A0A087XIP7_POEFO Loading...

V-maf avian musculoaponeurotic fibrosarcoma oncogene homolog F

AlphaFold DB (A0A3B3V389), UniProt , Accession A0A087XIP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 158 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
1M40.9Very low49.3Very low245 Ų245171.8 Ų171.8100%1.20788%0.884SS**  095.80-72.9-66.6166.400107.7
2T44.7Very low49.6Very low138 Ų138167.9 Ų167.985%0.84787%0.874SS**  trans-86.5132179.644.80000110
3T47.3Very low49.9Very low144 Ų144170.1 Ų170.188%0.88387%0.872SS**  trans-136.8109.4161.747.60000110.8
4E43.8Very low50.1Low179 Ų179171.1 Ų171.184%0.83687%0.871SS**  trans-62.7144.2171.1-60.9-162.7141.200111.6
5R49.9Very low49.6Very low252 Ų252171.2 Ų171.295%0.95187%0.867SS**  trans-114.4104.6162.5-101.6179175.1173.8-0.4109.1
6S48.8Very low49.1Very low103 Ų103169.4 Ų169.472%0.7287%0.873SS**  trans-59.9135.6179.9-500000112.8
7N47.4Very low49.1Very low161 Ų161163.3 Ų163.386%0.86186%0.862SS**  trans-63.2127.1170.5-67.9-69.6000110.8A9N7-A9 PolarHBondContact O-N 3.14Å
8K54.5Low48.8Very low203 Ų203164.2 Ų164.288%0.88386%0.86SS**  trans-79.9102.8171.1-69.6-175.6-178.9-177.80109L10K8-L10 PolarHBondContact O-N 3.21Å
9A54.8Low48.6Very low95 Ų95163.1 Ų163.179%0.78586%0.855SS**  trans-65.8111.1169.100000109.7N7 K11N7-A9 PolarHBondContact O-N 3.14Å; A9-K11 PolarHBondContact O-N 3.27Å; A9-K11 VanDerWaalsContact O-N 3.14Å
10L54.8Low48.8Very low165 Ų165159.8 Ų159.886%0.86484%0.842SS**  trans-65.9108.9165.4-72.6166.8000107.4K8 V12K8-L10 PolarHBondContact O-N 3.21Å; L10-V12 PolarHBondContact O-N 3.35Å
11K55Low49.3Very low205 Ų205154.4 Ų154.489%0.89182%0.816SS**  trans-71.595.8175.4-159.6157.6-178.1171.50107.5A9 K13A9-K11 PolarHBondContact O-N 3.27Å; A9-K11 VanDerWaalsContact O-N 3.14Å; K11-K13 PolarHBondContact O-N 3.38Å; K11-K13 VanDerWaalsContact O-N 3.16Å
12V52.8Low50.7Low125 Ų125152.7 Ų152.776%0.75880%0.803SS**  trans-52.2118.4170.8174.30000107.4L10 Q14L10-V12 PolarHBondContact O-N 3.35Å; V12-Q14 PolarHBondContact O-N 2.99Å
13K54.1Low52.7Low196 Ų196146.9 Ų146.985%0.85277%0.766SS**  trans-64.2119.5178.5-128.3174175.5177.70107.1K11 E15K11-K13 PolarHBondContact O-N 3.38Å; K11-K13 VanDerWaalsContact O-N 3.16Å; K13-E15 PolarHBondContact O-N 3.3Å
14Q52.1Low54.9Low184 Ų184142.1 Ų142.186%0.8674%0.739SS**  trans-42.4124.9177.9-167165.317.900111.8V12 C16V12-Q14 PolarHBondContact O-N 2.99Å; Q14-C16 PolarHBondContact O-N 3.04Å
15E43.3Very low57.3Low173 Ų173136.6 Ų136.681%0.80872%0.715SS**  trans-56.5111.3175.7-63.1-83.3142.700109.9K13 G17K13-E15 PolarHBondContact O-N 3.3Å; E15-G17 VanDerWaalsContact C-N 3.34Å; E15-G17 PolarHBondContact O-N 3.46Å; E15-G17 VanDerWaalsContact O-N 3.1Å
16C41.3Very low59.4Low142 Ų142129 Ų12996%0.95970%0.7SS**  trans-77.585.7167-970000108.5Q14Q14-C16 PolarHBondContact O-N 3.04Å
17G48.8Very low61.6Low66 Ų66128.7 Ų128.768%0.6869%0.688SS**  trans-118.7-1.4179.500000115.9E15E15-G17 VanDerWaalsContact C-N 3.34Å; E15-G17 PolarHBondContact O-N 3.46Å; E15-G17 VanDerWaalsContact O-N 3.1Å
18E44.5Very low63.9Low180 Ų180121 Ų12184%0.84165%0.647SS**  trans-142.366.8-172.3-71.1-174141.900111.8
19N44.8Very low65.9Low143 Ų143115.2 Ų115.277%0.76562%0.623SS**  trans-152.568159.6-91.4-71.6000107.9P21N19-P21 WeakPolarHBondContact O-CD 3.38Å
20V52.9Low67.9Low96 Ų96115 Ų11558%0.58262%0.616SS**  trans-67108.4149178.20000104F22 E47V20-F22 PolarHBondContact O-N 3.39Å; V20-F22 VanDerWaalsContact O-N 3.09Å; V20-E47 HydrophobicContact CG2-CG 4.47Å; V20-E47 WeakPolarHBondContact CG2-OE1 3.41Å
21P59.2Low69.9Low47 Ų47108.1 Ų108.131%0.30558%0.58SS.*  trans-59.3125.6179-17.132.1000106.3N19 L23N19-P21 WeakPolarHBondContact O-CD 3.38Å; P21-L23 HydrophobicContact CB-CD1 4.31Å; P21-L23 HydrophobicContact CB-CG 4.18Å; P21-L23 PolarHBondContact O-N 2.62Å
22F69.8Low71.9Confident210 Ų210100.7 Ų100.792%0.92155%0.554SS**  trans-69.672.6176.3-161.1-90.7000108.4V20V20-F22 PolarHBondContact O-N 3.39Å; V20-F22 VanDerWaalsContact O-N 3.09Å
23L85.9Confident74Confident15 Ų1599.5 Ų99.58%0.07955%0.547CS..  trans-76.1122179.3-80.7158.2000108.3P21 E27 L31 H39 L51 R54P21-L23 HydrophobicContact CB-CD1 4.31Å; P21-L23 HydrophobicContact CB-CG 4.18Å; P21-L23 PolarHBondContact O-N 2.62Å; L23-E27 HydrophobicContact CD2-CB 4.4Å; L23-L31 HydrophobicContact CD2-CD1 4.33Å; L23-H39 HydrophobicContact CD1-CB 4.45Å; L23-L51 HydrophobicContact CD1-CD1 4.3Å; L23-L51 HydrophobicContact CD1-CD2 3.97Å; L23-R54 PolarHBondContact O-NH1 3.34Å; L23-R54 PolarHBondContact O-NH2 2.92Å
24S93.8Very high76.1Confident44 Ų44100.6 Ų100.631%0.30855%0.546SS..  trans-66157.717369.60000110.9S26 E27 L28S24-S26 PolarHBondContact O-N 3.28Å; S24-E27 VanDerWaalsContact CB-OE2 3.32Å; S24-E27 WeakPolarHBondContact CB-OE2 3.38Å; S24-E27 PolarHBondContact N-OE2 3.16Å; S24-E27 PolarHBondContact O-N 3.24Å; S24-E27 WeakPolarHBondContact OG-CB 3.18Å; S24-E27 VanDerWaalsContact OG-CG 3.22Å; S24-E27 WeakPolarHBondContact OG-CG 3.31Å; S24-E27 PolarHBondContact OG-N 3.38Å; S24-E27 PolarHBondContact OG-OE2 3.41Å; S24-L28 VanDerWaalsContact O-CB 3.31Å; S24-L28 WeakPolarHBondContact O-CB 3.27Å; S24-L28 PolarHBondContact O-N 3.44Å
25D94.7Very high78.2Confident64 Ų6496.3 Ų96.334%0.34253%0.526SS..Hα-helixtrans-58.5-38.9175.9-81.7-6.4000111.2M29 R54 L58D25-M29 VanDerWaalsContact O-CG 3.28Å; D25-M29 WeakPolarHBondContact O-CG 3.36Å; D25-M29 PolarHBondContact O-N 3.39Å; D25-R54 IonicContact OD1-CZ 2.62Å; D25-R54 IonicContact OD1-NE 2.84Å; D25-R54 PolarHBondContact OD1-NE 3.34Å; D25-R54 IonicContact OD1-NH2 3.96Å; D25-R54 PolarHBondContact OD1-NH2 2.99Å; D25-L58 HydrophobicContact CB-CD1 3.79Å; D25-L58 HydrophobicContact CB-CD2 4.01Å; D25-L58 WeakPolarHBondContact OD1-CD1 3.47Å; D25-L58 WeakPolarHBondContact OD2-CD2 3.29Å
26S94.3Very high80.7Confident91 Ų9188.7 Ų88.764%0.63649%0.49SS*.Hα-helixtrans-63.9-51-179.7-173.80000111.7S24 L28 M29 S30S24-S26 PolarHBondContact O-N 3.28Å; S26-L28 PolarHBondContact O-N 3.26Å; S26-M29 PolarHBondContact O-N 3.48Å; S26-S30 PolarHBondContact O-N 2.99Å; S26-S30 VanDerWaalsContact O-N 3.09Å; S26-S30 PolarHBondContact O-OG 2.86Å
27E95.8Very high83.3Confident98 Ų9885.7 Ų85.746%0.45847%0.465SS..Hα-helixtrans-61.6-46.1176.8-69.5161.914200110.9L23 S24 M29 S30 L31L23-E27 HydrophobicContact CD2-CB 4.4Å; S24-E27 VanDerWaalsContact CB-OE2 3.32Å; S24-E27 WeakPolarHBondContact CB-OE2 3.38Å; S24-E27 PolarHBondContact N-OE2 3.16Å; S24-E27 PolarHBondContact O-N 3.24Å; S24-E27 WeakPolarHBondContact OG-CB 3.18Å; S24-E27 VanDerWaalsContact OG-CG 3.22Å; S24-E27 WeakPolarHBondContact OG-CG 3.31Å; S24-E27 PolarHBondContact OG-N 3.38Å; S24-E27 PolarHBondContact OG-OE2 3.41Å; E27-M29 PolarHBondContact O-N 3Å; E27-S30 WeakPolarHBondContact CA-OG 3.4Å; E27-S30 PolarHBondContact O-N 2.91Å; E27-S30 PolarHBondContact O-OG 3.38Å; E27-L31 WeakPolarHBondContact O-CG 3.27Å; E27-L31 PolarHBondContact O-N 3.19Å
28L95.9Very high85.5Confident0 Ų087.9 Ų87.90%046%0.46CS..Hα-helixtrans-60.3-33.6-179.7-17759.2000112.7S24 S26 L31 L36 L51 R54 R55 L58S24-L28 VanDerWaalsContact O-CB 3.31Å; S24-L28 WeakPolarHBondContact O-CB 3.27Å; S24-L28 PolarHBondContact O-N 3.44Å; S26-L28 PolarHBondContact O-N 3.26Å; L28-L31 HydrophobicContact CD1-CD1 4.49Å; L28-L36 HydrophobicContact CD1-CD1 3.84Å; L28-L51 HydrophobicContact CD1-CD1 3.92Å; L28-L51 HydrophobicContact CD1-CD2 4.34Å; L28-L51 HydrophobicContact CD1-CG 3.93Å; L28-L51 HydrophobicContact CD2-CD1 3.78Å; L28-L51 HydrophobicContact CD2-CG 4.4Å; L28-R54 HydrophobicContact CD2-CB 4.2Å; L28-R54 HydrophobicContact CD2-CG 3.9Å; L28-R55 HydrophobicContact CD1-CB 4.1Å; L28-R55 HydrophobicContact CD1-CG 4.31Å; L28-R55 HydrophobicContact CD2-CB 4.05Å; L28-R55 HydrophobicContact CG-CB 3.88Å; L28-R55 HydrophobicContact CG-CG 4.09Å; L28-R55 WeakPolarHBondContact O-CD 3.31Å; L28-R55 PolarHBondContact O-NE 2.85Å; L28-L58 HydrophobicContact CD2-CD1 4.17Å
29M96.3Very high87.7Confident80 Ų8082.6 Ų82.639%0.39444%0.436SS..Hα-helixtrans-69.8-42.8174.2-75.7179.264.800112.1D25 S26 E27 R55 L58D25-M29 VanDerWaalsContact O-CG 3.28Å; D25-M29 WeakPolarHBondContact O-CG 3.36Å; D25-M29 PolarHBondContact O-N 3.39Å; S26-M29 PolarHBondContact O-N 3.48Å; E27-M29 PolarHBondContact O-N 3Å; M29-R55 PolarHBondContact O-NH2 3.38Å; M29-L58 HydrophobicContact CG-CB 3.64Å; M29-L58 HydrophobicContact CG-CD1 4.04Å; M29-L58 HydrophobicContact CG-CG 4.42Å; M29-L58 HydrophobicContact SD-CB 3.78Å
30S96.5Very high90.1Very high90 Ų9076.4 Ų76.463%0.62940%0.402SS*.Hα-helixtrans-76.2-28.5-173680000114.3S26 E27 S32S26-S30 PolarHBondContact O-N 2.99Å; S26-S30 VanDerWaalsContact O-N 3.09Å; S26-S30 PolarHBondContact O-OG 2.86Å; E27-S30 WeakPolarHBondContact CA-OG 3.4Å; E27-S30 PolarHBondContact O-N 2.91Å; E27-S30 PolarHBondContact O-OG 3.38Å; S30-S32 PolarHBondContact O-N 2.83Å
31L96.9Very high92.1Very high21 Ų2181.3 Ų81.311%0.1141%0.41CS..SBendtrans-50.7136178.9-71.5172.6000111.7L23 E27 L28 E35 L36 R55L23-L31 HydrophobicContact CD2-CD1 4.33Å; E27-L31 WeakPolarHBondContact O-CG 3.27Å; E27-L31 PolarHBondContact O-N 3.19Å; L28-L31 HydrophobicContact CD1-CD1 4.49Å; L31-E35 HydrophobicContact CB-CB 4.38Å; L31-E35 HydrophobicContact CD2-CB 3.68Å; L31-L36 HydrophobicContact CB-CB 4.44Å; L31-L36 HydrophobicContact CD1-CB 4.5Å; L31-L36 HydrophobicContact CD1-CD1 4.35Å; L31-R55 PolarHBondContact O-NH1 3.06Å; L31-R55 PolarHBondContact O-NH2 3.25Å
32S97Very high93.6Very high50 Ų5083.2 Ų83.235%0.3544%0.438SS..  trans-63.3172.1163.8670000111.2S30 R34 E35 L36 R55S30-S32 PolarHBondContact O-N 2.83Å; S32-R34 VanDerWaalsContact C-N 3.27Å; S32-R34 PolarHBondContact O-N 2.87Å; S32-E35 WeakPolarHBondContact CB-OE2 3.38Å; S32-E35 PolarHBondContact N-OE2 3.19Å; S32-E35 VanDerWaalsContact OG-CD 3.22Å; S32-E35 VanDerWaalsContact OG-CG 3.29Å; S32-E35 WeakPolarHBondContact OG-CG 3.19Å; S32-E35 PolarHBondContact OG-N 3.1Å; S32-E35 VanDerWaalsContact OG-N 3.12Å; S32-E35 PolarHBondContact OG-OE2 3.16Å; S32-L36 WeakPolarHBondContact O-CB 3.5Å; S32-L36 PolarHBondContact O-N 3.47Å; S32-R55 PolarHBondContact O-NH1 3.16Å
33V96.4Very high94.7Very high100 Ų10074.7 Ų74.761%0.60640%0.402SS*.Hα-helixtrans-63.7-38.2172.91770000110.5N37V33-N37 WeakPolarHBondContact O-CB 3.43Å; V33-N37 PolarHBondContact O-N 3.17Å; V33-N37 PolarHBondContact O-ND2 3.39Å
34R97.6Very high95.2Very high218 Ų21876.3 Ų76.382%0.82342%0.415SS*.Hα-helixtrans-64.1-47.9178.9-177-179.8174.2-173.5-1.8111.6S32 N37 L38S32-R34 VanDerWaalsContact C-N 3.27Å; S32-R34 PolarHBondContact O-N 2.87Å; R34-N37 PolarHBondContact O-N 3.37Å; R34-L38 PolarHBondContact O-N 3.31Å; R34-L38 VanDerWaalsContact O-N 3.08Å
35E96.5Very high95.3Very high95 Ų9582.4 Ų82.444%0.44443%0.431SS..Hα-helixtrans-69.2-38-179.5-64.3155146.200111.5L31 S32 N37 L38 H39L31-E35 HydrophobicContact CB-CB 4.38Å; L31-E35 HydrophobicContact CD2-CB 3.68Å; S32-E35 WeakPolarHBondContact CB-OE2 3.38Å; S32-E35 PolarHBondContact N-OE2 3.19Å; S32-E35 VanDerWaalsContact OG-CD 3.22Å; S32-E35 VanDerWaalsContact OG-CG 3.29Å; S32-E35 WeakPolarHBondContact OG-CG 3.19Å; S32-E35 PolarHBondContact OG-N 3.1Å; S32-E35 VanDerWaalsContact OG-N 3.12Å; S32-E35 PolarHBondContact OG-OE2 3.16Å; E35-N37 VanDerWaalsContact C-N 3.33Å; E35-N37 PolarHBondContact O-N 2.92Å; E35-L38 WeakPolarHBondContact O-CB 3.48Å; E35-L38 PolarHBondContact O-N 2.99Å; E35-H39 PolarHBondContact O-N 3.41Å; E35-H39 VanDerWaalsContact O-N 3.15Å; E35-H39 PolarHBondContact O-ND1 2.98Å
36L95.6Very high95.3Very high12 Ų1284.3 Ų84.36%0.06344%0.438CS..Hα-helixtrans-58.2-48171.1176.668.5000110.6L28 L31 S32 L38 H39 L40 L51 R55L28-L36 HydrophobicContact CD1-CD1 3.84Å; L31-L36 HydrophobicContact CB-CB 4.44Å; L31-L36 HydrophobicContact CD1-CB 4.5Å; L31-L36 HydrophobicContact CD1-CD1 4.35Å; S32-L36 WeakPolarHBondContact O-CB 3.5Å; S32-L36 PolarHBondContact O-N 3.47Å; L36-L38 PolarHBondContact O-N 3.43Å; L36-H39 PolarHBondContact O-N 2.99Å; L36-L40 HydrophobicContact CD1-CD2 4.47Å; L36-L40 HydrophobicContact CD1-CG 4.32Å; L36-L40 HydrophobicContact CD2-CD1 4.43Å; L36-L40 HydrophobicContact CG-CD1 4.02Å; L36-L40 HydrophobicContact CG-CG 4.23Å; L36-L40 VanDerWaalsContact O-CG 3.28Å; L36-L40 WeakPolarHBondContact O-CG 3.47Å; L36-L40 PolarHBondContact O-N 3.39Å; L36-L51 HydrophobicContact CD1-CD2 4.03Å; L36-R55 VanDerWaalsContact CD2-NH1 3.34Å
37N95.9Very high95.3Very high79 Ų7983 Ų8342%0.42242%0.422SS..Hα-helixtrans-62.5-26.7179.8-74.4-24.9000113.2V33 R34 E35 R41V33-N37 WeakPolarHBondContact O-CB 3.43Å; V33-N37 PolarHBondContact O-N 3.17Å; V33-N37 PolarHBondContact O-ND2 3.39Å; R34-N37 PolarHBondContact O-N 3.37Å; E35-N37 VanDerWaalsContact C-N 3.33Å; E35-N37 PolarHBondContact O-N 2.92Å; N37-R41 WeakPolarHBondContact O-CG 3.28Å
38L94.8Very high95.2Very high112 Ų11280.3 Ų80.359%0.58641%0.41SS*.Hα-helixtrans-67.9-46.5171.3-174.963.9000111.1R34 E35 L36 L40 R41R34-L38 PolarHBondContact O-N 3.31Å; R34-L38 VanDerWaalsContact O-N 3.08Å; E35-L38 WeakPolarHBondContact O-CB 3.48Å; E35-L38 PolarHBondContact O-N 2.99Å; L36-L38 PolarHBondContact O-N 3.43Å; L38-L40 PolarHBondContact O-N 2.93Å; L38-R41 WeakPolarHBondContact O-CB 3.4Å; L38-R41 PolarHBondContact O-N 3.35Å
39H92.1Very high95.3Very high70 Ų7085.3 Ų85.332%0.32443%0.434SS..Hα-helixtrans-66.1-22.5177.1-71.180.9000113.5L23 E35 L36 R41L23-H39 HydrophobicContact CD1-CB 4.45Å; E35-H39 PolarHBondContact O-N 3.41Å; E35-H39 VanDerWaalsContact O-N 3.15Å; E35-H39 PolarHBondContact O-ND1 2.98Å; L36-H39 PolarHBondContact O-N 2.99Å; H39-R41 VanDerWaalsContact C-N 3.32Å
40L94.6Very high95.2Very high13 Ų1389 Ų897%0.06845%0.447CS..THydrogen-bonded Turntrans-80.1-10.7176.8-66.6176.8000113.5L36 L38 L43 I48 L51 K52L36-L40 HydrophobicContact CD1-CD2 4.47Å; L36-L40 HydrophobicContact CD1-CG 4.32Å; L36-L40 HydrophobicContact CD2-CD1 4.43Å; L36-L40 HydrophobicContact CG-CD1 4.02Å; L36-L40 HydrophobicContact CG-CG 4.23Å; L36-L40 VanDerWaalsContact O-CG 3.28Å; L36-L40 WeakPolarHBondContact O-CG 3.47Å; L36-L40 PolarHBondContact O-N 3.39Å; L38-L40 PolarHBondContact O-N 2.93Å; L40-L43 HydrophobicContact CD2-CD1 4.3Å; L40-L43 PolarHBondContact O-N 3.24Å; L40-I48 HydrophobicContact CB-CG1 4.37Å; L40-I48 HydrophobicContact CD1-CG2 4.26Å; L40-I48 HydrophobicContact CD2-CB 4.31Å; L40-I48 HydrophobicContact CD2-CG1 4.09Å; L40-I48 HydrophobicContact CD2-CG2 4.16Å; L40-L51 HydrophobicContact CD2-CB 4.3Å; L40-L51 HydrophobicContact CD2-CD2 3.71Å; L40-K52 HydrophobicContact CD1-CG 4.47Å
41R94.6Very high95.2Very high198 Ų19885.7 Ų85.775%0.74742%0.422SS*.THydrogen-bonded Turntrans-69.5133.8-179-66.1-173.4-178.4-133.9-0.5110.3N37 L38 H39 L43N37-R41 WeakPolarHBondContact O-CG 3.28Å; L38-R41 WeakPolarHBondContact O-CB 3.4Å; L38-R41 PolarHBondContact O-N 3.35Å; H39-R41 VanDerWaalsContact C-N 3.32Å; R41-L43 PolarHBondContact O-N 2.89Å
42G91.2Very high95.2Very high87 Ų8789.8 Ų89.890%0.89744%0.439SS*.THydrogen-bonded Turntrans80.2-3.2178.400000114.9
43L93.4Very high95.2Very high31 Ų3192.3 Ų92.316%0.16245%0.446CS..  trans-81.1151.7171.9-61.2-174.1000111.4L40 R41 E47 I48L40-L43 HydrophobicContact CD2-CD1 4.3Å; L40-L43 PolarHBondContact O-N 3.24Å; R41-L43 PolarHBondContact O-N 2.89Å; L43-E47 HydrophobicContact CB-CB 4.16Å; L43-I48 HydrophobicContact CB-CD1 4.5Å; L43-I48 HydrophobicContact CB-CG1 3.91Å
44S95.6Very high95.2Very high49 Ų4992 Ų9234%0.34343%0.434SS..  trans-66161.3171.266.40000111.7E46 E47 I48S44-E46 PolarHBondContact O-N 2.84Å; S44-E47 VanDerWaalsContact CB-OE2 3.31Å; S44-E47 WeakPolarHBondContact CB-OE2 3.36Å; S44-E47 PolarHBondContact N-OE2 3.24Å; S44-E47 PolarHBondContact O-N 2.84Å; S44-E47 WeakPolarHBondContact OG-CB 3.32Å; S44-E47 WeakPolarHBondContact OG-CG 3.11Å; S44-E47 PolarHBondContact OG-N 3.09Å; S44-E47 PolarHBondContact OG-OE2 3.42Å; S44-I48 VanDerWaalsContact O-CG1 3.27Å; S44-I48 WeakPolarHBondContact O-CG1 3.4Å; S44-I48 PolarHBondContact O-N 2.96Å
45R95.8Very high95.2Very high173 Ų17382.5 Ų82.565%0.65340%0.398SS*.Hα-helixtrans-59.3-39.6-180-177.3176179.8-1225.1111.6I48 Q49R45-I48 PolarHBondContact O-N 2.94Å; R45-Q49 WeakPolarHBondContact O-CG 3.38Å; R45-Q49 PolarHBondContact O-N 3.46Å
46E95.5Very high95.3Very high104 Ų10485.7 Ų85.749%0.48641%0.406SS..Hα-helixtrans-67.3-42.2-178.9-66.962.8-136.600110.8S44 Q49 K50S44-E46 PolarHBondContact O-N 2.84Å; E46-Q49 PolarHBondContact O-N 2.62Å; E46-K50 WeakPolarHBondContact O-CG 3.47Å; E46-K50 PolarHBondContact O-N 2.91Å
47E93Very high95.4Very high62 Ų6288.3 Ų88.329%0.2942%0.422SS..Hα-helixtrans-66-42.5175.6-71165.2138.400111.9V20 L43 S44 Q49 K50 L51V20-E47 HydrophobicContact CG2-CG 4.47Å; V20-E47 WeakPolarHBondContact CG2-OE1 3.41Å; L43-E47 HydrophobicContact CB-CB 4.16Å; S44-E47 VanDerWaalsContact CB-OE2 3.31Å; S44-E47 WeakPolarHBondContact CB-OE2 3.36Å; S44-E47 PolarHBondContact N-OE2 3.24Å; S44-E47 PolarHBondContact O-N 2.84Å; S44-E47 WeakPolarHBondContact OG-CB 3.32Å; S44-E47 WeakPolarHBondContact OG-CG 3.11Å; S44-E47 PolarHBondContact OG-N 3.09Å; S44-E47 PolarHBondContact OG-OE2 3.42Å; E47-Q49 VanDerWaalsContact C-N 3.3Å; E47-Q49 PolarHBondContact O-N 3.08Å; E47-K50 PolarHBondContact O-N 3.18Å; E47-L51 PolarHBondContact O-N 2.7Å
48I94.9Very high95.5Very high43 Ų4385 Ų8522%0.22140%0.404CS..Hα-helixtrans-58-45.1175.1-68168000110.5L40 L43 S44 R45 L51 K52L40-I48 HydrophobicContact CB-CG1 4.37Å; L40-I48 HydrophobicContact CD1-CG2 4.26Å; L40-I48 HydrophobicContact CD2-CB 4.31Å; L40-I48 HydrophobicContact CD2-CG1 4.09Å; L40-I48 HydrophobicContact CD2-CG2 4.16Å; L43-I48 HydrophobicContact CB-CD1 4.5Å; L43-I48 HydrophobicContact CB-CG1 3.91Å; S44-I48 VanDerWaalsContact O-CG1 3.27Å; S44-I48 WeakPolarHBondContact O-CG1 3.4Å; S44-I48 PolarHBondContact O-N 2.96Å; R45-I48 PolarHBondContact O-N 2.94Å; I48-L51 PolarHBondContact O-N 3.27Å; I48-K52 HydrophobicContact CG2-CD 4.05Å; I48-K52 WeakPolarHBondContact O-CB 3.41Å; I48-K52 WeakPolarHBondContact O-CG 3.27Å; I48-K52 PolarHBondContact O-N 3.46Å
49Q96.8Very high95.6Very high105 Ų10582.9 Ų82.949%0.49139%0.391SS..Hα-helixtrans-63.1-46.6177.7-74.9-179.54.200111.7R45 E46 E47 L51 K52 Q53R45-Q49 WeakPolarHBondContact O-CG 3.38Å; R45-Q49 PolarHBondContact O-N 3.46Å; E46-Q49 PolarHBondContact O-N 2.62Å; E47-Q49 VanDerWaalsContact C-N 3.3Å; E47-Q49 PolarHBondContact O-N 3.08Å; Q49-L51 PolarHBondContact O-N 3.22Å; Q49-K52 PolarHBondContact O-N 3.19Å; Q49-Q53 VanDerWaalsContact O-CB 3.27Å; Q49-Q53 WeakPolarHBondContact O-CB 3.44Å; Q49-Q53 PolarHBondContact O-N 3.04Å
50K95.1Very high95.9Very high157 Ų15783.4 Ų83.468%0.68340%0.396SS*.Hα-helixtrans-57.7-46.5176.7-75.1175.5-177.8175.50111.7E46 E47 Q53 R54E46-K50 WeakPolarHBondContact O-CG 3.47Å; E46-K50 PolarHBondContact O-N 2.91Å; E47-K50 PolarHBondContact O-N 3.18Å; K50-Q53 PolarHBondContact O-N 2.8Å; K50-R54 WeakPolarHBondContact O-CB 3.5Å; K50-R54 PolarHBondContact O-N 3.3Å
51L95.4Very high96.1Very high20 Ų2090.4 Ų90.411%0.10542%0.422CS..Hα-helixtrans-68.3-41.9-177.9-164.967.3000111.9L23 L28 L36 L40 E47 I48 Q49 R54 R55L23-L51 HydrophobicContact CD1-CD1 4.3Å; L23-L51 HydrophobicContact CD1-CD2 3.97Å; L28-L51 HydrophobicContact CD1-CD1 3.92Å; L28-L51 HydrophobicContact CD1-CD2 4.34Å; L28-L51 HydrophobicContact CD1-CG 3.93Å; L28-L51 HydrophobicContact CD2-CD1 3.78Å; L28-L51 HydrophobicContact CD2-CG 4.4Å; L36-L51 HydrophobicContact CD1-CD2 4.03Å; L40-L51 HydrophobicContact CD2-CB 4.3Å; L40-L51 HydrophobicContact CD2-CD2 3.71Å; E47-L51 PolarHBondContact O-N 2.7Å; I48-L51 PolarHBondContact O-N 3.27Å; Q49-L51 PolarHBondContact O-N 3.22Å; L51-R54 PolarHBondContact O-N 3.15Å; L51-R55 WeakPolarHBondContact O-CB 3.28Å; L51-R55 PolarHBondContact O-N 3.33Å
52K96.5Very high96.2Very high107 Ų10782.3 Ų82.347%0.46540%0.399SS..Hα-helixtrans-63.1-43174.4-76.1-178.8177.7179.50111.9L40 I48 Q49 R55 R56L40-K52 HydrophobicContact CD1-CG 4.47Å; I48-K52 HydrophobicContact CG2-CD 4.05Å; I48-K52 WeakPolarHBondContact O-CB 3.41Å; I48-K52 WeakPolarHBondContact O-CG 3.27Å; I48-K52 PolarHBondContact O-N 3.46Å; Q49-K52 PolarHBondContact O-N 3.19Å; K52-R55 PolarHBondContact O-N 3Å; K52-R56 WeakPolarHBondContact O-CB 3.36Å; K52-R56 PolarHBondContact O-N 3.47Å
53Q97.6Very high96.5Very high104 Ų10485.1 Ų85.149%0.48638%0.384SS..Hα-helixtrans-65.1-45.8178-176.557.831.200111.2Q49 K50 R55 R56 T57Q49-Q53 VanDerWaalsContact O-CB 3.27Å; Q49-Q53 WeakPolarHBondContact O-CB 3.44Å; Q49-Q53 PolarHBondContact O-N 3.04Å; K50-Q53 PolarHBondContact O-N 2.8Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.05Å; Q53-R56 WeakPolarHBondContact O-CB 3.48Å; Q53-R56 PolarHBondContact O-N 2.98Å; Q53-T57 PolarHBondContact O-N 2.98Å; Q53-T57 PolarHBondContact O-OG1 3.45Å
54R96.8Very high96.8Very high93 Ų9385.8 Ų85.835%0.35139%0.394SS..Hα-helixtrans-56.2-48.6174.3-177.6176165.1-140.84.7110.8L23 D25 L28 K50 L51 R56 T57 L58L23-R54 PolarHBondContact O-NH1 3.34Å; L23-R54 PolarHBondContact O-NH2 2.92Å; D25-R54 IonicContact OD1-CZ 2.62Å; D25-R54 IonicContact OD1-NE 2.84Å; D25-R54 PolarHBondContact OD1-NE 3.34Å; D25-R54 IonicContact OD1-NH2 3.96Å; D25-R54 PolarHBondContact OD1-NH2 2.99Å; L28-R54 HydrophobicContact CD2-CB 4.2Å; L28-R54 HydrophobicContact CD2-CG 3.9Å; K50-R54 WeakPolarHBondContact O-CB 3.5Å; K50-R54 PolarHBondContact O-N 3.3Å; L51-R54 PolarHBondContact O-N 3.15Å; R54-R56 VanDerWaalsContact C-N 3.33Å; R54-R56 PolarHBondContact O-N 3.28Å; R54-T57 PolarHBondContact O-N 3.49Å; R54-L58 HydrophobicContact CG-CD1 4.2Å; R54-L58 VanDerWaalsContact O-CG 3.32Å; R54-L58 WeakPolarHBondContact O-CG 3.37Å; R54-L58 PolarHBondContact O-N 3.03Å
55R97.6Very high96.9Very high19 Ų1986 Ų867%0.07240%0.399CS..Hα-helixtrans-58.7-42.4176.8-170.8174.3-174.5-170.2-10.8112.7L28 M29 L31 S32 L36 L51 K52 Q53 L58 K59L28-R55 HydrophobicContact CD1-CB 4.1Å; L28-R55 HydrophobicContact CD1-CG 4.31Å; L28-R55 HydrophobicContact CD2-CB 4.05Å; L28-R55 HydrophobicContact CG-CB 3.88Å; L28-R55 HydrophobicContact CG-CG 4.09Å; L28-R55 WeakPolarHBondContact O-CD 3.31Å; L28-R55 PolarHBondContact O-NE 2.85Å; M29-R55 PolarHBondContact O-NH2 3.38Å; L31-R55 PolarHBondContact O-NH1 3.06Å; L31-R55 PolarHBondContact O-NH2 3.25Å; S32-R55 PolarHBondContact O-NH1 3.16Å; L36-R55 VanDerWaalsContact CD2-NH1 3.34Å; L51-R55 WeakPolarHBondContact O-CB 3.28Å; L51-R55 PolarHBondContact O-N 3.33Å; K52-R55 PolarHBondContact O-N 3Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.05Å; R55-L58 PolarHBondContact O-N 3.12Å; R55-K59 VanDerWaalsContact NH2-NZ 3.14Å; R55-K59 PolarHBondContact O-N 2.66Å
56R98.3Very high97Very high161 Ų16180.9 Ų80.961%0.60839%0.389SS*.Hα-helixtrans-62.3-46.9177-175.4179-174.6-177.80.8111.4K52 Q53 R54 L58 K59 N60K52-R56 WeakPolarHBondContact O-CB 3.36Å; K52-R56 PolarHBondContact O-N 3.47Å; Q53-R56 WeakPolarHBondContact O-CB 3.48Å; Q53-R56 PolarHBondContact O-N 2.98Å; R54-R56 VanDerWaalsContact C-N 3.33Å; R54-R56 PolarHBondContact O-N 3.28Å; R56-L58 VanDerWaalsContact C-N 3.31Å; R56-L58 PolarHBondContact O-N 3.49Å; R56-K59 PolarHBondContact O-N 3.04Å; R56-N60 WeakPolarHBondContact O-CB 3.34Å; R56-N60 VanDerWaalsContact O-CG 3.26Å; R56-N60 PolarHBondContact O-N 3.19Å
57T98.1Very high97.2Very high67 Ų6778.8 Ų78.841%0.41139%0.386SS..Hα-helixtrans-58.8-44177.1-61.10000111.4Q53 R54 N60 R61Q53-T57 PolarHBondContact O-N 2.98Å; Q53-T57 PolarHBondContact O-OG1 3.45Å; R54-T57 PolarHBondContact O-N 3.49Å; T57-N60 PolarHBondContact O-N 3.17Å; T57-R61 PolarHBondContact O-N 3.34Å
58L97.8Very high97.5Very high9 Ų984.4 Ų84.45%0.04740%0.404CS..Hα-helixtrans-64.2-45.8177.8-68.6172.7000112.7D25 L28 M29 R54 R55 R56 N60 R61 G62D25-L58 HydrophobicContact CB-CD1 3.79Å; D25-L58 HydrophobicContact CB-CD2 4.01Å; D25-L58 WeakPolarHBondContact OD1-CD1 3.47Å; D25-L58 WeakPolarHBondContact OD2-CD2 3.29Å; L28-L58 HydrophobicContact CD2-CD1 4.17Å; M29-L58 HydrophobicContact CG-CB 3.64Å; M29-L58 HydrophobicContact CG-CD1 4.04Å; M29-L58 HydrophobicContact CG-CG 4.42Å; M29-L58 HydrophobicContact SD-CB 3.78Å; R54-L58 HydrophobicContact CG-CD1 4.2Å; R54-L58 VanDerWaalsContact O-CG 3.32Å; R54-L58 WeakPolarHBondContact O-CG 3.37Å; R54-L58 PolarHBondContact O-N 3.03Å; R55-L58 PolarHBondContact O-N 3.12Å; R56-L58 VanDerWaalsContact C-N 3.31Å; R56-L58 PolarHBondContact O-N 3.49Å; L58-N60 PolarHBondContact O-N 2.55Å; L58-R61 WeakPolarHBondContact O-CB 3.32Å; L58-R61 PolarHBondContact O-N 3.43Å; L58-G62 PolarHBondContact O-N 2.72Å; L58-G62 VanDerWaalsContact O-N 3.16Å
59K97.9Very high97.6Very high68 Ų6887.3 Ų87.330%0.29642%0.424SS..Hα-helixtrans-61.8-42.9175-76.7-170.3172.6-174.10112.1R55 R56 R61 G62 Y63R55-K59 VanDerWaalsContact NH2-NZ 3.14Å; R55-K59 PolarHBondContact O-N 2.66Å; R56-K59 PolarHBondContact O-N 3.04Å; K59-R61 VanDerWaalsContact C-N 3.28Å; K59-R61 PolarHBondContact O-N 3.39Å; K59-G62 CarbonylContact O-C 3.59Å; K59-G62 WeakPolarHBondContact O-CA 3.22Å; K59-G62 PolarHBondContact O-N 3.01Å; K59-Y63 HydrophobicContact CB-CD2 4.48Å; K59-Y63 HydrophobicContact CB-CE2 3.91Å; K59-Y63 VanDerWaalsContact O-CD2 3.27Å; K59-Y63 WeakPolarHBondContact O-CD2 3.4Å; K59-Y63 PolarHBondContact O-N 3.36Å
60N98.1Very high97.7Very high82 Ų8289.8 Ų89.844%0.43943%0.433SS..Hα-helixtrans-61.6-36.5176.9-75.7-5.9000112.5R56 T57 L58 G62 Y63 A64R56-N60 WeakPolarHBondContact O-CB 3.34Å; R56-N60 VanDerWaalsContact O-CG 3.26Å; R56-N60 PolarHBondContact O-N 3.19Å; T57-N60 PolarHBondContact O-N 3.17Å; L58-N60 PolarHBondContact O-N 2.55Å; N60-G62 VanDerWaalsContact C-N 3.34Å; N60-Y63 PolarHBondContact O-N 3.24Å; N60-A64 WeakPolarHBondContact O-CB 3.2Å; N60-A64 PolarHBondContact O-N 3.14Å
61R97.9Very high97.9Very high160 Ų16090.1 Ų90.160%0.60443%0.43SS*.Hα-helixtrans-59.4-46.1171.6-173.5-174.9-70.4153.7-4.2111T57 L58 K59 A64 A65T57-R61 PolarHBondContact O-N 3.34Å; L58-R61 WeakPolarHBondContact O-CB 3.32Å; L58-R61 PolarHBondContact O-N 3.43Å; K59-R61 VanDerWaalsContact C-N 3.28Å; K59-R61 PolarHBondContact O-N 3.39Å; R61-A64 PolarHBondContact O-N 3.09Å; R61-A65 PolarHBondContact O-N 2.83Å; R61-A65 VanDerWaalsContact O-N 3.17Å
62G97.1Very high98.1Very high27 Ų2792.3 Ų92.328%0.27844%0.444SS..Hα-helixtrans-60-47174.100000112.6L58 K59 N60 A64 A65 S66L58-G62 PolarHBondContact O-N 2.72Å; L58-G62 VanDerWaalsContact O-N 3.16Å; K59-G62 CarbonylContact O-C 3.59Å; K59-G62 WeakPolarHBondContact O-CA 3.22Å; K59-G62 PolarHBondContact O-N 3.01Å; N60-G62 VanDerWaalsContact C-N 3.34Å; G62-A64 VanDerWaalsContact C-N 3.3Å; G62-A64 PolarHBondContact O-N 3.48Å; G62-A65 PolarHBondContact O-N 2.98Å; G62-A65 VanDerWaalsContact O-N 3.15Å; G62-S66 PolarHBondContact O-N 3.32Å; G62-S66 PolarHBondContact O-OG 3.48Å
63Y98.2Very high98.2Very high146 Ų14690.6 Ų90.657%0.57345%0.445SS*.Hα-helixtrans-60.9-37.4177.5-61.8-39.5000112.8K59 N60 S66 C67K59-Y63 HydrophobicContact CB-CD2 4.48Å; K59-Y63 HydrophobicContact CB-CE2 3.91Å; K59-Y63 VanDerWaalsContact O-CD2 3.27Å; K59-Y63 WeakPolarHBondContact O-CD2 3.4Å; K59-Y63 PolarHBondContact O-N 3.36Å; N60-Y63 PolarHBondContact O-N 3.24Å; Y63-S66 PolarHBondContact O-N 3.39Å; Y63-C67 WeakPolarHBondContact O-CB 3.36Å; Y63-C67 PolarHBondContact O-N 2.9Å
64A98.6Very high98.2Very high46 Ų4691.9 Ų91.938%0.3845%0.451SS..Hα-helixtrans-63.8-43.217500000111.9N60 R61 G62 C67 R68N60-A64 WeakPolarHBondContact O-CB 3.2Å; N60-A64 PolarHBondContact O-N 3.14Å; R61-A64 PolarHBondContact O-N 3.09Å; G62-A64 VanDerWaalsContact C-N 3.3Å; G62-A64 PolarHBondContact O-N 3.48Å; A64-C67 PolarHBondContact O-N 3.2Å; A64-R68 WeakPolarHBondContact O-CG 3.47Å; A64-R68 PolarHBondContact O-N 3.04Å; A64-R68 VanDerWaalsContact O-N 3.09Å
65A98.2Very high98.3Very high54 Ų5493.7 Ų93.745%0.44646%0.458SS..Hα-helixtrans-63-49.5175.300000111.4R61 G62 C67 R68 V69R61-A65 PolarHBondContact O-N 2.83Å; R61-A65 VanDerWaalsContact O-N 3.17Å; G62-A65 PolarHBondContact O-N 2.98Å; G62-A65 VanDerWaalsContact O-N 3.15Å; A65-C67 VanDerWaalsContact C-N 3.28Å; A65-C67 PolarHBondContact O-N 3.15Å; A65-R68 WeakPolarHBondContact O-CB 3.48Å; A65-R68 PolarHBondContact O-N 3.42Å; A65-R68 VanDerWaalsContact O-N 3.14Å; A65-V69 WeakPolarHBondContact O-CG2 3.35Å; A65-V69 PolarHBondContact O-N 3.03Å
66S98.5Very high98.4Very high64 Ų6497 Ų9745%0.44848%0.475SS..Hα-helixtrans-61.1-35.7176.7-56.50000112.5G62 Y63 V69 K70G62-S66 PolarHBondContact O-N 3.32Å; G62-S66 PolarHBondContact O-OG 3.48Å; Y63-S66 PolarHBondContact O-N 3.39Å; S66-V69 PolarHBondContact O-N 2.91Å; S66-K70 WeakPolarHBondContact O-CB 3.42Å; S66-K70 WeakPolarHBondContact O-CG 3.47Å; S66-K70 PolarHBondContact O-N 3.44Å
67C98.6Very high98.4Very high61 Ų6191.5 Ų91.541%0.41246%0.463SS..Hα-helixtrans-63.2-43.5175.3-1790000111.5Y63 A64 A65 K70 R71Y63-C67 WeakPolarHBondContact O-CB 3.36Å; Y63-C67 PolarHBondContact O-N 2.9Å; A64-C67 PolarHBondContact O-N 3.2Å; A65-C67 VanDerWaalsContact C-N 3.28Å; A65-C67 PolarHBondContact O-N 3.15Å; C67-K70 PolarHBondContact O-N 3.09Å; C67-R71 WeakPolarHBondContact O-CB 3.22Å; C67-R71 PolarHBondContact O-N 2.89Å
68R98.7Very high98.4Very high180 Ų18093.1 Ų93.168%0.67947%0.469SS*.Hα-helixtrans-61.6-47.8175.5-67.8170.4-172.4-166.40.9111.3A64 A65 K70 R71 V72A64-R68 WeakPolarHBondContact O-CG 3.47Å; A64-R68 PolarHBondContact O-N 3.04Å; A64-R68 VanDerWaalsContact O-N 3.09Å; A65-R68 WeakPolarHBondContact O-CB 3.48Å; A65-R68 PolarHBondContact O-N 3.42Å; A65-R68 VanDerWaalsContact O-N 3.14Å; R68-K70 PolarHBondContact O-N 3.21Å; R68-R71 PolarHBondContact O-N 3.21Å; R68-V72 WeakPolarHBondContact O-CG2 3.4Å; R68-V72 PolarHBondContact O-N 2.95Å
69V98.6Very high98.4Very high103 Ų10396.8 Ų96.862%0.62449%0.486SS*.Hα-helixtrans-59.2-48.8178.1175.40000111A65 S66 R71 V72 S73A65-V69 WeakPolarHBondContact O-CG2 3.35Å; A65-V69 PolarHBondContact O-N 3.03Å; S66-V69 PolarHBondContact O-N 2.91Å; V69-R71 VanDerWaalsContact C-N 3.31Å; V69-R71 PolarHBondContact O-N 3.46Å; V69-V72 PolarHBondContact O-N 2.96Å; V69-S73 WeakPolarHBondContact O-CB 3.26Å; V69-S73 PolarHBondContact O-N 2.64Å
70K98.8Very high98.5Very high158 Ų158100.2 Ų100.269%0.68750%0.503SS*.Hα-helixtrans-57.8-43.2177.2-77.2-177.3179.7-173.90112.2S66 C67 R68 Q74S66-K70 WeakPolarHBondContact O-CB 3.42Å; S66-K70 WeakPolarHBondContact O-CG 3.47Å; S66-K70 PolarHBondContact O-N 3.44Å; C67-K70 PolarHBondContact O-N 3.09Å; R68-K70 PolarHBondContact O-N 3.21Å; K70-Q74 VanDerWaalsContact O-CB 3.26Å; K70-Q74 WeakPolarHBondContact O-CB 3.47Å; K70-Q74 PolarHBondContact O-N 3.47Å
71R98.8Very high98.5Very high163 Ų163101.6 Ų101.662%0.61551%0.507SS*.Hα-helixtrans-65.1-44.4179.6-171.7-175.5-57.9167.21.8112C67 R68 V69 Q74 R75C67-R71 WeakPolarHBondContact O-CB 3.22Å; C67-R71 PolarHBondContact O-N 2.89Å; R68-R71 PolarHBondContact O-N 3.21Å; V69-R71 VanDerWaalsContact C-N 3.31Å; V69-R71 PolarHBondContact O-N 3.46Å; R71-Q74 PolarHBondContact O-N 3.02Å; R71-R75 WeakPolarHBondContact O-CB 3.43Å; R71-R75 PolarHBondContact O-N 2.9Å
72V98.7Very high98.6Very high67 Ų67101.4 Ų101.441%0.40651%0.51SS..Hα-helixtrans-64.2-49.6178.6171.80000110.2R68 V69 Q74 R75 E76R68-V72 WeakPolarHBondContact O-CG2 3.4Å; R68-V72 PolarHBondContact O-N 2.95Å; V69-V72 PolarHBondContact O-N 2.96Å; V72-Q74 VanDerWaalsContact C-N 3.33Å; V72-Q74 PolarHBondContact O-N 3.14Å; V72-R75 WeakPolarHBondContact O-CB 3.35Å; V72-R75 PolarHBondContact O-N 3.48Å; V72-R75 VanDerWaalsContact O-N 3.14Å; V72-E76 HydrophobicContact CG1-CG 4.42Å; V72-E76 VanDerWaalsContact CG1-OE1 3.25Å; V72-E76 WeakPolarHBondContact CG1-OE1 3.44Å; V72-E76 WeakPolarHBondContact O-CG 3.34Å; V72-E76 PolarHBondContact O-N 2.92Å
73S98.6Very high98.6Very high70 Ų70105.1 Ų105.149%0.4952%0.522SS..Hα-helixtrans-59.7-40.8177.4173.70000112.5V69 E76 A77V69-S73 WeakPolarHBondContact O-CB 3.26Å; V69-S73 PolarHBondContact O-N 2.64Å; S73-E76 PolarHBondContact O-N 3.08Å; S73-A77 WeakPolarHBondContact O-CB 3.25Å; S73-A77 PolarHBondContact O-N 2.92Å
74Q98.7Very high98.7Very high131 Ų131104.5 Ų104.561%0.61252%0.524SS*.Hα-helixtrans-63.8-42.9175.8-175.4177.62500111.9K70 R71 V72 A77 L78K70-Q74 VanDerWaalsContact O-CB 3.26Å; K70-Q74 WeakPolarHBondContact O-CB 3.47Å; K70-Q74 PolarHBondContact O-N 3.47Å; R71-Q74 PolarHBondContact O-N 3.02Å; V72-Q74 VanDerWaalsContact C-N 3.33Å; V72-Q74 PolarHBondContact O-N 3.14Å; Q74-A77 PolarHBondContact O-N 3.49Å; Q74-L78 HydrophobicContact CG-CD1 4.4Å; Q74-L78 WeakPolarHBondContact O-CG 3.43Å; Q74-L78 PolarHBondContact O-N 3.37Å; Q74-L78 VanDerWaalsContact O-N 3.08Å
75R98.6Very high98.7Very high132 Ų132108 Ų10850%0.49854%0.536SS..Hα-helixtrans-61.4-47.4176.2-178.3-170.168.5109.4-2111.1R71 V72 A77 L78 E79R71-R75 WeakPolarHBondContact O-CB 3.43Å; R71-R75 PolarHBondContact O-N 2.9Å; V72-R75 WeakPolarHBondContact O-CB 3.35Å; V72-R75 PolarHBondContact O-N 3.48Å; V72-R75 VanDerWaalsContact O-N 3.14Å; R75-A77 VanDerWaalsContact C-N 3.34Å; R75-A77 PolarHBondContact O-N 2.9Å; R75-L78 PolarHBondContact O-N 3.29Å; R75-E79 WeakPolarHBondContact CG-OE1 3.41Å; R75-E79 IonicContact CZ-OE1 3.78Å; R75-E79 IonicContact CZ-OE2 3.6Å; R75-E79 IonicContact NE-OE1 2.75Å; R75-E79 IonicContact NH1-OE1 2.68Å; R75-E79 PolarHBondContact NH1-OE1 3.37Å; R75-E79 IonicContact NH1-OE2 3.47Å; R75-E79 WeakPolarHBondContact O-CG 3.46Å; R75-E79 PolarHBondContact O-N 2.75Å
76E98.8Very high98.7Very high89 Ų89110.1 Ų110.142%0.41654%0.536SS..Hα-helixtrans-61.8-41.3179.5-72.1168.2175.900111.9V72 S73 L78 E79 Q80V72-E76 HydrophobicContact CG1-CG 4.42Å; V72-E76 VanDerWaalsContact CG1-OE1 3.25Å; V72-E76 WeakPolarHBondContact CG1-OE1 3.44Å; V72-E76 WeakPolarHBondContact O-CG 3.34Å; V72-E76 PolarHBondContact O-N 2.92Å; S73-E76 PolarHBondContact O-N 3.08Å; E76-L78 PolarHBondContact O-N 3.4Å; E76-E79 PolarHBondContact O-N 3.48Å; E76-Q80 PolarHBondContact O-N 2.95Å
77A98.7Very high98.7Very high45 Ų45114.6 Ų114.637%0.37254%0.543SS..Hα-helixtrans-61.2-43.2174.700000111.9S73 Q74 R75 Q80 Q81S73-A77 WeakPolarHBondContact O-CB 3.25Å; S73-A77 PolarHBondContact O-N 2.92Å; Q74-A77 PolarHBondContact O-N 3.49Å; R75-A77 VanDerWaalsContact C-N 3.34Å; R75-A77 PolarHBondContact O-N 2.9Å; A77-Q80 PolarHBondContact O-N 3.38Å; A77-Q81 WeakPolarHBondContact O-CG 3.37Å; A77-Q81 PolarHBondContact O-N 3.39Å
78L98.8Very high98.7Very high101 Ų101115.3 Ų115.353%0.52954%0.541SS..Hα-helixtrans-65.8-39175.8-70.6171.1000112.2Q74 R75 E76 Q81 K82Q74-L78 HydrophobicContact CG-CD1 4.4Å; Q74-L78 WeakPolarHBondContact O-CG 3.43Å; Q74-L78 PolarHBondContact O-N 3.37Å; Q74-L78 VanDerWaalsContact O-N 3.08Å; R75-L78 PolarHBondContact O-N 3.29Å; E76-L78 PolarHBondContact O-N 3.4Å; L78-Q81 PolarHBondContact O-N 3.27Å; L78-K82 WeakPolarHBondContact O-CB 3.36Å; L78-K82 PolarHBondContact O-N 2.91Å
79E98.8Very high98.7Very high85 Ų85111.2 Ų111.240%0.39754%0.535SS..Hα-helixtrans-62.6-42.2174.9-74.9171-176.500111.1R75 E76 K82 M83R75-E79 WeakPolarHBondContact CG-OE1 3.41Å; R75-E79 IonicContact CZ-OE1 3.78Å; R75-E79 IonicContact CZ-OE2 3.6Å; R75-E79 IonicContact NE-OE1 2.75Å; R75-E79 IonicContact NH1-OE1 2.68Å; R75-E79 PolarHBondContact NH1-OE1 3.37Å; R75-E79 IonicContact NH1-OE2 3.47Å; R75-E79 WeakPolarHBondContact O-CG 3.46Å; R75-E79 PolarHBondContact O-N 2.75Å; E76-E79 PolarHBondContact O-N 3.48Å; E79-K82 PolarHBondContact O-N 2.95Å; E79-M83 WeakPolarHBondContact O-CG 3.4Å; E79-M83 PolarHBondContact O-N 2.96Å
80Q98.8Very high98.7Very high140 Ų140111.7 Ų111.765%0.65453%0.531SS*.Hα-helixtrans-62.5-47.2173.6-82172.5-11.900112.4E76 A77 K82 M83 E84E76-Q80 PolarHBondContact O-N 2.95Å; A77-Q80 PolarHBondContact O-N 3.38Å; Q80-K82 VanDerWaalsContact C-N 3.3Å; Q80-K82 PolarHBondContact O-N 3.38Å; Q80-M83 PolarHBondContact O-N 3.41Å; Q80-M83 VanDerWaalsContact O-N 3.13Å; Q80-E84 PolarHBondContact O-N 3.43Å
81Q98.8Very high98.7Very high112 Ų112109.1 Ų109.152%0.52352%0.517SS..Hα-helixtrans-59.4-41.9176.7-75-174.9-36.700111.8A77 L78 M83 E84 L85A77-Q81 WeakPolarHBondContact O-CG 3.37Å; A77-Q81 PolarHBondContact O-N 3.39Å; L78-Q81 PolarHBondContact O-N 3.27Å; Q81-M83 PolarHBondContact O-N 3Å; Q81-E84 PolarHBondContact O-N 3.26Å; Q81-L85 WeakPolarHBondContact O-CB 3.46Å; Q81-L85 WeakPolarHBondContact O-CG 3.32Å; Q81-L85 PolarHBondContact O-N 2.96Å
82K98.6Very high98.7Very high156 Ų156104.7 Ų104.768%0.67851%0.505SS*.Hα-helixtrans-59.9-45.9174.8-179-171.9172.8-173.90111.3L78 E79 Q80 Q86L78-K82 WeakPolarHBondContact O-CB 3.36Å; L78-K82 PolarHBondContact O-N 2.91Å; E79-K82 PolarHBondContact O-N 2.95Å; Q80-K82 VanDerWaalsContact C-N 3.3Å; Q80-K82 PolarHBondContact O-N 3.38Å; K82-Q86 VanDerWaalsContact O-CB 3.32Å; K82-Q86 WeakPolarHBondContact O-CB 3.34Å; K82-Q86 PolarHBondContact O-N 3.48Å
83M98.7Very high98.7Very high104 Ų104103.4 Ų103.451%0.51251%0.506SS..Hα-helixtrans-64.1-40.5179.2-72.2-17874.300112.2E79 Q80 Q81 Q86 R87E79-M83 WeakPolarHBondContact O-CG 3.4Å; E79-M83 PolarHBondContact O-N 2.96Å; Q80-M83 PolarHBondContact O-N 3.41Å; Q80-M83 VanDerWaalsContact O-N 3.13Å; Q81-M83 PolarHBondContact O-N 3Å; M83-Q86 PolarHBondContact O-N 3.13Å; M83-R87 WeakPolarHBondContact O-CG 3.37Å; M83-R87 PolarHBondContact O-N 3.07Å
84E98.7Very high98.7Very high133 Ų133103.4 Ų103.462%0.62151%0.51SS*.Hα-helixtrans-63.9-48.7177.3-174.7170.8-158.100111.5Q80 Q81 Q86 R87 E88Q80-E84 PolarHBondContact O-N 3.43Å; Q81-E84 PolarHBondContact O-N 3.26Å; E84-Q86 VanDerWaalsContact C-N 3.3Å; E84-Q86 PolarHBondContact O-N 2.94Å; E84-R87 PolarHBondContact O-N 2.95Å; E84-E88 PolarHBondContact O-N 2.91Å
85L98.8Very high98.7Very high121 Ų121101.5 Ų101.563%0.63450%0.501SS*.Hα-helixtrans-60.8-39.3175.8-71.8172.4000112.3Q81 E88 V89Q81-L85 WeakPolarHBondContact O-CB 3.46Å; Q81-L85 WeakPolarHBondContact O-CG 3.32Å; Q81-L85 PolarHBondContact O-N 2.96Å; L85-E88 PolarHBondContact O-N 3.37Å; L85-V89 WeakPolarHBondContact O-CG2 3.41Å; L85-V89 PolarHBondContact O-N 2.9Å
86Q98.7Very high98.7Very high98 Ų9899 Ų9946%0.45850%0.497SS..Hα-helixtrans-62.6-44.3177.5-176.160.23800111.7K82 M83 E84 E88 V89 E90K82-Q86 VanDerWaalsContact O-CB 3.32Å; K82-Q86 WeakPolarHBondContact O-CB 3.34Å; K82-Q86 PolarHBondContact O-N 3.48Å; M83-Q86 PolarHBondContact O-N 3.13Å; E84-Q86 VanDerWaalsContact C-N 3.3Å; E84-Q86 PolarHBondContact O-N 2.94Å; Q86-E88 VanDerWaalsContact C-N 3.29Å; Q86-E88 PolarHBondContact O-N 2.68Å; Q86-V89 PolarHBondContact O-N 3.38Å; Q86-E90 WeakPolarHBondContact CG-OE1 3.32Å; Q86-E90 PolarHBondContact NE2-OE1 3.37Å; Q86-E90 WeakPolarHBondContact O-CG 3.37Å; Q86-E90 PolarHBondContact O-N 3.28Å
87R98.8Very high98.7Very high157 Ų15797.5 Ų97.559%0.59250%0.501SS*.Hα-helixtrans-61.7-39.6174.9-71.4173.3-173148.20.4111.8M83 E84 E90 R91M83-R87 WeakPolarHBondContact O-CG 3.37Å; M83-R87 PolarHBondContact O-N 3.07Å; E84-R87 PolarHBondContact O-N 2.95Å; R87-E90 PolarHBondContact O-N 2.85Å; R87-R91 WeakPolarHBondContact O-CB 3.48Å; R87-R91 PolarHBondContact O-N 2.89Å
88E98.7Very high98.7Very high77 Ų7796.9 Ų96.936%0.3650%0.499SS..Hα-helixtrans-66.8-40.7179.3-177.259.4-170.600111.9E84 L85 Q86 E90 R91 L92E84-E88 PolarHBondContact O-N 2.91Å; L85-E88 PolarHBondContact O-N 3.37Å; Q86-E88 VanDerWaalsContact C-N 3.29Å; Q86-E88 PolarHBondContact O-N 2.68Å; E88-E90 VanDerWaalsContact C-N 3.34Å; E88-E90 PolarHBondContact O-N 2.92Å; E88-R91 PolarHBondContact O-N 3.47Å; E88-R91 IonicContact OE1-CZ 2.84Å; E88-R91 IonicContact OE1-NE 3.52Å; E88-R91 IonicContact OE1-NH2 3.56Å; E88-R91 PolarHBondContact OE1-NH2 3.46Å; E88-R91 IonicContact OE2-CZ 3.5Å; E88-R91 IonicContact OE2-NE 3.59Å; E88-R91 PolarHBondContact OE2-NE 2.99Å; E88-R91 IonicContact OE2-NH2 3.08Å; E88-L92 HydrophobicContact CG-CD1 4.1Å; E88-L92 WeakPolarHBondContact O-CB 3.48Å; E88-L92 WeakPolarHBondContact O-CG 3.39Å; E88-L92 PolarHBondContact O-N 3.04Å
89V98.8Very high98.6Very high93 Ų9396.8 Ų96.856%0.56450%0.497SS*.Hα-helixtrans-60.2-44.3172.81690000111.2L85 Q86 G93L85-V89 WeakPolarHBondContact O-CG2 3.41Å; L85-V89 PolarHBondContact O-N 2.9Å; Q86-V89 PolarHBondContact O-N 3.38Å; V89-G93 PolarHBondContact O-N 3.32Å
90E98.7Very high98.6Very high114 Ų114101.5 Ų101.553%0.53351%0.511SS..Hα-helixtrans-64-44.3178-73.5166.7-163.500111.9Q86 R87 E88 G93 A94Q86-E90 WeakPolarHBondContact CG-OE1 3.32Å; Q86-E90 PolarHBondContact NE2-OE1 3.37Å; Q86-E90 WeakPolarHBondContact O-CG 3.37Å; Q86-E90 PolarHBondContact O-N 3.28Å; R87-E90 PolarHBondContact O-N 2.85Å; E88-E90 VanDerWaalsContact C-N 3.34Å; E88-E90 PolarHBondContact O-N 2.92Å; E90-G93 PolarHBondContact O-N 3.34Å; E90-A94 PolarHBondContact O-N 3.25Å
91R98.6Very high98.6Very high103 Ų103102.4 Ų102.439%0.38951%0.512SS..Hα-helixtrans-59-52.7176.1-172.5-169.771.479.41.8111.4R87 E88 G93 A94 E95R87-R91 WeakPolarHBondContact O-CB 3.48Å; R87-R91 PolarHBondContact O-N 2.89Å; E88-R91 PolarHBondContact O-N 3.47Å; E88-R91 IonicContact OE1-CZ 2.84Å; E88-R91 IonicContact OE1-NE 3.52Å; E88-R91 IonicContact OE1-NH2 3.56Å; E88-R91 PolarHBondContact OE1-NH2 3.46Å; E88-R91 IonicContact OE2-CZ 3.5Å; E88-R91 IonicContact OE2-NE 3.59Å; E88-R91 PolarHBondContact OE2-NE 2.99Å; E88-R91 IonicContact OE2-NH2 3.08Å; R91-G93 VanDerWaalsContact C-N 3.27Å; R91-G93 PolarHBondContact O-N 2.84Å; R91-A94 PolarHBondContact O-N 3.44Å; R91-E95 IonicContact CZ-OE1 3.67Å; R91-E95 IonicContact CZ-OE2 3.81Å; R91-E95 IonicContact NH1-OE1 2.59Å; R91-E95 PolarHBondContact NH1-OE1 3.23Å; R91-E95 IonicContact NH1-OE2 2.86Å; R91-E95 PolarHBondContact NH1-OE2 2.96Å; R91-E95 PolarHBondContact O-N 2.99Å
92L98.6Very high98.6Very high70 Ų70103.6 Ų103.637%0.36652%0.518SS..Hα-helixtrans-63.8-33.8178.2-70.8173.9000112.1E88 N96E88-L92 HydrophobicContact CG-CD1 4.1Å; E88-L92 WeakPolarHBondContact O-CB 3.48Å; E88-L92 WeakPolarHBondContact O-CG 3.39Å; E88-L92 PolarHBondContact O-N 3.04Å; L92-N96 VanDerWaalsContact O-CB 3.31Å; L92-N96 WeakPolarHBondContact O-CB 3.26Å; L92-N96 PolarHBondContact O-N 3.13Å; L92-N96 PolarHBondContact O-ND2 3.29Å
93G98.6Very high98.5Very high41 Ų41102 Ų10242%0.42352%0.517SS..Hα-helixtrans-62-46.5173.500000112.1V89 E90 R91 N96 A97V89-G93 PolarHBondContact O-N 3.32Å; E90-G93 PolarHBondContact O-N 3.34Å; R91-G93 VanDerWaalsContact C-N 3.27Å; R91-G93 PolarHBondContact O-N 2.84Å; G93-N96 PolarHBondContact O-N 3.02Å; G93-A97 WeakPolarHBondContact O-CB 3.41Å; G93-A97 PolarHBondContact O-N 3.43Å
94A98.6Very high98.5Very high70 Ų70104.1 Ų104.158%0.57953%0.525SS*.Hα-helixtrans-64.2-43.9177.100000112.2E90 R91 A97 G98E90-A94 PolarHBondContact O-N 3.25Å; R91-A94 PolarHBondContact O-N 3.44Å; A94-A97 PolarHBondContact O-N 3.46Å; A94-G98 PolarHBondContact O-N 3Å
95E98.5Very high98.4Very high90 Ų9099.1 Ų99.142%0.42151%0.51SS..Hα-helixtrans-62.3-44.6176.8-75.8171.9-163.700111.9R91 A97 G98 M99R91-E95 IonicContact CZ-OE1 3.67Å; R91-E95 IonicContact CZ-OE2 3.81Å; R91-E95 IonicContact NH1-OE1 2.59Å; R91-E95 PolarHBondContact NH1-OE1 3.23Å; R91-E95 IonicContact NH1-OE2 2.86Å; R91-E95 PolarHBondContact NH1-OE2 2.96Å; R91-E95 PolarHBondContact O-N 2.99Å; E95-A97 VanDerWaalsContact C-N 3.35Å; E95-A97 PolarHBondContact O-N 2.95Å; E95-G98 PolarHBondContact O-N 2.96Å; E95-M99 WeakPolarHBondContact O-CG 3.46Å; E95-M99 PolarHBondContact O-N 3.31Å
96N98.6Very high98.4Very high79 Ų7998.4 Ų98.442%0.42251%0.506SS..Hα-helixtrans-61.9-41175.3-85.5-57.7000112.6L92 G93 G98 M99 R100L92-N96 VanDerWaalsContact O-CB 3.31Å; L92-N96 WeakPolarHBondContact O-CB 3.26Å; L92-N96 PolarHBondContact O-N 3.13Å; L92-N96 PolarHBondContact O-ND2 3.29Å; G93-N96 PolarHBondContact O-N 3.02Å; N96-G98 VanDerWaalsContact C-N 3.33Å; N96-M99 PolarHBondContact O-N 3.45Å; N96-M99 WeakPolarHBondContact OD1-CE 3.31Å; N96-R100 WeakPolarHBondContact O-CB 3.43Å; N96-R100 VanDerWaalsContact O-CG 3.26Å; N96-R100 WeakPolarHBondContact O-CG 3.44Å; N96-R100 PolarHBondContact O-N 2.59Å
97A98.4Very high98.4Very high59 Ų5995.6 Ų95.649%0.48850%0.503SS..Hα-helixtrans-62.8-41.5175.700000111.5G93 A94 E95 R100 K101G93-A97 WeakPolarHBondContact O-CB 3.41Å; G93-A97 PolarHBondContact O-N 3.43Å; A94-A97 PolarHBondContact O-N 3.46Å; E95-A97 VanDerWaalsContact C-N 3.35Å; E95-A97 PolarHBondContact O-N 2.95Å; A97-R100 PolarHBondContact O-N 2.86Å; A97-K101 PolarHBondContact O-N 2.92Å; A97-K101 VanDerWaalsContact O-N 3.13Å
98G98.4Very high98.3Very high32 Ų3291 Ų9133%0.3350%0.499SS..Hα-helixtrans-58.5-53.6173.700000112.3A94 E95 N96 R100 K101 E102A94-G98 PolarHBondContact O-N 3Å; E95-G98 PolarHBondContact O-N 2.96Å; N96-G98 VanDerWaalsContact C-N 3.33Å; G98-R100 VanDerWaalsContact C-N 3.3Å; G98-R100 PolarHBondContact O-N 3.38Å; G98-K101 WeakPolarHBondContact O-CB 3.41Å; G98-K101 PolarHBondContact O-N 3.38Å; G98-K101 VanDerWaalsContact O-N 3.1Å; G98-E102 PolarHBondContact O-N 2.94Å
99M98.3Very high98.2Very high99 Ų9995.9 Ų95.949%0.48851%0.514SS..Hα-helixtrans-59-39.5178.9-70.8-172.1-71.300112.6E95 N96 K101 E102 L103E95-M99 WeakPolarHBondContact O-CG 3.46Å; E95-M99 PolarHBondContact O-N 3.31Å; N96-M99 PolarHBondContact O-N 3.45Å; N96-M99 WeakPolarHBondContact OD1-CE 3.31Å; M99-K101 VanDerWaalsContact C-N 3.35Å; M99-K101 PolarHBondContact O-N 3.21Å; M99-E102 PolarHBondContact O-N 2.86Å; M99-L103 WeakPolarHBondContact O-CG 3.48Å; M99-L103 PolarHBondContact O-N 3.32Å
100R98.3Very high98.1Very high184 Ų18496.1 Ų96.169%0.69451%0.512SS*.Hα-helixtrans-61.9-42.5176-76.2175.2-179.9-78.3-1.7112.1N96 A97 G98 L103 E104N96-R100 WeakPolarHBondContact O-CB 3.43Å; N96-R100 VanDerWaalsContact O-CG 3.26Å; N96-R100 WeakPolarHBondContact O-CG 3.44Å; N96-R100 PolarHBondContact O-N 2.59Å; A97-R100 PolarHBondContact O-N 2.86Å; G98-R100 VanDerWaalsContact C-N 3.3Å; G98-R100 PolarHBondContact O-N 3.38Å; R100-L103 PolarHBondContact O-N 3.48Å; R100-E104 WeakPolarHBondContact O-CB 3.49Å; R100-E104 PolarHBondContact O-N 2.89Å
101K98.2Very high98Very high158 Ų15891.9 Ų91.969%0.68750%0.496SS*.Hα-helixtrans-65.5-38.9177.3-172.2178.7-180-179.50111.8A97 G98 M99 E104 G105A97-K101 PolarHBondContact O-N 2.92Å; A97-K101 VanDerWaalsContact O-N 3.13Å; G98-K101 WeakPolarHBondContact O-CB 3.41Å; G98-K101 PolarHBondContact O-N 3.38Å; G98-K101 VanDerWaalsContact O-N 3.1Å; M99-K101 VanDerWaalsContact C-N 3.35Å; M99-K101 PolarHBondContact O-N 3.21Å; K101-E104 PolarHBondContact O-N 3.44Å; K101-G105 PolarHBondContact O-N 3.01Å
102E98.1Very high97.9Very high138 Ų13889.3 Ų89.365%0.64550%0.497SS*.Hα-helixtrans-63.7-45.9174.3-71.1-179.6-16700111.8G98 M99 E104 G105 L106G98-E102 PolarHBondContact O-N 2.94Å; M99-E102 PolarHBondContact O-N 2.86Å; E102-E104 PolarHBondContact O-N 3.48Å; E102-G105 PolarHBondContact O-N 3.1Å; E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 2.97Å
103L98.3Very high97.8Very high123 Ų12391.8 Ų91.864%0.64451%0.51SS*.Hα-helixtrans-59.4-44.4175.5-77.7171.9000112.2M99 R100 L106 G107M99-L103 WeakPolarHBondContact O-CG 3.48Å; M99-L103 PolarHBondContact O-N 3.32Å; R100-L103 PolarHBondContact O-N 3.48Å; L103-L106 PolarHBondContact O-N 3.21Å; L103-G107 PolarHBondContact O-N 2.95Å
104E97.8Very high97.6Very high147 Ų14794.7 Ų94.769%0.68751%0.512SS*.Hα-helixtrans-60-46.6174.9-175.6-177179.700111.2R100 K101 E102 L106 G107 A108R100-E104 WeakPolarHBondContact O-CB 3.49Å; R100-E104 PolarHBondContact O-N 2.89Å; K101-E104 PolarHBondContact O-N 3.44Å; E102-E104 PolarHBondContact O-N 3.48Å; E104-L106 PolarHBondContact O-N 2.94Å; E104-G107 PolarHBondContact O-N 3.43Å; E104-A108 WeakPolarHBondContact O-CB 3.45Å; E104-A108 PolarHBondContact O-N 3.46Å
105G97.8Very high97.4Very high29 Ų2999.8 Ų99.830%0.29952%0.517SS..Hα-helixtrans-61.6-40.717800000113.2K101 E102 R109K101-G105 PolarHBondContact O-N 3.01Å; E102-G105 PolarHBondContact O-N 3.1Å; G105-R109 WeakPolarHBondContact O-CG 3.39Å; G105-R109 PolarHBondContact O-N 3.26Å
106L97.6Very high97.1Very high105 Ų105102.1 Ų102.155%0.5553%0.526SS..Hα-helixtrans-67.7-43.3174.8-70.8173.9000111.6E102 L103 E104 A108 R109 L110E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 2.97Å; L103-L106 PolarHBondContact O-N 3.21Å; E104-L106 PolarHBondContact O-N 2.94Å; L106-A108 VanDerWaalsContact C-N 3.33Å; L106-A108 PolarHBondContact O-N 3.33Å; L106-R109 PolarHBondContact O-N 3.42Å; L106-L110 WeakPolarHBondContact O-CB 3.38Å; L106-L110 PolarHBondContact O-N 2.98Å
107G97.8Very high96.8Very high39 Ų39100.5 Ų100.540%0.40252%0.524SS..Hα-helixtrans-58.8-42.7175.700000112.5L103 E104 L110 A111L103-G107 PolarHBondContact O-N 2.95Å; E104-G107 PolarHBondContact O-N 3.43Å; G107-L110 PolarHBondContact O-N 2.91Å; G107-A111 WeakPolarHBondContact O-CB 3.48Å; G107-A111 PolarHBondContact O-N 3.29Å
108A97.3Very high96.5Very high62 Ų62106.6 Ų106.651%0.51253%0.534SS..Hα-helixtrans-62.7-42.9176.100000112.4E104 L106 A111 A112E104-A108 WeakPolarHBondContact O-CB 3.45Å; E104-A108 PolarHBondContact O-N 3.46Å; L106-A108 VanDerWaalsContact C-N 3.33Å; L106-A108 PolarHBondContact O-N 3.33Å; A108-A111 PolarHBondContact O-N 2.91Å; A108-A112 WeakPolarHBondContact O-CB 3.31Å; A108-A112 PolarHBondContact O-N 3.26Å
109R96.8Very high95.8Very high178 Ų178107.3 Ų107.367%0.67254%0.541SS*.Hα-helixtrans-63.5-45.5176.1-69.3177.4-147.5-156.86.1111.6G105 L106 A111 A112 L113G105-R109 WeakPolarHBondContact O-CG 3.39Å; G105-R109 PolarHBondContact O-N 3.26Å; L106-R109 PolarHBondContact O-N 3.42Å; R109-A111 PolarHBondContact O-N 3.39Å; R109-A112 PolarHBondContact O-N 3.43Å; R109-L113 WeakPolarHBondContact O-CG 3.37Å; R109-L113 PolarHBondContact O-N 3.21Å
110L97.4Very high95Very high98 Ų98107.2 Ų107.251%0.51354%0.542SS..Hα-helixtrans-61.7-44.4177.8-179135.4000111.3L106 G107 A112 L113 Q114L106-L110 WeakPolarHBondContact O-CB 3.38Å; L106-L110 PolarHBondContact O-N 2.98Å; G107-L110 PolarHBondContact O-N 2.91Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.24Å; L110-L113 PolarHBondContact O-N 3.5Å; L110-Q114 HydrophobicContact CD2-CG 4.39Å; L110-Q114 WeakPolarHBondContact O-CG 3.49Å; L110-Q114 PolarHBondContact O-N 3.44Å
111A96.6Very high93.9Very high25 Ų25106.3 Ų106.321%0.20755%0.546CS..Hα-helixtrans-62-39.7175.900000112.4G107 A108 R109 Q114 R115G107-A111 WeakPolarHBondContact O-CB 3.48Å; G107-A111 PolarHBondContact O-N 3.29Å; A108-A111 PolarHBondContact O-N 2.91Å; R109-A111 PolarHBondContact O-N 3.39Å; A111-Q114 PolarHBondContact O-N 2.93Å; A111-R115 VanDerWaalsContact O-CG 3.31Å; A111-R115 WeakPolarHBondContact O-CG 3.35Å; A111-R115 PolarHBondContact O-N 2.88Å
112A95.8Very high92.4Very high50 Ų50103.2 Ų103.241%0.41355%0.55SS..Hα-helixtrans-62.6-45.5175.600000111.9A108 R109 L110 R115 F116A108-A112 WeakPolarHBondContact O-CB 3.31Å; A108-A112 PolarHBondContact O-N 3.26Å; R109-A112 PolarHBondContact O-N 3.43Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.24Å; A112-R115 PolarHBondContact O-N 3.35Å; A112-F116 PolarHBondContact O-N 2.88Å
113L96.1Very high90.5Very high122 Ų12298.6 Ų98.664%0.63954%0.539SS*.Hα-helixtrans-62.9-41.4176.2-70.2173.1000112.1R109 L110 F116 A117R109-L113 WeakPolarHBondContact O-CG 3.37Å; R109-L113 PolarHBondContact O-N 3.21Å; L110-L113 PolarHBondContact O-N 3.5Å; L113-F116 PolarHBondContact O-N 3.27Å; L113-A117 WeakPolarHBondContact O-CB 3.34Å; L113-A117 PolarHBondContact O-N 3.4Å
114Q95.3Very high88.1Confident101 Ų10195.2 Ų95.247%0.47253%0.534SS..Hα-helixtrans-63.7-41.6176-74.5177.5-18.700112.5L110 A111 A117 R118L110-Q114 HydrophobicContact CD2-CG 4.39Å; L110-Q114 WeakPolarHBondContact O-CG 3.49Å; L110-Q114 PolarHBondContact O-N 3.44Å; A111-Q114 PolarHBondContact O-N 2.93Å; Q114-A117 PolarHBondContact O-N 3.43Å; Q114-R118 WeakPolarHBondContact O-CG 3.47Å; Q114-R118 PolarHBondContact O-N 3.15Å
115R94.3Very high86Confident178 Ų17892 Ų9267%0.67254%0.54SS*.Hα-helixtrans-62.4-43.7174.5-72.3176.2-161.7130.31.7111.3A111 A112 R118 G119A111-R115 VanDerWaalsContact O-CG 3.31Å; A111-R115 WeakPolarHBondContact O-CG 3.35Å; A111-R115 PolarHBondContact O-N 2.88Å; A112-R115 PolarHBondContact O-N 3.35Å; R115-R118 PolarHBondContact O-N 3.11Å; R115-G119 PolarHBondContact O-N 2.9Å
116F92.1Very high83.7Confident138 Ų13896.3 Ų96.361%0.60556%0.561SS**Hα-helixtrans-59.6-51.1176.2176.9-103.2000111.4A112 L113 R118 G119 L120A112-F116 PolarHBondContact O-N 2.88Å; L113-F116 PolarHBondContact O-N 3.27Å; F116-R118 PolarHBondContact O-N 2.94Å; F116-G119 PolarHBondContact O-N 3.33Å; F116-G119 VanDerWaalsContact O-N 3.11Å; F116-L120 HydrophobicContact CD1-CD1 4.14Å; F116-L120 HydrophobicContact CE1-CD1 3.6Å; F116-L120 HydrophobicContact CE1-CG 4.32Å; F116-L120 HydrophobicContact CZ-CD1 3.93Å; F116-L120 HydrophobicContact CZ-CD2 4.3Å; F116-L120 HydrophobicContact CZ-CG 4.31Å; F116-L120 PolarHBondContact O-N 3.48Å; F116-L120 VanDerWaalsContact O-N 3.1Å
117A92.7Very high81.5Confident46 Ų4697.7 Ų97.738%0.3857%0.568SS.*Hα-helixtrans-58.2-45.2177.800000112.2L113 Q114 G119 L120 E121L113-A117 WeakPolarHBondContact O-CB 3.34Å; L113-A117 PolarHBondContact O-N 3.4Å; Q114-A117 PolarHBondContact O-N 3.43Å; A117-G119 VanDerWaalsContact C-N 3.32Å; A117-G119 PolarHBondContact O-N 2.97Å; A117-L120 WeakPolarHBondContact O-CB 3.48Å; A117-L120 PolarHBondContact O-N 3.17Å; A117-E121 WeakPolarHBondContact O-CG 3.41Å; A117-E121 PolarHBondContact O-N 3.41Å; A117-E121 VanDerWaalsContact O-N 3.15Å
118R91.3Very high79.3Confident187 Ų187103.9 Ų103.971%0.70659%0.591SS**Hα-helixtrans-63.2-36175.6-74.1-179.1-175.2-178.72.2113.2Q114 R115 F116 L120 E121 A122Q114-R118 WeakPolarHBondContact O-CG 3.47Å; Q114-R118 PolarHBondContact O-N 3.15Å; R115-R118 PolarHBondContact O-N 3.11Å; F116-R118 PolarHBondContact O-N 2.94Å; R118-L120 VanDerWaalsContact C-N 3.28Å; R118-L120 PolarHBondContact O-N 3.1Å; R118-E121 PolarHBondContact O-N 3.47Å; R118-A122 WeakPolarHBondContact O-CB 3.44Å; R118-A122 PolarHBondContact O-N 2.97Å
119G83.5Confident77.2Confident47 Ų47105.3 Ų105.349%0.48560%0.603SS.*Hα-helixtrans-62.8-35.4174.900000112.5R115 F116 A117 G123R115-G119 PolarHBondContact O-N 2.9Å; F116-G119 PolarHBondContact O-N 3.33Å; F116-G119 VanDerWaalsContact O-N 3.11Å; A117-G119 VanDerWaalsContact C-N 3.32Å; A117-G119 PolarHBondContact O-N 2.97Å; G119-G123 PolarHBondContact O-N 3.36Å; G119-G123 VanDerWaalsContact O-N 3.09Å
120L82.8Confident75.2Confident96 Ų96102.4 Ų102.450%0.50361%0.605SS.*Hα-helixtrans-67.3-40173.1-63.7174.8000112.1F116 A117 R118F116-L120 HydrophobicContact CD1-CD1 4.14Å; F116-L120 HydrophobicContact CE1-CD1 3.6Å; F116-L120 HydrophobicContact CE1-CG 4.32Å; F116-L120 HydrophobicContact CZ-CD1 3.93Å; F116-L120 HydrophobicContact CZ-CD2 4.3Å; F116-L120 HydrophobicContact CZ-CG 4.31Å; F116-L120 PolarHBondContact O-N 3.48Å; F116-L120 VanDerWaalsContact O-N 3.1Å; A117-L120 WeakPolarHBondContact O-CB 3.48Å; A117-L120 PolarHBondContact O-N 3.17Å; R118-L120 VanDerWaalsContact C-N 3.28Å; R118-L120 PolarHBondContact O-N 3.1Å
121E74.7Confident72.8Confident165 Ų165101.5 Ų101.577%0.77161%0.612SS**Hα-helixtrans-74.3-38.2180-63.7-63.4135.400113A117 R118A117-E121 WeakPolarHBondContact O-CG 3.41Å; A117-E121 PolarHBondContact O-N 3.41Å; A117-E121 VanDerWaalsContact O-N 3.15Å; R118-E121 PolarHBondContact O-N 3.47Å
122A67.4Low70.4Confident93 Ų93105.6 Ų105.677%0.76964%0.636SS**Hα-helixtrans-80.2-26-179.200000113.2R118 G124R118-A122 WeakPolarHBondContact O-CB 3.44Å; R118-A122 PolarHBondContact O-N 2.97Å; A122-G124 VanDerWaalsContact C-N 3.34Å; A122-G124 PolarHBondContact O-N 3.01Å
123G56.8Low68.6Low41 Ų41115.1 Ų115.142%0.42366%0.661SS.*SBendtrans-9264170.100000110.8G119 G125G119-G123 PolarHBondContact O-N 3.36Å; G119-G123 VanDerWaalsContact O-N 3.09Å; G123-G125 PolarHBondContact O-N 3.2Å
124G49.1Very low66.6Low52 Ų52116.1 Ų116.154%0.53667%0.667SS.*  trans-47.9121.4-174.700000113.1A122 T126A122-G124 VanDerWaalsContact C-N 3.34Å; A122-G124 PolarHBondContact O-N 3.01Å; G124-T126 PolarHBondContact O-N 2.7Å; G124-T126 PolarHBondContact O-OG1 3.09Å
125G53Low64.8Low79 Ų79118 Ų11881%0.81468%0.68SS**SBendtrans59.9-15.1152.500000120.4G123G123-G125 PolarHBondContact O-N 3.2Å
126T50.3Low62.9Low120 Ų120115.7 Ų115.774%0.73669%0.686SS**SBendtrans-109.2-11.5-162-56.90000114.3G124G124-T126 PolarHBondContact O-N 2.7Å; G124-T126 PolarHBondContact O-OG1 3.09Å
127L49.8Very low60.7Low135 Ų135112.9 Ų112.971%0.70769%0.688SS**SBendtrans-95.8-4.5176.1-69.4-177.9000115.1A129 T130L127-A129 PolarHBondContact O-N 3.03Å; L127-A129 VanDerWaalsContact O-N 3.16Å; L127-T130 PolarHBondContact O-N 3.44Å
128L51.8Low58.9Low169 Ų169115.6 Ų115.689%0.88570%0.704SS**THydrogen-bonded Turntrans-73.5-2.8179.8-140.483.1000113.9
129A53Low57.3Low91 Ų91112.5 Ų112.575%0.75271%0.706SS**THydrogen-bonded Turntrans-92.5-15.3177.500000114.1L127L127-A129 PolarHBondContact O-N 3.03Å; L127-A129 VanDerWaalsContact O-N 3.16Å
130T55.6Low55.9Low117 Ų117117.1 Ų117.172%0.71872%0.718SS**SBendtrans-147.976.5-17758.70000112.2L127L127-T130 PolarHBondContact O-N 3.44Å
131A45.9Very low54.5Low79 Ų79117.9 Ų117.965%0.65373%0.727SS**  trans-136.2128.6156.600000108.8R133A131-R133 PolarHBondContact O-N 3.35Å
132P48Very low53.7Low112 Ų112117.2 Ų117.273%0.72773%0.727SS**  trans-65.3138.4-177.729.6-33.2000108.5L134P132-L134 VanDerWaalsContact C-N 3.31Å; P132-L134 PolarHBondContact O-N 3.04Å
133R57.3Low53.1Low249 Ų249118.2 Ų118.294%0.9472%0.723SS**  trans-6493.9172.3-71.3-160.1163.1-153.3-4.1109.1A131 N135A131-R133 PolarHBondContact O-N 3.35Å; R133-N135 PolarHBondContact O-N 3.17Å; R133-N135 VanDerWaalsContact O-N 3.1Å
134L54.2Low53.6Low144 Ų144125.5 Ų125.575%0.75474%0.743SS**  trans-73.699.6162.4-67.4177.2000107P132 T136P132-L134 VanDerWaalsContact C-N 3.31Å; P132-L134 PolarHBondContact O-N 3.04Å; L134-T136 VanDerWaalsContact C-N 3.33Å; L134-T136 PolarHBondContact O-N 3.14Å
135N56.4Low54.1Low140 Ų140127.7 Ų127.775%0.74975%0.75SS**  trans-56.489.816653.2-6.9000110.3R133 A137R133-N135 PolarHBondContact O-N 3.17Å; R133-N135 VanDerWaalsContact O-N 3.1Å; N135-A137 PolarHBondContact O-N 3.26Å
136T54.8Low54.6Low129 Ų129129.8 Ų129.879%0.79175%0.75SS**  trans-73.576.7165.3-38.20000108.5L134 S138L134-T136 VanDerWaalsContact C-N 3.33Å; L134-T136 PolarHBondContact O-N 3.14Å; T136-S138 PolarHBondContact O-N 3.38Å
137A47.1Very low55Low80 Ų80133.4 Ų133.466%0.66176%0.758SS**  trans-69.795.5170.400000108.1N135 V139N135-A137 PolarHBondContact O-N 3.26Å; A137-V139 PolarHBondContact O-N 3.38Å
138S54.3Low55.3Low102 Ų102135.7 Ų135.771%0.71377%0.765SS**  trans-66.7101.1165.8-64.10000108.3T136 I140T136-S138 PolarHBondContact O-N 3.38Å; S138-I140 PolarHBondContact O-N 3.23Å; S138-I140 VanDerWaalsContact O-N 3.16Å
139V57.6Low55.3Low123 Ų123133.5 Ų133.575%0.74576%0.761SS**  trans-67.2108.8170.8175.70000107.9A137 T141A137-V139 PolarHBondContact O-N 3.38Å; V139-T141 PolarHBondContact O-N 3.16Å
140I54.3Low55.2Low144 Ų144138.2 Ų138.274%0.73877%0.768SS**  trans-83.799169.3-58.1175.1000106.7S138 I142S138-I140 PolarHBondContact O-N 3.23Å; S138-I140 VanDerWaalsContact O-N 3.16Å; I140-I142 HydrophobicContact CG2-CG1 4.12Å; I140-I142 PolarHBondContact O-N 3.31Å; I140-I142 VanDerWaalsContact O-N 3.12Å
141T53.1Low55Low111 Ų111141.8 Ų141.868%0.68178%0.776SS**  trans-74.799.4171.7-42.50000108.6V139 V143V139-T141 PolarHBondContact O-N 3.16Å; T141-V143 HydrophobicContact CG2-CG2 4.19Å; T141-V143 PolarHBondContact O-N 3.48Å; T141-V143 VanDerWaalsContact O-N 3.14Å
142I57.1Low55.3Low151 Ų151146.9 Ų146.977%0.77479%0.787SS**  trans-76.996.8168.8-57.6176000107.2I140 K144I140-I142 HydrophobicContact CG2-CG1 4.12Å; I140-I142 PolarHBondContact O-N 3.31Å; I140-I142 VanDerWaalsContact O-N 3.12Å; I142-K144 PolarHBondContact O-N 2.83Å
143V56.1Low55.3Low114 Ų114153 Ų15369%0.69180%0.795SS**  trans-74.7108.2169.4-178.80000107.6T141 S145T141-V143 HydrophobicContact CG2-CG2 4.19Å; T141-V143 PolarHBondContact O-N 3.48Å; T141-V143 VanDerWaalsContact O-N 3.14Å; V143-S145 PolarHBondContact O-N 3.1Å; V143-S145 VanDerWaalsContact O-N 3.17Å
144K66.1Low55Low194 Ų194150.1 Ų150.184%0.84379%0.793SS**  trans-72.2102.8173.1-176.9159.9-178.5167.30109I142I142-K144 PolarHBondContact O-N 2.83Å
145S61.1Low54.8Low98 Ų98152.3 Ų152.369%0.68580%0.799SS**PPolyproline II helixtrans-65.9134.3173.5-50.10000110.4V143V143-S145 PolarHBondContact O-N 3.1Å; V143-S145 VanDerWaalsContact O-N 3.17Å
146P63.7Low54.4Low123 Ų123154.7 Ų154.780%0.79981%0.805SS**PPolyproline II helixtrans-67.7138.4172.826.8-31.3000110.3Q148P146-Q148 PolarHBondContact O-N 2.93Å
147Q57.1Low54.9Low197 Ų197154.2 Ų154.292%0.92180%0.804SS**PPolyproline II helixtrans-63.6121.6174.3-74.2-173.3-49.800109.7
148Q56.1Low55.6Low182 Ų182159.7 Ų159.785%0.8584%0.838SS**PPolyproline II helixtrans-73.1136.1168.9-76.8-177.4-24.900109.8P146 Q150P146-Q148 PolarHBondContact O-N 2.93Å; Q148-Q150 PolarHBondContact O-N 2.82Å
149P52Low55.7Low123 Ų123162.6 Ų162.680%0.79984%0.844SS**PPolyproline II helixtrans-67.8132.7173.826.4-31.1000110.6Q151P149-Q151 PolarHBondContact O-N 3.16Å
150Q51.8Low55.6Low191 Ų191164.7 Ų164.789%0.89385%0.85SS**  trans-69.7109.3-178.3-145.6160.2-37.300109.3Q148 Q152Q148-Q150 PolarHBondContact O-N 2.82Å; Q150-Q152 PolarHBondContact O-N 3.12Å
151Q51.4Low55.7Low191 Ų191165.8 Ų165.889%0.89386%0.856SS**  trans-70.1123.3169.9-86.6-179-32.200109.3P149 R153P149-Q151 PolarHBondContact O-N 3.16Å; Q151-R153 PolarHBondContact O-N 3.48Å
152Q51.8Low55.8Low186 Ų186169.1 Ų169.187%0.86987%0.866SS**  trans-62124.7174.8-70.7173.8-22.500109.1Q150 E154Q150-Q152 PolarHBondContact O-N 3.12Å; Q152-E154 PolarHBondContact O-N 3.24Å
153R48Very low55.8Low241 Ų241170.2 Ų170.291%0.90987%0.872SS**  trans-74.1104.2173.8-162.6-171.2-71.1-172.4-2.4107.3Q151Q151-R153 PolarHBondContact O-N 3.48Å
154E50.4Low55.7Low189 Ų189173.9 Ų173.988%0.88388%0.884SS**PPolyproline II helixtrans-62.3132.2170-71.5-178.6137.600109.5Q152Q152-E154 PolarHBondContact O-N 3.24Å
155Q51.3Low55Low189 Ų189172.5 Ų172.588%0.88389%0.887SS**PPolyproline II helixtrans-85126.3172.7-69.2177.18.300108.4
156E46.7Very low54.5Low190 Ų190178.2 Ų178.289%0.88890%0.902SS**PPolyproline II helixtrans-83.5138.7160.4-87.7-143.7125.500110.2
157P65.6Low53.8Low119 Ų119182.8 Ų182.877%0.77391%0.911SS**PPolyproline II helixtrans-85.1155.2172.135.3-30.7000111.5
158S62.8Low53.5Low196 Ų196181.5 Ų181.5100%1.37191%0.91SS**  trans-67.50169.2-67.50000113.4

Retrieved 158 of 158 residues in 288.2 ms (Link to these results)