SS..THydrogen-bonded Turntrans-61.4-30.6-179.2-81.4172.2000114.1F235 Y236 N241 Y274 A285F235-L239 HydrophobicContact CD1-CD2 4.14Å; F235-L239 HydrophobicContact CE1-CD2 3.76Å; F235-L239 PolarHBondContact O-N 2.98Å; Y236-L239 HydrophobicContact CD1-CD1 4.28Å; Y236-L239 HydrophobicContact CD1-CD2 4.09Å; Y236-L239 HydrophobicContact CD1-CG 4.36Å; L239-N241 VanDerWaalsContact C-N 3.32Å; L239-Y274 HydrophobicContact CD2-CD2 4.48Å; L239-Y274 HydrophobicContact CD2-CE1 3.99Å; L239-Y274 HydrophobicContact CD2-CE2 3.94Å; L239-A285 HydrophobicContact CD1-CB 4.03Å
240S83.3Confident91.4Very high125 Ų12561.6 Ų61.687%0.87432%0.321SS*.THydrogen-bonded Turntrans-67.7-32.6176.554.80000112.3H238H238-S240 VanDerWaalsContact C-N 3.26Å; H238-S240 PolarHBondContact O-N 3.21Å
241N87.3Confident91.5Very high97 Ų9763.1 Ų63.152%0.51933%0.326SS..  trans-146.177.7178.6-172.725.7000112.2H238 L239 Y243H238-N241 CarbonylContact O-C 3.41Å; H238-N241 PolarHBondContact O-N 3.35Å; H238-N241 VanDerWaalsContact O-N 3.12Å; L239-N241 VanDerWaalsContact C-N 3.32Å; N241-Y243 PolarHBondContact O-N 3.27Å; N241-Y243 WeakPolarHBondContact OD1-CD2 3.3Å
242P87.3Confident91.5Very high18 Ų1863.5 Ų63.512%0.11733%0.329CS..  trans-82.850.6-174.532-34.1000112.3F235 H238 R271F235-P242 HydrophobicContact CD2-CB 3.9Å; F235-P242 HydrophobicContact CE2-CB 3.71Å; F235-P242 HydrophobicContact CE2-CG 4.32Å; F235-P242 HydrophobicContact CZ-CB 4.38Å; H238-P242 WeakPolarHBondContact O-CA 3.45Å; H238-P242 WeakPolarHBondContact O-CD 3.22Å; P242-R271 HydrophobicContact CB-CG 4.28Å; P242-R271 HydrophobicContact CG-CG 3.94Å; P242-R271 PolarHBondContact O-NH1 3.47Å
243Y91.7Very high91.5Very high142 Ų14263.3 Ų63.356%0.55733%0.328SS*.  trans-123.986178.1-67.5-91.9000109.1N241N241-Y243 PolarHBondContact O-N 3.27Å; N241-Y243 WeakPolarHBondContact OD1-CD2 3.3Å
244P91.9Very high91.6Very high10 Ų1066.5 Ų66.57%0.06534%0.336CS..  trans-61.1140.3177.323.4-31.8000111.1Y234 T248 K249 L252 F267Y234-P244 HydrophobicContact CD1-CB 4.49Å; Y234-P244 HydrophobicContact CE1-CB 3.66Å; Y234-P244 HydrophobicContact CE1-CG 4.19Å; P244-T248 HydrophobicContact CB-CG2 3.84Å; P244-K249 HydrophobicContact CB-CG 4Å; P244-K249 HydrophobicContact CG-CG 3.83Å; P244-K249 VanDerWaalsContact O-CE 3.31Å; P244-K249 WeakPolarHBondContact O-CE 3.23Å; P244-L252 HydrophobicContact CB-CD1 4.44Å; P244-F267 HydrophobicContact CG-CD1 4.24Å; P244-F267 HydrophobicContact CG-CD2 4.02Å; P244-F267 HydrophobicContact CG-CE1 4.34Å; P244-F267 HydrophobicContact CG-CE2 4.11Å; P244-F267 HydrophobicContact CG-CG 4.11Å; P244-F267 HydrophobicContact CG-CZ 4.29Å
245S93.7Very high91.6Very high61 Ų6169.8 Ų69.843%0.42735%0.351SS..  trans-63.7165.5170.267.90000110.9E247 T248 K249S245-E247 VanDerWaalsContact C-N 3.35Å; S245-E247 PolarHBondContact O-N 2.91Å; S245-T248 WeakPolarHBondContact O-CB 3.43Å; S245-T248 PolarHBondContact O-N 3.45Å; S245-T248 VanDerWaalsContact O-N 3.09Å; S245-T248 WeakPolarHBondContact OG-CB 3.34Å; S245-T248 PolarHBondContact OG-N 3.01Å; S245-T248 PolarHBondContact OG-OG1 2.9Å; S245-K249 WeakPolarHBondContact O-CG 3.26Å; S245-K249 PolarHBondContact O-N 2.79Å
246E92Very high91.6Very high101 Ų10170 Ų7047%0.47235%0.353SS..Hα-helixtrans-60.6-44.9-178.1-156.559.3-156.900112.1T248 K249 E250E246-T248 VanDerWaalsContact C-N 3.3Å; E246-T248 PolarHBondContact O-N 3.45Å; E246-K249 WeakPolarHBondContact O-CB 3.35Å; E246-K249 PolarHBondContact O-N 3.43Å; E246-K249 VanDerWaalsContact O-N 3.11Å; E246-K249 IonicContact OE2-NZ 2.66Å; E246-K249 PolarHBondContact OE2-NZ 3.43Å; E246-E250 PolarHBondContact O-N 3.14Å
247E93.3Very high91.7Very high153 Ų15372.9 Ų72.972%0.71539%0.386SS*.Hα-helixtrans-57.2-41.7172.3-175.7-177-172.700112.2S245 K249 E250 E251S245-E247 VanDerWaalsContact C-N 3.35Å; S245-E247 PolarHBondContact O-N 2.91Å; E247-K249 VanDerWaalsContact C-N 3.33Å; E247-K249 PolarHBondContact O-N 2.91Å; E247-E250 WeakPolarHBondContact O-CB 3.41Å; E247-E250 PolarHBondContact O-N 3.5Å; E247-E251 PolarHBondContact O-N 3.02Å
248T93.3Very high91.9Very high36 Ų3670.4 Ų70.422%0.22137%0.367CS..Hα-helixtrans-67.6-35.3178.6-55.20000111.7Y234 P244 S245 E246 E251 L252Y234-T248 HydrophobicContact CD2-CG2 4.09Å; Y234-T248 HydrophobicContact CE1-CG2 4.43Å; Y234-T248 HydrophobicContact CE2-CG2 3.4Å; P244-T248 HydrophobicContact CB-CG2 3.84Å; S245-T248 WeakPolarHBondContact O-CB 3.43Å; S245-T248 PolarHBondContact O-N 3.45Å; S245-T248 VanDerWaalsContact O-N 3.09Å; S245-T248 WeakPolarHBondContact OG-CB 3.34Å; S245-T248 PolarHBondContact OG-N 3.01Å; S245-T248 PolarHBondContact OG-OG1 2.9Å; E246-T248 VanDerWaalsContact C-N 3.3Å; E246-T248 PolarHBondContact O-N 3.45Å; T248-E251 PolarHBondContact O-N 3.36Å; T248-L252 HydrophobicContact CG2-CD1 4.14Å; T248-L252 HydrophobicContact CG2-CG 4.41Å; T248-L252 VanDerWaalsContact O-CG 3.23Å; T248-L252 WeakPolarHBondContact O-CG 3.44Å; T248-L252 PolarHBondContact O-N 3.23Å
249K94.6Very high92.1Very high42 Ų4270.5 Ų70.518%0.18337%0.372CS..Hα-helixtrans-67.6-38.3175.6-65.2171.7-165162.50111.6P244 S245 E246 E247 E251 L252 A253 V260 V263P244-K249 HydrophobicContact CB-CG 4Å; P244-K249 HydrophobicContact CG-CG 3.83Å; P244-K249 VanDerWaalsContact O-CE 3.31Å; P244-K249 WeakPolarHBondContact O-CE 3.23Å; S245-K249 WeakPolarHBondContact O-CG 3.26Å; S245-K249 PolarHBondContact O-N 2.79Å; E246-K249 WeakPolarHBondContact O-CB 3.35Å; E246-K249 PolarHBondContact O-N 3.43Å; E246-K249 VanDerWaalsContact O-N 3.11Å; E246-K249 IonicContact OE2-NZ 2.66Å; E246-K249 PolarHBondContact OE2-NZ 3.43Å; E247-K249 VanDerWaalsContact C-N 3.33Å; E247-K249 PolarHBondContact O-N 2.91Å; K249-E251 VanDerWaalsContact C-N 3.31Å; K249-L252 PolarHBondContact O-N 3.43Å; K249-A253 WeakPolarHBondContact O-CB 3.43Å; K249-A253 PolarHBondContact O-N 3.29Å; K249-V260 HydrophobicContact CB-CG1 4.02Å; K249-V260 HydrophobicContact CD-CG1 4.46Å; K249-V263 HydrophobicContact CB-CG1 4.15Å; K249-V263 HydrophobicContact CG-CG1 4.19Å
250E95.4Very high92.4Very high113 Ų11369.9 Ų69.953%0.52837%0.371SS..Hα-helixtrans-60.6-43.2173.4-70176.2179.100110.9E246 E247 A253 R254 V260E246-E250 PolarHBondContact O-N 3.14Å; E247-E250 WeakPolarHBondContact O-CB 3.41Å; E247-E250 PolarHBondContact O-N 3.5Å; E250-A253 WeakPolarHBondContact O-CB 3.35Å; E250-A253 PolarHBondContact O-N 2.86Å; E250-R254 WeakPolarHBondContact O-CB 3.49Å; E250-R254 PolarHBondContact O-N 2.95Å; E250-V260 HydrophobicContact CG-CG2 4Å
251E94.1Very high92.8Very high54 Ų5467.5 Ų67.525%0.25236%0.355SS..Hα-helixtrans-63.4-45.2176.7179.457.5-161.700112.7E247 T248 K249 R254 K255E247-E251 PolarHBondContact O-N 3.02Å; T248-E251 PolarHBondContact O-N 3.36Å; K249-E251 VanDerWaalsContact C-N 3.31Å; E251-R254 PolarHBondContact O-N 2.91Å; E251-R254 IonicContact OE1-CZ 2.84Å; E251-R254 IonicContact OE1-NH2 3.14Å; E251-R254 PolarHBondContact OE1-NH2 2.89Å; E251-R254 IonicContact OE2-CZ 2.65Å; E251-R254 VanDerWaalsContact OE2-CZ 3.24Å; E251-R254 IonicContact OE2-NE 2.77Å; E251-R254 PolarHBondContact OE2-NE 3.37Å; E251-R254 VanDerWaalsContact OE2-NE 3.13Å; E251-R254 IonicContact OE2-NH2 3.91Å; E251-R254 PolarHBondContact OE2-NH2 2.95Å; E251-K255 HydrophobicContact CG-CD 4.25Å; E251-K255 WeakPolarHBondContact O-CB 3.32Å; E251-K255 WeakPolarHBondContact O-CG 3.29Å; E251-K255 PolarHBondContact O-N 3.33Å; E251-K255 WeakPolarHBondContact OE1-CD 3.15Å; E251-K255 WeakPolarHBondContact OE1-CE 3.47Å; E251-K255 IonicContact OE1-NZ 2.68Å; E251-K255 PolarHBondContact OE1-NZ 3.36Å
252L94.6Very high93Very high9 Ų966.6 Ų66.65%0.04735%0.347CS..Hα-helixtrans-66.8-36.9176.6-67.8170.9000112V230 L231 Y234 P244 T248 K249 G256 V263 F267V230-L252 HydrophobicContact CG1-CD2 3.59Å; L231-L252 HydrophobicContact CD2-CB 4.32Å; Y234-L252 HydrophobicContact CD1-CD1 4.05Å; Y234-L252 HydrophobicContact CD2-CD1 4.31Å; Y234-L252 HydrophobicContact CD2-CD2 4.41Å; Y234-L252 HydrophobicContact CG-CD1 3.89Å; Y234-L252 HydrophobicContact CG-CD2 4.24Å; P244-L252 HydrophobicContact CB-CD1 4.44Å; T248-L252 HydrophobicContact CG2-CD1 4.14Å; T248-L252 HydrophobicContact CG2-CG 4.41Å; T248-L252 VanDerWaalsContact O-CG 3.23Å; T248-L252 WeakPolarHBondContact O-CG 3.44Å; T248-L252 PolarHBondContact O-N 3.23Å; K249-L252 PolarHBondContact O-N 3.43Å; L252-G256 PolarHBondContact O-N 3.39Å; L252-V263 HydrophobicContact CB-CG1 4.25Å; L252-V263 HydrophobicContact CD1-CG1 4.43Å; L252-F267 HydrophobicContact CD1-CE2 3.72Å; L252-F267 HydrophobicContact CD1-CZ 3.85Å
253A94.8Very high93.4Very high7 Ų765.8 Ų65.86%0.05834%0.342CS..Hα-helixtrans-61.6-47.2174.200000110.9K249 E250 G256 G257 I258 V260 V263K249-A253 WeakPolarHBondContact O-CB 3.43Å; K249-A253 PolarHBondContact O-N 3.29Å; E250-A253 WeakPolarHBondContact O-CB 3.35Å; E250-A253 PolarHBondContact O-N 2.86Å; A253-G256 PolarHBondContact O-N 3.35Å; A253-G257 WeakPolarHBondContact O-CA 3.31Å; A253-G257 PolarHBondContact O-N 3.43Å; A253-I258 CarbonylContact C-O 3.44Å; A253-I258 WeakPolarHBondContact CA-O 3.15Å; A253-I258 WeakPolarHBondContact CB-O 3.36Å; A253-I258 PolarHBondContact O-N 3Å; A253-I258 VanDerWaalsContact O-O 3.11Å; A253-V260 HydrophobicContact CB-CG2 3.88Å; A253-V263 HydrophobicContact CB-CG2 3.88Å
254R95.6Very high93.5Very high170 Ų17061 Ų6164%0.64233%0.329SS*.Hα-helixtrans-62.7-46.7177-171.1-179.262.879.4-9.8112.2E250 E251 G257E250-R254 WeakPolarHBondContact O-CB 3.49Å; E250-R254 PolarHBondContact O-N 2.95Å; E251-R254 PolarHBondContact O-N 2.91Å; E251-R254 IonicContact OE1-CZ 2.84Å; E251-R254 IonicContact OE1-NH2 3.14Å; E251-R254 PolarHBondContact OE1-NH2 2.89Å; E251-R254 IonicContact OE2-CZ 2.65Å; E251-R254 VanDerWaalsContact OE2-CZ 3.24Å; E251-R254 IonicContact OE2-NE 2.77Å; E251-R254 PolarHBondContact OE2-NE 3.37Å; E251-R254 VanDerWaalsContact OE2-NE 3.13Å; E251-R254 IonicContact OE2-NH2 3.91Å; E251-R254 PolarHBondContact OE2-NH2 2.95Å; R254-G257 PolarHBondContact O-N 3.47Å
255K93.1Very high93.5Very high108 Ų10865.1 Ų65.147%0.4735%0.35SS..Hα-helixtrans-66.3-37.2177.8-79.9173.5164.2144.90113.3V230 E251V230-K255 HydrophobicContact CG1-CB 3.77Å; V230-K255 HydrophobicContact CG1-CD 4.42Å; V230-K255 HydrophobicContact CG2-CB 4.2Å; E251-K255 HydrophobicContact CG-CD 4.25Å; E251-K255 WeakPolarHBondContact O-CB 3.32Å; E251-K255 WeakPolarHBondContact O-CG 3.29Å; E251-K255 PolarHBondContact O-N 3.33Å; E251-K255 WeakPolarHBondContact OE1-CD 3.15Å; E251-K255 WeakPolarHBondContact OE1-CE 3.47Å; E251-K255 IonicContact OE1-NZ 2.68Å; E251-K255 PolarHBondContact OE1-NZ 3.36Å
256G91Very high93.6Very high5 Ų564.1 Ų64.15%0.05234%0.337CS..Hα-helixtrans-85.2-10.6179.200000114.5A227 L252 A253 I258A227-G256 VanDerWaalsContact CB-O 3.28Å; A227-G256 WeakPolarHBondContact CB-O 3.27Å; L252-G256 PolarHBondContact O-N 3.39Å; A253-G256 PolarHBondContact O-N 3.35Å; G256-I258 VanDerWaalsContact C-N 3.27Å; G256-I258 PolarHBondContact O-N 2.95Å
257G92.9Very high93.7Very high71 Ų7159.4 Ų59.473%0.73232%0.315SS*.THydrogen-bonded Turntrans61.635.6-173.100000112.9A253 R254A253-G257 WeakPolarHBondContact O-CA 3.31Å; A253-G257 PolarHBondContact O-N 3.43Å; R254-G257 PolarHBondContact O-N 3.47Å
258I93.3Very high93.7Very high26 Ų2653.1 Ų53.113%0.13329%0.292CS..SBendtrans-127.4168.9-178.758172.4000110.2F223 A227 L231 A253 G256 Q262 V263F223-I258 HydrophobicContact CD1-CG2 4.2Å; F223-I258 HydrophobicContact CD2-CD1 4.4Å; F223-I258 HydrophobicContact CE1-CG2 4.36Å; F223-I258 HydrophobicContact CE2-CD1 4.09Å; F223-I258 HydrophobicContact CZ-CD1 4.34Å; A227-I258 HydrophobicContact CB-CG2 4.17Å; L231-I258 HydrophobicContact CD1-CD1 3.77Å; L231-I258 HydrophobicContact CD2-CD1 4.43Å; L231-I258 HydrophobicContact CG-CD1 4.42Å; A253-I258 CarbonylContact C-O 3.44Å; A253-I258 WeakPolarHBondContact CA-O 3.15Å; A253-I258 WeakPolarHBondContact CB-O 3.36Å; A253-I258 PolarHBondContact O-N 3Å; A253-I258 VanDerWaalsContact O-O 3.11Å; G256-I258 VanDerWaalsContact C-N 3.27Å; G256-I258 PolarHBondContact O-N 2.95Å; I258-Q262 HydrophobicContact CB-CB 4.36Å; I258-V263 HydrophobicContact CD1-CG2 3.63Å; I258-V263 HydrophobicContact CG1-CG2 3.88Å
259T93.8Very high93.7Very high76 Ų7655.1 Ų55.147%0.46630%0.301SS..  trans-83.6153.6-179.770.50000112.4S261 Q262 V263T259-S261 PolarHBondContact O-N 3.19Å; T259-Q262 WeakPolarHBondContact O-CA 3.48Å; T259-Q262 VanDerWaalsContact O-CB 3.3Å; T259-Q262 WeakPolarHBondContact O-CB 3.33Å; T259-Q262 PolarHBondContact O-N 3.18Å; T259-Q262 VanDerWaalsContact OG1-CG 3.29Å; T259-Q262 WeakPolarHBondContact OG1-CG 3.24Å; T259-Q262 PolarHBondContact OG1-N 3.3Å; T259-Q262 PolarHBondContact OG1-OE1 3.47Å; T259-V263 PolarHBondContact O-N 3.29Å
260V92.9Very high93.6Very high44 Ų4454 Ų5427%0.26730%0.296SS..Hα-helixtrans-57-35176.2179.60000112.1K249 E250 A253 V263 S264K249-V260 HydrophobicContact CB-CG1 4.02Å; K249-V260 HydrophobicContact CD-CG1 4.46Å; E250-V260 HydrophobicContact CG-CG2 4Å; A253-V260 HydrophobicContact CB-CG2 3.88Å; V260-V263 PolarHBondContact O-N 2.95Å; V260-S264 PolarHBondContact O-N 3.25Å; V260-S264 PolarHBondContact O-OG 3.02Å; V260-S264 VanDerWaalsContact O-OG 3.13Å
261S92.4Very high93.5Very high75 Ų7551.6 Ų51.652%0.52428%0.282SS..Hα-helixtrans-65-40.5173.6-178.50000112.1T259 S264 N265T259-S261 PolarHBondContact O-N 3.19Å; S261-S264 PolarHBondContact O-N 2.94Å; S261-N265 WeakPolarHBondContact O-CB 3.32Å; S261-N265 VanDerWaalsContact O-CG 3.27Å; S261-N265 PolarHBondContact O-N 3.19Å; S261-N265 PolarHBondContact O-ND2 3.45Å
262Q91.9Very high93.3Very high78 Ų7853.3 Ų53.336%0.36429%0.292SS..Hα-helixtrans-63.8-40.8174.2-76.9170.7-30.100111.8F223 I258 T259 W266F223-Q262 HydrophobicContact CE1-CB 4.19Å; F223-Q262 HydrophobicContact CE1-CG 4.28Å; F223-Q262 HydrophobicContact CZ-CB 3.79Å; F223-Q262 HydrophobicContact CZ-CG 4.28Å; I258-Q262 HydrophobicContact CB-CB 4.36Å; T259-Q262 WeakPolarHBondContact O-CA 3.48Å; T259-Q262 VanDerWaalsContact O-CB 3.3Å; T259-Q262 WeakPolarHBondContact O-CB 3.33Å; T259-Q262 PolarHBondContact O-N 3.18Å; T259-Q262 VanDerWaalsContact OG1-CG 3.29Å; T259-Q262 WeakPolarHBondContact OG1-CG 3.24Å; T259-Q262 PolarHBondContact OG1-N 3.3Å; T259-Q262 PolarHBondContact OG1-OE1 3.47Å; Q262-W266 VanDerWaalsContact O-CB 3.26Å; Q262-W266 WeakPolarHBondContact O-CB 3.35Å; Q262-W266 PolarHBondContact O-N 3.19Å
263V94.2Very high93Very high0 Ų059.6 Ų59.60%032%0.315CS..Hα-helixtrans-60.6-51.9173.41780000110.6L231 K249 L252 A253 I258 T259 V260 N265 W266 F267L231-V263 HydrophobicContact CD2-CG1 3.97Å; L231-V263 HydrophobicContact CD2-CG2 4.22Å; K249-V263 HydrophobicContact CB-CG1 4.15Å; K249-V263 HydrophobicContact CG-CG1 4.19Å; L252-V263 HydrophobicContact CB-CG1 4.25Å; L252-V263 HydrophobicContact CD1-CG1 4.43Å; A253-V263 HydrophobicContact CB-CG2 3.88Å; I258-V263 HydrophobicContact CD1-CG2 3.63Å; I258-V263 HydrophobicContact CG1-CG2 3.88Å; T259-V263 PolarHBondContact O-N 3.29Å; V260-V263 PolarHBondContact O-N 2.95Å; V263-N265 PolarHBondContact O-N 3.39Å; V263-W266 WeakPolarHBondContact O-CB 3.34Å; V263-W266 PolarHBondContact O-N 2.81Å; V263-W266 VanDerWaalsContact O-N 3.09Å; V263-F267 HydrophobicContact CG1-CD2 3.71Å; V263-F267 HydrophobicContact CG1-CE2 3.75Å; V263-F267 WeakPolarHBondContact O-CD2 3.36Å; V263-F267 PolarHBondContact O-N 3.14Å
264S93.8Very high92.6Very high41 Ų4161.4 Ų61.429%0.28732%0.321SS..Hα-helixtrans-57.1-47.1179.7-67.70000112.4V260 S261 W266 F267 G268V260-S264 PolarHBondContact O-N 3.25Å; V260-S264 PolarHBondContact O-OG 3.02Å; V260-S264 VanDerWaalsContact O-OG 3.13Å; S261-S264 PolarHBondContact O-N 2.94Å; S264-W266 VanDerWaalsContact C-N 3.33Å; S264-W266 PolarHBondContact O-N 2.96Å; S264-F267 PolarHBondContact O-N 3.38Å; S264-G268 PolarHBondContact O-N 2.8Å
265N93.2Very high92.2Very high97 Ų9761.1 Ų61.152%0.51932%0.324SS..Hα-helixtrans-64.7-37.3176.9-74.4-39.3000112.1S261 V263 N269S261-N265 WeakPolarHBondContact O-CB 3.32Å; S261-N265 VanDerWaalsContact O-CG 3.27Å; S261-N265 PolarHBondContact O-N 3.19Å; S261-N265 PolarHBondContact O-ND2 3.45Å; V263-N265 PolarHBondContact O-N 3.39Å; N265-N269 WeakPolarHBondContact O-CB 3.39Å; N265-N269 VanDerWaalsContact O-CG 3.28Å; N265-N269 PolarHBondContact O-N 3.2Å; N265-N269 PolarHBondContact O-ND2 3.22Å
266W94.7Very high91.8Very high40 Ų4063.6 Ų63.615%0.15234%0.335CS..Hα-helixtrans-65.8-47.7177.7-17299.2000111.6F223 L231 N232 F235 Q262 V263 S264 G268 N269 K270F223-W266 AromaticContact CD2-CD1 3.66Å; F223-W266 HydrophobicContact CD2-CG 4.48Å; F223-W266 HydrophobicContact CE2-CB 3.95Å; F223-W266 AromaticContact CE2-CD1 3.34Å; F223-W266 AromaticContact CE2-CG 3.89Å; F223-W266 HydrophobicContact CE2-CG 3.89Å; L231-W266 HydrophobicContact CB-CD2 4.04Å; L231-W266 HydrophobicContact CB-CE3 3.88Å; L231-W266 HydrophobicContact CB-CH2 3.7Å; L231-W266 HydrophobicContact CB-CZ2 3.83Å; L231-W266 HydrophobicContact CB-CZ3 3.73Å; L231-W266 HydrophobicContact CD1-CB 4.29Å; L231-W266 HydrophobicContact CD1-CD2 3.74Å; L231-W266 HydrophobicContact CD1-CE3 4.23Å; L231-W266 HydrophobicContact CD1-CG 3.75Å; L231-W266 HydrophobicContact CD2-CE3 4.43Å; L231-W266 HydrophobicContact CG-CD2 4.39Å; L231-W266 HydrophobicContact CG-CE3 4.43Å; N232-W266 VanDerWaalsContact OD1-CH2 3.31Å; N232-W266 WeakPolarHBondContact OD1-CH2 3.27Å; N232-W266 WeakPolarHBondContact OD1-CZ2 3.02Å; F235-W266 HydrophobicContact CB-CH2 4.3Å; F235-W266 HydrophobicContact CB-CZ3 4.15Å; F235-W266 HydrophobicContact CD2-CZ3 4.35Å; F235-W266 HydrophobicContact CG-CZ3 4.44Å; Q262-W266 VanDerWaalsContact O-CB 3.26Å; Q262-W266 WeakPolarHBondContact O-CB 3.35Å; Q262-W266 PolarHBondContact O-N 3.19Å; V263-W266 WeakPolarHBondContact O-CB 3.34Å; V263-W266 PolarHBondContact O-N 2.81Å; V263-W266 VanDerWaalsContact O-N 3.09Å; S264-W266 VanDerWaalsContact C-N 3.33Å; S264-W266 PolarHBondContact O-N 2.96Å; W266-G268 PolarHBondContact O-N 3.24Å; W266-N269 PolarHBondContact O-N 3.17Å; W266-K270 HydrophobicContact CD2-CB 4.37Å; W266-K270 HydrophobicContact CE3-CB 3.95Å; W266-K270 HydrophobicContact CE3-CG 4.41Å; W266-K270 HydrophobicContact CH2-CB 4.1Å; W266-K270 HydrophobicContact CH2-CD 3.65Å; W266-K270 HydrophobicContact CH2-CG 3.67Å; W266-K270 HydrophobicContact CZ2-CD 3.85Å; W266-K270 HydrophobicContact CZ2-CG 4.27Å; W266-K270 HydrophobicContact CZ3-CB 3.79Å; W266-K270 HydrophobicContact CZ3-CD 4.24Å; W266-K270 HydrophobicContact CZ3-CG 3.75Å; W266-K270 VanDerWaalsContact O-CB 3.29Å; W266-K270 WeakPolarHBondContact O-CB 3.34Å; W266-K270 PolarHBondContact O-N 3.3Å
267F94.9Very high91.2Very high3 Ų367 Ų671%0.01335%0.352CS..Hα-helixtrans-64-41.4178.4-86.3-84.4000112.3L231 Y234 F235 P244 L252 V263 S264 N269 K270 R271L231-F267 HydrophobicContact CD2-CD2 4.33Å; L231-F267 HydrophobicContact CD2-CE2 3.57Å; L231-F267 HydrophobicContact CD2-CZ 4.32Å; Y234-F267 AromaticContact CD1-CE1 3.7Å; Y234-F267 HydrophobicContact CD1-CE1 3.7Å; Y234-F267 AromaticContact CD1-CZ 3.54Å; Y234-F267 HydrophobicContact CD1-CZ 3.54Å; Y234-F267 HydrophobicContact CE1-CE1 4.28Å; Y234-F267 HydrophobicContact CE1-CZ 4.32Å; Y234-F267 HydrophobicContact CG-CZ 4.3Å; F235-F267 HydrophobicContact CB-CE1 3.94Å; F235-F267 AromaticContact CD2-CD1 3.83Å; F235-F267 HydrophobicContact CD2-CD1 3.83Å; F235-F267 AromaticContact CD2-CE1 3.85Å; F235-F267 HydrophobicContact CD2-CE1 3.85Å; F235-F267 HydrophobicContact CG-CE1 4.42Å; P244-F267 HydrophobicContact CG-CD1 4.24Å; P244-F267 HydrophobicContact CG-CD2 4.02Å; P244-F267 HydrophobicContact CG-CE1 4.34Å; P244-F267 HydrophobicContact CG-CE2 4.11Å; P244-F267 HydrophobicContact CG-CG 4.11Å; P244-F267 HydrophobicContact CG-CZ 4.29Å; L252-F267 HydrophobicContact CD1-CE2 3.72Å; L252-F267 HydrophobicContact CD1-CZ 3.85Å; V263-F267 HydrophobicContact CG1-CD2 3.71Å; V263-F267 HydrophobicContact CG1-CE2 3.75Å; V263-F267 WeakPolarHBondContact O-CD2 3.36Å; V263-F267 PolarHBondContact O-N 3.14Å; S264-F267 PolarHBondContact O-N 3.38Å; F267-N269 PolarHBondContact O-N 2.95Å; F267-K270 PolarHBondContact O-N 3.3Å; F267-R271 WeakPolarHBondContact O-CG 2.92Å; F267-R271 PolarHBondContact O-N 3.48Å
268G93.3Very high90.1Very high21 Ų2167 Ų6722%0.21634%0.338CS..Hα-helixtrans-57.2-48.4173.400000112.1S264 W266 I272S264-G268 PolarHBondContact O-N 2.8Å; W266-G268 PolarHBondContact O-N 3.24Å; G268-I272 WeakPolarHBondContact O-CG1 3.48Å; G268-I272 PolarHBondContact O-N 2.96Å
269N92.6Very high88.8Confident78 Ų7868.9 Ų68.942%0.41736%0.364SS..Hα-helixtrans-66.9-41.9177.8-75.2-47.4000113N265 W266 F267 I272 R273N265-N269 WeakPolarHBondContact O-CB 3.39Å; N265-N269 VanDerWaalsContact O-CG 3.28Å; N265-N269 PolarHBondContact O-N 3.2Å; N265-N269 PolarHBondContact O-ND2 3.22Å; W266-N269 PolarHBondContact O-N 3.17Å; F267-N269 PolarHBondContact O-N 2.95Å; N269-I272 PolarHBondContact O-N 2.96Å; N269-R273 WeakPolarHBondContact O-CG 3.33Å; N269-R273 PolarHBondContact O-N 2.94Å
270K92.3Very high87.5Confident18 Ų1872.6 Ų72.68%0.07837%0.373CS..Hα-helixtrans-63.8-42.7-179.3-173.678.5-178.4-164.50110.9N232 F235 Y236 W266 F267 I272 R273 Y274 E284N232-K270 PolarHBondContact OD1-NZ 3.48Å; F235-K270 HydrophobicContact CD1-CG 4Å; F235-K270 HydrophobicContact CD2-CB 4.27Å; F235-K270 HydrophobicContact CD2-CG 3.7Å; F235-K270 HydrophobicContact CE1-CG 3.9Å; F235-K270 HydrophobicContact CE2-CB 4.04Å; F235-K270 HydrophobicContact CE2-CG 3.59Å; F235-K270 HydrophobicContact CG-CG 3.91Å; F235-K270 HydrophobicContact CZ-CB 4.48Å; F235-K270 HydrophobicContact CZ-CG 3.7Å; Y236-K270 PolarHBondContact OH-NZ 2.96Å; W266-K270 HydrophobicContact CD2-CB 4.37Å; W266-K270 HydrophobicContact CE3-CB 3.95Å; W266-K270 HydrophobicContact CE3-CG 4.41Å; W266-K270 HydrophobicContact CH2-CB 4.1Å; W266-K270 HydrophobicContact CH2-CD 3.65Å; W266-K270 HydrophobicContact CH2-CG 3.67Å; W266-K270 HydrophobicContact CZ2-CD 3.85Å; W266-K270 HydrophobicContact CZ2-CG 4.27Å; W266-K270 HydrophobicContact CZ3-CB 3.79Å; W266-K270 HydrophobicContact CZ3-CD 4.24Å; W266-K270 HydrophobicContact CZ3-CG 3.75Å; W266-K270 VanDerWaalsContact O-CB 3.29Å; W266-K270 WeakPolarHBondContact O-CB 3.34Å; W266-K270 PolarHBondContact O-N 3.3Å; F267-K270 PolarHBondContact O-N 3.3Å; K270-I272 PolarHBondContact O-N 3.46Å; K270-R273 PolarHBondContact O-N 3Å; K270-Y274 WeakPolarHBondContact O-CB 3.23Å; K270-Y274 PolarHBondContact O-N 2.83Å; K270-E284 IonicContact NZ-OE2 3.83Å
271R93.1Very high86.1Confident63 Ų6372.2 Ų72.224%0.23837%0.368CS..Hα-helixtrans-59.5-45.4174.3-73.6-166.8-57.3-94.80.3112.6F235 P242 F267 R273 Y274 K275F235-R271 HydrophobicContact CE2-CG 3.81Å; F235-R271 HydrophobicContact CZ-CG 4.44Å; P242-R271 HydrophobicContact CB-CG 4.28Å; P242-R271 HydrophobicContact CG-CG 3.94Å; P242-R271 PolarHBondContact O-NH1 3.47Å; F267-R271 WeakPolarHBondContact O-CG 2.92Å; F267-R271 PolarHBondContact O-N 3.48Å; R271-R273 PolarHBondContact O-N 3.45Å; R271-Y274 PolarHBondContact O-N 3.24Å; R271-K275 WeakPolarHBondContact O-CB 3.49Å; R271-K275 PolarHBondContact O-N 3.5Å
272I90.5Very high84.7Confident90 Ų9073.4 Ų73.446%0.46237%0.366SS..Hα-helixtrans-61.8-44.1178.2-66167.7000110.7G268 N269 K270 K276G268-I272 WeakPolarHBondContact O-CG1 3.48Å; G268-I272 PolarHBondContact O-N 2.96Å; N269-I272 PolarHBondContact O-N 2.96Å; K270-I272 PolarHBondContact O-N 3.46Å; I272-K276 HydrophobicContact CG2-CD 4.2Å; I272-K276 WeakPolarHBondContact O-CG 3.46Å; I272-K276 PolarHBondContact O-N 3.13Å
273R89.1Confident83.4Confident141 Ų14176.7 Ų76.753%0.53238%0.381SS..Hα-helixtrans-66.2-43.7178.4-68.1-177.7-151.5172.67.8112.2N269 K270 R271 K276 N277 F281N269-R273 WeakPolarHBondContact O-CG 3.33Å; N269-R273 PolarHBondContact O-N 2.94Å; K270-R273 PolarHBondContact O-N 3Å; R271-R273 PolarHBondContact O-N 3.45Å; R273-K276 PolarHBondContact O-N 2.91Å; R273-N277 PolarHBondContact O-N 3.37Å; R273-N277 VanDerWaalsContact O-N 3.15Å; R273-F281 HydrophobicContact CB-CE2 4.38Å; R273-F281 HydrophobicContact CB-CZ 4.47Å
274Y86.6Confident82.2Confident44 Ų4480.6 Ų80.617%0.17340%0.399CS..Hα-helixtrans-61.5-45.8178.8-174.5-97.6000111.5F235 L239 K270 R271 K276 N277 T278 F281F235-Y274 HydrophobicContact CE1-CD2 4.06Å; F235-Y274 HydrophobicContact CE1-CG 4.07Å; F235-Y274 HydrophobicContact CZ-CG 4.13Å; L239-Y274 HydrophobicContact CD2-CD2 4.48Å; L239-Y274 HydrophobicContact CD2-CE1 3.99Å; L239-Y274 HydrophobicContact CD2-CE2 3.94Å; K270-Y274 WeakPolarHBondContact O-CB 3.23Å; K270-Y274 PolarHBondContact O-N 2.83Å; R271-Y274 PolarHBondContact O-N 3.24Å; Y274-K276 VanDerWaalsContact C-N 3.3Å; Y274-K276 PolarHBondContact O-N 3.37Å; Y274-N277 CarbonylContact O-C 3.08Å; Y274-N277 PolarHBondContact O-N 3.29Å; Y274-T278 WeakPolarHBondContact O-CA 3.39Å; Y274-T278 PolarHBondContact O-N 2.63Å; Y274-T278 PolarHBondContact O-OG1 2.76Å; Y274-F281 HydrophobicContact CD2-CB 3.46Å; Y274-F281 VanDerWaalsContact CD2-CB 3.46Å; Y274-F281 HydrophobicContact CD2-CG 4.12Å; Y274-F281 HydrophobicContact CE2-CB 3.67Å
275K86.4Confident80.9Confident165 Ų16578.9 Ų78.972%0.71739%0.387SS*.Hα-helixtrans-62.1-34.5177.4-171.3176.969.9169.90113.2R271R271-K275 WeakPolarHBondContact O-CB 3.49Å; R271-K275 PolarHBondContact O-N 3.5Å
276K85.3Confident80Confident159 Ų15977.5 Ų77.569%0.69138%0.383SS*.Hα-helixtrans-79.5-22.3-179.4-73.3-178.3176.3-170.90113.5I272 R273 Y274I272-K276 HydrophobicContact CG2-CD 4.2Å; I272-K276 WeakPolarHBondContact O-CG 3.46Å; I272-K276 PolarHBondContact O-N 3.13Å; R273-K276 PolarHBondContact O-N 2.91Å; Y274-K276 VanDerWaalsContact C-N 3.3Å; Y274-K276 PolarHBondContact O-N 3.37Å
277N77.1Confident79.1Confident78 Ų7880.2 Ų80.242%0.41740%0.398SS..  trans-139.341.5-167.7-104.278.7000113.2R273 Y274 G279 K280 F281R273-N277 PolarHBondContact O-N 3.37Å; R273-N277 VanDerWaalsContact O-N 3.15Å; Y274-N277 CarbonylContact O-C 3.08Å; Y274-N277 PolarHBondContact O-N 3.29Å; N277-G279 VanDerWaalsContact C-N 3.29Å; N277-G279 PolarHBondContact O-N 3.45Å; N277-G279 VanDerWaalsContact O-N 3.12Å; N277-K280 PolarHBondContact O-N 3.02Å; N277-K280 VanDerWaalsContact O-N 3.15Å; N277-F281 HydrophobicContact CB-CD2 3.95Å; N277-F281 HydrophobicContact CB-CE2 3.82Å; N277-F281 WeakPolarHBondContact O-CD2 3.42Å
278T71.8Confident78Confident70 Ų7082.6 Ų82.643%0.42941%0.407SS..Hα-helixtrans-48.7-43-171.5-51.10000114.2Y274 K280 F281 Q282Y274-T278 WeakPolarHBondContact O-CA 3.39Å; Y274-T278 PolarHBondContact O-N 2.63Å; Y274-T278 PolarHBondContact O-OG1 2.76Å; T278-K280 PolarHBondContact O-N 2.9Å; T278-F281 PolarHBondContact O-N 3.44Å; T278-Q282 PolarHBondContact O-N 3.45Å; T278-Q282 VanDerWaalsContact O-N 3.12Å
279G66Low76.7Confident66 Ų6685.3 Ų85.368%0.6842%0.42SS*.Hα-helixtrans-64-34.1-177.300000115.5N277N277-G279 VanDerWaalsContact C-N 3.29Å; N277-G279 PolarHBondContact O-N 3.45Å; N277-G279 VanDerWaalsContact O-N 3.12Å
280K65.1Low75.2Confident153 Ų15386.2 Ų86.267%0.66542%0.422SS*.Hα-helixtrans-80.5-31.7-180-68.1-168.4178.6-174.10112.9N277 T278N277-K280 PolarHBondContact O-N 3.02Å; N277-K280 VanDerWaalsContact O-N 3.15Å; T278-K280 PolarHBondContact O-N 2.9Å
281F64.3Low73.7Confident37 Ų3791.2 Ų91.216%0.16244%0.443CS..Hα-helixtrans-85.8-11.2-179.7-70.7-72.6000113R273 Y274 N277 T278 E284 A285R273-F281 HydrophobicContact CB-CE2 4.38Å; R273-F281 HydrophobicContact CB-CZ 4.47Å; Y274-F281 HydrophobicContact CD2-CB 3.46Å; Y274-F281 VanDerWaalsContact CD2-CB 3.46Å; Y274-F281 HydrophobicContact CD2-CG 4.12Å; Y274-F281 HydrophobicContact CE2-CB 3.67Å; N277-F281 HydrophobicContact CB-CD2 3.95Å; N277-F281 HydrophobicContact CB-CE2 3.82Å; N277-F281 WeakPolarHBondContact O-CD2 3.42Å; T278-F281 PolarHBondContact O-N 3.44Å; F281-E284 WeakPolarHBondContact CD1-OE2 3.28Å; F281-A285 WeakPolarHBondContact O-CB 3.33Å; F281-A285 PolarHBondContact O-N 3.26Å
282Q63.4Low72Confident100 Ų10091.3 Ų91.347%0.46745%0.451SS..Hα-helixtrans-62.4-44.4171.1-161.173.521.100110.7T278 E284 A285 T286T278-Q282 PolarHBondContact O-N 3.45Å; T278-Q282 VanDerWaalsContact O-N 3.12Å; Q282-E284 PolarHBondContact O-N 2.82Å; Q282-A285 WeakPolarHBondContact O-CB 3.32Å; Q282-A285 PolarHBondContact O-N 2.87Å; Q282-A285 VanDerWaalsContact O-N 3.12Å; Q282-T286 PolarHBondContact O-N 2.76Å; Q282-T286 PolarHBondContact O-OG1 2.91Å
283E63.9Low70Confident147 Ų14790.8 Ų90.869%0.68746%0.456SS*.Hα-helixtrans-63.2-40.1177.9-170.8176.8-172.300112.4T286 M287E283-T286 PolarHBondContact O-N 2.87Å; E283-T286 PolarHBondContact O-OG1 2.94Å; E283-M287 PolarHBondContact O-N 2.97Å
284E69.2Low68Low82 Ų8288.5 Ų88.538%0.38346%0.457SS..Hα-helixtrans-63.4-41.6171.6-69.3-171.8-178.500111.5Y236 K270 F281 Q282 T286 M287 Y288Y236-E284 HydrophobicContact CE2-CB 4.3Å; Y236-E284 PolarHBondContact OH-OE2 3.18Å; K270-E284 IonicContact NZ-OE2 3.83Å; F281-E284 WeakPolarHBondContact CD1-OE2 3.28Å; Q282-E284 PolarHBondContact O-N 2.82Å; E284-T286 VanDerWaalsContact C-N 3.35Å; E284-T286 PolarHBondContact O-N 2.74Å; E284-M287 WeakPolarHBondContact O-CB 3.23Å; E284-M287 PolarHBondContact O-N 2.98Å; E284-Y288 VanDerWaalsContact O-CD2 3.27Å; E284-Y288 WeakPolarHBondContact O-CD2 3.34Å; E284-Y288 PolarHBondContact O-N 3.25Å; E284-Y288 VanDerWaalsContact O-N 3.14Å
285A66.1Low66.1Low4 Ų490.1 Ų90.13%0.03348%0.48CS..Hα-helixtrans-62.9-40.3177.800000112Y236 L239 F281 Q282 M287 Y288 T289Y236-A285 HydrophobicContact CD1-CB 3.54Å; Y236-A285 HydrophobicContact CE1-CB 3.88Å; Y236-A285 HydrophobicContact CG-CB 4.19Å; L239-A285 HydrophobicContact CD1-CB 4.03Å; F281-A285 WeakPolarHBondContact O-CB 3.33Å; F281-A285 PolarHBondContact O-N 3.26Å; Q282-A285 WeakPolarHBondContact O-CB 3.32Å; Q282-A285 PolarHBondContact O-N 2.87Å; Q282-A285 VanDerWaalsContact O-N 3.12Å; A285-M287 VanDerWaalsContact C-N 3.33Å; A285-M287 PolarHBondContact O-N 3.11Å; A285-Y288 PolarHBondContact O-N 3.37Å; A285-T289 PolarHBondContact O-N 3.22Å; A285-T289 PolarHBondContact O-OG1 2.95Å
286T74.9Confident63.9Low69 Ų6988.3 Ų88.342%0.42348%0.483SS..Hα-helixtrans-59.1-45.8175.4-16.10000110.9Q282 E283 E284 Y288 T289 E290Q282-T286 PolarHBondContact O-N 2.76Å; Q282-T286 PolarHBondContact O-OG1 2.91Å; E283-T286 PolarHBondContact O-N 2.87Å; E283-T286 PolarHBondContact O-OG1 2.94Å; E284-T286 VanDerWaalsContact C-N 3.35Å; E284-T286 PolarHBondContact O-N 2.74Å; T286-Y288 PolarHBondContact O-N 2.85Å; T286-T289 PolarHBondContact O-N 2.95Å; T286-E290 WeakPolarHBondContact O-CG 3.46Å; T286-E290 PolarHBondContact O-N 3.35Å
287M75.9Confident61.6Low97 Ų9789.6 Ų89.648%0.47849%0.489SS..Hα-helixtrans-60.3-39.5177.7-78.3-76.3140.600113.7E283 E284 A285 K291E283-M287 PolarHBondContact O-N 2.97Å; E284-M287 WeakPolarHBondContact O-CB 3.23Å; E284-M287 PolarHBondContact O-N 2.98Å; A285-M287 VanDerWaalsContact C-N 3.33Å; A285-M287 PolarHBondContact O-N 3.11Å; M287-K291 VanDerWaalsContact O-CG 3.3Å; M287-K291 WeakPolarHBondContact O-CG 3.41Å; M287-K291 PolarHBondContact O-N 3.33Å
288Y71.6Confident59.8Low52 Ų5292.3 Ų92.320%0.20451%0.508CS..Hα-helixtrans-73.5-34177.3-81.9-85.7000112.1N232 Y236 E284 A285 T286 K291 T292N232-Y288 HydrophobicContact CB-CE1 3.89Å; N232-Y288 HydrophobicContact CB-CE2 4.06Å; N232-Y288 PolarHBondContact ND2-OH 3.12Å; Y236-Y288 AromaticContact CD2-CD2 3.42Å; Y236-Y288 HydrophobicContact CD2-CD2 3.42Å; Y236-Y288 VanDerWaalsContact CD2-CD2 3.42Å; Y236-Y288 HydrophobicContact CD2-CE2 4.07Å; Y236-Y288 AromaticContact CD2-CG 3.73Å; Y236-Y288 HydrophobicContact CD2-CG 3.73Å; Y236-Y288 AromaticContact CE2-CD2 3.53Å; Y236-Y288 HydrophobicContact CE2-CD2 3.53Å; Y236-Y288 AromaticContact CE2-CE2 3.82Å; Y236-Y288 HydrophobicContact CE2-CE2 3.82Å; Y236-Y288 HydrophobicContact CE2-CG 4.3Å; E284-Y288 VanDerWaalsContact O-CD2 3.27Å; E284-Y288 WeakPolarHBondContact O-CD2 3.34Å; E284-Y288 PolarHBondContact O-N 3.25Å; E284-Y288 VanDerWaalsContact O-N 3.14Å; A285-Y288 PolarHBondContact O-N 3.37Å; T286-Y288 PolarHBondContact O-N 2.85Å; Y288-K291 PolarHBondContact O-N 3.2Å; Y288-T292 PolarHBondContact O-N 3.36Å; Y288-T292 PolarHBondContact O-OG1 2.85Å
289T66.4Low58.3Low79 Ų79101 Ų10149%0.48553%0.532SS..Hα-helixtrans-68.4-38.2177-44.80000111.8A285 T286 T292 S293A285-T289 PolarHBondContact O-N 3.22Å; A285-T289 PolarHBondContact O-OG1 2.95Å; T286-T289 PolarHBondContact O-N 2.95Å; T289-T292 WeakPolarHBondContact CA-OG1 3.49Å; T289-T292 PolarHBondContact O-OG1 3.06Å; T289-S293 PolarHBondContact O-N 3.21Å; T289-S293 PolarHBondContact O-OG 3.26Å
290E61Low56.5Low97 Ų97101.5 Ų101.545%0.45354%0.538SS..Hα-helixtrans-66.9-35.8174.7-72.7169.6-168.600112.6T286 S293 T294T286-E290 WeakPolarHBondContact O-CG 3.46Å; T286-E290 PolarHBondContact O-N 3.35Å; E290-S293 PolarHBondContact O-N 3.31Å; E290-T294 WeakPolarHBondContact O-CG2 2.92Å; E290-T294 PolarHBondContact O-N 3.03Å; E290-T294 PolarHBondContact O-OG1 3.49Å
291K59.5Low55Low122 Ų122100.4 Ų100.453%0.5355%0.549SS..Hα-helixtrans-69.3-39.5177.1-76.1173.2-178.81790113.2M287 Y288 S293 T294 A295M287-K291 VanDerWaalsContact O-CG 3.3Å; M287-K291 WeakPolarHBondContact O-CG 3.41Å; M287-K291 PolarHBondContact O-N 3.33Å; Y288-K291 PolarHBondContact O-N 3.2Å; K291-S293 VanDerWaalsContact C-N 3.27Å; K291-S293 PolarHBondContact O-N 3.09Å; K291-T294 WeakPolarHBondContact CA-OG1 3.3Å; K291-T294 PolarHBondContact O-N 3.13Å; K291-T294 PolarHBondContact O-OG1 3.45Å; K291-T294 VanDerWaalsContact O-OG1 3.13Å; K291-A295 PolarHBondContact O-N 3.44Å; K291-A295 VanDerWaalsContact O-N 3.09Å
292T57Low53.5Low66 Ų66102.7 Ų102.741%0.40558%0.583SS.*Hα-helixtrans-66.1-29.917229.60000112.9Y288 T289 T296Y288-T292 PolarHBondContact O-N 3.36Å; Y288-T292 PolarHBondContact O-OG1 2.85Å; T289-T292 WeakPolarHBondContact CA-OG1 3.49Å; T289-T292 PolarHBondContact O-OG1 3.06Å; T292-T296 PolarHBondContact O-OG1 2.86Å
293S49Very low51.9Low79 Ų79101.8 Ų101.855%0.55260%0.601SS**Hα-helixtrans-77.2-31.2178.6-54.30000112.8T289 E290 K291T289-S293 PolarHBondContact O-N 3.21Å; T289-S293 PolarHBondContact O-OG 3.26Å; E290-S293 PolarHBondContact O-N 3.31Å; K291-S293 VanDerWaalsContact C-N 3.27Å; K291-S293 PolarHBondContact O-N 3.09Å
294T47.2Very low50.6Low92 Ų92103.6 Ų103.656%0.56461%0.61SS**Hα-helixtrans-85.4-29.8179.544.70000113.4E290 K291 T296 K297E290-T294 WeakPolarHBondContact O-CG2 2.92Å; E290-T294 PolarHBondContact O-N 3.03Å; E290-T294 PolarHBondContact O-OG1 3.49Å; K291-T294 WeakPolarHBondContact CA-OG1 3.3Å; K291-T294 PolarHBondContact O-N 3.13Å; K291-T294 PolarHBondContact O-OG1 3.45Å; K291-T294 VanDerWaalsContact O-OG1 3.13Å; T294-T296 PolarHBondContact O-N 3.15Å; T294-K297 PolarHBondContact O-N 3.43Å
295A45.9Very low49Very low79 Ų79105 Ų10565%0.65363%0.628SS**Hα-helixtrans-62.1-24.4172.400000113.2K291 K297K291-A295 PolarHBondContact O-N 3.44Å; K291-A295 VanDerWaalsContact O-N 3.09Å; A295-K297 VanDerWaalsContact C-N 3.3Å; A295-K297 PolarHBondContact O-N 3.03Å
296T41.6Very low47.3Very low126 Ų126109.9 Ų109.977%0.77366%0.662SS**THydrogen-bonded Turntrans-81.2-6.9176.7-52.20000112.8T292 T294T292-T296 PolarHBondContact O-OG1 2.86Å; T294-T296 PolarHBondContact O-N 3.15Å
297K36.3Very low45.4Very low187 Ų187111.8 Ų111.881%0.81368%0.677SS**THydrogen-bonded Turntrans-122.236.5-174-154.8177.6178.7-179.40113.9T294 A295T294-K297 PolarHBondContact O-N 3.43Å; A295-K297 VanDerWaalsContact C-N 3.3Å; A295-K297 PolarHBondContact O-N 3.03Å
298V40.4Very low43.2Very low135 Ų135116.1 Ų116.182%0.81870%0.696SS**  trans-108.572.4167.2-173.10000110
299R38.8Very low41.3Very low252 Ų252119 Ų11995%0.95172%0.724SS**SBendtrans-151.485.8152.1-168.9123.8178.7-121.22.1107.9
300G28.8Very low40.1Very low77 Ų77121.6 Ų121.679%0.79474%0.74SS**  trans167.9123.9176.700000112.4
301S33.3Very low38.7Very low129 Ų129122.8 Ų122.890%0.90276%0.756SS**  trans-62.8152.7-166.2-59.10000118.3
302G33Very low37.7Very low85 Ų85122.4 Ų122.488%0.87677%0.769SS**  91.7123.6126.700000118.9
303G31Very low36.9Very low82 Ų82125.6 Ų125.685%0.84579%0.791SS**  trans150.6118.8161.200000114.2
304Q35.9Very low35.9Very low185 Ų185125.4 Ų125.486%0.86480%0.801SS**  trans-79.4163.4-174.3-66.7176.724.100114.7
305S34.3Very low35.3Very low110 Ų110126.9 Ų126.977%0.76982%0.815SS**  trans60119.1145.756.80000120.7
306S30.7Very low34.5Very low108 Ų108129.4 Ų129.476%0.75583%0.827SS**  17414096-166.30000111.2
307C36.3Very low34.1Very low108 Ų108126.6 Ų126.673%0.7382%0.823SS**  trans-80.5149.1173.1470000111
308Q28.6Very low34.3Very low189 Ų189123.9 Ų123.988%0.88382%0.824SS**  trans-166.3152.8146.2-111162.68100114.5
309S31.3Very low33.7Very low113 Ų113127.5 Ų127.579%0.7983%0.829SS**  trans-80.9161.1-153.3-52.50000116.8
310T41.6Very low34.8Very low132 Ų132120.5 Ų120.581%0.8182%0.816SS**  trans-58.2156.5163.948.40000114.3
311P32.3Very low34.9Very low122 Ų122124.1 Ų124.179%0.79282%0.817SS**  trans-125.9139.2142.533.6-20.2000112.9
312S37.7Very low34.7Very low115 Ų115124.1 Ų124.180%0.80481%0.812SS**  trans-87.7150.7156.9-62.50000109.2
313P41.3Very low34.7Very low133 Ų133125.2 Ų125.286%0.86481%0.805SS**  -147.4176.7103.432.8-13.1000110.8
314G27.9Very low35.1Very low75 Ų75125.2 Ų125.277%0.77381%0.805SS**  cis172.3151.74.800000108.5
315S33.3Very low35.2Very low123 Ų123119.2 Ų119.286%0.8679%0.794SS**  trans8134.9159.9-160.20000122.7
316C29.4Very low35.5Very low132 Ų132120.6 Ų120.689%0.89279%0.792SS**  trans-158.2126.8132.7-1420000110.4
317G33.2Very low36.1Very low67 Ų67121.9 Ų121.969%0.69179%0.788SS**  trans-85.4-172.5-176.100000114.8
318P40.9Very low36.5Very low129 Ų129122.5 Ų122.584%0.83879%0.788SS**  trans-132.3146.1160.234.4-18.1000114.7
319F28.4Very low37.3Very low211 Ų211119.4 Ų119.493%0.92578%0.777SS**  trans-112.6168.5164.3-92.8-54.7000109.4
320P61.8Low38Very low105 Ų105118.2 Ų118.268%0.68277%0.765SS**  -109.5-177.8-128.741.6-34.7000113.4
321L30Very low37.9Very low154 Ų154117 Ų11781%0.80675%0.753SS**  173.3137127.2-89.6165.6000111.6
322T30.7Very low38.6Very low129 Ų129120.2 Ų120.279%0.79175%0.75SS**  trans57.3138.4139.9-156.60000119.5
323S32.4Very low38.8Very low107 Ų107118.6 Ų118.675%0.74874%0.735SS**  cis-157.2134.228.5-1770000109.2
324G39.5Very low38.8Very low82 Ų82116.1 Ų116.185%0.84571%0.714SS**  trans-83.9112.1-179.600000111.8
325G38.4Very low39.7Very low60 Ų60115.9 Ų115.962%0.61971%0.705SS**SBendtrans-160.8-33171.600000113.7M327G325-M327 PolarHBondContact O-N 3.31Å
326D39.6Very low40.3Very low138 Ų138116.3 Ų116.374%0.73869%0.691SS**THydrogen-bonded Turntrans-94.27.9-170.4-73.6-40000116T330D326-T330 PolarHBondContact O-OG1 2.85Å
327M44Very low40.6Very low136 Ų136113 Ų11367%0.6767%0.665SS**Hα-helixtrans-77.1-27.9-177.4-75.6-102.3-75.800113.1G325 L331G325-M327 PolarHBondContact O-N 3.31Å; M327-L331 HydrophobicContact CB-CD1 4.37Å; M327-L331 HydrophobicContact CE-CD1 4.38Å; M327-L331 WeakPolarHBondContact O-CB 3.32Å; M327-L331 WeakPolarHBondContact O-CD1 3.39Å; M327-L331 PolarHBondContact O-N 3.24Å
328V45.3Very low40.8Very low121 Ų121117.7 Ų117.773%0.73367%0.668SS**Hα-helixtrans-77-32.4-166.1-178.80000113.2
329L44.3Very low40.6Very low124 Ų124116.5 Ų116.565%0.64966%0.661SS**Hα-helixtrans-84.7-34.3179.3-147.975.8000112.4R332 T333L329-R332 PolarHBondContact O-N 3.08Å; L329-T333 PolarHBondContact O-OG1 3.38Å
330T46.8Very low41.2Very low88 Ų88112 Ų11254%0.5465%0.653SS.*Hα-helixtrans-69.7-38.2179.5-46.50000111.8D326 L334D326-T330 PolarHBondContact O-OG1 2.85Å; T330-L334 HydrophobicContact CG2-CD1 4.46Å; T330-L334 PolarHBondContact O-N 3.48Å
331L39.4Very low40Very low107 Ų107113 Ų11356%0.5666%0.659SS**Hα-helixtrans-66.8-36.8176.4-94.4151.9000112.7M327 T333 L334 A335M327-L331 HydrophobicContact CB-CD1 4.37Å; M327-L331 HydrophobicContact CE-CD1 4.38Å; M327-L331 WeakPolarHBondContact O-CB 3.32Å; M327-L331 WeakPolarHBondContact O-CD1 3.39Å; M327-L331 PolarHBondContact O-N 3.24Å; L331-T333 VanDerWaalsContact C-N 3.3Å; L331-T333 PolarHBondContact O-N 2.8Å; L331-L334 PolarHBondContact O-N 3.39Å; L331-A335 WeakPolarHBondContact O-CB 3.15Å; L331-A335 PolarHBondContact O-N 3.06Å; L331-A335 VanDerWaalsContact O-N 3.11Å
332R47.1Very low40.2Very low189 Ų189109.4 Ų109.471%0.71366%0.66SS**Hα-helixtrans-67.3-33-178.2-148.8174.9-172.3153.91.7112.2L329 F336L329-R332 PolarHBondContact O-N 3.08Å; R332-F336 HydrophobicContact CG-CE2 4.49Å; R332-F336 WeakPolarHBondContact O-CD2 3.19Å; R332-F336 VanDerWaalsContact O-CE2 3.27Å; R332-F336 WeakPolarHBondContact O-CE2 3.22Å
333T42.4Very low40.2Very low81 Ų81107 Ų10750%0.49766%0.661SS.*Hα-helixtrans-79.1-29.3179.5-51.50000112.6L329 L331L329-T333 PolarHBondContact O-OG1 3.38Å; L331-T333 VanDerWaalsContact C-N 3.3Å; L331-T333 PolarHBondContact O-N 2.8Å
334L40.7Very low40Very low81 Ų81108.6 Ų108.642%0.42467%0.665SS.*Hα-helixtrans-82.4-26.1178.3-69.7176.4000113.7T330 L331 F336 L337T330-L334 HydrophobicContact CG2-CD1 4.46Å; T330-L334 PolarHBondContact O-N 3.48Å; L331-L334 PolarHBondContact O-N 3.39Å; L334-F336 PolarHBondContact O-N 3.24Å; L334-L337 PolarHBondContact O-N 3.5Å
335A46.3Very low39.7Very low70 Ų70110.1 Ų110.158%0.57966%0.662SS**G310 helixtrans-64.8-22.9178.200000113.8L331 L337L331-A335 WeakPolarHBondContact O-CB 3.15Å; L331-A335 PolarHBondContact O-N 3.06Å; L331-A335 VanDerWaalsContact O-N 3.11Å; A335-L337 VanDerWaalsContact C-N 3.3Å; A335-L337 PolarHBondContact O-N 3.05Å
336F45.3Very low39.3Very low132 Ų132115.1 Ų115.158%0.57967%0.673SS**G310 helixtrans-81.40.8-179.5-72.7-73.8000115R332 L334R332-F336 HydrophobicContact CG-CE2 4.49Å; R332-F336 WeakPolarHBondContact O-CD2 3.19Å; R332-F336 VanDerWaalsContact O-CE2 3.27Å; R332-F336 WeakPolarHBondContact O-CE2 3.22Å; L334-F336 PolarHBondContact O-N 3.24Å
337L35.6Very low38.9Very low63 Ų63117 Ų11733%0.3368%0.678SS.*G310 helixtrans-99.63.8-178.6-69.1174.6000114.4K136 L334 A335K136-L337 HydrophobicContact CD-CD2 3.62Å; K136-L337 HydrophobicContact CG-CD2 4.07Å; L334-L337 PolarHBondContact O-N 3.5Å; A335-L337 VanDerWaalsContact C-N 3.3Å; A335-L337 PolarHBondContact O-N 3.05Å
338Q38.3Very low38.4Very low164 Ų164116 Ų11677%0.76668%0.682SS**SBendtrans-96.1128.5179-161.6165.4-7.400110.5
339P37.1Very low37.8Very low105 Ų105115.8 Ų115.868%0.68268%0.682SS**PPolyproline II helixtrans-70.5149.6176.628.3-31.8000111
340P40.3Very low37.1Very low117 Ų117116 Ų11676%0.7669%0.689SS**PPolyproline II helixtrans-72140.5179.230.2-32.7000110.5
341P37.4Very low36.3Very low124 Ų124120.3 Ų120.381%0.80570%0.703SS**PPolyproline II helixtrans-69.6147.1162.728.9-28.9000109.6
342G33Very low35.8Very low80 Ų80120.1 Ų120.183%0.82571%0.711SS**PPolyproline II helixtrans-56.8162.5-169.300000116.5
343G31.2Very low35Very low79 Ų79115 Ų11581%0.81470%0.703SS**PPolyproline II helixtrans-72.3161.9-15900000117.5
344V29.2Very low34.3Very low139 Ų139123 Ų12384%0.84272%0.724SS**  trans-140.4123.2146.1-176.20000107
345C32.3Very low33.9Very low114 Ų114127.4 Ų127.477%0.7774%0.743SS**  trans-78.3124175177.30000109.4
346L29Very low33Very low165 Ų165135.1 Ų135.186%0.86476%0.757SS**  trans-143.1125.5158.7-74.2177.8000109.9
347Q32.6Very low32.3Very low179 Ų179133.7 Ų133.784%0.83677%0.77SS**  trans-70.1163.7178.9-88.3-167.4-10.800113.5
348P32Very low32.1Very low115 Ų115136.9 Ų136.975%0.74779%0.792SS**  trans-97.1158.7-175.337.4-31.5000113.6
349P32.7Very low31.8Very low115 Ų115133.3 Ų133.375%0.74779%0.791SS**  trans-116.8126.3153.131.7-18.1000113.2
350T29.7Very low32.1Very low129 Ų129134.2 Ų134.279%0.79180%0.796SS**  trans32116.5134.559.60000121.6
351H30.6Very low32Very low179 Ų179137.3 Ų137.383%0.82980%0.801SS**  39.2110.4123.4-149.4-94.9000119
352S30Very low32.4Very low103 Ų103136.7 Ų136.772%0.7280%0.797SS**  trans-150.6118.914741.30000111.9
353S29.2Very low33.1Very low80 Ų80138.5 Ų138.556%0.55979%0.794SS**  trans-71.5139171.656.70000111.2
354W28.1Very low33.3Very low249 Ų249140.2 Ų140.294%0.94379%0.794SS**  trans-115.6115.6159.6-7794.2000110.1
355Q31.4Very low33.7Very low175 Ų175139.2 Ų139.282%0.81879%0.793SS**PPolyproline II helixtrans-76.6151.1-176-71.8173.9-6.700111.9
356R28.5Very low34.5Very low231 Ų231139.7 Ų139.787%0.87280%0.795SS**PPolyproline II helixtrans-68.4123.7174.5179.9-176.9-66.5168.8-2.3110.7
357A29.6Very low35Very low103 Ų103137 Ų13785%0.85180%0.796SS**PPolyproline II helixtrans-76.7134.6170.100000110.9
358T32.3Very low35.2Very low130 Ų130132.3 Ų132.380%0.79880%0.796SS**  trans-136.2141.1174.2-43.30000108.8
359A31.7Very low35.4Very low89 Ų89134.6 Ų134.674%0.73680%0.802SS**  trans154.2163.1141.800000111.4
360P44Very low35.7Very low123 Ų123134.7 Ų134.780%0.79981%0.805SS**  cis-132.9170.5-14.322.41.6000114.8
361Q38.3Very low35.9Very low183 Ų183132.3 Ų132.386%0.85581%0.806SS**  trans-116.7152.9162.1-83-85.4-18.500109.6
362P44.9Very low36.3Very low110 Ų110129.2 Ų129.271%0.71481%0.805SS**  trans-95.4173.9178.838.3-31.7000114.1
363P48.5Very low36.4Very low119 Ų119133 Ų13377%0.77381%0.808SS**  trans-114.9-173.7-141.443.3-36.1000116.8
364S34.5Very low36.7Very low115 Ų115135 Ų13580%0.80481%0.813SS**  trans101.4136.317072.10000115.1
365S38.2Very low37.2Very low117 Ų117127.9 Ų127.982%0.81880%0.801SS**  cis-165.5174.62.5-103.80000108.6
366P49.1Very low37.6Very low125 Ų125126.4 Ų126.481%0.81280%0.799SS**  trans-103155.7-150.238.6-33.4000116.1
367A38.6Very low38.2Very low109 Ų109121.1 Ų121.190%0.90179%0.792SS**  trans-147.3135.1157.100000105.9
368G36.8Very low39.1Very low80 Ų80121.3 Ų121.383%0.82579%0.787SS**  cis150.4107.216.700000103.2
369D35.7Very low39.4Very low163 Ų163126 Ų12687%0.87281%0.807SS**  trans-80.2156.9-167.7-155.80.6000112.5
370S40.9Very low39.8Very low117 Ų117127.9 Ų127.982%0.81881%0.811SS**  trans-80.3137.5-171.5-57.30000112.4
371G32.7Very low39.6Very low79 Ų79128.2 Ų128.281%0.81481%0.812SS**  trans-143.1118.2170.300000111
372S39.5Very low39.7Very low114 Ų114125.1 Ų125.180%0.79781%0.809SS**  trans-84.3142.8178.9-179.20000111.7
373F32.8Very low39.4Very low181 Ų181126 Ų12679%0.79482%0.815SS**  trans-176129.2139.5-125.2-108.2000112.1
374N35.6Very low38.8Very low124 Ų124126.4 Ų126.466%0.66382%0.817SS**  trans29.8145.6142.4-59.5-9.5000120
375S38.3Very low39.1Very low98 Ų98127.2 Ų127.269%0.68582%0.818SS**  cis178.9160.93121.60000109
376D38.3Very low39.2Very low145 Ų145127.9 Ų127.978%0.77582%0.818SS**  trans74.5122.3141.3-91.2-46.5000124.1
377V41.9Very low38.4Very low119 Ų119128.2 Ų128.272%0.72182%0.819SS**  73.6127125.4127.30000121.8
378S48.5Very low38.4Very low107 Ų107129.8 Ų129.875%0.74881%0.812SS**  trans60134.8151-53.10000117.6
379N39.8Very low38.5Very low230 Ų230134.3 Ų134.3100%1.2381%0.811SS**  cis-164.9040.7-170.136.8000108.6

Retrieved 379 of 379 residues in 203.7 ms (Link to these results)