A0A087Y2X1_POEFO Loading...

Coiled-coil domain containing 13

AlphaFold DB , UniProt , Accession A0A087Y2X1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 514 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
1D62.9Low79.3Confident181 Ų181102.2 Ų102.297%0.96858%0.582SS**  0-43.60-61.8-10.8000114.3A3 V4 S5D1-A3 PolarHBondContact O-N 3.38Å; D1-V4 PolarHBondContact O-N 2.98Å; D1-S5 PolarHBondContact O-N 3.23Å
2D65.8Low80.3Confident147 Ų147101.2 Ų101.279%0.78657%0.573SS**Hα-helixtrans-62-35.9-177.8-67.4-30.5000115.5V4 S5 S6D2-V4 PolarHBondContact O-N 3.48Å; D2-S5 PolarHBondContact O-N 2.66Å; D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 2.99Å
3A70.1Confident81.1Confident76 Ų76103.3 Ų103.363%0.62857%0.572SS**Hα-helixtrans-66.3-38178.900000112.7D1 S6 V7D1-A3 PolarHBondContact O-N 3.38Å; A3-S6 PolarHBondContact O-N 3.35Å; A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 3.46Å; A3-V7 VanDerWaalsContact O-N 3.17Å
4V76.4Confident82Confident92 Ų92104.2 Ų104.256%0.55857%0.57SS**Hα-helixtrans-73.2-39.5179.9179.70000110.6D1 D2 S6 V7 I8D1-V4 PolarHBondContact O-N 2.98Å; D2-V4 PolarHBondContact O-N 3.48Å; V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.06Å; V4-V7 PolarHBondContact O-N 2.95Å; V4-I8 HydrophobicContact CG1-CD1 3.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.33Å
5S78.8Confident82.7Confident59 Ų59104.7 Ų104.741%0.41357%0.566SS.*Hα-helixtrans-62.7-37.7174.3-168.40000112.2D1 D2 R9D1-S5 PolarHBondContact O-N 3.23Å; D2-S5 PolarHBondContact O-N 2.66Å; S5-R9 WeakPolarHBondContact O-CB 3.36Å; S5-R9 PolarHBondContact O-N 2.98Å
6S82Confident83.4Confident66 Ų66104 Ų10446%0.46256%0.562SS.*Hα-helixtrans-62.9-46.1174.8-1730000112.2D2 A3 V4 R9 S10D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 2.99Å; A3-S6 PolarHBondContact O-N 3.35Å; V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.06Å; S6-R9 PolarHBondContact O-N 3.4Å; S6-S10 PolarHBondContact O-N 3.26Å; S6-S10 PolarHBondContact O-OG 3.25Å
7V85.4Confident84.1Confident85 Ų85105.4 Ų105.452%0.51557%0.565SS.*Hα-helixtrans-64.1-43.6179.21720000111.8A3 V4 R9 S10 L11A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 3.46Å; A3-V7 VanDerWaalsContact O-N 3.17Å; V4-V7 PolarHBondContact O-N 2.95Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 2.98Å; V7-S10 PolarHBondContact O-N 2.97Å; V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 PolarHBondContact O-N 3.49Å
8I86.6Confident84.7Confident93 Ų93104.4 Ų104.448%0.47756%0.558SS.*Hα-helixtrans-63-40.7176.6-67.2168.6000110.8V4 S10 L11 L12V4-I8 HydrophobicContact CG1-CD1 3.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.33Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.39Å; I8-L11 PolarHBondContact O-N 3.27Å; I8-L12 HydrophobicContact CG2-CD1 3.93Å; I8-L12 HydrophobicContact CG2-CG 4.44Å; I8-L12 WeakPolarHBondContact O-CB 3.42Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.93Å
9R87.7Confident85.3Confident155 Ų155103.1 Ų103.159%0.58555%0.55SS**Hα-helixtrans-65.5-37177.1-169.1-178.8-65157.81.6112S5 S6 V7 K13S5-R9 WeakPolarHBondContact O-CB 3.36Å; S5-R9 PolarHBondContact O-N 2.98Å; S6-R9 PolarHBondContact O-N 3.4Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 2.98Å; R9-K13 VanDerWaalsContact O-CG 3.31Å; R9-K13 WeakPolarHBondContact O-CG 3.43Å; R9-K13 PolarHBondContact O-N 3.45Å; R9-K13 VanDerWaalsContact O-N 3.11Å
10S87.1Confident85.8Confident70 Ų70103.6 Ų103.649%0.4955%0.552SS.*Hα-helixtrans-68.1-43175.1-64.20000112S6 V7 I8 K13 E14S6-S10 PolarHBondContact O-N 3.26Å; S6-S10 PolarHBondContact O-OG 3.25Å; V7-S10 PolarHBondContact O-N 2.97Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.39Å; S10-K13 PolarHBondContact O-N 2.87Å; S10-E14 PolarHBondContact O-N 2.91Å
11L89.8Confident86.4Confident100 Ų100101.8 Ų101.852%0.52454%0.543SS..Hα-helixtrans-62.8-41.8175.7-84.1157.3000112.7V7 I8 K13 E14 Q15V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 PolarHBondContact O-N 3.49Å; I8-L11 PolarHBondContact O-N 3.27Å; L11-K13 VanDerWaalsContact C-N 3.35Å; L11-E14 PolarHBondContact O-N 2.94Å; L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 3.32Å
12L90.8Very high88Confident90 Ų9097.8 Ų97.847%0.47152%0.518SS..Hα-helixtrans-64.3-40.5176-75.2168.5000111.6I8 Q15 D16I8-L12 HydrophobicContact CG2-CD1 3.93Å; I8-L12 HydrophobicContact CG2-CG 4.44Å; I8-L12 WeakPolarHBondContact O-CB 3.42Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.93Å; L12-Q15 PolarHBondContact O-N 3.49Å; L12-D16 WeakPolarHBondContact O-CB 3.43Å; L12-D16 VanDerWaalsContact O-CG 3.28Å; L12-D16 PolarHBondContact O-N 2.83Å
13K91.4Very high89.4Confident129 Ų12994.7 Ų94.756%0.56150%0.501SS*.Hα-helixtrans-62.9-43.4174.8-77.7178.2175.4-169.20112.3R9 S10 L11 Q15 D16 E17R9-K13 VanDerWaalsContact O-CG 3.31Å; R9-K13 WeakPolarHBondContact O-CG 3.43Å; R9-K13 PolarHBondContact O-N 3.45Å; R9-K13 VanDerWaalsContact O-N 3.11Å; S10-K13 PolarHBondContact O-N 2.87Å; L11-K13 VanDerWaalsContact C-N 3.35Å; K13-Q15 VanDerWaalsContact C-N 3.32Å; K13-Q15 PolarHBondContact O-N 2.9Å; K13-D16 PolarHBondContact O-N 3.33Å; K13-E17 WeakPolarHBondContact O-CG 3.48Å; K13-E17 PolarHBondContact O-N 3.37Å
14E92.9Very high90.7Very high116 Ų11697.5 Ų97.554%0.54250%0.496SS..Hα-helixtrans-63.7-40.1177.3-171.1172.7-168.600111.2S10 L11 E17 I18S10-E14 PolarHBondContact O-N 2.91Å; L11-E14 PolarHBondContact O-N 2.94Å; E14-E17 PolarHBondContact O-N 2.81Å; E14-I18 HydrophobicContact CG-CD1 4.39Å; E14-I18 WeakPolarHBondContact O-CD1 3.49Å; E14-I18 VanDerWaalsContact O-CG1 3.27Å; E14-I18 WeakPolarHBondContact O-CG1 3.4Å; E14-I18 PolarHBondContact O-N 2.91Å
15Q93.3Very high91.7Very high111 Ų11198.9 Ų98.952%0.51950%0.496SS..Hα-helixtrans-66.2-41.3174.8-170.9173.98.600112.6L11 L12 K13 E17 I18 L19L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 3.32Å; L12-Q15 PolarHBondContact O-N 3.49Å; K13-Q15 VanDerWaalsContact C-N 3.32Å; K13-Q15 PolarHBondContact O-N 2.9Å; Q15-E17 VanDerWaalsContact C-N 3.34Å; Q15-I18 PolarHBondContact O-N 3.49Å; Q15-L19 HydrophobicContact CG-CD1 4.33Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.3Å
16D93.2Very high92.5Very high94 Ų94100.9 Ų100.950%0.50350%0.502SS..Hα-helixtrans-63.7-40.3175.6-75-22.8000111.2L12 K13 L19 L20L12-D16 WeakPolarHBondContact O-CB 3.43Å; L12-D16 VanDerWaalsContact O-CG 3.28Å; L12-D16 PolarHBondContact O-N 2.83Å; K13-D16 PolarHBondContact O-N 3.33Å; D16-L19 PolarHBondContact O-N 2.88Å; D16-L20 WeakPolarHBondContact O-CB 3.32Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 3.1Å
17E95.1Very high93.2Very high128 Ų128106.6 Ų106.660%0.59851%0.513SS*.Hα-helixtrans-62-45.1174.9-76.9179.1-178.100111.7K13 E14 Q15 L19 L20 D21K13-E17 WeakPolarHBondContact O-CG 3.48Å; K13-E17 PolarHBondContact O-N 3.37Å; E14-E17 PolarHBondContact O-N 2.81Å; Q15-E17 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.5Å; E17-L20 PolarHBondContact O-N 3.14Å; E17-D21 PolarHBondContact O-N 3.41Å
18I95.7Very high93.8Very high88 Ų88106.9 Ų106.945%0.45151%0.511SS..Hα-helixtrans-61.7-43.8176.4-67.5163.8000111.3E14 Q15 D21 Q22E14-I18 HydrophobicContact CG-CD1 4.39Å; E14-I18 WeakPolarHBondContact O-CD1 3.49Å; E14-I18 VanDerWaalsContact O-CG1 3.27Å; E14-I18 WeakPolarHBondContact O-CG1 3.4Å; E14-I18 PolarHBondContact O-N 2.91Å; Q15-I18 PolarHBondContact O-N 3.49Å; I18-D21 PolarHBondContact O-N 3.27Å; I18-Q22 WeakPolarHBondContact O-CG 3.42Å; I18-Q22 PolarHBondContact O-N 3.36Å
19L95.8Very high94.3Very high78 Ų78107.1 Ų107.141%0.40851%0.511SS..Hα-helixtrans-66.2-38.9178.4-72.6172.1000111.7Q15 D16 E17 Q22 I23Q15-L19 HydrophobicContact CG-CD1 4.33Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.3Å; D16-L19 PolarHBondContact O-N 2.88Å; E17-L19 PolarHBondContact O-N 3.5Å; L19-Q22 PolarHBondContact O-N 2.85Å; L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.73Å
20L96.4Very high94.7Very high113 Ų113103.8 Ų103.859%0.59250%0.504SS*.Hα-helixtrans-64.1-41.1175.3-75170.6000111.7D16 E17 I23 R24D16-L20 WeakPolarHBondContact O-CB 3.32Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 3.1Å; E17-L20 PolarHBondContact O-N 3.14Å; L20-I23 PolarHBondContact O-N 2.81Å; L20-R24 PolarHBondContact O-N 2.98Å
21D96.5Very high95.2Very high66 Ų66102.1 Ų102.135%0.35350%0.498SS..Hα-helixtrans-64.5-43.3175.6-80.3-22.2000111.7E17 I18 I23 R24 E25E17-D21 PolarHBondContact O-N 3.41Å; I18-D21 PolarHBondContact O-N 3.27Å; D21-I23 PolarHBondContact O-N 2.86Å; D21-R24 WeakPolarHBondContact O-CB 3.47Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 VanDerWaalsContact O-N 3.17Å; D21-R24 IonicContact OD1-CZ 3.99Å; D21-R24 IonicContact OD1-NH1 2.76Å; D21-R24 PolarHBondContact OD1-NH1 3.24Å; D21-R24 IonicContact OD1-NH2 2.79Å; D21-R24 PolarHBondContact OD1-NH2 3.48Å; D21-E25 WeakPolarHBondContact O-CG 3.44Å; D21-E25 PolarHBondContact O-N 2.79Å
22Q96.7Very high95.6Very high97 Ų97104.8 Ų104.845%0.45350%0.501SS..Hα-helixtrans-62.3-41.8174.8-73.6177.5-2.500112.6I18 L19 R24 E25 L26I18-Q22 WeakPolarHBondContact O-CG 3.42Å; I18-Q22 PolarHBondContact O-N 3.36Å; L19-Q22 PolarHBondContact O-N 2.85Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.76Å; Q22-E25 PolarHBondContact O-N 2.82Å; Q22-L26 WeakPolarHBondContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CG 3.41Å; Q22-L26 PolarHBondContact O-N 3.5Å
23I96.3Very high95.8Very high83 Ų83105 Ų10543%0.42650%0.502SS..Hα-helixtrans-63-38.6175.8-71.1167.4000110.5L19 L20 D21 R27L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.73Å; L20-I23 PolarHBondContact O-N 2.81Å; D21-I23 PolarHBondContact O-N 2.86Å; I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.21Å; I23-R27 VanDerWaalsContact O-N 3.11Å
24R97.4Very high96.1Very high135 Ų135105.8 Ų105.851%0.50951%0.506SS..Hα-helixtrans-63.4-49.1175.9-173.1178.668.2-131-7.4111L20 D21 Q22 L26 R27 D28L20-R24 PolarHBondContact O-N 2.98Å; D21-R24 WeakPolarHBondContact O-CB 3.47Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 VanDerWaalsContact O-N 3.17Å; D21-R24 IonicContact OD1-CZ 3.99Å; D21-R24 IonicContact OD1-NH1 2.76Å; D21-R24 PolarHBondContact OD1-NH1 3.24Å; D21-R24 IonicContact OD1-NH2 2.79Å; D21-R24 PolarHBondContact OD1-NH2 3.48Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.76Å; R24-L26 PolarHBondContact O-N 2.87Å; R24-R27 PolarHBondContact O-N 3.48Å; R24-D28 PolarHBondContact O-N 2.85Å
25E96.6Very high96.3Very high121 Ų121107.2 Ų107.257%0.56551%0.51SS*.Hα-helixtrans-60.4-44.8179.4-72.8178.818000112.8D21 Q22 R27 D28 E29D21-E25 WeakPolarHBondContact O-CG 3.44Å; D21-E25 PolarHBondContact O-N 2.79Å; Q22-E25 PolarHBondContact O-N 2.82Å; E25-R27 VanDerWaalsContact C-N 3.3Å; E25-R27 PolarHBondContact O-N 3.23Å; E25-D28 PolarHBondContact O-N 2.74Å; E25-E29 PolarHBondContact O-N 3.04Å
26L96.4Very high96.5Very high101 Ų101106.2 Ų106.253%0.52951%0.508SS..Hα-helixtrans-65.7-31.8177.7-72.4173.4000112.7Q22 R24 N30Q22-L26 WeakPolarHBondContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CG 3.41Å; Q22-L26 PolarHBondContact O-N 3.5Å; R24-L26 PolarHBondContact O-N 2.87Å; L26-N30 WeakPolarHBondContact O-CB 3.14Å; L26-N30 PolarHBondContact O-N 3.03Å; L26-N30 PolarHBondContact O-ND2 3.29Å
27R96.8Very high96.6Very high186 Ų186106.6 Ų106.670%0.70251%0.509SS*.Hα-helixtrans-68.5-42.9172.8-78.6-176.6-170-160.45.1111.4I23 R24 E25 N30 G31I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.21Å; I23-R27 VanDerWaalsContact O-N 3.11Å; R24-R27 PolarHBondContact O-N 3.48Å; E25-R27 VanDerWaalsContact C-N 3.3Å; E25-R27 PolarHBondContact O-N 3.23Å; R27-N30 PolarHBondContact O-N 3.39Å; R27-G31 PolarHBondContact O-N 3.4Å
28D97.2Very high96.7Very high90 Ų90103.7 Ų103.748%0.48150%0.503SS..Hα-helixtrans-65.1-40.5178.2-70.8-18.6000111.5R24 E25 G31 R32R24-D28 PolarHBondContact O-N 2.85Å; E25-D28 PolarHBondContact O-N 2.74Å; D28-G31 PolarHBondContact O-N 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.26Å; D28-R32 PolarHBondContact O-N 3.31Å
29E97.2Very high96.7Very high99 Ų99105.4 Ų105.446%0.46351%0.509SS..Hα-helixtrans-65.6-46.5175.7-171.7168.6-157.700112.2E25 G31 R32 L33E25-E29 PolarHBondContact O-N 3.04Å; E29-G31 VanDerWaalsContact C-N 3.26Å; E29-G31 PolarHBondContact O-N 2.84Å; E29-R32 PolarHBondContact O-N 3.03Å; E29-R32 VanDerWaalsContact O-N 3.12Å; E29-L33 HydrophobicContact CG-CD1 4.36Å; E29-L33 WeakPolarHBondContact O-CG 3.37Å; E29-L33 PolarHBondContact O-N 3.38Å
30N95.6Very high96.6Very high85 Ų85106.4 Ų106.446%0.45551%0.511SS..Hα-helixtrans-57.6-41.3172.8-84.9-53000111.6L26 R27 R32 L33 F34L26-N30 WeakPolarHBondContact O-CB 3.14Å; L26-N30 PolarHBondContact O-N 3.03Å; L26-N30 PolarHBondContact O-ND2 3.29Å; R27-N30 PolarHBondContact O-N 3.39Å; N30-R32 VanDerWaalsContact C-N 3.35Å; N30-R32 PolarHBondContact O-N 3.12Å; N30-L33 PolarHBondContact O-N 3.25Å; N30-F34 WeakPolarHBondContact O-CD2 3.28Å; N30-F34 PolarHBondContact O-N 2.96Å
31G97.6Very high96.5Very high34 Ų34104.5 Ų104.535%0.35150%0.501SS..Hα-helixtrans-60.6-40.5175.500000113.3R27 D28 E29 K35R27-G31 PolarHBondContact O-N 3.4Å; D28-G31 PolarHBondContact O-N 3.28Å; E29-G31 VanDerWaalsContact C-N 3.26Å; E29-G31 PolarHBondContact O-N 2.84Å; G31-K35 WeakPolarHBondContact O-CG 3.48Å; G31-K35 PolarHBondContact O-N 3.38Å
32R97.9Very high96.3Very high157 Ų157108.3 Ų108.359%0.59252%0.515SS*.Hα-helixtrans-66-43.7173.8-72.4-173.2-69.6-100.21.8111.8D28 E29 N30 K35 L36D28-R32 WeakPolarHBondContact O-CG 3.26Å; D28-R32 PolarHBondContact O-N 3.31Å; E29-R32 PolarHBondContact O-N 3.03Å; E29-R32 VanDerWaalsContact O-N 3.12Å; N30-R32 VanDerWaalsContact C-N 3.35Å; N30-R32 PolarHBondContact O-N 3.12Å; R32-K35 PolarHBondContact O-N 3.48Å; R32-L36 PolarHBondContact O-N 3.27Å
33L96.7Very high96Very high94 Ų94108 Ų10849%0.49251%0.513SS..Hα-helixtrans-63-42.3178.3-70.6173.8000112E29 N30 K35 L36 L37E29-L33 HydrophobicContact CG-CD1 4.36Å; E29-L33 WeakPolarHBondContact O-CG 3.37Å; E29-L33 PolarHBondContact O-N 3.38Å; N30-L33 PolarHBondContact O-N 3.25Å; L33-K35 VanDerWaalsContact C-N 3.34Å; L33-K35 PolarHBondContact O-N 3Å; L33-L36 PolarHBondContact O-N 3.46Å; L33-L37 VanDerWaalsContact O-CB 3.29Å; L33-L37 WeakPolarHBondContact O-CB 3.19Å; L33-L37 PolarHBondContact O-N 2.86Å
34F97.4Very high95.4Very high145 Ų145109.2 Ų109.264%0.63652%0.52SS*.Hα-helixtrans-61.8-38.9175.7-88.1-67000112.9N30 S38N30-F34 WeakPolarHBondContact O-CD2 3.28Å; N30-F34 PolarHBondContact O-N 2.96Å; F34-S38 PolarHBondContact O-N 2.9Å; F34-S38 PolarHBondContact O-OG 2.8Å
35K97.3Very high94.8Very high147 Ų147109.8 Ų109.864%0.63953%0.525SS*.Hα-helixtrans-66.2-44.9175-73.4178.9-178.4178.90111.9G31 R32 L33 L37 S38 E39G31-K35 WeakPolarHBondContact O-CG 3.48Å; G31-K35 PolarHBondContact O-N 3.38Å; R32-K35 PolarHBondContact O-N 3.48Å; L33-K35 VanDerWaalsContact C-N 3.34Å; L33-K35 PolarHBondContact O-N 3Å; K35-L37 VanDerWaalsContact C-N 3.31Å; K35-L37 PolarHBondContact O-N 3.43Å; K35-S38 PolarHBondContact O-N 3.33Å; K35-S38 PolarHBondContact O-OG 3.16Å; K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 2.79Å
36L97.1Very high93.9Very high90 Ų90108.7 Ų108.747%0.47152%0.52SS..Hα-helixtrans-64-39.7177.9-175.563.9000111.5R32 L33 E39 K40R32-L36 PolarHBondContact O-N 3.27Å; L33-L36 PolarHBondContact O-N 3.46Å; L36-E39 PolarHBondContact O-N 3.41Å; L36-K40 VanDerWaalsContact O-CG 3.29Å; L36-K40 WeakPolarHBondContact O-CG 3.39Å; L36-K40 PolarHBondContact O-N 3.03Å
37L96.2Very high92.9Very high101 Ų101108.9 Ų108.953%0.52952%0.521SS..Hα-helixtrans-64.4-41.7177.9-166.6143.3000111.2L33 K35 K40 D41L33-L37 VanDerWaalsContact O-CB 3.29Å; L33-L37 WeakPolarHBondContact O-CB 3.19Å; L33-L37 PolarHBondContact O-N 2.86Å; K35-L37 VanDerWaalsContact C-N 3.31Å; K35-L37 PolarHBondContact O-N 3.43Å; L37-K40 PolarHBondContact O-N 2.98Å; L37-D41 WeakPolarHBondContact CD2-OD2 3.48Å; L37-D41 WeakPolarHBondContact O-CB 3.16Å; L37-D41 PolarHBondContact O-N 3.44Å
38S95.7Very high91.7Very high68 Ų68103.1 Ų103.148%0.47651%0.514SS..Hα-helixtrans-67.7-36.6176.669.40000113.1F34 K35 F42F34-S38 PolarHBondContact O-N 2.9Å; F34-S38 PolarHBondContact O-OG 2.8Å; K35-S38 PolarHBondContact O-N 3.33Å; K35-S38 PolarHBondContact O-OG 3.16Å; S38-F42 WeakPolarHBondContact O-CB 3.42Å; S38-F42 PolarHBondContact O-N 2.96Å
39E96Very high90Very high123 Ų123104.9 Ų104.958%0.57552%0.522SS*.Hα-helixtrans-62.1-45.4171.5-75174.1-168.300111.6K35 L36 F42 E43K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 2.79Å; L36-E39 PolarHBondContact O-N 3.41Å; E39-F42 WeakPolarHBondContact O-CB 3.21Å; E39-F42 PolarHBondContact O-N 3.47Å; E39-E43 PolarHBondContact O-N 2.88Å
40K94.4Very high88.2Confident100 Ų100104.3 Ų104.344%0.43553%0.525SS..Hα-helixtrans-67.9-38.6178.3-67.9-69.9147.8-167.20112.4L36 L37 F42 E43 I44L36-K40 VanDerWaalsContact O-CG 3.29Å; L36-K40 WeakPolarHBondContact O-CG 3.39Å; L36-K40 PolarHBondContact O-N 3.03Å; L37-K40 PolarHBondContact O-N 2.98Å; K40-F42 VanDerWaalsContact C-N 3.28Å; K40-F42 PolarHBondContact O-N 3.25Å; K40-E43 IonicContact NZ-OE2 3.07Å; K40-E43 PolarHBondContact NZ-OE2 2.79Å; K40-E43 PolarHBondContact O-N 3.48Å; K40-I44 WeakPolarHBondContact O-CB 3.25Å; K40-I44 VanDerWaalsContact O-CG1 3.27Å; K40-I44 WeakPolarHBondContact O-CG1 3.47Å; K40-I44 PolarHBondContact O-N 2.91Å
41D93.6Very high86.2Confident73 Ų73103.5 Ų103.539%0.3954%0.537SS..Hα-helixtrans-62.5-38.1173.3-82.7-20.3000111.8L37 K45L37-D41 WeakPolarHBondContact CD2-OD2 3.48Å; L37-D41 WeakPolarHBondContact O-CB 3.16Å; L37-D41 PolarHBondContact O-N 3.44Å; D41-K45 WeakPolarHBondContact O-CB 3.38Å; D41-K45 VanDerWaalsContact O-CG 3.24Å; D41-K45 WeakPolarHBondContact O-CG 3.46Å; D41-K45 PolarHBondContact O-N 2.77Å
42F93.1Very high84Confident146 Ų146105 Ų10564%0.6454%0.542SS*.Hα-helixtrans-66-43.4174.3-172.4-93.1000111.4S38 E39 K40 K45 H46S38-F42 WeakPolarHBondContact O-CB 3.42Å; S38-F42 PolarHBondContact O-N 2.96Å; E39-F42 WeakPolarHBondContact O-CB 3.21Å; E39-F42 PolarHBondContact O-N 3.47Å; K40-F42 VanDerWaalsContact C-N 3.28Å; K40-F42 PolarHBondContact O-N 3.25Å; F42-K45 PolarHBondContact O-N 3.47Å; F42-H46 WeakPolarHBondContact O-CB 3.44Å; F42-H46 PolarHBondContact O-N 3.09Å
43E90.3Very high81.9Confident90 Ų90100.7 Ų100.742%0.42154%0.537SS..Hα-helixtrans-62.2-43.7176-169.9175.1-169.700111.9E39 K40 K45 H46 L47E39-E43 PolarHBondContact O-N 2.88Å; K40-E43 IonicContact NZ-OE2 3.07Å; K40-E43 PolarHBondContact NZ-OE2 2.79Å; K40-E43 PolarHBondContact O-N 3.48Å; E43-K45 PolarHBondContact O-N 2.82Å; E43-H46 PolarHBondContact O-N 3.4Å; E43-L47 HydrophobicContact CG-CD1 4.07Å; E43-L47 HydrophobicContact CG-CG 4.46Å; E43-L47 WeakPolarHBondContact O-CB 3.23Å; E43-L47 VanDerWaalsContact O-CG 3.28Å; E43-L47 WeakPolarHBondContact O-CG 3.4Å; E43-L47 PolarHBondContact O-N 3.15Å
44I83.1Confident80.1Confident109 Ų10998.7 Ų98.756%0.55954%0.539SS*.Hα-helixtrans-61.5-45.1174.9-70.1165.6000110.6K40 H46 L47 A48K40-I44 WeakPolarHBondContact O-CB 3.25Å; K40-I44 VanDerWaalsContact O-CG1 3.27Å; K40-I44 WeakPolarHBondContact O-CG1 3.47Å; K40-I44 PolarHBondContact O-N 2.91Å; I44-H46 VanDerWaalsContact C-N 3.34Å; I44-H46 PolarHBondContact O-N 3.08Å; I44-L47 PolarHBondContact O-N 2.77Å; I44-A48 VanDerWaalsContact O-CB 3.24Å; I44-A48 WeakPolarHBondContact O-CB 3.33Å; I44-A48 PolarHBondContact O-N 3.01Å
45K84.2Confident78.2Confident146 Ų14698.9 Ų98.964%0.63555%0.545SS*.Hα-helixtrans-62.8-41.5176.2-75.3170.7-173.4170.80111.6D41 F42 E43 A48 L49D41-K45 WeakPolarHBondContact O-CB 3.38Å; D41-K45 VanDerWaalsContact O-CG 3.24Å; D41-K45 WeakPolarHBondContact O-CG 3.46Å; D41-K45 PolarHBondContact O-N 2.77Å; F42-K45 PolarHBondContact O-N 3.47Å; E43-K45 PolarHBondContact O-N 2.82Å; K45-A48 PolarHBondContact O-N 3.43Å; K45-L49 VanDerWaalsContact O-CB 3.32Å; K45-L49 WeakPolarHBondContact O-CB 3.11Å; K45-L49 PolarHBondContact O-N 2.94Å
46H79.2Confident76.4Confident98 Ų9895 Ų9545%0.45454%0.54SS..Hα-helixtrans-67.3-42.3178-177-88.5000112F42 E43 I44 L49 T50F42-H46 WeakPolarHBondContact O-CB 3.44Å; F42-H46 PolarHBondContact O-N 3.09Å; E43-H46 PolarHBondContact O-N 3.4Å; I44-H46 VanDerWaalsContact C-N 3.34Å; I44-H46 PolarHBondContact O-N 3.08Å; H46-L49 PolarHBondContact O-N 3.47Å; H46-T50 PolarHBondContact CE1-OG1 3.45Å; H46-T50 VanDerWaalsContact CE1-OG1 3.28Å; H46-T50 VanDerWaalsContact O-CB 3.26Å; H46-T50 WeakPolarHBondContact O-CB 3.33Å; H46-T50 PolarHBondContact O-N 2.92Å; H46-T50 PolarHBondContact O-OG1 2.83Å
47L75.2Confident75.1Confident106 Ų10692.3 Ų92.356%0.55554%0.535SS*.Hα-helixtrans-69.5-32.9174.7-71173.1000112.1E43 I44 G51E43-L47 HydrophobicContact CG-CD1 4.07Å; E43-L47 HydrophobicContact CG-CG 4.46Å; E43-L47 WeakPolarHBondContact O-CB 3.23Å; E43-L47 VanDerWaalsContact O-CG 3.28Å; E43-L47 WeakPolarHBondContact O-CG 3.4Å; E43-L47 PolarHBondContact O-N 3.15Å; I44-L47 PolarHBondContact O-N 2.77Å; L47-G51 WeakPolarHBondContact O-CA 3.43Å; L47-G51 PolarHBondContact O-N 3.27Å
48A70.1Confident74Confident65 Ų6589.9 Ų89.954%0.53753%0.529SS..Hα-helixtrans-66.7-39.8171.100000111.2I44 K45 S52I44-A48 VanDerWaalsContact O-CB 3.24Å; I44-A48 WeakPolarHBondContact O-CB 3.33Å; I44-A48 PolarHBondContact O-N 3.01Å; K45-A48 PolarHBondContact O-N 3.43Å; A48-S52 WeakPolarHBondContact O-CB 3.47Å; A48-S52 PolarHBondContact O-N 3.23Å; A48-S52 VanDerWaalsContact O-N 3.08Å
49L62.7Low73.2Confident126 Ų12691.2 Ų91.266%0.6653%0.534SS*.Hα-helixtrans-71.1-40.5177.6-170.866000112.3K45 H46 S52K45-L49 VanDerWaalsContact O-CB 3.32Å; K45-L49 WeakPolarHBondContact O-CB 3.11Å; K45-L49 PolarHBondContact O-N 2.94Å; H46-L49 PolarHBondContact O-N 3.47Å; L49-S52 PolarHBondContact O-OG 2.77Å
50T59.4Low72.4Confident87 Ų8787.6 Ų87.653%0.53453%0.526SS..Hα-helixtrans-86-30.7-177.6-46.40000112.4H46 S52H46-T50 PolarHBondContact CE1-OG1 3.45Å; H46-T50 VanDerWaalsContact CE1-OG1 3.28Å; H46-T50 VanDerWaalsContact O-CB 3.26Å; H46-T50 WeakPolarHBondContact O-CB 3.33Å; H46-T50 PolarHBondContact O-N 2.92Å; H46-T50 PolarHBondContact O-OG1 2.83Å; T50-S52 VanDerWaalsContact C-N 3.27Å
51G52.9Low71.8Confident68 Ų6885.4 Ų85.470%0.70153%0.526SS*.Hα-helixtrans-73.5-18.7169.900000112.7L47 S53L47-G51 WeakPolarHBondContact O-CA 3.43Å; L47-G51 PolarHBondContact O-N 3.27Å; G51-S53 PolarHBondContact O-N 3.47Å
52S51.1Low71.4Confident66 Ų6685.8 Ų85.846%0.46253%0.531SS..SBendtrans-78.293.215491.80000108A48 L49 T50 G54A48-S52 WeakPolarHBondContact O-CB 3.47Å; A48-S52 PolarHBondContact O-N 3.23Å; A48-S52 VanDerWaalsContact O-N 3.08Å; L49-S52 PolarHBondContact O-OG 2.77Å; T50-S52 VanDerWaalsContact C-N 3.27Å; S52-G54 PolarHBondContact O-N 3.25Å
53S54.6Low71.4Confident67 Ų6783.4 Ų83.447%0.46952%0.521SS..  trans-65.475.6166-1720000108.7G51 L55 A56 G57G51-S53 PolarHBondContact O-N 3.47Å; S53-L55 PolarHBondContact O-N 3.01Å; S53-L55 VanDerWaalsContact O-N 3.13Å; S53-A56 WeakPolarHBondContact OG-CB 3.09Å; S53-G57 VanDerWaalsContact O-CA 3.3Å; S53-G57 WeakPolarHBondContact O-CA 3.36Å; S53-G57 PolarHBondContact O-N 3.48Å; S53-G57 PolarHBondContact OG-N 2.94Å
54G57.9Low71.5Confident52 Ų5284.2 Ų84.254%0.53653%0.527SS..THydrogen-bonded Turntrans-67.2-15.5-165.500000114.6S52 A58S52-G54 PolarHBondContact O-N 3.25Å; G54-A58 WeakPolarHBondContact O-CB 3.49Å
55L58.3Low72Confident148 Ų14883.8 Ų83.878%0.77553%0.529SS*.THydrogen-bonded Turntrans-111.4-50.2173.9-115.974.1000112.6S53 A58 V59S53-L55 PolarHBondContact O-N 3.01Å; S53-L55 VanDerWaalsContact O-N 3.13Å; L55-A58 PolarHBondContact O-N 3.39Å; L55-V59 WeakPolarHBondContact O-CB 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.84Å
56A59.8Low72.5Confident65 Ų6581.5 Ų81.554%0.53752%0.521SS..Hα-helixtrans-74.9-36.1-176.900000112.7S53 V59 A60S53-A56 WeakPolarHBondContact OG-CB 3.09Å; A56-V59 PolarHBondContact O-N 2.7Å; A56-A60 VanDerWaalsContact O-CB 3.32Å; A56-A60 WeakPolarHBondContact O-CB 3.46Å; A56-A60 PolarHBondContact O-N 3.3Å
57G69.5Low73.3Confident35 Ų3581.3 Ų81.336%0.36152%0.522SS..Hα-helixtrans-67-37.7171.200000112.6S53 A60 A61S53-G57 VanDerWaalsContact O-CA 3.3Å; S53-G57 WeakPolarHBondContact O-CA 3.36Å; S53-G57 PolarHBondContact O-N 3.48Å; S53-G57 PolarHBondContact OG-N 2.94Å; G57-A60 PolarHBondContact O-N 3.43Å; G57-A61 VanDerWaalsContact O-CB 3.24Å; G57-A61 WeakPolarHBondContact O-CB 3.32Å; G57-A61 PolarHBondContact O-N 2.75Å
58A72.7Confident74.1Confident49 Ų4978.8 Ų78.841%0.40551%0.514SS..Hα-helixtrans-67.2-40.9174.600000112.2G54 L55 A61 T62G54-A58 WeakPolarHBondContact O-CB 3.49Å; L55-A58 PolarHBondContact O-N 3.39Å; A58-A61 PolarHBondContact O-N 2.86Å; A58-T62 WeakPolarHBondContact O-CB 3.29Å; A58-T62 WeakPolarHBondContact O-CG2 3.41Å; A58-T62 PolarHBondContact O-N 2.86Å; A58-T62 PolarHBondContact O-OG1 3.29Å
59V79.5Confident75.4Confident96 Ų9681.9 Ų81.958%0.58252%0.515SS*.Hα-helixtrans-66.7-39.9174.1171.40000111.3L55 A56 T62 K63L55-V59 WeakPolarHBondContact O-CB 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.84Å; A56-V59 PolarHBondContact O-N 2.7Å; V59-T62 WeakPolarHBondContact CA-OG1 3.39Å; V59-T62 PolarHBondContact O-OG1 2.83Å; V59-K63 VanDerWaalsContact O-CB 3.31Å; V59-K63 WeakPolarHBondContact O-CB 3.46Å; V59-K63 PolarHBondContact O-N 3.45Å
60A79.4Confident77.1Confident48 Ų4881.2 Ų81.240%0.39751%0.507SS..Hα-helixtrans-66.1-44174.600000111.9A56 G57 K63 I64A56-A60 VanDerWaalsContact O-CB 3.32Å; A56-A60 WeakPolarHBondContact O-CB 3.46Å; A56-A60 PolarHBondContact O-N 3.3Å; G57-A60 PolarHBondContact O-N 3.43Å; A60-K63 PolarHBondContact O-N 3.29Å; A60-I64 WeakPolarHBondContact O-CB 3.27Å; A60-I64 WeakPolarHBondContact O-CD1 3.37Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 2.89Å
61A80.5Confident78.7Confident53 Ų5382.1 Ų82.144%0.43851%0.508SS..Hα-helixtrans-63.3-45.6178.500000112G57 A58 K63 I64 V65G57-A61 VanDerWaalsContact O-CB 3.24Å; G57-A61 WeakPolarHBondContact O-CB 3.32Å; G57-A61 PolarHBondContact O-N 2.75Å; A58-A61 PolarHBondContact O-N 2.86Å; A61-K63 VanDerWaalsContact C-N 3.31Å; A61-K63 PolarHBondContact O-N 2.9Å; A61-I64 PolarHBondContact O-N 2.89Å; A61-V65 WeakPolarHBondContact O-CG2 3.34Å; A61-V65 PolarHBondContact O-N 3.44Å
62T85.3Confident80.7Confident82 Ų8288.2 Ų88.250%0.50351%0.51SS..Hα-helixtrans-61.4-40.9173.947.60000111.2A58 V59 I64 V65 E66A58-T62 WeakPolarHBondContact O-CB 3.29Å; A58-T62 WeakPolarHBondContact O-CG2 3.41Å; A58-T62 PolarHBondContact O-N 2.86Å; A58-T62 PolarHBondContact O-OG1 3.29Å; V59-T62 WeakPolarHBondContact CA-OG1 3.39Å; V59-T62 PolarHBondContact O-OG1 2.83Å; T62-I64 PolarHBondContact O-N 3.45Å; T62-V65 PolarHBondContact O-N 2.84Å; T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 2.73Å
63K93.6Very high82.8Confident95 Ų9590 Ų9041%0.41351%0.511SS..Hα-helixtrans-66-38.5177.2-166.157.3172.5-175.10113.3V59 A60 A61 V65 E66 L67V59-K63 VanDerWaalsContact O-CB 3.31Å; V59-K63 WeakPolarHBondContact O-CB 3.46Å; V59-K63 PolarHBondContact O-N 3.45Å; A60-K63 PolarHBondContact O-N 3.29Å; A61-K63 VanDerWaalsContact C-N 3.31Å; A61-K63 PolarHBondContact O-N 2.9Å; K63-V65 VanDerWaalsContact C-N 3.32Å; K63-E66 WeakPolarHBondContact CD-OE2 3.2Å; K63-E66 IonicContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact NZ-OE2 2.85Å; K63-E66 PolarHBondContact O-N 3.4Å; K63-L67 HydrophobicContact CD-CG 4.48Å; K63-L67 HydrophobicContact CG-CD1 4.15Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 VanDerWaalsContact O-CG 3.29Å; K63-L67 WeakPolarHBondContact O-CG 3.49Å; K63-L67 PolarHBondContact O-N 3.43Å
64I92.1Very high84.7Confident107 Ų10792 Ų9255%0.54952%0.516SS..Hα-helixtrans-61.9-42.7174.7-71.3163000110.3A60 A61 T62 S68A60-I64 WeakPolarHBondContact O-CB 3.27Å; A60-I64 WeakPolarHBondContact O-CD1 3.37Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 2.89Å; A61-I64 PolarHBondContact O-N 2.89Å; T62-I64 PolarHBondContact O-N 3.45Å; I64-S68 VanDerWaalsContact O-CB 3.24Å; I64-S68 WeakPolarHBondContact O-CB 3.43Å; I64-S68 PolarHBondContact O-N 3.23Å; I64-S68 PolarHBondContact O-OG 2.99Å
65V93.6Very high86.4Confident101 Ų10192.8 Ų92.861%0.61251%0.513SS*.Hα-helixtrans-65.2-45.5176.7173.30000111.3A61 T62 K63 S68 K69A61-V65 WeakPolarHBondContact O-CG2 3.34Å; A61-V65 PolarHBondContact O-N 3.44Å; T62-V65 PolarHBondContact O-N 2.84Å; K63-V65 VanDerWaalsContact C-N 3.32Å; V65-S68 PolarHBondContact O-N 2.85Å; V65-K69 WeakPolarHBondContact O-CB 2.87Å; V65-K69 PolarHBondContact O-N 2.87Å
66E95.5Very high88.1Confident97 Ų9788.5 Ų88.545%0.45350%0.499SS..Hα-helixtrans-59-48.8175.3-77.1-176.6178.600112.3T62 K63 S68 K69 K70T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 2.73Å; K63-E66 WeakPolarHBondContact CD-OE2 3.2Å; K63-E66 IonicContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact NZ-OE2 2.85Å; K63-E66 PolarHBondContact O-N 3.4Å; E66-S68 VanDerWaalsContact C-N 3.31Å; E66-S68 PolarHBondContact O-N 3.48Å; E66-K69 PolarHBondContact O-N 2.78Å; E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 2.95Å
67L95.1Very high89.7Confident94 Ų9489.9 Ų89.949%0.49249%0.494SS..Hα-helixtrans-63.4-39.9178.4-72.9175.3000110.9K63 K69 K70 N71K63-L67 HydrophobicContact CD-CG 4.48Å; K63-L67 HydrophobicContact CG-CD1 4.15Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 VanDerWaalsContact O-CG 3.29Å; K63-L67 WeakPolarHBondContact O-CG 3.49Å; K63-L67 PolarHBondContact O-N 3.43Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.15Å; L67-K70 PolarHBondContact O-N 3.49Å; L67-N71 WeakPolarHBondContact O-CB 3.36Å; L67-N71 PolarHBondContact O-N 3.5Å
68S93.4Very high90.9Very high53 Ų5392.6 Ų92.637%0.37150%0.5SS..Hα-helixtrans-63.5-39.3175.5-61.40000111.9I64 V65 E66 N71 R72I64-S68 VanDerWaalsContact O-CB 3.24Å; I64-S68 WeakPolarHBondContact O-CB 3.43Å; I64-S68 PolarHBondContact O-N 3.23Å; I64-S68 PolarHBondContact O-OG 2.99Å; V65-S68 PolarHBondContact O-N 2.85Å; E66-S68 VanDerWaalsContact C-N 3.31Å; E66-S68 PolarHBondContact O-N 3.48Å; S68-N71 PolarHBondContact O-N 2.9Å; S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.26Å
69K96.9Very high91.9Very high131 Ų13196.5 Ų96.557%0.5751%0.509SS*.Hα-helixtrans-65.3-47.8175-171-179.5176.6-174.50111.2V65 E66 L67 N71 R72 E73V65-K69 WeakPolarHBondContact O-CB 2.87Å; V65-K69 PolarHBondContact O-N 2.87Å; E66-K69 PolarHBondContact O-N 2.78Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.15Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 2.93Å; K69-R72 PolarHBondContact O-N 3.39Å; K69-E73 VanDerWaalsContact CE-OE1 3.25Å; K69-E73 WeakPolarHBondContact CE-OE1 3.45Å; K69-E73 WeakPolarHBondContact O-CG 3.41Å; K69-E73 PolarHBondContact O-N 3.43Å
70K97.3Very high92.6Very high112 Ų11296.7 Ų96.749%0.48750%0.502SS..Hα-helixtrans-59-38.8174.4-73.7-175179.6-173.10112.3E66 L67 E73 L74E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 2.95Å; L67-K70 PolarHBondContact O-N 3.49Å; K70-E73 PolarHBondContact O-N 3.48Å; K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.23Å; K70-L74 PolarHBondContact O-N 2.89Å
71N94Very high93.3Very high106 Ų10698.9 Ų98.957%0.56750%0.504SS*.Hα-helixtrans-66.2-40.1178.5-141-14.2000111.3L67 S68 K69 L74 C75L67-N71 WeakPolarHBondContact O-CB 3.36Å; L67-N71 PolarHBondContact O-N 3.5Å; S68-N71 PolarHBondContact O-N 2.9Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 2.93Å; N71-L74 PolarHBondContact O-N 3.33Å; N71-C75 WeakPolarHBondContact O-CB 3.47Å; N71-C75 PolarHBondContact O-N 3.34Å; N71-C75 PolarHBondContact O-SG 3.36Å
72R95.2Very high93.9Very high195 Ų195103.1 Ų103.174%0.73651%0.513SS*.Hα-helixtrans-63.8-42.9173-70.2174.6-173.9173.42.3112.3S68 K69 C75 A76S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.26Å; K69-R72 PolarHBondContact O-N 3.39Å; R72-C75 PolarHBondContact O-N 3.22Å; R72-A76 PolarHBondContact O-N 3.22Å
73E94.1Very high94.4Very high104 Ų104103.8 Ų103.849%0.48651%0.512SS..Hα-helixtrans-62.8-45.4176.9-72.2168-174.400111.7K69 K70 C75 A76 E77K69-E73 VanDerWaalsContact CE-OE1 3.25Å; K69-E73 WeakPolarHBondContact CE-OE1 3.45Å; K69-E73 WeakPolarHBondContact O-CG 3.41Å; K69-E73 PolarHBondContact O-N 3.43Å; K70-E73 PolarHBondContact O-N 3.48Å; E73-C75 PolarHBondContact O-N 3.24Å; E73-A76 WeakPolarHBondContact O-CB 3.46Å; E73-A76 PolarHBondContact O-N 3.47Å; E73-E77 PolarHBondContact O-N 3.46Å
74L95.1Very high94.5Very high108 Ų108104.2 Ų104.257%0.56551%0.511SS*.Hα-helixtrans-63.1-40.5175.8-73.2173.6000112.2K70 N71 A76 E77 I78K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.23Å; K70-L74 PolarHBondContact O-N 2.89Å; N71-L74 PolarHBondContact O-N 3.33Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.81Å; L74-E77 PolarHBondContact O-N 3.28Å; L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.36Å; L74-I78 PolarHBondContact O-N 3.11Å
75C92.8Very high94.4Very high69 Ų69102.7 Ų102.747%0.46651%0.51SS..Hα-helixtrans-58.9-44173.2-74.80000111.7N71 R72 E73 I78 E79N71-C75 WeakPolarHBondContact O-CB 3.47Å; N71-C75 PolarHBondContact O-N 3.34Å; N71-C75 PolarHBondContact O-SG 3.36Å; R72-C75 PolarHBondContact O-N 3.22Å; E73-C75 PolarHBondContact O-N 3.24Å; C75-I78 PolarHBondContact O-N 3.02Å; C75-E79 WeakPolarHBondContact O-CG 3.36Å; C75-E79 PolarHBondContact O-N 2.73Å
76A94.1Very high94.5Very high59 Ų59104.8 Ų104.849%0.48851%0.511SS..Hα-helixtrans-63.7-42.3177.200000112.3R72 E73 L74 E79 K80R72-A76 PolarHBondContact O-N 3.22Å; E73-A76 WeakPolarHBondContact O-CB 3.46Å; E73-A76 PolarHBondContact O-N 3.47Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.81Å; A76-E79 PolarHBondContact O-N 2.89Å; A76-K80 WeakPolarHBondContact O-CB 3.38Å; A76-K80 PolarHBondContact O-N 3.35Å
77E95Very high94.4Very high93 Ų93106 Ų10644%0.43552%0.517SS..Hα-helixtrans-68.3-36.7178.1-157.465.3-147.700111.6E73 L74 K80 E81 R84E73-E77 PolarHBondContact O-N 3.46Å; L74-E77 PolarHBondContact O-N 3.28Å; E77-K80 PolarHBondContact O-N 2.86Å; E77-K80 IonicContact OE1-NZ 2.66Å; E77-E81 WeakPolarHBondContact O-CB 3.36Å; E77-E81 PolarHBondContact O-N 3.46Å; E77-R84 IonicContact OE1-NH2 2.73Å; E77-R84 PolarHBondContact OE1-NH2 2.89Å
78I94Very high94.1Very high93 Ų93104.8 Ų104.848%0.47752%0.516SS..Hα-helixtrans-63.1-43.7172.9-72.2168000111.1L74 C75 E81 K82L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.36Å; L74-I78 PolarHBondContact O-N 3.11Å; C75-I78 PolarHBondContact O-N 3.02Å; I78-E81 PolarHBondContact O-N 2.93Å; I78-K82 HydrophobicContact CG2-CD 4.2Å; I78-K82 HydrophobicContact CG2-CG 4.46Å; I78-K82 WeakPolarHBondContact O-CB 3.22Å; I78-K82 WeakPolarHBondContact O-CG 3.35Å; I78-K82 PolarHBondContact O-N 2.93Å
79E94Very high94.1Very high130 Ų130105 Ų10561%0.60752%0.517SS*.Hα-helixtrans-64.4-43.3177.3-76.1-164.1166.100111.8C75 A76 E81 K82 I83C75-E79 WeakPolarHBondContact O-CG 3.36Å; C75-E79 PolarHBondContact O-N 2.73Å; A76-E79 PolarHBondContact O-N 2.89Å; E79-E81 VanDerWaalsContact C-N 3.31Å; E79-E81 PolarHBondContact O-N 2.98Å; E79-K82 WeakPolarHBondContact O-CB 3.24Å; E79-K82 PolarHBondContact O-N 3.39Å; E79-I83 VanDerWaalsContact O-CG1 3.29Å; E79-I83 WeakPolarHBondContact O-CG1 3.37Å; E79-I83 PolarHBondContact O-N 3.3Å
80K93.3Very high93.8Very high100 Ų100101.4 Ų101.444%0.43551%0.505SS..Hα-helixtrans-58.9-43.2173.8-175.5-177.8173.7-167.20111.7A76 E77 I83 R84A76-K80 WeakPolarHBondContact O-CB 3.38Å; A76-K80 PolarHBondContact O-N 3.35Å; E77-K80 PolarHBondContact O-N 2.86Å; E77-K80 IonicContact OE1-NZ 2.66Å; K80-I83 PolarHBondContact O-N 2.84Å; K80-R84 PolarHBondContact O-N 3.33Å
81E93.8Very high93.8Very high94 Ų94101.8 Ų101.844%0.43950%0.503SS..Hα-helixtrans-68.9-37.9177.7-163.755.6-144.500112.4E77 I78 E79 I83 R84 S85E77-E81 WeakPolarHBondContact O-CB 3.36Å; E77-E81 PolarHBondContact O-N 3.46Å; I78-E81 PolarHBondContact O-N 2.93Å; E79-E81 VanDerWaalsContact C-N 3.31Å; E79-E81 PolarHBondContact O-N 2.98Å; E81-I83 VanDerWaalsContact C-N 3.3Å; E81-I83 PolarHBondContact O-N 2.86Å; E81-R84 PolarHBondContact O-N 3.32Å; E81-R84 IonicContact OE2-CZ 3.74Å; E81-R84 IonicContact OE2-NE 4Å; E81-R84 PolarHBondContact OE2-NE 3.27Å; E81-R84 IonicContact OE2-NH2 3.16Å; E81-R84 PolarHBondContact OE2-NH2 3.44Å; E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 3.47Å
82K93.9Very high93.6Very high143 Ų143100.8 Ų100.862%0.62250%0.497SS*.Hα-helixtrans-60.2-40.6171.5-79.2177.2179.1175.60111.8I78 E79 K86I78-K82 HydrophobicContact CG2-CD 4.2Å; I78-K82 HydrophobicContact CG2-CG 4.46Å; I78-K82 WeakPolarHBondContact O-CB 3.22Å; I78-K82 WeakPolarHBondContact O-CG 3.35Å; I78-K82 PolarHBondContact O-N 2.93Å; E79-K82 WeakPolarHBondContact O-CB 3.24Å; E79-K82 PolarHBondContact O-N 3.39Å; K82-K86 VanDerWaalsContact O-CB 3.3Å; K82-K86 WeakPolarHBondContact O-CB 3.32Å; K82-K86 PolarHBondContact O-N 2.87Å
83I94.6Very high93.5Very high96 Ų9697 Ų9749%0.49248%0.482SS..Hα-helixtrans-64.9-48.2176.1-67.3164.4000110.1E79 K80 E81 S85 K86 Q87E79-I83 VanDerWaalsContact O-CG1 3.29Å; E79-I83 WeakPolarHBondContact O-CG1 3.37Å; E79-I83 PolarHBondContact O-N 3.3Å; K80-I83 PolarHBondContact O-N 2.84Å; E81-I83 VanDerWaalsContact C-N 3.3Å; E81-I83 PolarHBondContact O-N 2.86Å; I83-S85 PolarHBondContact O-N 3.34Å; I83-K86 PolarHBondContact O-N 2.98Å; I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.32Å; I83-Q87 PolarHBondContact O-N 2.88Å
84R95.9Very high93.5Very high104 Ų10496.5 Ų96.539%0.39248%0.48SS..Hα-helixtrans-59.2-45176.3-74.7-167.6-74.8-142.4-7.9112.3E77 K80 E81 K86 Q87 S88E77-R84 IonicContact OE1-NH2 2.73Å; E77-R84 PolarHBondContact OE1-NH2 2.89Å; K80-R84 PolarHBondContact O-N 3.33Å; E81-R84 PolarHBondContact O-N 3.32Å; E81-R84 IonicContact OE2-CZ 3.74Å; E81-R84 IonicContact OE2-NE 4Å; E81-R84 PolarHBondContact OE2-NE 3.27Å; E81-R84 IonicContact OE2-NH2 3.16Å; E81-R84 PolarHBondContact OE2-NH2 3.44Å; R84-K86 PolarHBondContact O-N 2.94Å; R84-Q87 PolarHBondContact O-N 3.48Å; R84-S88 WeakPolarHBondContact O-CB 3.47Å; R84-S88 PolarHBondContact O-N 2.71Å
85S91.3Very high93.3Very high74 Ų7495.1 Ų95.152%0.51747%0.473SS..Hα-helixtrans-61.3-43.4176.5-178.40000111.7E81 I83 S88 S89E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 3.47Å; I83-S85 PolarHBondContact O-N 3.34Å; S85-S88 PolarHBondContact O-N 2.94Å; S85-S89 VanDerWaalsContact O-CB 3.31Å; S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.47Å
86K94.4Very high93.1Very high146 Ų14697.5 Ų97.564%0.63548%0.477SS*.Hα-helixtrans-64.6-41.5176-171.8177.4-178.3-1780112.1K82 I83 R84 S89 N90K82-K86 VanDerWaalsContact O-CB 3.3Å; K82-K86 WeakPolarHBondContact O-CB 3.32Å; K82-K86 PolarHBondContact O-N 2.87Å; I83-K86 PolarHBondContact O-N 2.98Å; R84-K86 PolarHBondContact O-N 2.94Å; K86-S89 PolarHBondContact O-N 3.43Å; K86-N90 WeakPolarHBondContact O-CB 3.49Å; K86-N90 PolarHBondContact O-N 3.36Å; K86-N90 PolarHBondContact O-ND2 3.35Å
87Q94.4Very high92.9Very high122 Ų122101.2 Ų101.257%0.5748%0.482SS*.Hα-helixtrans-62.1-48.1175.1-73.8172.5-14.200111.3I83 R84 N90 R91I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.32Å; I83-Q87 PolarHBondContact O-N 2.88Å; R84-Q87 PolarHBondContact O-N 3.48Å; Q87-N90 PolarHBondContact O-N 2.91Å; Q87-R91 PolarHBondContact O-N 3.39Å
88S89Confident92.7Very high69 Ų69102 Ų10248%0.48349%0.486SS..Hα-helixtrans-61.1-45.6176.2-1760000112R84 S85 N90 R91 I92R84-S88 WeakPolarHBondContact O-CB 3.47Å; R84-S88 PolarHBondContact O-N 2.71Å; S85-S88 PolarHBondContact O-N 2.94Å; S88-N90 VanDerWaalsContact C-N 3.33Å; S88-N90 PolarHBondContact O-N 3.31Å; S88-R91 PolarHBondContact O-N 3.44Å; S88-R91 VanDerWaalsContact O-N 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.39Å; S88-I92 PolarHBondContact O-N 2.87Å
89S91.9Very high92.4Very high57 Ų57102.7 Ų102.740%0.39949%0.49SS..Hα-helixtrans-60.9-39.3176175.90000113S85 K86 R93S85-S89 VanDerWaalsContact O-CB 3.31Å; S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.47Å; K86-S89 PolarHBondContact O-N 3.43Å; S89-R93 WeakPolarHBondContact O-CB 3.47Å; S89-R93 PolarHBondContact O-N 3.45Å
90N92.4Very high91.9Very high56 Ų56101.6 Ų101.630%0.29949%0.485SS..Hα-helixtrans-65.6-43.2174.3-72.4-14.8000111.1K86 Q87 S88 I92 R93 E94K86-N90 WeakPolarHBondContact O-CB 3.49Å; K86-N90 PolarHBondContact O-N 3.36Å; K86-N90 PolarHBondContact O-ND2 3.35Å; Q87-N90 PolarHBondContact O-N 2.91Å; S88-N90 VanDerWaalsContact C-N 3.33Å; S88-N90 PolarHBondContact O-N 3.31Å; N90-I92 PolarHBondContact O-N 3.3Å; N90-R93 WeakPolarHBondContact O-CB 3.41Å; N90-R93 PolarHBondContact O-N 2.86Å; N90-R93 VanDerWaalsContact O-N 3.16Å; N90-R93 PolarHBondContact OD1-NH2 3.36Å; N90-E94 WeakPolarHBondContact O-CG 3.47Å; N90-E94 PolarHBondContact O-N 2.9Å
91R95.4Very high91.2Very high119 Ų119100.1 Ų100.145%0.44949%0.486SS..Hα-helixtrans-63.5-40.6177.9-173.959.9-177.5148.26.4112.3Q87 S88 R93 E94 L95 E98Q87-R91 PolarHBondContact O-N 3.39Å; S88-R91 PolarHBondContact O-N 3.44Å; S88-R91 VanDerWaalsContact O-N 3.14Å; R91-R93 VanDerWaalsContact C-N 3.33Å; R91-R93 PolarHBondContact O-N 2.9Å; R91-E94 IonicContact NH1-OE2 2.69Å; R91-E94 PolarHBondContact NH1-OE2 3.48Å; R91-E94 VanDerWaalsContact NH1-OE2 3.16Å; R91-E94 PolarHBondContact O-N 3.44Å; R91-L95 HydrophobicContact CG-CD1 4.31Å; R91-L95 WeakPolarHBondContact O-CG 3.49Å; R91-L95 PolarHBondContact O-N 3.01Å; R91-E98 IonicContact NH1-OE1 3.59Å
92I91.7Very high90.6Very high85 Ų8598.1 Ų98.144%0.43649%0.486SS..Hα-helixtrans-58.8-47.2172.7-69.6166.8000109.8S88 N90 E94 L95 E96S88-I92 WeakPolarHBondContact O-CG1 3.39Å; S88-I92 PolarHBondContact O-N 2.87Å; N90-I92 PolarHBondContact O-N 3.3Å; I92-E94 VanDerWaalsContact C-N 3.32Å; I92-E94 PolarHBondContact O-N 3.22Å; I92-L95 PolarHBondContact O-N 2.97Å; I92-E96 HydrophobicContact CG2-CG 4.24Å; I92-E96 WeakPolarHBondContact O-CB 3.49Å; I92-E96 VanDerWaalsContact O-CG 3.31Å; I92-E96 WeakPolarHBondContact O-CG 3.34Å; I92-E96 PolarHBondContact O-N 3.5Å
93R92.9Very high89.8Confident115 Ų11596.4 Ų96.443%0.43448%0.483SS..Hα-helixtrans-63.9-34.8179.6-160.8-173.6-44.4140.121.8113.3S89 N90 R91 K97S89-R93 WeakPolarHBondContact O-CB 3.47Å; S89-R93 PolarHBondContact O-N 3.45Å; N90-R93 WeakPolarHBondContact O-CB 3.41Å; N90-R93 PolarHBondContact O-N 2.86Å; N90-R93 VanDerWaalsContact O-N 3.16Å; N90-R93 PolarHBondContact OD1-NH2 3.36Å; R91-R93 VanDerWaalsContact C-N 3.33Å; R91-R93 PolarHBondContact O-N 2.9Å; R93-K97 VanDerWaalsContact O-CG 3.28Å; R93-K97 WeakPolarHBondContact O-CG 3.26Å; R93-K97 PolarHBondContact O-N 3.28Å; R93-K97 VanDerWaalsContact O-N 3.14Å
94E93.4Very high88.4Confident94 Ų9498 Ų9844%0.43949%0.488SS..Hα-helixtrans-65.7-49.1172.6-73.5165-16600110.9N90 R91 I92 E96 K97 E98N90-E94 WeakPolarHBondContact O-CG 3.47Å; N90-E94 PolarHBondContact O-N 2.9Å; R91-E94 IonicContact NH1-OE2 2.69Å; R91-E94 PolarHBondContact NH1-OE2 3.48Å; R91-E94 VanDerWaalsContact NH1-OE2 3.16Å; R91-E94 PolarHBondContact O-N 3.44Å; I92-E94 VanDerWaalsContact C-N 3.32Å; I92-E94 PolarHBondContact O-N 3.22Å; E94-E96 VanDerWaalsContact C-N 3.33Å; E94-E96 PolarHBondContact O-N 3.05Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 PolarHBondContact O-N 3.28Å; E94-K97 VanDerWaalsContact O-N 3.12Å; E94-E98 WeakPolarHBondContact O-CG 3.06Å; E94-E98 PolarHBondContact O-N 3.23Å
95L90.4Very high86.7Confident79 Ų7999.7 Ų99.741%0.41451%0.505SS..Hα-helixtrans-62-39.4177.5-70.8171.9000112.2R91 I92 K97 E98 L99R91-L95 HydrophobicContact CG-CD1 4.31Å; R91-L95 WeakPolarHBondContact O-CG 3.49Å; R91-L95 PolarHBondContact O-N 3.01Å; I92-L95 PolarHBondContact O-N 2.97Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 2.91Å; L95-E98 PolarHBondContact O-N 3.44Å; L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.43Å
96E89.4Confident85Confident120 Ų120101.4 Ų101.456%0.56151%0.513SS*.Hα-helixtrans-60.9-41.1173.4-75.4171.8168.800111.6I92 E94 L99 Q100I92-E96 HydrophobicContact CG2-CG 4.24Å; I92-E96 WeakPolarHBondContact O-CB 3.49Å; I92-E96 VanDerWaalsContact O-CG 3.31Å; I92-E96 WeakPolarHBondContact O-CG 3.34Å; I92-E96 PolarHBondContact O-N 3.5Å; E94-E96 VanDerWaalsContact C-N 3.33Å; E94-E96 PolarHBondContact O-N 3.05Å; E96-L99 PolarHBondContact O-N 3.28Å; E96-Q100 WeakPolarHBondContact O-CB 3.45Å; E96-Q100 PolarHBondContact O-N 3.44Å
97K90.6Very high82.6Confident137 Ų137100.2 Ų100.260%0.59652%0.517SS*.Hα-helixtrans-67.4-44.4175.1-74.8174178-172.70112.1R93 E94 L95 L99 Q100 C101R93-K97 VanDerWaalsContact O-CG 3.28Å; R93-K97 WeakPolarHBondContact O-CG 3.26Å; R93-K97 PolarHBondContact O-N 3.28Å; R93-K97 VanDerWaalsContact O-N 3.14Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 PolarHBondContact O-N 3.28Å; E94-K97 VanDerWaalsContact O-N 3.12Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 2.91Å; K97-L99 VanDerWaalsContact C-N 3.28Å; K97-L99 PolarHBondContact O-N 3.01Å; K97-Q100 PolarHBondContact O-N 3.42Å; K97-C101 WeakPolarHBondContact O-CB 3.49Å; K97-C101 PolarHBondContact O-N 3.36Å; K97-C101 PolarHBondContact O-SG 2.89Å; K97-C101 VanDerWaalsContact O-SG 3.36Å
98E89.8Confident80.3Confident108 Ų108100.3 Ų100.351%0.50553%0.528SS..Hα-helixtrans-58.6-42.9175.4-73.3173.9-156.800110.7R91 E94 L95 C101 A102R91-E98 IonicContact NH1-OE1 3.59Å; E94-E98 WeakPolarHBondContact O-CG 3.06Å; E94-E98 PolarHBondContact O-N 3.23Å; L95-E98 PolarHBondContact O-N 3.44Å; E98-C101 PolarHBondContact O-N 2.94Å; E98-A102 WeakPolarHBondContact O-CB 3.46Å; E98-A102 PolarHBondContact O-N 3.49Å
99L87.5Confident77.9Confident109 Ų109100.1 Ų100.157%0.57154%0.538SS*.Hα-helixtrans-67.2-41.3178-159.5154.7000111.6L95 E96 K97 A102 L103L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.43Å; E96-L99 PolarHBondContact O-N 3.28Å; K97-L99 VanDerWaalsContact C-N 3.28Å; K97-L99 PolarHBondContact O-N 3.01Å; L99-A102 PolarHBondContact O-N 2.9Å; L99-L103 HydrophobicContact CD2-CD1 3.99Å; L99-L103 PolarHBondContact O-N 3.25Å
100Q84.1Confident75.2Confident106 Ų106106.9 Ų106.950%0.49556%0.563SS.*Hα-helixtrans-61.9-46.5174.6-169.169.717.700111.6E96 K97 A102 L103 E104E96-Q100 WeakPolarHBondContact O-CB 3.45Å; E96-Q100 PolarHBondContact O-N 3.44Å; K97-Q100 PolarHBondContact O-N 3.42Å; Q100-A102 VanDerWaalsContact C-N 3.32Å; Q100-A102 PolarHBondContact O-N 2.84Å; Q100-L103 WeakPolarHBondContact O-CB 3.39Å; Q100-L103 PolarHBondContact O-N 2.95Å; Q100-E104 WeakPolarHBondContact O-CG 3.34Å; Q100-E104 PolarHBondContact O-N 2.96Å
101C78.9Confident72.9Confident69 Ų69113.6 Ų113.647%0.46659%0.59SS.*Hα-helixtrans-64.2-36.6175.1-69.90000111.9K97 E98 N105K97-C101 WeakPolarHBondContact O-CB 3.49Å; K97-C101 PolarHBondContact O-N 3.36Å; K97-C101 PolarHBondContact O-SG 2.89Å; K97-C101 VanDerWaalsContact O-SG 3.36Å; E98-C101 PolarHBondContact O-N 2.94Å; C101-N105 PolarHBondContact O-N 3.16Å; C101-N105 PolarHBondContact O-ND2 3.33Å
102A79.6Confident69.9Low53 Ų53113.8 Ų113.844%0.43860%0.604SS.*Hα-helixtrans-66-38.4174.400000111.7E98 L99 Q100 N105 V106E98-A102 WeakPolarHBondContact O-CB 3.46Å; E98-A102 PolarHBondContact O-N 3.49Å; L99-A102 PolarHBondContact O-N 2.9Å; Q100-A102 VanDerWaalsContact C-N 3.32Å; Q100-A102 PolarHBondContact O-N 2.84Å; A102-N105 PolarHBondContact O-N 2.97Å; A102-V106 WeakPolarHBondContact O-CG2 3.35Å; A102-V106 PolarHBondContact O-N 3.24Å
103L77.1Confident67.3Low107 Ų107115.5 Ų115.556%0.5662%0.618SS**Hα-helixtrans-64.9-42.3175.7-123.682.6000112.3L99 Q100 N105 V106L99-L103 HydrophobicContact CD2-CD1 3.99Å; L99-L103 PolarHBondContact O-N 3.25Å; Q100-L103 WeakPolarHBondContact O-CB 3.39Å; Q100-L103 PolarHBondContact O-N 2.95Å; L103-N105 PolarHBondContact O-N 3.2Å; L103-V106 PolarHBondContact O-N 2.91Å; L103-V106 VanDerWaalsContact O-N 3.11Å
104E66.9Low64.6Low128 Ų128119.4 Ų119.460%0.59864%0.642SS**Hα-helixtrans-63.7-30177.2-74.6171.8-177.200112.3Q100 V106Q100-E104 WeakPolarHBondContact O-CG 3.34Å; Q100-E104 PolarHBondContact O-N 2.96Å; E104-V106 VanDerWaalsContact C-N 3.35Å
105N59.3Low62.2Low140 Ų140124.4 Ų124.475%0.74966%0.662SS**THydrogen-bonded Turntrans-81.4-8.4175.6-70.5-47.5000114.2C101 A102 L103C101-N105 PolarHBondContact O-N 3.16Å; C101-N105 PolarHBondContact O-ND2 3.33Å; A102-N105 PolarHBondContact O-N 2.97Å; L103-N105 PolarHBondContact O-N 3.2Å
106V54.9Low59.6Low111 Ų111127.1 Ų127.167%0.67368%0.682SS**THydrogen-bonded Turntrans-103.315.8-177.4176.60000112.4A102 L103 E104 P108A102-V106 WeakPolarHBondContact O-CG2 3.35Å; A102-V106 PolarHBondContact O-N 3.24Å; L103-V106 PolarHBondContact O-N 2.91Å; L103-V106 VanDerWaalsContact O-N 3.11Å; E104-V106 VanDerWaalsContact C-N 3.35Å; V106-P108 WeakPolarHBondContact O-CD 3.45Å
107V44Very low57.2Low121 Ų121128.7 Ų128.773%0.73369%0.694SS**  trans-99.584.7169.5-172.70000111.1
108P47.5Very low54.3Low123 Ų123128.6 Ų128.680%0.79970%0.699SS**  trans-88.2110.4163.433.3-29.1000109.6V106V106-P108 WeakPolarHBondContact O-CD 3.45Å
109G38.8Very low51.8Low66 Ų66132.3 Ų132.368%0.6871%0.714SS**  trans131.498.2150.500000116.7
110Q35.4Very low49.1Very low198 Ų198132.2 Ų132.293%0.92572%0.722SS**  -162.2118.6119.5-108.7173.111.800110.8
111K43.2Very low46.5Very low198 Ų198133 Ų13386%0.86174%0.74SS**  trans-63151.5163.4-61174.2178.6177.70107.2
112T33.4Very low44.4Very low122 Ų122135.1 Ų135.175%0.74876%0.755SS**  -176.5126.584-51.20000109.9
113T36.8Very low42.2Very low121 Ų121141.9 Ų141.974%0.74278%0.778SS**  trans32.7127.3151.947.40000122.1
114Q35.2Very low40.1Very low198 Ų198143.5 Ų143.593%0.92579%0.787SS**  -162.7138.9107.1-128.1165.3-3100113.8
115K44.1Very low38.6Very low199 Ų199146 Ų14687%0.86580%0.798SS**  trans-59.6142.9175.8-86.4167.1160175.10114
116T34.8Very low37.8Very low135 Ų135147.4 Ų147.483%0.82880%0.8SS**  -173103.2128.635.50000106.9
117L39.8Very low37.1Very low154 Ų154152 Ų15281%0.80682%0.815SS**  52.496.595-161.180.9000113.4
118D29.8Very low37Very low134 Ų134153.8 Ų153.872%0.71782%0.815SS**  -176.9124.2112-99.8-33.6000114.6
119K37.3Very low37Very low186 Ų186154.7 Ų154.781%0.80981%0.809SS**  trans45.4120.4142.1-97.3162.6172.7171.60123.8
120S30.8Very low37.8Very low107 Ų107155 Ų15575%0.74880%0.795SS**  trans75.595.5135.663.10000120.3
121S29.6Very low39.6Very low124 Ų124150.4 Ų150.487%0.86778%0.782SS**  -175.6107.4112.334.30000109.1
122S33.8Very low41.1Very low113 Ų113145.8 Ų145.879%0.7977%0.766SS**  trans-80114.216451.10000108
123E34.1Very low43.4Very low194 Ų194143.1 Ų143.191%0.90775%0.75SS**  -151.9101.5127.8-100.7177.2-163.200106.5
124D33.5Very low45.7Very low142 Ų142143.8 Ų143.876%0.75974%0.742SS**  trans-60.9126.5168.6-75.8-53.9000109.5
125H35.5Very low48Very low180 Ų180136.3 Ų136.383%0.83371%0.712SS**  178.2145.2112.4-93.3-66.7000110.6
126E41.4Very low50.1Low169 Ų169131.4 Ų131.479%0.7969%0.694SS**  trans87.943.2169.5-50.2-168.5167.400118.3Q128E126-Q128 PolarHBondContact O-N 3.37Å
127Q39.5Very low52.8Low208 Ų208131.4 Ų131.497%0.97269%0.685SS**  trans-73.458.6144.7-78.1166.6-20.900110.6
128Q42.3Very low55.2Low158 Ų158131.1 Ų131.174%0.73868%0.679SS**  trans-151.362.6160.5-167.4151.89.600106.5E126 N130E126-Q128 PolarHBondContact O-N 3.37Å; Q128-N130 PolarHBondContact O-N 3.5Å
129E48.3Very low58.2Low143 Ų143131 Ų13167%0.66867%0.673SS**  trans-63.587.3158.7-83.5-160.8162.800107.4
130N55.6Low60.9Low72 Ų72126.9 Ų126.939%0.38566%0.659SS.*  trans-47.6132.2-176.1-168-16.9000108.4Q128 L132 V133Q128-N130 PolarHBondContact O-N 3.5Å; N130-L132 HydrophobicContact CB-CB 4.27Å; N130-L132 CarbonylContact O-C 3.58Å; N130-L132 PolarHBondContact O-N 3.48Å; N130-L132 WeakPolarHBondContact OD1-CB 3.48Å; N130-L132 PolarHBondContact OD1-N 3.14Å; N130-V133 HydrophobicContact CB-CG2 4.28Å; N130-V133 PolarHBondContact O-N 3.12Å
131P72.5Confident63.8Low101 Ų101124.3 Ų124.366%0.65664%0.644SS**Hα-helixtrans-48.3-24.4173.118.9-33000112.7S135P131-S135 WeakPolarHBondContact O-CB 3.43Å; P131-S135 PolarHBondContact O-N 3.08Å
132L74.7Confident66.9Low102 Ų102120.8 Ų120.853%0.53462%0.623SS.*Hα-helixtrans-56.5-46.2169.2-138.594.9000113.7N130 S135 L136N130-L132 HydrophobicContact CB-CB 4.27Å; N130-L132 CarbonylContact O-C 3.58Å; N130-L132 PolarHBondContact O-N 3.48Å; N130-L132 WeakPolarHBondContact OD1-CB 3.48Å; N130-L132 PolarHBondContact OD1-N 3.14Å; L132-S135 PolarHBondContact O-N 3.19Å; L132-S135 PolarHBondContact O-OG 2.93Å; L132-L136 HydrophobicContact CD2-CD1 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.46Å; L132-L136 VanDerWaalsContact O-CG 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.28Å; L132-L136 PolarHBondContact O-N 3.39Å
133V82.1Confident69.6Low66 Ų66119.3 Ų119.340%0.461%0.609SS.*Hα-helixtrans-64.3-43.9-179.2176.80000110.6N130 S135 L136 Q137N130-V133 HydrophobicContact CB-CG2 4.28Å; N130-V133 PolarHBondContact O-N 3.12Å; V133-S135 PolarHBondContact O-N 3.48Å; V133-L136 PolarHBondContact O-N 3.14Å; V133-Q137 WeakPolarHBondContact O-CB 3.35Å; V133-Q137 PolarHBondContact O-N 3.43Å
134K84.2Confident72.3Confident135 Ų135115.6 Ų115.659%0.58759%0.591SS**Hα-helixtrans-61.8-43.4174-69.4-178.5-179.5175.20111.8L136 Q137 E138K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 2.99Å; K134-Q137 PolarHBondContact O-N 2.81Å; K134-E138 WeakPolarHBondContact O-CB 3.45Å; K134-E138 PolarHBondContact O-N 3.39Å
135S85.4Confident75.2Confident41 Ų41113.4 Ų113.429%0.28758%0.579SS.*Hα-helixtrans-64.6-35.1176.381.90000112.9P131 L132 V133 K139P131-S135 WeakPolarHBondContact O-CB 3.43Å; P131-S135 PolarHBondContact O-N 3.08Å; L132-S135 PolarHBondContact O-N 3.19Å; L132-S135 PolarHBondContact O-OG 2.93Å; V133-S135 PolarHBondContact O-N 3.48Å; S135-K139 WeakPolarHBondContact O-CB 3.29Å; S135-K139 VanDerWaalsContact O-CG 3.24Å; S135-K139 WeakPolarHBondContact O-CG 3.5Å; S135-K139 PolarHBondContact O-N 3.42Å
136L87Confident78.1Confident96 Ų96110.6 Ų110.650%0.50357%0.565SS.*Hα-helixtrans-72.1-38.1176.7-73.1171.8000111.1L132 V133 K134 K139 L140L132-L136 HydrophobicContact CD2-CD1 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.46Å; L132-L136 VanDerWaalsContact O-CG 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.28Å; L132-L136 PolarHBondContact O-N 3.39Å; V133-L136 PolarHBondContact O-N 3.14Å; K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 2.99Å; L136-K139 PolarHBondContact O-N 3.41Å; L136-L140 WeakPolarHBondContact O-CB 3.43Å; L136-L140 PolarHBondContact O-N 3.35Å
137Q90.9Very high80.6Confident135 Ų135107 Ų10763%0.63155%0.554SS**Hα-helixtrans-68.5-38.2176.1-170.1154.2-1.500112.2V133 K134 L140 A141V133-Q137 WeakPolarHBondContact O-CB 3.35Å; V133-Q137 PolarHBondContact O-N 3.43Å; K134-Q137 PolarHBondContact O-N 2.81Å; Q137-L140 PolarHBondContact O-N 2.96Å; Q137-A141 WeakPolarHBondContact O-CB 3.49Å; Q137-A141 PolarHBondContact O-N 2.73Å
138E91.2Very high83.2Confident147 Ų147100.5 Ų100.569%0.68753%0.529SS*.Hα-helixtrans-67.2-41.7172.7-169.4172.8-16300111.8K134 L140 A141 A142K134-E138 WeakPolarHBondContact O-CB 3.45Å; K134-E138 PolarHBondContact O-N 3.39Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.84Å; E138-A141 PolarHBondContact O-N 3.31Å; E138-A142 WeakPolarHBondContact O-CB 3.29Å; E138-A142 PolarHBondContact O-N 2.87Å
139K93.4Very high85.7Confident133 Ų13397.5 Ų97.558%0.57852%0.515SS*.Hα-helixtrans-62.6-38.7172.6-78174.5-178.4176.90112.4S135 L136 T143S135-K139 WeakPolarHBondContact O-CB 3.29Å; S135-K139 VanDerWaalsContact O-CG 3.24Å; S135-K139 WeakPolarHBondContact O-CG 3.5Å; S135-K139 PolarHBondContact O-N 3.42Å; L136-K139 PolarHBondContact O-N 3.41Å; K139-T143 WeakPolarHBondContact O-CB 3.4Å; K139-T143 PolarHBondContact O-N 3.4Å; K139-T143 PolarHBondContact O-OG1 3.39Å
140L92.5Very high88.1Confident99 Ų9997.6 Ų97.652%0.51851%0.51SS..Hα-helixtrans-63.6-48.1175.3-178.966000110.5L136 Q137 E138 A142 T143 Q144L136-L140 WeakPolarHBondContact O-CB 3.43Å; L136-L140 PolarHBondContact O-N 3.35Å; Q137-L140 PolarHBondContact O-N 2.96Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.84Å; L140-A142 PolarHBondContact O-N 3.49Å; L140-T143 PolarHBondContact O-N 2.92Å; L140-Q144 WeakPolarHBondContact O-CB 3.24Å; L140-Q144 VanDerWaalsContact O-CG 3.32Å; L140-Q144 WeakPolarHBondContact O-CG 3.45Å; L140-Q144 PolarHBondContact O-N 2.93Å
141A93.2Very high90Very high52 Ų52101 Ų10143%0.4352%0.518SS..Hα-helixtrans-61.2-43.817700000112.1Q137 E138 T143 Q144 L145Q137-A141 WeakPolarHBondContact O-CB 3.49Å; Q137-A141 PolarHBondContact O-N 2.73Å; E138-A141 PolarHBondContact O-N 3.31Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.18Å; A141-Q144 PolarHBondContact O-N 3.24Å; A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 2.91Å
142A93.4Very high91.1Very high51 Ų51100.2 Ų100.242%0.42151%0.508SS..Hα-helixtrans-62.9-38.5175.800000112.3E138 L140 L145 K146E138-A142 WeakPolarHBondContact O-CB 3.29Å; E138-A142 PolarHBondContact O-N 2.87Å; L140-A142 PolarHBondContact O-N 3.49Å; A142-L145 PolarHBondContact O-N 2.93Å; A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.3Å
143T91.4Very high92.1Very high82 Ų82100.9 Ų100.950%0.50351%0.508SS..Hα-helixtrans-70.6-40.6176.8-54.20000111.2K139 L140 A141 L145 K146 V147K139-T143 WeakPolarHBondContact O-CB 3.4Å; K139-T143 PolarHBondContact O-N 3.4Å; K139-T143 PolarHBondContact O-OG1 3.39Å; L140-T143 PolarHBondContact O-N 2.92Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.18Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.39Å; T143-K146 PolarHBondContact O-N 3.02Å; T143-V147 WeakPolarHBondContact O-CG2 3.38Å; T143-V147 PolarHBondContact O-N 3.16Å
144Q89.4Confident92.7Very high115 Ų115101.5 Ų101.554%0.53751%0.512SS..Hα-helixtrans-60.2-41.3173.8-75.5174.6-8.700111.6L140 A141 V147 T148L140-Q144 WeakPolarHBondContact O-CB 3.24Å; L140-Q144 VanDerWaalsContact O-CG 3.32Å; L140-Q144 WeakPolarHBondContact O-CG 3.45Å; L140-Q144 PolarHBondContact O-N 2.93Å; A141-Q144 PolarHBondContact O-N 3.24Å; Q144-V147 PolarHBondContact O-N 3.16Å; Q144-T148 WeakPolarHBondContact O-CG2 3.45Å; Q144-T148 PolarHBondContact O-N 3.28Å
145L95.4Very high93.3Very high97 Ų9799.8 Ų99.851%0.50851%0.506SS..Hα-helixtrans-65-41.6175.2-170.9140.7000111.9A141 A142 T143 V147 T148 E149A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 2.91Å; A142-L145 PolarHBondContact O-N 2.93Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.39Å; L145-V147 VanDerWaalsContact C-N 3.33Å; L145-V147 PolarHBondContact O-N 3.39Å; L145-T148 PolarHBondContact O-N 2.99Å; L145-T148 PolarHBondContact O-OG1 3.44Å; L145-E149 HydrophobicContact CD2-CG 4.3Å; L145-E149 VanDerWaalsContact CD2-OE1 3.24Å; L145-E149 WeakPolarHBondContact CD2-OE1 3.34Å; L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.95Å
146K96.8Very high93.8Very high120 Ų120100.7 Ų100.752%0.52251%0.512SS..Hα-helixtrans-61.6-39.4172.4-77.6-180176.3-179.50112.7A142 T143 T148 E149 Y150A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.3Å; T143-K146 PolarHBondContact O-N 3.02Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 2.87Å; K146-E149 PolarHBondContact O-N 3.49Å; K146-Y150 HydrophobicContact CB-CD2 4.47Å; K146-Y150 HydrophobicContact CB-CE2 4.3Å; K146-Y150 WeakPolarHBondContact O-CD2 3.38Å; K146-Y150 PolarHBondContact O-N 3.34Å
147V94.3Very high94.2Very high93 Ų9398.8 Ų98.856%0.56451%0.51SS*.Hα-helixtrans-63.4-41.5177.2168.80000111T143 Q144 L145 R151T143-V147 WeakPolarHBondContact O-CG2 3.38Å; T143-V147 PolarHBondContact O-N 3.16Å; Q144-V147 PolarHBondContact O-N 3.16Å; L145-V147 VanDerWaalsContact C-N 3.33Å; L145-V147 PolarHBondContact O-N 3.39Å; V147-R151 WeakPolarHBondContact O-CB 3.45Å; V147-R151 PolarHBondContact O-N 3.47Å
148T93.4Very high94.4Very high73 Ų7398.8 Ų98.845%0.44851%0.508SS..Hα-helixtrans-68.7-38.9176.759.10000111.9Q144 L145 K146 R151 N152Q144-T148 WeakPolarHBondContact O-CG2 3.45Å; Q144-T148 PolarHBondContact O-N 3.28Å; L145-T148 PolarHBondContact O-N 2.99Å; L145-T148 PolarHBondContact O-OG1 3.44Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 2.87Å; T148-R151 WeakPolarHBondContact O-CB 3.35Å; T148-R151 PolarHBondContact O-N 3.16Å; T148-N152 PolarHBondContact O-N 3.07Å; T148-N152 PolarHBondContact O-ND2 3.14Å; T148-N152 PolarHBondContact O-OD1 3.39Å
149E95.6Very high94.6Very high95 Ų9597 Ų9744%0.44450%0.5SS..Hα-helixtrans-59.9-49.5172.8-75.3178171.500112.2L145 K146 R151 N152 Q153L145-E149 HydrophobicContact CD2-CG 4.3Å; L145-E149 VanDerWaalsContact CD2-OE1 3.24Å; L145-E149 WeakPolarHBondContact CD2-OE1 3.34Å; L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.95Å; K146-E149 PolarHBondContact O-N 3.49Å; E149-R151 VanDerWaalsContact C-N 3.32Å; E149-R151 PolarHBondContact O-N 2.93Å; E149-N152 PolarHBondContact O-N 3.33Å; E149-N152 VanDerWaalsContact O-N 3.14Å; E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 3.29Å
150Y96.6Very high94.6Very high144 Ų14496.4 Ų96.457%0.56550%0.499SS*.Hα-helixtrans-62-39.4176.7-74.7-54.9000112K146 N152 Q153 V154K146-Y150 HydrophobicContact CB-CD2 4.47Å; K146-Y150 HydrophobicContact CB-CE2 4.3Å; K146-Y150 WeakPolarHBondContact O-CD2 3.38Å; K146-Y150 PolarHBondContact O-N 3.34Å; Y150-N152 VanDerWaalsContact C-N 3.28Å; Y150-N152 PolarHBondContact O-N 3.33Å; Y150-Q153 PolarHBondContact O-N 3.48Å; Y150-V154 WeakPolarHBondContact O-CB 3.36Å; Y150-V154 VanDerWaalsContact O-CG2 3.29Å; Y150-V154 WeakPolarHBondContact O-CG2 3.43Å; Y150-V154 PolarHBondContact O-N 3.37Å
151R96Very high94.7Very high145 Ų14596.5 Ų96.555%0.54750%0.499SS..Hα-helixtrans-59-42.8174.6-165-167.879118.75.6111.2V147 T148 E149 Q155V147-R151 WeakPolarHBondContact O-CB 3.45Å; V147-R151 PolarHBondContact O-N 3.47Å; T148-R151 WeakPolarHBondContact O-CB 3.35Å; T148-R151 PolarHBondContact O-N 3.16Å; E149-R151 VanDerWaalsContact C-N 3.32Å; E149-R151 PolarHBondContact O-N 2.93Å; R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.8Å; R151-Q155 VanDerWaalsContact O-N 3.08Å
152N95.3Very high94.6Very high84 Ų8499.8 Ų99.845%0.44950%0.504SS..Hα-helixtrans-69.5-41.1178.9-66.1-13.2000111.7T148 E149 Y150 V154 Q155 S156T148-N152 PolarHBondContact O-N 3.07Å; T148-N152 PolarHBondContact O-ND2 3.14Å; T148-N152 PolarHBondContact O-OD1 3.39Å; E149-N152 PolarHBondContact O-N 3.33Å; E149-N152 VanDerWaalsContact O-N 3.14Å; Y150-N152 VanDerWaalsContact C-N 3.28Å; Y150-N152 PolarHBondContact O-N 3.33Å; N152-V154 PolarHBondContact O-N 3.43Å; N152-Q155 PolarHBondContact O-N 2.73Å; N152-S156 PolarHBondContact O-N 3.02Å
153Q95.8Very high94.7Very high115 Ų115100.8 Ų100.854%0.53751%0.505SS..Hα-helixtrans-60.1-44.7174.4-72.4176.218.900111.8E149 Y150 Q155 S156 A157E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 3.29Å; Y150-Q153 PolarHBondContact O-N 3.48Å; Q153-Q155 VanDerWaalsContact C-N 3.29Å; Q153-Q155 PolarHBondContact O-N 3.12Å; Q153-S156 PolarHBondContact O-N 2.94Å; Q153-A157 WeakPolarHBondContact O-CB 3.42Å; Q153-A157 PolarHBondContact O-N 3.3Å
154V96.3Very high94.6Very high79 Ų7999.2 Ų99.248%0.47950%0.5SS..Hα-helixtrans-62.7-36.9176.4170.70000111.3Y150 N152 K158Y150-V154 WeakPolarHBondContact O-CB 3.36Å; Y150-V154 VanDerWaalsContact O-CG2 3.29Å; Y150-V154 WeakPolarHBondContact O-CG2 3.43Å; Y150-V154 PolarHBondContact O-N 3.37Å; N152-V154 PolarHBondContact O-N 3.43Å; V154-K158 HydrophobicContact CG1-CD 4.34Å; V154-K158 WeakPolarHBondContact O-CB 3.44Å; V154-K158 VanDerWaalsContact O-CG 3.29Å; V154-K158 WeakPolarHBondContact O-CG 3.41Å; V154-K158 PolarHBondContact O-N 2.91Å
155Q96.8Very high94.4Very high99 Ų9998 Ų9846%0.46349%0.494SS..Hα-helixtrans-67.8-42.6174.9-74.1178.7-1.500112.2R151 N152 Q153 K158 Q159R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.8Å; R151-Q155 VanDerWaalsContact O-N 3.08Å; N152-Q155 PolarHBondContact O-N 2.73Å; Q153-Q155 VanDerWaalsContact C-N 3.29Å; Q153-Q155 PolarHBondContact O-N 3.12Å; Q155-K158 PolarHBondContact O-N 3.5Å; Q155-Q159 PolarHBondContact O-N 3.24Å
156S94.8Very high94Very high61 Ų61100.7 Ų100.743%0.42750%0.502SS..Hα-helixtrans-60.5-50.8174.7-163.70000111.1N152 Q153 K158 Q159 E160N152-S156 PolarHBondContact O-N 3.02Å; Q153-S156 PolarHBondContact O-N 2.94Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 2.87Å; S156-Q159 CarbonylContact O-C 3.56Å; S156-Q159 WeakPolarHBondContact O-CA 3.31Å; S156-Q159 WeakPolarHBondContact O-CB 3.44Å; S156-Q159 PolarHBondContact O-N 3.16Å; S156-E160 WeakPolarHBondContact O-CG 3.4Å; S156-E160 PolarHBondContact O-N 2.9Å; S156-E160 PolarHBondContact OG-OE1 3.34Å
157A94.7Very high93.5Very high55 Ų5598.3 Ų98.346%0.45550%0.497SS..Hα-helixtrans-59.9-38.8179.100000112.3Q153 Q159 L161Q153-A157 WeakPolarHBondContact O-CB 3.42Å; Q153-A157 PolarHBondContact O-N 3.3Å; A157-Q159 VanDerWaalsContact C-N 3.34Å; A157-Q159 PolarHBondContact O-N 3.39Å; A157-L161 VanDerWaalsContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CB 3.39Å; A157-L161 PolarHBondContact O-N 3.02Å
158K96.6Very high93Very high136 Ų13697.8 Ų97.859%0.59149%0.491SS*.Hα-helixtrans-64.1-37.4173-79.6179.6179.3-176.70112.5V154 Q155 S156 K162V154-K158 HydrophobicContact CG1-CD 4.34Å; V154-K158 WeakPolarHBondContact O-CB 3.44Å; V154-K158 VanDerWaalsContact O-CG 3.29Å; V154-K158 WeakPolarHBondContact O-CG 3.41Å; V154-K158 PolarHBondContact O-N 2.91Å; Q155-K158 PolarHBondContact O-N 3.5Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 2.87Å; K158-K162 WeakPolarHBondContact O-CG 3.36Å; K158-K162 PolarHBondContact O-N 3.41Å; K158-K162 VanDerWaalsContact O-N 3.14Å
159Q95.1Very high92.4Very high108 Ų10896.9 Ų96.951%0.50548%0.483SS..Hα-helixtrans-71.5-44.3177.6-177.761.11500111.5Q155 S156 A157 L161 K162 V163Q155-Q159 PolarHBondContact O-N 3.24Å; S156-Q159 CarbonylContact O-C 3.56Å; S156-Q159 WeakPolarHBondContact O-CA 3.31Å; S156-Q159 WeakPolarHBondContact O-CB 3.44Å; S156-Q159 PolarHBondContact O-N 3.16Å; A157-Q159 VanDerWaalsContact C-N 3.34Å; A157-Q159 PolarHBondContact O-N 3.39Å; Q159-L161 VanDerWaalsContact C-N 3.29Å; Q159-L161 PolarHBondContact O-N 3.05Å; Q159-K162 WeakPolarHBondContact O-CB 3.45Å; Q159-K162 PolarHBondContact O-N 3.07Å; Q159-K162 VanDerWaalsContact O-N 3.15Å; Q159-V163 WeakPolarHBondContact O-CG2 3.29Å; Q159-V163 PolarHBondContact O-N 3.26Å
160E93.8Very high91.6Very high121 Ų12195.4 Ų95.457%0.56548%0.483SS*.Hα-helixtrans-58.8-41.8174-72.8168-141.500111.2S156 K162 V163 A164S156-E160 WeakPolarHBondContact O-CG 3.4Å; S156-E160 PolarHBondContact O-N 2.9Å; S156-E160 PolarHBondContact OG-OE1 3.34Å; E160-K162 PolarHBondContact O-N 3.38Å; E160-V163 PolarHBondContact O-N 3.16Å; E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.01Å
161L93.9Very high90.7Very high101 Ų10194.1 Ų94.153%0.52948%0.482SS..Hα-helixtrans-61.1-42.2174.7-177.263.5000112.2A157 Q159 V163 A164 Q165A157-L161 VanDerWaalsContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CB 3.39Å; A157-L161 PolarHBondContact O-N 3.02Å; Q159-L161 VanDerWaalsContact C-N 3.29Å; Q159-L161 PolarHBondContact O-N 3.05Å; L161-V163 VanDerWaalsContact C-N 3.34Å; L161-A164 PolarHBondContact O-N 3.33Å; L161-Q165 VanDerWaalsContact O-CG 3.3Å; L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 3.03Å
162K92.2Very high89.6Confident121 Ų12188 Ų8853%0.52646%0.461SS..Hα-helixtrans-64.1-39.1175.1-74.5176.2179.9-177.40112.1K158 Q159 E160 Q165 K166K158-K162 WeakPolarHBondContact O-CG 3.36Å; K158-K162 PolarHBondContact O-N 3.41Å; K158-K162 VanDerWaalsContact O-N 3.14Å; Q159-K162 WeakPolarHBondContact O-CB 3.45Å; Q159-K162 PolarHBondContact O-N 3.07Å; Q159-K162 VanDerWaalsContact O-N 3.15Å; E160-K162 PolarHBondContact O-N 3.38Å; K162-Q165 PolarHBondContact O-N 2.87Å; K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.03Å
163V93.7Very high88.4Confident73 Ų7384.7 Ų84.744%0.44245%0.446SS..Hα-helixtrans-65.6-47.1176.1173.10000110.1Q159 E160 L161 Q165 K166 V167Q159-V163 WeakPolarHBondContact O-CG2 3.29Å; Q159-V163 PolarHBondContact O-N 3.26Å; E160-V163 PolarHBondContact O-N 3.16Å; L161-V163 VanDerWaalsContact C-N 3.34Å; V163-Q165 VanDerWaalsContact C-N 3.3Å; V163-Q165 PolarHBondContact O-N 2.9Å; V163-K166 WeakPolarHBondContact O-CB 3.38Å; V163-K166 PolarHBondContact O-N 2.85Å; V163-V167 HydrophobicContact CG1-CG2 4.45Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.38Å
164A89.3Confident87.1Confident48 Ų4887.8 Ų87.840%0.39746%0.461SS..Hα-helixtrans-57.5-43.317600000111.8E160 L161 K166 V167 L168E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.01Å; L161-A164 PolarHBondContact O-N 3.33Å; A164-K166 VanDerWaalsContact C-N 3.35Å; A164-K166 PolarHBondContact O-N 2.91Å; A164-V167 PolarHBondContact O-N 3.1Å; A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 2.92Å
165Q86.9Confident85.6Confident89 Ų8993.1 Ų93.142%0.41648%0.481SS..Hα-helixtrans-60-41.7173.8-74.7174.3-9.400112.5L161 K162 V163 L168 L169 L178L161-Q165 VanDerWaalsContact O-CG 3.3Å; L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 3.03Å; K162-Q165 PolarHBondContact O-N 2.87Å; V163-Q165 VanDerWaalsContact C-N 3.3Å; V163-Q165 PolarHBondContact O-N 2.9Å; Q165-L168 PolarHBondContact O-N 3.25Å; Q165-L169 WeakPolarHBondContact O-CG 3.43Å; Q165-L169 PolarHBondContact O-N 3.08Å; Q165-L178 HydrophobicContact CB-CD1 4.11Å; Q165-L178 HydrophobicContact CG-CD1 4.22Å
166K86.3Confident84Confident154 Ų15490.4 Ų90.467%0.6747%0.471SS*.Hα-helixtrans-65.4-41.6176-74.7-177.9178.5-170.90112.8K162 V163 A164 L169 S170K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.03Å; V163-K166 WeakPolarHBondContact O-CB 3.38Å; V163-K166 PolarHBondContact O-N 2.85Å; A164-K166 VanDerWaalsContact C-N 3.35Å; A164-K166 PolarHBondContact O-N 2.91Å; K166-L169 PolarHBondContact O-N 3.46Å; K166-S170 PolarHBondContact O-N 3.19Å
167V86.1Confident83Confident70 Ų7091 Ų9142%0.42447%0.469SS..Hα-helixtrans-62.7-47.2176.4176.20000110V163 A164 L169 S170 E171V163-V167 HydrophobicContact CG1-CG2 4.45Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.38Å; A164-V167 PolarHBondContact O-N 3.1Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.34Å; V167-S170 PolarHBondContact O-N 3.5Å; V167-S170 PolarHBondContact O-OG 3.08Å; V167-E171 PolarHBondContact O-N 3.04Å; V167-E171 VanDerWaalsContact O-N 3.07Å
168L83Confident82Confident83 Ų8390.4 Ų90.444%0.43546%0.458SS..Hα-helixtrans-58.2-44.5175.7-69.6172.6000111.7A164 Q165 S170 E171 V172 L178A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 2.92Å; Q165-L168 PolarHBondContact O-N 3.25Å; L168-S170 VanDerWaalsContact C-N 3.29Å; L168-S170 PolarHBondContact O-N 2.95Å; L168-E171 PolarHBondContact O-N 2.96Å; L168-V172 WeakPolarHBondContact O-CB 3.33Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.21Å; L168-L178 HydrophobicContact CB-CD2 4.08Å
169L81.4Confident81Confident53 Ų5390.6 Ų90.628%0.27746%0.461SS..Hα-helixtrans-60.1-37.3174.4-74.7168.1000112.6Q165 K166 V167 E171 V172 G173 V176 L178Q165-L169 WeakPolarHBondContact O-CG 3.43Å; Q165-L169 PolarHBondContact O-N 3.08Å; K166-L169 PolarHBondContact O-N 3.46Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.34Å; L169-E171 VanDerWaalsContact C-N 3.33Å; L169-E171 PolarHBondContact O-N 2.88Å; L169-V172 PolarHBondContact O-N 3.29Å; L169-G173 CarbonylContact O-C 3.14Å; L169-G173 VanDerWaalsContact O-CA 3.31Å; L169-G173 WeakPolarHBondContact O-CA 3.46Å; L169-G173 PolarHBondContact O-N 3.15Å; L169-V176 WeakPolarHBondContact CD2-O 3.31Å; L169-L178 HydrophobicContact CD1-CD1 4.23Å; L169-L178 HydrophobicContact CD2-CD1 4.06Å; L169-L178 HydrophobicContact CD2-CG 3.94Å; L169-L178 HydrophobicContact CG-CD1 3.85Å; L169-L178 HydrophobicContact CG-CG 4.23Å
170S79.1Confident79.8Confident64 Ų6491.8 Ų91.845%0.44847%0.467SS..Hα-helixtrans-67.7-32.3177.373.50000113.3K166 V167 L168K166-S170 PolarHBondContact O-N 3.19Å; V167-S170 PolarHBondContact O-N 3.5Å; V167-S170 PolarHBondContact O-OG 3.08Å; L168-S170 VanDerWaalsContact C-N 3.29Å; L168-S170 PolarHBondContact O-N 2.95Å
171E78.3Confident78.6Confident117 Ų11788.1 Ų88.155%0.54745%0.45SS..Hα-helixtrans-80.8-32.6177.1-68.4-176175.900113.1V167 L168 L169 R191V167-E171 PolarHBondContact O-N 3.04Å; V167-E171 VanDerWaalsContact O-N 3.07Å; L168-E171 PolarHBondContact O-N 2.96Å; L169-E171 VanDerWaalsContact C-N 3.33Å; L169-E171 PolarHBondContact O-N 2.88Å; E171-R191 WeakPolarHBondContact O-CB 3.47Å; E171-R191 PolarHBondContact O-N 3.15Å
172V72.8Confident77.6Confident18 Ų1890.2 Ų90.211%0.10946%0.461CS..Hα-helixtrans-86.6-29.2-178.2170.80000111.1L168 L169 V176 M181 F188L168-V172 WeakPolarHBondContact O-CB 3.33Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.21Å; L169-V172 PolarHBondContact O-N 3.29Å; V172-V176 HydrophobicContact CG1-CB 3.5Å; V172-V176 VanDerWaalsContact CG1-CB 3.5Å; V172-V176 HydrophobicContact CG1-CG1 3.58Å; V172-V176 HydrophobicContact CG1-CG2 3.93Å; V172-M181 HydrophobicContact CG1-SD 3.56Å; V172-M181 VanDerWaalsContact CG1-SD 3.56Å; V172-M181 HydrophobicContact CG2-SD 4.1Å; V172-F188 HydrophobicContact CB-CE1 4.39Å; V172-F188 HydrophobicContact CB-CZ 3.88Å; V172-F188 HydrophobicContact CG1-CE1 4Å; V172-F188 HydrophobicContact CG1-CE2 3.6Å; V172-F188 HydrophobicContact CG1-CZ 3.21Å; V172-F188 HydrophobicContact CG2-CE1 4Å; V172-F188 HydrophobicContact CG2-CZ 4Å
173G69.5Low76.8Confident13 Ų1390.4 Ų90.413%0.13447%0.468CS..  trans106.5142.4-171.600000111.4L169 E175 V176L169-G173 CarbonylContact O-C 3.14Å; L169-G173 VanDerWaalsContact O-CA 3.31Å; L169-G173 WeakPolarHBondContact O-CA 3.46Å; L169-G173 PolarHBondContact O-N 3.15Å; G173-E175 PolarHBondContact O-N 3.48Å; G173-E175 VanDerWaalsContact O-N 3.11Å; G173-V176 PolarHBondContact O-N 3.29Å
174E68.4Low75.5Confident180 Ų18092.2 Ų92.284%0.84148%0.475SS*.THydrogen-bonded Turntrans-64-16.6-176.9-67.6177.7-176.600113.5
175E64.2Low74.3Confident191 Ų19195 Ų9589%0.89349%0.489SS*.THydrogen-bonded Turntrans-85.60.1-176.3-62.3-76163.600114.2G173G173-E175 PolarHBondContact O-N 3.48Å; G173-E175 VanDerWaalsContact O-N 3.11Å
176V63.9Low73.3Confident42 Ų42102.8 Ų102.826%0.25552%0.515SS..  trans-115.3123.8-169.6-175.40000112.6L169 V172 G173 L178 M181 F188L169-V176 WeakPolarHBondContact CD2-O 3.31Å; V172-V176 HydrophobicContact CG1-CB 3.5Å; V172-V176 VanDerWaalsContact CG1-CB 3.5Å; V172-V176 HydrophobicContact CG1-CG1 3.58Å; V172-V176 HydrophobicContact CG1-CG2 3.93Å; G173-V176 PolarHBondContact O-N 3.29Å; V176-L178 PolarHBondContact O-N 3.41Å; V176-M181 HydrophobicContact CG1-CG 3.91Å; V176-M181 HydrophobicContact CG1-SD 4.01Å; V176-F188 HydrophobicContact CG1-CD2 4.36Å; V176-F188 HydrophobicContact CG1-CE2 3.92Å; V176-F188 HydrophobicContact CG2-CE2 4.18Å
177N74Confident72.1Confident73 Ų73100.4 Ų100.439%0.3952%0.518SS..  trans-76.5113.9177.7-173.5-23000111.8Q179 Q180 M181N177-Q179 PolarHBondContact O-N 2.9Å; N177-Q179 VanDerWaalsContact O-N 3.16Å; N177-Q179 WeakPolarHBondContact OD1-CB 3.3Å; N177-Q179 PolarHBondContact OD1-N 3.46Å; N177-Q180 HydrophobicContact CB-CB 4.41Å; N177-Q180 HydrophobicContact CB-CG 4.16Å; N177-Q180 PolarHBondContact O-N 3.49Å; N177-M181 PolarHBondContact O-N 3.25Å
178L73.5Confident71.2Confident43 Ų4399.9 Ų99.923%0.22551%0.51CS..Hα-helixtrans-53.2-33.2178.1-74.6165000113.8Q165 L168 L169 V176 M181 L182Q165-L178 HydrophobicContact CB-CD1 4.11Å; Q165-L178 HydrophobicContact CG-CD1 4.22Å; L168-L178 HydrophobicContact CB-CD2 4.08Å; L169-L178 HydrophobicContact CD1-CD1 4.23Å; L169-L178 HydrophobicContact CD2-CD1 4.06Å; L169-L178 HydrophobicContact CD2-CG 3.94Å; L169-L178 HydrophobicContact CG-CD1 3.85Å; L169-L178 HydrophobicContact CG-CG 4.23Å; V176-L178 PolarHBondContact O-N 3.41Å; L178-M181 PolarHBondContact O-N 2.93Å; L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 2.84Å; L178-L182 VanDerWaalsContact O-N 3.15Å
179Q74.8Confident70.7Confident140 Ų140102 Ų10265%0.65451%0.512SS*.Hα-helixtrans-69.3-34.1178.3-70.4178.2-40.500112.3N177 N183N177-Q179 PolarHBondContact O-N 2.9Å; N177-Q179 VanDerWaalsContact O-N 3.16Å; N177-Q179 WeakPolarHBondContact OD1-CB 3.3Å; N177-Q179 PolarHBondContact OD1-N 3.46Å; Q179-N183 VanDerWaalsContact O-CG 3.31Å; Q179-N183 PolarHBondContact O-N 3.28Å; Q179-N183 PolarHBondContact O-ND2 3.44Å
180Q69.8Low70.5Confident133 Ų133100.3 Ų100.362%0.62151%0.507SS*.Hα-helixtrans-72.8-32.5177.6-68.4176.7-2000111.6N177 N183 N184N177-Q180 HydrophobicContact CB-CB 4.41Å; N177-Q180 HydrophobicContact CB-CG 4.16Å; N177-Q180 PolarHBondContact O-N 3.49Å; Q180-N183 PolarHBondContact O-N 3.17Å; Q180-N184 PolarHBondContact O-N 3.15Å
181M69.3Low70.6Confident45 Ų45103.4 Ų103.422%0.22251%0.509CS..Hα-helixtrans-67.2-41.6173.2-82.4-157.960.700113.6V172 V176 N177 L178 N183 N184 F188V172-M181 HydrophobicContact CG1-SD 3.56Å; V172-M181 VanDerWaalsContact CG1-SD 3.56Å; V172-M181 HydrophobicContact CG2-SD 4.1Å; V176-M181 HydrophobicContact CG1-CG 3.91Å; V176-M181 HydrophobicContact CG1-SD 4.01Å; N177-M181 PolarHBondContact O-N 3.25Å; L178-M181 PolarHBondContact O-N 2.93Å; M181-N183 PolarHBondContact O-N 3.32Å; M181-N184 CarbonylContact O-C 3.59Å; M181-N184 VanDerWaalsContact O-C 3.3Å; M181-N184 PolarHBondContact O-N 3.36Å; M181-F188 HydrophobicContact CE-CB 3.68Å; M181-F188 HydrophobicContact CE-CD1 3.09Å; M181-F188 HydrophobicContact CE-CD2 3.91Å; M181-F188 HydrophobicContact CE-CE1 3.64Å; M181-F188 HydrophobicContact CE-CE2 4.4Å; M181-F188 HydrophobicContact CE-CG 3.24Å; M181-F188 HydrophobicContact CE-CZ 4.3Å; M181-F188 HydrophobicContact CG-CD2 4.01Å; M181-F188 HydrophobicContact CG-CG 4.19Å; M181-F188 HydrophobicContact SD-CB 4.39Å; M181-F188 HydrophobicContact SD-CD1 3.72Å; M181-F188 HydrophobicContact SD-CD2 3.56Å; M181-F188 VanDerWaalsContact SD-CD2 3.56Å; M181-F188 HydrophobicContact SD-CE1 3.81Å; M181-F188 HydrophobicContact SD-CE2 3.72Å; M181-F188 HydrophobicContact SD-CG 3.58Å; M181-F188 VanDerWaalsContact SD-CG 3.58Å; M181-F188 HydrophobicContact SD-CZ 3.86Å
182L72.4Confident70.8Confident144 Ų144101.9 Ų101.975%0.75451%0.511SS*.Hα-helixtrans-62.1-33.7176.2-73.5170.1000111.6L178L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 2.84Å; L178-L182 VanDerWaalsContact O-N 3.15Å
183N76.5Confident71.3Confident126 Ų126105.6 Ų105.667%0.67453%0.527SS*.Hα-helixtrans-79.5-23.7179.5-66.8-16.5000113.3Q179 Q180 M181Q179-N183 VanDerWaalsContact O-CG 3.31Å; Q179-N183 PolarHBondContact O-N 3.28Å; Q179-N183 PolarHBondContact O-ND2 3.44Å; Q180-N183 PolarHBondContact O-N 3.17Å; M181-N183 PolarHBondContact O-N 3.32Å
184N66.8Low72Confident111 Ų111109.3 Ų109.359%0.59454%0.541SS*.  trans-142.278.4-179.4-78.3-33.9000112.4Q180 M181 R186Q180-N184 PolarHBondContact O-N 3.15Å; M181-N184 CarbonylContact O-C 3.59Å; M181-N184 VanDerWaalsContact O-C 3.3Å; M181-N184 PolarHBondContact O-N 3.36Å; N184-R186 VanDerWaalsContact C-N 3.29Å; N184-R186 PolarHBondContact O-N 2.93Å
185P62.8Low72.8Confident106 Ų106104.1 Ų104.169%0.68852%0.519SS*.THydrogen-bonded Turntrans-72.8-16.4-17426.7-34.3000114.5
186R66.1Low74Confident252 Ų25299.9 Ų99.995%0.95150%0.502SS*.THydrogen-bonded Turntrans-84.8-20.9-168.3-157.8175.5-169.4160.33.2114.7N184N184-R186 VanDerWaalsContact C-N 3.29Å; N184-R186 PolarHBondContact O-N 2.93Å
187S62.3Low75.2Confident105 Ų10599.7 Ų99.773%0.73451%0.505SS*.SBendtrans-98.6-4.7-176.555.80000113.7
188F67.3Low76.1Confident59 Ų59101.7 Ų101.726%0.25952%0.515SS..  trans-86.8129-174.1-176.4-98.7000112.3V172 V176 M181 G190V172-F188 HydrophobicContact CB-CE1 4.39Å; V172-F188 HydrophobicContact CB-CZ 3.88Å; V172-F188 HydrophobicContact CG1-CE1 4Å; V172-F188 HydrophobicContact CG1-CE2 3.6Å; V172-F188 HydrophobicContact CG1-CZ 3.21Å; V172-F188 HydrophobicContact CG2-CE1 4Å; V172-F188 HydrophobicContact CG2-CZ 4Å; V176-F188 HydrophobicContact CG1-CD2 4.36Å; V176-F188 HydrophobicContact CG1-CE2 3.92Å; V176-F188 HydrophobicContact CG2-CE2 4.18Å; M181-F188 HydrophobicContact CE-CB 3.68Å; M181-F188 HydrophobicContact CE-CD1 3.09Å; M181-F188 HydrophobicContact CE-CD2 3.91Å; M181-F188 HydrophobicContact CE-CE1 3.64Å; M181-F188 HydrophobicContact CE-CE2 4.4Å; M181-F188 HydrophobicContact CE-CG 3.24Å; M181-F188 HydrophobicContact CE-CZ 4.3Å; M181-F188 HydrophobicContact CG-CD2 4.01Å; M181-F188 HydrophobicContact CG-CG 4.19Å; M181-F188 HydrophobicContact SD-CB 4.39Å; M181-F188 HydrophobicContact SD-CD1 3.72Å; M181-F188 HydrophobicContact SD-CD2 3.56Å; M181-F188 VanDerWaalsContact SD-CD2 3.56Å; M181-F188 HydrophobicContact SD-CE1 3.81Å; M181-F188 HydrophobicContact SD-CE2 3.72Å; M181-F188 HydrophobicContact SD-CG 3.58Å; M181-F188 VanDerWaalsContact SD-CG 3.58Å; M181-F188 HydrophobicContact SD-CZ 3.86Å; F188-G190 VanDerWaalsContact CE1-CA 3.43Å
189R72.2Confident77Confident128 Ų128104.5 Ų104.548%0.48353%0.527SS..  trans-115.2114.6175.1-163.4178.7-178.7151.82.9108.3Q193 Q194R189-Q193 HydrophobicContact CG-CB 4.01Å; R189-Q193 HydrophobicContact CG-CG 3.97Å; R189-Q193 VanDerWaalsContact CG-OE1 3.24Å; R189-Q194 HydrophobicContact CG-CG 4.45Å; R189-Q194 PolarHBondContact O-NE2 3.36Å
190G76.8Confident77.9Confident17 Ų17101 Ų10118%0.17552%0.515CS..  trans-63.8158.7-175.200000114.3F188 S192 Q193 Q194F188-G190 VanDerWaalsContact CE1-CA 3.43Å; G190-S192 VanDerWaalsContact C-N 3.29Å; G190-S192 PolarHBondContact O-N 3.48Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 3.4Å; G190-Q194 WeakPolarHBondContact O-CG 3.42Å; G190-Q194 PolarHBondContact O-N 3.2Å
191R81.8Confident79.1Confident128 Ų128102.8 Ų102.848%0.48352%0.516SS..Hα-helixtrans-56.9-41.5-178.2-173.7-177.7176.2167.43.2112.2E171 Q193 Q194 I195E171-R191 WeakPolarHBondContact O-CB 3.47Å; E171-R191 PolarHBondContact O-N 3.15Å; R191-Q193 VanDerWaalsContact C-N 3.3Å; R191-Q193 PolarHBondContact O-N 3.42Å; R191-Q194 PolarHBondContact O-N 2.84Å; R191-I195 HydrophobicContact CG-CD1 3.89Å; R191-I195 HydrophobicContact CG-CG1 4.38Å; R191-I195 WeakPolarHBondContact O-CB 3.5Å; R191-I195 VanDerWaalsContact O-CG1 3.26Å; R191-I195 WeakPolarHBondContact O-CG1 3.45Å; R191-I195 PolarHBondContact O-N 2.97Å
192S81.1Confident80.4Confident86 Ų86104.1 Ų104.160%0.60153%0.526SS*.Hα-helixtrans-58.6-41.8175.856.90000112G190 I195 L196G190-S192 VanDerWaalsContact C-N 3.29Å; G190-S192 PolarHBondContact O-N 3.48Å; S192-I195 PolarHBondContact O-N 3.14Å; S192-L196 WeakPolarHBondContact O-CB 3.46Å; S192-L196 VanDerWaalsContact O-CG 3.31Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 3.45Å
193Q83.1Confident81.4Confident95 Ų95105.2 Ų105.244%0.44452%0.52SS..Hα-helixtrans-74.4-30.5178.8-161.1-175.42.800112.6R189 G190 R191 A197R189-Q193 HydrophobicContact CG-CB 4.01Å; R189-Q193 HydrophobicContact CG-CG 3.97Å; R189-Q193 VanDerWaalsContact CG-OE1 3.24Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 3.4Å; R191-Q193 VanDerWaalsContact C-N 3.3Å; R191-Q193 PolarHBondContact O-N 3.42Å; Q193-A197 WeakPolarHBondContact O-CB 3.38Å; Q193-A197 PolarHBondContact O-N 2.84Å
194Q84.2Confident82.2Confident92 Ų92103.7 Ų103.743%0.4351%0.509SS..Hα-helixtrans-68.6-45.2170.4-67178.219.600111.2R189 G190 R191 L196 A197 L198R189-Q194 HydrophobicContact CG-CG 4.45Å; R189-Q194 PolarHBondContact O-NE2 3.36Å; G190-Q194 WeakPolarHBondContact O-CG 3.42Å; G190-Q194 PolarHBondContact O-N 3.2Å; R191-Q194 PolarHBondContact O-N 2.84Å; Q194-L196 PolarHBondContact O-N 2.95Å; Q194-A197 PolarHBondContact O-N 2.99Å; Q194-L198 WeakPolarHBondContact O-CB 3.32Å; Q194-L198 WeakPolarHBondContact O-CG 3.22Å; Q194-L198 PolarHBondContact O-N 3.36Å
195I86Confident83.5Confident71 Ų71102.6 Ų102.636%0.36450%0.503SS..Hα-helixtrans-59.5-47.8175.2-70.7167.5000110.2R191 S192 A197 L198 Q199R191-I195 HydrophobicContact CG-CD1 3.89Å; R191-I195 HydrophobicContact CG-CG1 4.38Å; R191-I195 WeakPolarHBondContact O-CB 3.5Å; R191-I195 VanDerWaalsContact O-CG1 3.26Å; R191-I195 WeakPolarHBondContact O-CG1 3.45Å; R191-I195 PolarHBondContact O-N 2.97Å; S192-I195 PolarHBondContact O-N 3.14Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.38Å; I195-L198 PolarHBondContact O-N 3.42Å; I195-Q199 HydrophobicContact CG2-CG 4.12Å; I195-Q199 WeakPolarHBondContact O-CB 3.46Å; I195-Q199 VanDerWaalsContact O-CG 3.26Å; I195-Q199 WeakPolarHBondContact O-CG 3.41Å; I195-Q199 PolarHBondContact O-N 2.95Å
196L89.6Confident84.8Confident102 Ų102103.3 Ų103.353%0.53450%0.497SS..Hα-helixtrans-59.5-44176.9-76.8169.7000111.7S192 Q194 L198 Q199 T200S192-L196 WeakPolarHBondContact O-CB 3.46Å; S192-L196 VanDerWaalsContact O-CG 3.31Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 3.45Å; Q194-L196 PolarHBondContact O-N 2.95Å; L196-L198 VanDerWaalsContact C-N 3.35Å; L196-L198 PolarHBondContact O-N 3.17Å; L196-Q199 PolarHBondContact O-N 3.49Å; L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.89Å; L196-T200 VanDerWaalsContact O-OG1 3.07Å
197A90.1Very high85.9Confident38 Ų3896.8 Ų96.831%0.31448%0.477SS..Hα-helixtrans-62.1-4217700000112.3Q193 Q194 I195 R201Q193-A197 WeakPolarHBondContact O-CB 3.38Å; Q193-A197 PolarHBondContact O-N 2.84Å; Q194-A197 PolarHBondContact O-N 2.99Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.38Å; A197-R201 WeakPolarHBondContact O-CB 3.28Å; A197-R201 PolarHBondContact O-N 3.25Å
198L92.3Very high87.2Confident115 Ų11597.6 Ų97.660%0.60247%0.47SS*.Hα-helixtrans-66.7-43175.9-72.8171.9000111.7Q194 I195 L196 T200 R201 V202Q194-L198 WeakPolarHBondContact O-CB 3.32Å; Q194-L198 WeakPolarHBondContact O-CG 3.22Å; Q194-L198 PolarHBondContact O-N 3.36Å; I195-L198 PolarHBondContact O-N 3.42Å; L196-L198 VanDerWaalsContact C-N 3.35Å; L196-L198 PolarHBondContact O-N 3.17Å; L198-T200 PolarHBondContact O-N 3.18Å; L198-R201 PolarHBondContact O-N 2.66Å; L198-V202 WeakPolarHBondContact O-CB 3.35Å; L198-V202 VanDerWaalsContact O-CG2 3.29Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.03Å
199Q92.9Very high88Confident102 Ų10299.6 Ų99.648%0.47748%0.483SS..Hα-helixtrans-61.6-42.7176.5-76175.6-1700111.9I195 L196 R201 V202 R203I195-Q199 HydrophobicContact CG2-CG 4.12Å; I195-Q199 WeakPolarHBondContact O-CB 3.46Å; I195-Q199 VanDerWaalsContact O-CG 3.26Å; I195-Q199 WeakPolarHBondContact O-CG 3.41Å; I195-Q199 PolarHBondContact O-N 2.95Å; L196-Q199 PolarHBondContact O-N 3.49Å; Q199-R201 VanDerWaalsContact C-N 3.33Å; Q199-V202 PolarHBondContact O-N 3.44Å; Q199-R203 WeakPolarHBondContact O-CB 3.44Å; Q199-R203 PolarHBondContact O-N 3.04Å
200T93.6Very high88.2Confident67 Ų6796.7 Ų96.741%0.41148%0.481SS..Hα-helixtrans-60.4-45.7174-62.30000110.7L196 L198 R203 E204L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.89Å; L196-T200 VanDerWaalsContact O-OG1 3.07Å; L198-T200 PolarHBondContact O-N 3.18Å; T200-R203 WeakPolarHBondContact O-CB 3.45Å; T200-R203 PolarHBondContact O-N 2.97Å; T200-E204 WeakPolarHBondContact O-CG 3.46Å; T200-E204 PolarHBondContact O-N 2.89Å
201R94.7Very high88Confident170 Ų170101 Ų10164%0.64250%0.496SS*.Hα-helixtrans-68.8-36.8-179.5-162.3157.4-176.5121.2-4.4113.1A197 L198 Q199 E204 L205A197-R201 WeakPolarHBondContact O-CB 3.28Å; A197-R201 PolarHBondContact O-N 3.25Å; L198-R201 PolarHBondContact O-N 2.66Å; Q199-R201 VanDerWaalsContact C-N 3.33Å; R201-E204 PolarHBondContact O-N 3.1Å; R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CB 3.4Å; R201-L205 VanDerWaalsContact O-CG 3.24Å; R201-L205 WeakPolarHBondContact O-CG 3.26Å; R201-L205 PolarHBondContact O-N 3.07Å
202V95.3Very high87.5Confident72 Ų72101.3 Ų101.344%0.43650%0.503SS..Hα-helixtrans-62.5-44.9172.4168.60000110.1L198 Q199 E204 L205 E206L198-V202 WeakPolarHBondContact O-CB 3.35Å; L198-V202 VanDerWaalsContact O-CG2 3.29Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.03Å; Q199-V202 PolarHBondContact O-N 3.44Å; V202-E204 PolarHBondContact O-N 3.46Å; V202-L205 PolarHBondContact O-N 2.95Å; V202-E206 HydrophobicContact CG1-CG 4.22Å; V202-E206 WeakPolarHBondContact O-CB 3.29Å; V202-E206 VanDerWaalsContact O-CG 3.29Å; V202-E206 WeakPolarHBondContact O-CG 3.32Å; V202-E206 PolarHBondContact O-N 3.31Å
203R94.4Very high86.6Confident168 Ų168106.2 Ų106.263%0.63451%0.508SS*.Hα-helixtrans-61.9-41.7177-169.5-174.7-57.8170.23.3112.3Q199 T200 E206 Q207Q199-R203 WeakPolarHBondContact O-CB 3.44Å; Q199-R203 PolarHBondContact O-N 3.04Å; T200-R203 WeakPolarHBondContact O-CB 3.45Å; T200-R203 PolarHBondContact O-N 2.97Å; R203-E206 PolarHBondContact O-N 2.85Å; R203-Q207 VanDerWaalsContact O-CB 3.31Å; R203-Q207 WeakPolarHBondContact O-CB 3.42Å; R203-Q207 PolarHBondContact O-N 3.47Å
204E93.9Very high85.4Confident93 Ų93107.9 Ų107.944%0.43552%0.516SS..Hα-helixtrans-61.8-44174.4-73.6169-174.800111.5T200 R201 V202 Q207 Q208T200-E204 WeakPolarHBondContact O-CG 3.46Å; T200-E204 PolarHBondContact O-N 2.89Å; R201-E204 PolarHBondContact O-N 3.1Å; V202-E204 PolarHBondContact O-N 3.46Å; E204-Q207 WeakPolarHBondContact O-CB 3.47Å; E204-Q207 PolarHBondContact O-N 3.19Å; E204-Q208 VanDerWaalsContact O-CG 3.29Å; E204-Q208 WeakPolarHBondContact O-CG 3.14Å; E204-Q208 PolarHBondContact O-N 3.46Å
205L93.2Very high84Confident89 Ų89106.7 Ų106.747%0.46652%0.522SS..Hα-helixtrans-67-41.3177.2-71.4170000112.3R201 V202 Q207 Q208 L209R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CB 3.4Å; R201-L205 VanDerWaalsContact O-CG 3.24Å; R201-L205 WeakPolarHBondContact O-CG 3.26Å; R201-L205 PolarHBondContact O-N 3.07Å; V202-L205 PolarHBondContact O-N 2.95Å; L205-Q207 VanDerWaalsContact C-N 3.31Å; L205-Q207 PolarHBondContact O-N 2.95Å; L205-Q208 PolarHBondContact O-N 3.42Å; L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.07Å
206E90Very high82.3Confident120 Ų120109 Ų10956%0.56154%0.535SS*.Hα-helixtrans-60.8-41.9173.3-75.5173.9167.500111.1V202 R203 L209 C210V202-E206 HydrophobicContact CG1-CG 4.22Å; V202-E206 WeakPolarHBondContact O-CB 3.29Å; V202-E206 VanDerWaalsContact O-CG 3.29Å; V202-E206 WeakPolarHBondContact O-CG 3.32Å; V202-E206 PolarHBondContact O-N 3.31Å; R203-E206 PolarHBondContact O-N 2.85Å; E206-L209 PolarHBondContact O-N 2.93Å; E206-C210 WeakPolarHBondContact O-CB 3.3Å; E206-C210 PolarHBondContact O-N 3.37Å
207Q89.8Confident80.4Confident115 Ų115109.2 Ų109.254%0.53754%0.54SS..Hα-helixtrans-62.9-46.7174.6-172.3174.88.300110.5R203 E204 L205 L209 C210 H211R203-Q207 VanDerWaalsContact O-CB 3.31Å; R203-Q207 WeakPolarHBondContact O-CB 3.42Å; R203-Q207 PolarHBondContact O-N 3.47Å; E204-Q207 WeakPolarHBondContact O-CB 3.47Å; E204-Q207 PolarHBondContact O-N 3.19Å; L205-Q207 VanDerWaalsContact C-N 3.31Å; L205-Q207 PolarHBondContact O-N 2.95Å; Q207-L209 VanDerWaalsContact C-N 3.34Å; Q207-L209 PolarHBondContact O-N 3.45Å; Q207-C210 WeakPolarHBondContact O-CB 3.33Å; Q207-C210 PolarHBondContact O-N 3.5Å; Q207-H211 VanDerWaalsContact CG-CE1 3.45Å; Q207-H211 WeakPolarHBondContact CG-CE1 3.33Å; Q207-H211 PolarHBondContact O-N 3.47Å; Q207-H211 PolarHBondContact O-ND1 2.93Å
208Q90.2Very high78.3Confident123 Ų123116.1 Ų116.158%0.57557%0.566SS**Hα-helixtrans-59.3-42.3176.4-73.4172.68.600112.3E204 L205 C210 H211 Q212E204-Q208 VanDerWaalsContact O-CG 3.29Å; E204-Q208 WeakPolarHBondContact O-CG 3.14Å; E204-Q208 PolarHBondContact O-N 3.46Å; L205-Q208 PolarHBondContact O-N 3.42Å; Q208-C210 PolarHBondContact O-N 3.31Å; Q208-H211 PolarHBondContact O-N 3.32Å; Q208-Q212 WeakPolarHBondContact O-CB 3.49Å; Q208-Q212 PolarHBondContact O-N 3.26Å
209L84Confident76.1Confident101 Ų101115.3 Ų115.353%0.52957%0.57SS.*Hα-helixtrans-66.1-35.3175.7-73.2172.3000112.8L205 E206 Q207 Q212 R213L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.07Å; E206-L209 PolarHBondContact O-N 2.93Å; Q207-L209 VanDerWaalsContact C-N 3.34Å; Q207-L209 PolarHBondContact O-N 3.45Å; L209-Q212 PolarHBondContact O-N 2.94Å; L209-R213 WeakPolarHBondContact O-CB 3.22Å; L209-R213 PolarHBondContact O-N 2.95Å
210C75.9Confident73.8Confident66 Ų66115.2 Ų115.245%0.44658%0.577SS.*Hα-helixtrans-65-42.5174.4-169.20000111.5E206 Q207 Q208 R213 Q214E206-C210 WeakPolarHBondContact O-CB 3.3Å; E206-C210 PolarHBondContact O-N 3.37Å; Q207-C210 WeakPolarHBondContact O-CB 3.33Å; Q207-C210 PolarHBondContact O-N 3.5Å; Q208-C210 PolarHBondContact O-N 3.31Å; C210-R213 PolarHBondContact O-N 3.2Å; C210-Q214 WeakPolarHBondContact O-CG 3.49Å; C210-Q214 PolarHBondContact O-N 3.01Å
211H73.1Confident71.4Confident108 Ų108121.4 Ų121.450%0.560%0.601SS.*Hα-helixtrans-66.3-38.6175.3-70.375.8000111.7Q207 Q208 Q214 A215Q207-H211 VanDerWaalsContact CG-CE1 3.45Å; Q207-H211 WeakPolarHBondContact CG-CE1 3.33Å; Q207-H211 PolarHBondContact O-N 3.47Å; Q207-H211 PolarHBondContact O-ND1 2.93Å; Q208-H211 PolarHBondContact O-N 3.32Å; H211-Q214 PolarHBondContact O-N 2.98Å; H211-A215 PolarHBondContact O-N 3.38Å
212Q69.5Low69.1Low134 Ų134121.1 Ų121.163%0.62661%0.606SS**Hα-helixtrans-65.5-37.6175.5-165.9172.914.400112.1Q208 L209 A215 D216Q208-Q212 WeakPolarHBondContact O-CB 3.49Å; Q208-Q212 PolarHBondContact O-N 3.26Å; L209-Q212 PolarHBondContact O-N 2.94Å; Q212-A215 PolarHBondContact O-N 3.05Å; Q212-D216 PolarHBondContact O-N 2.71Å; Q212-D216 VanDerWaalsContact O-N 3.13Å
213R63.7Low66.2Low189 Ų189124.3 Ų124.371%0.71362%0.621SS**Hα-helixtrans-70.2-32176.1-159.6-178.3-64.4-166.30112.7L209 C210 V217L209-R213 WeakPolarHBondContact O-CB 3.22Å; L209-R213 PolarHBondContact O-N 2.95Å; C210-R213 PolarHBondContact O-N 3.2Å; R213-V217 VanDerWaalsContact O-CG2 3.25Å; R213-V217 WeakPolarHBondContact O-CG2 3.41Å; R213-V217 PolarHBondContact O-N 3.04Å
214Q56.8Low63.3Low130 Ų130125.4 Ų125.461%0.60763%0.631SS**Hα-helixtrans-73.9-31173.1-73.2-177.6-600112.7C210 H211C210-Q214 WeakPolarHBondContact O-CG 3.49Å; C210-Q214 PolarHBondContact O-N 3.01Å; H211-Q214 PolarHBondContact O-N 2.98Å
215A55.9Low61.2Low67 Ų67126.8 Ų126.855%0.55465%0.651SS**Hα-helixtrans-69.2-33.8173.100000112.7H211 Q212H211-A215 PolarHBondContact O-N 3.38Å; Q212-A215 PolarHBondContact O-N 3.05Å
216D50.3Low58.4Low119 Ų119125.7 Ų125.764%0.63666%0.661SS**Hα-helixtrans-74.5-24.9179.3-148.921.6000113Q212 Q218 S219Q212-D216 PolarHBondContact O-N 2.71Å; Q212-D216 VanDerWaalsContact O-N 3.13Å; D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.32Å; D216-S219 PolarHBondContact O-N 2.86Å
217V49.2Very low56.4Low107 Ų107127.5 Ų127.565%0.64868%0.68SS**THydrogen-bonded Turntrans-77.9-14.9178.71740000112.9R213R213-V217 VanDerWaalsContact O-CG2 3.25Å; R213-V217 WeakPolarHBondContact O-CG2 3.41Å; R213-V217 PolarHBondContact O-N 3.04Å
218Q46.1Very low53.8Low184 Ų184126.5 Ų126.586%0.8669%0.692SS**THydrogen-bonded Turntrans-84.7-4.6172.7-80.9-177.80.300114.1D216D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.32Å
219S46.3Very low51.4Low97 Ų97125.6 Ų125.668%0.67870%0.699SS**SBendtrans-107.1-4.7-177-168.30000115D216D216-S219 PolarHBondContact O-N 2.86Å
220V44.8Very low49.6Very low101 Ų101128.9 Ų128.961%0.61271%0.711SS**  trans-135.462.8-173.6-167.70000111Q222V220-Q222 VanDerWaalsContact C-N 3.27Å
221E42.1Very low48.3Very low197 Ų197134 Ų13492%0.92173%0.728SS**  trans-94.754.2155.1-76.2-154.1160.500110
222Q46.7Very low47.4Very low163 Ų163135.1 Ų135.176%0.76273%0.732SS**  trans-16084.1165.9-153.916111.100108.3V220V220-Q222 VanDerWaalsContact C-N 3.27Å
223D35.2Very low46.6Very low139 Ų139132.2 Ų132.274%0.74373%0.725SS**  trans173.1120.8131.7-84-21.2000113.2
224F32.5Very low46.4Very low192 Ų192128.1 Ų128.184%0.84272%0.722SS**  trans69.3107.8138.4-102.1-103.2000121.2
225S49.8Very low46.5Very low122 Ų122125 Ų12585%0.85372%0.718SS**  trans-45.5128.9149.3-45.90000112.3
226G35.5Very low46.9Very low65 Ų65126.4 Ų126.467%0.6771%0.714SS**  trans-163.6104.5172.500000111.3A228G226-A228 PolarHBondContact O-N 2.86Å
227T46.3Very low47.8Very low158 Ų158125.1 Ų125.197%0.96971%0.707SS**  trans-46.197.3165.5120000111.4
228A35.1Very low49Very low95 Ų95129.3 Ų129.379%0.78571%0.711SS**  trans-98102.2171.200000110G226 H230G226-A228 PolarHBondContact O-N 2.86Å; A228-H230 PolarHBondContact O-N 3.34Å
229S40.2Very low50.8Low103 Ų103125.2 Ų125.272%0.7270%0.695SS**  trans-41.1131.5161.8-178.40000111.6H231S229-H231 VanDerWaalsContact C-N 3.32Å; S229-H231 PolarHBondContact O-N 3.43Å
230H46.8Very low52.7Low170 Ų170124.3 Ų124.379%0.78768%0.682SS**  trans-61.382.9175.5-87.6-65000112.2A228 K232A228-H230 PolarHBondContact O-N 3.34Å; H230-K232 PolarHBondContact O-N 2.79Å
231H49.1Very low54.7Low174 Ų174123 Ų12381%0.80667%0.671SS**  trans-90.586.9153.6-93.3-69.5000108.9S229S229-H231 VanDerWaalsContact C-N 3.32Å; S229-H231 PolarHBondContact O-N 3.43Å
232K53Low57.1Low132 Ų132121 Ų12157%0.57466%0.657SS**  trans-63132.2161.6-73.4-180179.5175.30107.9H230H230-K232 PolarHBondContact O-N 2.79Å
233P52.7Low59.2Low73 Ų73117.1 Ų117.147%0.47464%0.64SS.*  trans-59.9143.5-179.221.2-29.9000110.7A235 Q236P233-A235 PolarHBondContact O-N 3.46Å; P233-Q236 HydrophobicContact CG-CB 4.33Å; P233-Q236 WeakPolarHBondContact O-CB 3.47Å; P233-Q236 PolarHBondContact O-N 3.42Å
234P60.2Low62Low103 Ų103117.6 Ų117.667%0.66963%0.632SS**Hα-helixtrans-58-21.7-175.418.7-30000114R238P234-R238 PolarHBondContact O-N 3.29Å
235A59.3Low65Low63 Ų63111.8 Ų111.852%0.52161%0.612SS.*Hα-helixtrans-66.5-34.1173.100000113.4P233 R238 N239P233-A235 PolarHBondContact O-N 3.46Å; A235-R238 PolarHBondContact O-N 2.93Å; A235-N239 PolarHBondContact O-N 3.29Å; A235-N239 PolarHBondContact O-ND2 3.38Å
236Q64.9Low67.2Low98 Ų98108.2 Ų108.246%0.45858%0.583SS.*Hα-helixtrans-73.9-32.6-177-141.7172.912.700111.9P233 L240P233-Q236 HydrophobicContact CG-CB 4.33Å; P233-Q236 WeakPolarHBondContact O-CB 3.47Å; P233-Q236 PolarHBondContact O-N 3.42Å; Q236-L240 WeakPolarHBondContact O-CG 3.31Å; Q236-L240 PolarHBondContact O-N 2.95Å
237N67.1Low69.9Low92 Ų92110 Ų11049%0.49257%0.574SS.*Hα-helixtrans-71-37.2174.9-163-17.1000111.7L240 N241N237-L240 PolarHBondContact O-N 3.34Å; N237-N241 PolarHBondContact O-N 3.19Å; N237-N241 PolarHBondContact O-ND2 2.88Å; N237-N241 PolarHBondContact OD1-ND2 3.48Å
238R76.1Confident72.3Confident194 Ų194108.1 Ų108.173%0.73255%0.552SS**Hα-helixtrans-61.7-43.5173.4-71.6179.9-179.9178.60.4112.3P234 A235 N241 Y242P234-R238 PolarHBondContact O-N 3.29Å; A235-R238 PolarHBondContact O-N 2.93Å; R238-N241 PolarHBondContact O-N 3.36Å; R238-Y242 WeakPolarHBondContact O-CB 3.28Å; R238-Y242 PolarHBondContact O-N 3.26Å
239N83.5Confident75.2Confident99 Ų99108.9 Ų108.953%0.52954%0.539SS..Hα-helixtrans-63.2-41.4176.5-71.7-34000112.3A235 Y242 I243A235-N239 PolarHBondContact O-N 3.29Å; A235-N239 PolarHBondContact O-ND2 3.38Å; N239-Y242 PolarHBondContact O-N 2.84Å; N239-I243 VanDerWaalsContact O-CG1 3.25Å; N239-I243 WeakPolarHBondContact O-CG1 3.29Å; N239-I243 PolarHBondContact O-N 2.94Å
240L86.9Confident77.9Confident77 Ų77110.9 Ų110.940%0.40354%0.535SS..Hα-helixtrans-65.3-40.7177.6-72.4171.9000112.7Q236 N237 I243 R244Q236-L240 WeakPolarHBondContact O-CG 3.31Å; Q236-L240 PolarHBondContact O-N 2.95Å; N237-L240 PolarHBondContact O-N 3.34Å; L240-I243 PolarHBondContact O-N 3.44Å; L240-R244 WeakPolarHBondContact O-CG 3.46Å; L240-R244 PolarHBondContact O-N 3.44Å
241N86.4Confident80.2Confident73 Ų73109.8 Ų109.839%0.3952%0.524SS..Hα-helixtrans-67.9-39.6176.2-68.3-26.6000111.5N237 R238 R244 T245N237-N241 PolarHBondContact O-N 3.19Å; N237-N241 PolarHBondContact O-ND2 2.88Å; N237-N241 PolarHBondContact OD1-ND2 3.48Å; R238-N241 PolarHBondContact O-N 3.36Å; N241-R244 PolarHBondContact O-N 3.24Å; N241-T245 PolarHBondContact O-N 3.41Å; N241-T245 PolarHBondContact O-OG1 2.8Å
242Y92.7Very high82.5Confident157 Ų157105.4 Ų105.462%0.61650%0.504SS*.Hα-helixtrans-61.5-43.4174.6-178.5-114.4000112.4R238 N239 T245 I246R238-Y242 WeakPolarHBondContact O-CB 3.28Å; R238-Y242 PolarHBondContact O-N 3.26Å; N239-Y242 PolarHBondContact O-N 2.84Å; Y242-T245 PolarHBondContact O-N 2.94Å; Y242-I246 HydrophobicContact CD1-CD1 3.74Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE1-CG1 4.39Å; Y242-I246 HydrophobicContact CE2-CD1 3.98Å; Y242-I246 HydrophobicContact CE2-CG1 4.32Å; Y242-I246 HydrophobicContact CG-CD1 4.29Å; Y242-I246 WeakPolarHBondContact O-CG1 3.39Å; Y242-I246 PolarHBondContact O-N 3.31Å
243I90.3Very high84.5Confident81 Ų81100.6 Ų100.642%0.41549%0.489SS..Hα-helixtrans-60.7-47175.1-69164.5000110.8N239 L240 T245 I246 E247N239-I243 VanDerWaalsContact O-CG1 3.25Å; N239-I243 WeakPolarHBondContact O-CG1 3.29Å; N239-I243 PolarHBondContact O-N 2.94Å; L240-I243 PolarHBondContact O-N 3.44Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.02Å; I243-I246 PolarHBondContact O-N 2.97Å; I243-E247 HydrophobicContact CG2-CG 4.33Å; I243-E247 WeakPolarHBondContact O-CG 3.47Å; I243-E247 PolarHBondContact O-N 3.3Å
244R94.6Very high86.5Confident149 Ų149103.8 Ų103.856%0.56250%0.495SS*.Hα-helixtrans-61.1-38.3177.1-73.2-174.4-139.6152.55.9112.6L240 N241 E247 K248L240-R244 WeakPolarHBondContact O-CG 3.46Å; L240-R244 PolarHBondContact O-N 3.44Å; N241-R244 PolarHBondContact O-N 3.24Å; R244-E247 PolarHBondContact O-N 2.94Å; R244-K248 VanDerWaalsContact O-CB 3.32Å; R244-K248 WeakPolarHBondContact O-CB 3.33Å; R244-K248 PolarHBondContact O-N 3.09Å
245T95Very high88.2Confident70 Ų70104.2 Ų104.243%0.42949%0.489SS..Hα-helixtrans-63.6-47.5175.6-57.60000110.8N241 Y242 I243 E247 K248 E249N241-T245 PolarHBondContact O-N 3.41Å; N241-T245 PolarHBondContact O-OG1 2.8Å; Y242-T245 PolarHBondContact O-N 2.94Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.02Å; T245-E247 VanDerWaalsContact C-N 3.34Å; T245-E247 PolarHBondContact O-N 3.4Å; T245-K248 PolarHBondContact O-N 3.37Å; T245-E249 HydrophobicContact CG2-CG 4.44Å; T245-E249 WeakPolarHBondContact CG2-OE1 3.36Å; T245-E249 WeakPolarHBondContact O-CB 3.35Å; T245-E249 WeakPolarHBondContact O-CG 3.39Å; T245-E249 PolarHBondContact O-N 3.11Å
246I95Very high90Very high47 Ų47108.8 Ų108.824%0.24149%0.492CS..Hα-helixtrans-61-42.3176.2-68.9166.2000111.4Y242 I243 K248 E249 K250Y242-I246 HydrophobicContact CD1-CD1 3.74Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE1-CG1 4.39Å; Y242-I246 HydrophobicContact CE2-CD1 3.98Å; Y242-I246 HydrophobicContact CE2-CG1 4.32Å; Y242-I246 HydrophobicContact CG-CD1 4.29Å; Y242-I246 WeakPolarHBondContact O-CG1 3.39Å; Y242-I246 PolarHBondContact O-N 3.31Å; I243-I246 PolarHBondContact O-N 2.97Å; I246-K248 VanDerWaalsContact C-N 3.34Å; I246-E249 PolarHBondContact O-N 2.92Å; I246-K250 HydrophobicContact CG2-CD 4.01Å; I246-K250 HydrophobicContact CG2-CG 4.28Å; I246-K250 WeakPolarHBondContact O-CB 3.34Å; I246-K250 VanDerWaalsContact O-CG 3.28Å; I246-K250 WeakPolarHBondContact O-CG 3.48Å; I246-K250 PolarHBondContact O-N 3.06Å
247E92.9Very high91.5Very high102 Ų102109.4 Ų109.448%0.47750%0.498SS..Hα-helixtrans-63.9-40.5178.1-74.4175.8169.500112I243 R244 T245 R251I243-E247 HydrophobicContact CG2-CG 4.33Å; I243-E247 WeakPolarHBondContact O-CG 3.47Å; I243-E247 PolarHBondContact O-N 3.3Å; R244-E247 PolarHBondContact O-N 2.94Å; T245-E247 VanDerWaalsContact C-N 3.34Å; T245-E247 PolarHBondContact O-N 3.4Å; E247-R251 WeakPolarHBondContact O-CB 3.37Å; E247-R251 PolarHBondContact O-N 2.86Å
248K97.1Very high92.8Very high119 Ų119107.4 Ų107.452%0.51749%0.491SS..Hα-helixtrans-63.7-48.9174.1-178.5179.2168.9-178.40111.1R244 T245 I246 K250 R251 E252R244-K248 VanDerWaalsContact O-CB 3.32Å; R244-K248 WeakPolarHBondContact O-CB 3.33Å; R244-K248 PolarHBondContact O-N 3.09Å; T245-K248 PolarHBondContact O-N 3.37Å; I246-K248 VanDerWaalsContact C-N 3.34Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.95Å; K248-R251 WeakPolarHBondContact O-CB 3.48Å; K248-R251 PolarHBondContact O-N 2.89Å; K248-R251 VanDerWaalsContact O-N 3.13Å; K248-E252 WeakPolarHBondContact CE-OE1 3.43Å; K248-E252 HydrophobicContact CG-CG 4.49Å; K248-E252 IonicContact NZ-OE1 2.74Å; K248-E252 WeakPolarHBondContact O-CG 3.3Å; K248-E252 PolarHBondContact O-N 3.24Å
249E95.8Very high93.8Very high110 Ų110100.9 Ų100.951%0.51448%0.479SS..Hα-helixtrans-61.2-39.8177.8-74.1173.6-17700112.1T245 I246 E252 A253T245-E249 HydrophobicContact CG2-CG 4.44Å; T245-E249 WeakPolarHBondContact CG2-OE1 3.36Å; T245-E249 WeakPolarHBondContact O-CB 3.35Å; T245-E249 WeakPolarHBondContact O-CG 3.39Å; T245-E249 PolarHBondContact O-N 3.11Å; I246-E249 PolarHBondContact O-N 2.92Å; E249-E252 PolarHBondContact O-N 2.91Å; E249-A253 WeakPolarHBondContact O-CB 3.09Å; E249-A253 PolarHBondContact O-N 3.15Å
250K96.1Very high94.3Very high145 Ų145101.3 Ų101.363%0.6348%0.481SS*.Hα-helixtrans-63.1-41.7173.9-78.5179.2179.1-179.10111.8I246 K248 A253 F254I246-K250 HydrophobicContact CG2-CD 4.01Å; I246-K250 HydrophobicContact CG2-CG 4.28Å; I246-K250 WeakPolarHBondContact O-CB 3.34Å; I246-K250 VanDerWaalsContact O-CG 3.28Å; I246-K250 WeakPolarHBondContact O-CG 3.48Å; I246-K250 PolarHBondContact O-N 3.06Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.95Å; K250-A253 PolarHBondContact O-N 3.42Å; K250-F254 WeakPolarHBondContact O-CB 3.46Å; K250-F254 PolarHBondContact O-N 2.93Å
251R96.4Very high94.7Very high148 Ų148103 Ų10356%0.55849%0.487SS*.Hα-helixtrans-65-47.8177-166.2-177.9-58.6129.15.5111E247 K248 A253 F254 E255E247-R251 WeakPolarHBondContact O-CB 3.37Å; E247-R251 PolarHBondContact O-N 2.86Å; K248-R251 WeakPolarHBondContact O-CB 3.48Å; K248-R251 PolarHBondContact O-N 2.89Å; K248-R251 VanDerWaalsContact O-N 3.13Å; R251-A253 VanDerWaalsContact C-N 3.33Å; R251-A253 PolarHBondContact O-N 3.3Å; R251-F254 PolarHBondContact O-N 3.37Å; R251-E255 WeakPolarHBondContact O-CG 3.33Å; R251-E255 PolarHBondContact O-N 3.27Å
252E96.9Very high95.2Very high82 Ų82104.6 Ų104.638%0.38349%0.492SS..Hα-helixtrans-64.3-36177.2-70.6174.9179.200112.3K248 E249 R256K248-E252 WeakPolarHBondContact CE-OE1 3.43Å; K248-E252 HydrophobicContact CG-CG 4.49Å; K248-E252 IonicContact NZ-OE1 2.74Å; K248-E252 WeakPolarHBondContact O-CG 3.3Å; K248-E252 PolarHBondContact O-N 3.24Å; E249-E252 PolarHBondContact O-N 2.91Å; E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 VanDerWaalsContact O-CG 3.25Å; E252-R256 WeakPolarHBondContact O-CG 3.46Å; E252-R256 PolarHBondContact O-N 3.5Å; E252-R256 PolarHBondContact O-NE 3.47Å
253A95Very high95.4Very high30 Ų3098.5 Ų98.525%0.24848%0.476CS..Hα-helixtrans-66.7-41.8172.800000111.7E249 K250 R251 R256 I257E249-A253 WeakPolarHBondContact O-CB 3.09Å; E249-A253 PolarHBondContact O-N 3.15Å; K250-A253 PolarHBondContact O-N 3.42Å; R251-A253 VanDerWaalsContact C-N 3.33Å; R251-A253 PolarHBondContact O-N 3.3Å; A253-R256 PolarHBondContact O-N 2.96Å; A253-I257 WeakPolarHBondContact O-CB 3.39Å; A253-I257 VanDerWaalsContact O-CG1 3.27Å; A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.42Å
254F93.5Very high95.7Very high140 Ų14099.8 Ų99.861%0.61448%0.483SS*.Hα-helixtrans-65-42.7176.7-175.9-93.8000112.1K250 R251 I257 S258K250-F254 WeakPolarHBondContact O-CB 3.46Å; K250-F254 PolarHBondContact O-N 2.93Å; R251-F254 PolarHBondContact O-N 3.37Å; F254-I257 PolarHBondContact O-N 3.36Å; F254-S258 VanDerWaalsContact O-CB 3.29Å; F254-S258 WeakPolarHBondContact O-CB 3.46Å; F254-S258 PolarHBondContact O-N 2.92Å; F254-S258 PolarHBondContact O-OG 3.35Å
255E96.6Very high95.8Very high113 Ų11397.1 Ų97.153%0.52848%0.48SS..Hα-helixtrans-62.6-43.7175.1-74.3172-170.700111.4R251 S258 A259R251-E255 WeakPolarHBondContact O-CG 3.33Å; R251-E255 PolarHBondContact O-N 3.27Å; E255-S258 PolarHBondContact O-N 3.08Å; E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.46Å
256R97.7Very high95.9Very high158 Ų15899.6 Ų99.660%0.59649%0.485SS*.Hα-helixtrans-59.6-50.7173.9-77.5-178-69157.4-5112.3E252 A253 S258 A259 D260E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 VanDerWaalsContact O-CG 3.25Å; E252-R256 WeakPolarHBondContact O-CG 3.46Å; E252-R256 PolarHBondContact O-N 3.5Å; E252-R256 PolarHBondContact O-NE 3.47Å; A253-R256 PolarHBondContact O-N 2.96Å; R256-S258 VanDerWaalsContact C-N 3.27Å; R256-S258 PolarHBondContact O-N 3.11Å; R256-A259 PolarHBondContact O-N 2.73Å; R256-D260 VanDerWaalsContact O-CG 3.32Å; R256-D260 PolarHBondContact O-N 2.96Å
257I95.4Very high96Very high112 Ų112103.3 Ų103.357%0.57450%0.501SS*.Hα-helixtrans-61.7-37.7178.5-69166.9000111.1A253 F254 D260 H261A253-I257 WeakPolarHBondContact O-CB 3.39Å; A253-I257 VanDerWaalsContact O-CG1 3.27Å; A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.42Å; F254-I257 PolarHBondContact O-N 3.36Å; I257-D260 PolarHBondContact O-N 2.96Å; I257-H261 VanDerWaalsContact O-CB 3.27Å; I257-H261 WeakPolarHBondContact O-CB 3.45Å; I257-H261 PolarHBondContact O-N 3.41Å
258S94.1Very high96.1Very high49 Ų49103.9 Ų103.934%0.34350%0.503SS..Hα-helixtrans-67-42.3178-60.10000111.7F254 E255 R256 H261 E262F254-S258 VanDerWaalsContact O-CB 3.29Å; F254-S258 WeakPolarHBondContact O-CB 3.46Å; F254-S258 PolarHBondContact O-N 2.92Å; F254-S258 PolarHBondContact O-OG 3.35Å; E255-S258 PolarHBondContact O-N 3.08Å; R256-S258 VanDerWaalsContact C-N 3.27Å; R256-S258 PolarHBondContact O-N 3.11Å; S258-H261 PolarHBondContact O-N 3Å; S258-E262 PolarHBondContact O-N 2.9Å
259A97.3Very high96.1Very high58 Ų58101.9 Ų101.948%0.47950%0.496SS..Hα-helixtrans-64.3-43.6174.900000111.8E255 R256 H261 E262 G263E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.46Å; R256-A259 PolarHBondContact O-N 2.73Å; A259-H261 VanDerWaalsContact C-N 3.33Å; A259-H261 PolarHBondContact O-N 2.99Å; A259-E262 PolarHBondContact O-N 3.39Å; A259-G263 PolarHBondContact O-N 3.41Å
260D95.8Very high96.2Very high108 Ų108100.5 Ų100.558%0.57849%0.492SS*.Hα-helixtrans-63-40.4175.5-70-16.7000111.3R256 I257 G263 L264R256-D260 VanDerWaalsContact O-CG 3.32Å; R256-D260 PolarHBondContact O-N 2.96Å; I257-D260 PolarHBondContact O-N 2.96Å; D260-G263 PolarHBondContact O-N 2.95Å; D260-L264 WeakPolarHBondContact O-CB 3.46Å; D260-L264 WeakPolarHBondContact O-CG 3.34Å; D260-L264 PolarHBondContact O-N 2.88Å
261H94.8Very high96.2Very high113 Ų11397.9 Ų97.952%0.52349%0.488SS..Hα-helixtrans-63-44.6175.9-176.366.4000111.8I257 S258 A259 G263 L264 L265I257-H261 VanDerWaalsContact O-CB 3.27Å; I257-H261 WeakPolarHBondContact O-CB 3.45Å; I257-H261 PolarHBondContact O-N 3.41Å; S258-H261 PolarHBondContact O-N 3Å; A259-H261 VanDerWaalsContact C-N 3.33Å; A259-H261 PolarHBondContact O-N 2.99Å; H261-G263 VanDerWaalsContact C-N 3.34Å; H261-L264 PolarHBondContact O-N 2.96Å; H261-L265 WeakPolarHBondContact O-CG 3.44Å; H261-L265 PolarHBondContact O-N 3.32Å
262E96.8Very high96.3Very high106 Ų10695.5 Ų95.550%0.49548%0.482SS..Hα-helixtrans-63.9-40.2175.3-165-169.1150.400111.7S258 A259 L265 K266S258-E262 PolarHBondContact O-N 2.9Å; A259-E262 PolarHBondContact O-N 3.39Å; E262-L265 PolarHBondContact O-N 3.39Å; E262-K266 WeakPolarHBondContact O-CG 3.44Å; E262-K266 PolarHBondContact O-N 2.64Å; E262-K266 VanDerWaalsContact O-N 3.09Å; E262-K266 VanDerWaalsContact OE1-CE 3.26Å; E262-K266 WeakPolarHBondContact OE1-CE 3.32Å; E262-K266 IonicContact OE1-NZ 2.73Å; E262-K266 PolarHBondContact OE1-NZ 3.16Å
263G96.9Very high96.3Very high29 Ų2997.7 Ų97.730%0.29949%0.49SS..Hα-helixtrans-59.4-50173.700000112.3A259 D260 H261 L265 K266 E267A259-G263 PolarHBondContact O-N 3.41Å; D260-G263 PolarHBondContact O-N 2.95Å; H261-G263 VanDerWaalsContact C-N 3.34Å; G263-L265 VanDerWaalsContact C-N 3.31Å; G263-L265 PolarHBondContact O-N 3.49Å; G263-K266 WeakPolarHBondContact O-CB 3.35Å; G263-K266 PolarHBondContact O-N 3.04Å; G263-K266 VanDerWaalsContact O-N 3.14Å; G263-E267 WeakPolarHBondContact O-CG 3.41Å; G263-E267 PolarHBondContact O-N 3.34Å
264L96.2Very high96.5Very high107 Ų107103.5 Ų103.556%0.5651%0.51SS*.Hα-helixtrans-61.3-37.1176.9-77168.8000112.6D260 H261 E267 H268D260-L264 WeakPolarHBondContact O-CB 3.46Å; D260-L264 WeakPolarHBondContact O-CG 3.34Å; D260-L264 PolarHBondContact O-N 2.88Å; H261-L264 PolarHBondContact O-N 2.96Å; L264-E267 PolarHBondContact O-N 2.96Å; L264-H268 VanDerWaalsContact O-CB 3.27Å; L264-H268 WeakPolarHBondContact O-CB 3.42Å; L264-H268 PolarHBondContact O-N 2.87Å
265L95.9Very high96.5Very high93 Ų93101 Ų10149%0.48750%0.503SS..Hα-helixtrans-63.7-41.7174.6-76.7175.5000112H261 E262 G263 H268 E269H261-L265 WeakPolarHBondContact O-CG 3.44Å; H261-L265 PolarHBondContact O-N 3.32Å; E262-L265 PolarHBondContact O-N 3.39Å; G263-L265 VanDerWaalsContact C-N 3.31Å; G263-L265 PolarHBondContact O-N 3.49Å; L265-H268 PolarHBondContact O-N 3.07Å; L265-E269 PolarHBondContact O-N 3.46Å
266K97.9Very high96.6Very high122 Ų12299.9 Ų99.953%0.5350%0.497SS..Hα-helixtrans-64-46.8175.5-72.3171-175.9165.60111.3E262 G263 H268 E269 D270E262-K266 WeakPolarHBondContact O-CG 3.44Å; E262-K266 PolarHBondContact O-N 2.64Å; E262-K266 VanDerWaalsContact O-N 3.09Å; E262-K266 VanDerWaalsContact OE1-CE 3.26Å; E262-K266 WeakPolarHBondContact OE1-CE 3.32Å; E262-K266 IonicContact OE1-NZ 2.73Å; E262-K266 PolarHBondContact OE1-NZ 3.16Å; G263-K266 WeakPolarHBondContact O-CB 3.35Å; G263-K266 PolarHBondContact O-N 3.04Å; G263-K266 VanDerWaalsContact O-N 3.14Å; K266-H268 VanDerWaalsContact C-N 3.34Å; K266-H268 PolarHBondContact O-N 3.44Å; K266-E269 PolarHBondContact O-N 2.96Å; K266-D270 PolarHBondContact O-N 3.1Å
267E96.7Very high96.5Very high125 Ų12594.9 Ų94.958%0.58449%0.49SS*.Hα-helixtrans-60.9-42.1176.7-71-177.8175.300112.3G263 L264 E269 D270 V271G263-E267 WeakPolarHBondContact O-CG 3.41Å; G263-E267 PolarHBondContact O-N 3.34Å; L264-E267 PolarHBondContact O-N 2.96Å; E267-E269 PolarHBondContact O-N 3.33Å; E267-D270 PolarHBondContact O-N 3.01Å; E267-V271 WeakPolarHBondContact O-CG2 3.47Å; E267-V271 PolarHBondContact O-N 3.43Å
268H95.6Very high96.4Very high114 Ų11492.2 Ų92.253%0.52848%0.481SS..Hα-helixtrans-60.5-45.4176175.8-91.8000111.7L264 L265 K266 D270 V271 K272L264-H268 VanDerWaalsContact O-CB 3.27Å; L264-H268 WeakPolarHBondContact O-CB 3.42Å; L264-H268 PolarHBondContact O-N 2.87Å; L265-H268 PolarHBondContact O-N 3.07Å; K266-H268 VanDerWaalsContact C-N 3.34Å; K266-H268 PolarHBondContact O-N 3.44Å; H268-D270 VanDerWaalsContact C-N 3.34Å; H268-D270 PolarHBondContact O-N 2.74Å; H268-V271 PolarHBondContact O-N 2.96Å; H268-K272 VanDerWaalsContact O-CB 3.25Å; H268-K272 WeakPolarHBondContact O-CB 3.47Å; H268-K272 PolarHBondContact O-N 3.11Å
269E97.3Very high96.5Very high78 Ų7893.9 Ų93.936%0.36448%0.482SS..Hα-helixtrans-63.4-37.8175.6-80.6-62.5145.900112.3L265 K266 E267 K272 K273L265-E269 PolarHBondContact O-N 3.46Å; K266-E269 PolarHBondContact O-N 2.96Å; E267-E269 PolarHBondContact O-N 3.33Å; E269-K272 PolarHBondContact O-N 2.9Å; E269-K272 IonicContact OE1-NZ 2.71Å; E269-K272 PolarHBondContact OE1-NZ 2.96Å; E269-K272 IonicContact OE2-NZ 3.32Å; E269-K272 PolarHBondContact OE2-NZ 2.91Å; E269-K273 VanDerWaalsContact O-CG 3.31Å; E269-K273 WeakPolarHBondContact O-CG 3.36Å; E269-K273 PolarHBondContact O-N 3.47Å
270D96.9Very high96.5Very high80 Ų8093.4 Ų93.443%0.42848%0.478SS..Hα-helixtrans-69.2-40.4176.5-75.9-14.2000112.9K266 E267 H268 K272 K273 K274K266-D270 PolarHBondContact O-N 3.1Å; E267-D270 PolarHBondContact O-N 3.01Å; H268-D270 VanDerWaalsContact C-N 3.34Å; H268-D270 PolarHBondContact O-N 2.74Å; D270-K272 VanDerWaalsContact C-N 3.34Å; D270-K273 PolarHBondContact O-N 3.32Å; D270-K273 IonicContact OD1-NZ 2.86Å; D270-K274 WeakPolarHBondContact O-CG 3.38Å; D270-K274 PolarHBondContact O-N 2.91Å
271V97.2Very high96.6Very high91 Ų9196.1 Ų96.155%0.55248%0.48SS*.Hα-helixtrans-63.9-41.4173.3171.30000110.7E267 H268 K274 L275E267-V271 WeakPolarHBondContact O-CG2 3.47Å; E267-V271 PolarHBondContact O-N 3.43Å; H268-V271 PolarHBondContact O-N 2.96Å; V271-K274 PolarHBondContact O-N 3.42Å; V271-L275 WeakPolarHBondContact O-CB 3.46Å; V271-L275 PolarHBondContact O-N 3.42Å
272K97.7Very high96.5Very high97 Ų9793.7 Ų93.742%0.42248%0.476SS..Hα-helixtrans-60.5-44.5175.2178.8-178.4167.2-163.20111.8H268 E269 D270 L275 E276H268-K272 VanDerWaalsContact O-CB 3.25Å; H268-K272 WeakPolarHBondContact O-CB 3.47Å; H268-K272 PolarHBondContact O-N 3.11Å; E269-K272 PolarHBondContact O-N 2.9Å; E269-K272 IonicContact OE1-NZ 2.71Å; E269-K272 PolarHBondContact OE1-NZ 2.96Å; E269-K272 IonicContact OE2-NZ 3.32Å; E269-K272 PolarHBondContact OE2-NZ 2.91Å; D270-K272 VanDerWaalsContact C-N 3.34Å; K272-L275 PolarHBondContact O-N 2.91Å; K272-E276 WeakPolarHBondContact O-CG 3.25Å; K272-E276 PolarHBondContact O-N 3.45Å
273K98.1Very high96.6Very high128 Ų12896.3 Ų96.356%0.55748%0.481SS*.Hα-helixtrans-60.3-44.8173.3-71.4168.8-169.1164.30112E269 D270 L275 E276 A277E269-K273 VanDerWaalsContact O-CG 3.31Å; E269-K273 WeakPolarHBondContact O-CG 3.36Å; E269-K273 PolarHBondContact O-N 3.47Å; D270-K273 PolarHBondContact O-N 3.32Å; D270-K273 IonicContact OD1-NZ 2.86Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 3.3Å; K273-E276 PolarHBondContact O-N 3.27Å; K273-A277 WeakPolarHBondContact O-CB 3.43Å; K273-A277 PolarHBondContact O-N 2.97Å
274K97.7Very high96.6Very high152 Ų15298.2 Ų98.266%0.66149%0.487SS*.Hα-helixtrans-61.8-40176.3-72.5171.9-175.61710111.9D270 V271 S278D270-K274 WeakPolarHBondContact O-CG 3.38Å; D270-K274 PolarHBondContact O-N 2.91Å; V271-K274 PolarHBondContact O-N 3.42Å; K274-S278 WeakPolarHBondContact O-CB 3.48Å; K274-S278 PolarHBondContact O-N 3.45Å
275L95Very high96.7Very high89 Ų8998.7 Ų98.747%0.46649%0.486SS..Hα-helixtrans-64.4-48176.4177.263.7000111.3V271 K272 K273 A277 S278 K279V271-L275 WeakPolarHBondContact O-CB 3.46Å; V271-L275 PolarHBondContact O-N 3.42Å; K272-L275 PolarHBondContact O-N 2.91Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 3.3Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.48Å; L275-S278 PolarHBondContact O-N 3.27Å; L275-K279 HydrophobicContact CD1-CG 4.44Å; L275-K279 HydrophobicContact CG-CD 4.36Å; L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.19Å
276E97.8Very high96.7Very high89 Ų8996.8 Ų96.842%0.41648%0.481SS..Hα-helixtrans-63-40.5177.6-70.2-53136.400111.9K272 K273 S278 K279 A280K272-E276 WeakPolarHBondContact O-CG 3.25Å; K272-E276 PolarHBondContact O-N 3.45Å; K273-E276 PolarHBondContact O-N 3.27Å; E276-S278 VanDerWaalsContact C-N 3.34Å; E276-S278 PolarHBondContact O-N 2.89Å; E276-K279 PolarHBondContact O-N 3.48Å; E276-K279 IonicContact OE1-NZ 3.51Å; E276-K279 PolarHBondContact OE1-NZ 3.31Å; E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.84Å
277A96.6Very high96.7Very high53 Ų5396.6 Ų96.644%0.43848%0.482SS..Hα-helixtrans-61.3-41.2172.400000112.2K273 L275 A280 R281K273-A277 WeakPolarHBondContact O-CB 3.43Å; K273-A277 PolarHBondContact O-N 2.97Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.48Å; A277-A280 PolarHBondContact O-N 3.35Å; A277-R281 WeakPolarHBondContact O-CG 3.44Å; A277-R281 PolarHBondContact O-N 3.01Å
278S91.9Very high96.8Very high55 Ų5595.7 Ų95.739%0.38548%0.478SS..Hα-helixtrans-66.9-40.6176.2-162.70000112.3K274 L275 E276 A280 R281 S282K274-S278 WeakPolarHBondContact O-CB 3.48Å; K274-S278 PolarHBondContact O-N 3.45Å; L275-S278 PolarHBondContact O-N 3.27Å; E276-S278 VanDerWaalsContact C-N 3.34Å; E276-S278 PolarHBondContact O-N 2.89Å; S278-A280 VanDerWaalsContact C-N 3.35Å; S278-R281 PolarHBondContact O-N 3.29Å; S278-S282 WeakPolarHBondContact O-CB 3.48Å; S278-S282 PolarHBondContact O-N 2.93Å
279K97.6Very high96.9Very high85 Ų8594.5 Ų94.537%0.3748%0.475SS..Hα-helixtrans-61.4-43.3174-74.2174.3-176.1167.80111.2L275 E276 S282 R283L275-K279 HydrophobicContact CD1-CG 4.44Å; L275-K279 HydrophobicContact CG-CD 4.36Å; L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.19Å; E276-K279 PolarHBondContact O-N 3.48Å; E276-K279 IonicContact OE1-NZ 3.51Å; E276-K279 PolarHBondContact OE1-NZ 3.31Å; K279-S282 PolarHBondContact O-N 2.94Å; K279-R283 WeakPolarHBondContact O-CG 3.47Å; K279-R283 PolarHBondContact O-N 3.18Å
280A96.7Very high96.9Very high48 Ų4897.9 Ų97.940%0.39749%0.488SS..Hα-helixtrans-60.1-49.1176.700000111.4E276 A277 S278 S282 R283 T284E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.84Å; A277-A280 PolarHBondContact O-N 3.35Å; S278-A280 VanDerWaalsContact C-N 3.35Å; A280-S282 VanDerWaalsContact C-N 3.32Å; A280-S282 PolarHBondContact O-N 2.98Å; A280-R283 WeakPolarHBondContact O-CB 3.37Å; A280-R283 PolarHBondContact O-N 3.06Å; A280-R283 VanDerWaalsContact O-N 3.16Å; A280-T284 PolarHBondContact O-N 3.48Å; A280-T284 VanDerWaalsContact O-N 3.09Å; A280-T284 PolarHBondContact O-OG1 3.34Å
281R97.4Very high96.9Very high164 Ų16497.1 Ų97.162%0.61949%0.486SS*.Hα-helixtrans-57.8-43.1175.2-71.4-172.3-61.2-174.53112.6A277 S278 R283 T284 Q285A277-R281 WeakPolarHBondContact O-CG 3.44Å; A277-R281 PolarHBondContact O-N 3.01Å; S278-R281 PolarHBondContact O-N 3.29Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.32Å; R281-T284 PolarHBondContact O-N 3.5Å; R281-Q285 WeakPolarHBondContact O-CB 3.47Å; R281-Q285 WeakPolarHBondContact O-CG 3.26Å; R281-Q285 PolarHBondContact O-N 3.48Å
282S93.3Very high97Very high63 Ų6397.1 Ų97.144%0.44148%0.483SS..Hα-helixtrans-63.9-36.1178.8-178.90000112.6S278 K279 A280 S286S278-S282 WeakPolarHBondContact O-CB 3.48Å; S278-S282 PolarHBondContact O-N 2.93Å; K279-S282 PolarHBondContact O-N 2.94Å; A280-S282 VanDerWaalsContact C-N 3.32Å; A280-S282 PolarHBondContact O-N 2.98Å; S282-S286 WeakPolarHBondContact O-CB 3.5Å; S282-S286 PolarHBondContact O-N 3.5Å; S282-S286 PolarHBondContact O-OG 2.97Å
283R97.6Very high97Very high161 Ų16199 Ų9961%0.60849%0.491SS*.Hα-helixtrans-64.1-50.4173.7-70.8175-171.9165.94.2111.3K279 A280 R281 Q285 S286 E287K279-R283 WeakPolarHBondContact O-CG 3.47Å; K279-R283 PolarHBondContact O-N 3.18Å; A280-R283 WeakPolarHBondContact O-CB 3.37Å; A280-R283 PolarHBondContact O-N 3.06Å; A280-R283 VanDerWaalsContact O-N 3.16Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.32Å; R283-Q285 PolarHBondContact O-N 2.88Å; R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 2.96Å; R283-S286 VanDerWaalsContact O-N 3.1Å; R283-E287 WeakPolarHBondContact O-CG 3.4Å; R283-E287 PolarHBondContact O-N 3.05Å
284T97.7Very high97Very high68 Ų6899.1 Ų99.142%0.41750%0.495SS..Hα-helixtrans-59.3-46.8178.1-53.30000111.7A280 R281 S286 E287 E288A280-T284 PolarHBondContact O-N 3.48Å; A280-T284 VanDerWaalsContact O-N 3.09Å; A280-T284 PolarHBondContact O-OG1 3.34Å; R281-T284 PolarHBondContact O-N 3.5Å; T284-S286 VanDerWaalsContact C-N 3.28Å; T284-S286 PolarHBondContact O-N 3.46Å; T284-E287 WeakPolarHBondContact O-CB 3.31Å; T284-E287 PolarHBondContact O-N 3.39Å; T284-E287 VanDerWaalsContact O-N 3.11Å; T284-E288 WeakPolarHBondContact O-CG 3.45Å; T284-E288 PolarHBondContact O-N 3.2Å
285Q97.1Very high97Very high117 Ų11797.3 Ų97.355%0.54749%0.489SS..Hα-helixtrans-61.1-36.8175.7-74.1178.2-21.700112.5R281 R283 E287 E288 I289R281-Q285 WeakPolarHBondContact O-CB 3.47Å; R281-Q285 WeakPolarHBondContact O-CG 3.26Å; R281-Q285 PolarHBondContact O-N 3.48Å; R283-Q285 PolarHBondContact O-N 2.88Å; Q285-E287 VanDerWaalsContact C-N 3.33Å; Q285-E288 PolarHBondContact O-N 3.34Å; Q285-I289 VanDerWaalsContact O-CG1 3.28Å; Q285-I289 WeakPolarHBondContact O-CG1 3.47Å; Q285-I289 PolarHBondContact O-N 3.07Å
286S97Very high97.2Very high54 Ų5497.8 Ų97.838%0.37849%0.491SS..Hα-helixtrans-67.1-36.2176.1-61.70000112S282 R283 T284 K290S282-S286 WeakPolarHBondContact O-CB 3.5Å; S282-S286 PolarHBondContact O-N 3.5Å; S282-S286 PolarHBondContact O-OG 2.97Å; R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 2.96Å; R283-S286 VanDerWaalsContact O-N 3.1Å; T284-S286 VanDerWaalsContact C-N 3.28Å; T284-S286 PolarHBondContact O-N 3.46Å; S286-K290 WeakPolarHBondContact O-CG 3.35Å; S286-K290 PolarHBondContact O-N 2.92Å; S286-K290 VanDerWaalsContact O-N 3.15Å
287E97.8Very high97.2Very high117 Ų11796.8 Ų96.855%0.54749%0.494SS..Hα-helixtrans-67.2-45.2173.9-70.9165-173.500111R283 T284 Q285 I289 K290 T291R283-E287 WeakPolarHBondContact O-CG 3.4Å; R283-E287 PolarHBondContact O-N 3.05Å; T284-E287 WeakPolarHBondContact O-CB 3.31Å; T284-E287 PolarHBondContact O-N 3.39Å; T284-E287 VanDerWaalsContact O-N 3.11Å; Q285-E287 VanDerWaalsContact C-N 3.33Å; E287-I289 VanDerWaalsContact C-N 3.34Å; E287-I289 PolarHBondContact O-N 3.39Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 3.46Å; E287-K290 VanDerWaalsContact O-N 3.09Å; E287-T291 WeakPolarHBondContact O-CG2 3.37Å; E287-T291 PolarHBondContact O-N 2.93Å
288E97.8Very high97.2Very high106 Ų10697.2 Ų97.250%0.49549%0.493SS..Hα-helixtrans-59-42174-71172.1-172.500112.4T284 Q285 K290 T291 L292T284-E288 WeakPolarHBondContact O-CG 3.45Å; T284-E288 PolarHBondContact O-N 3.2Å; Q285-E288 PolarHBondContact O-N 3.34Å; E288-K290 VanDerWaalsContact C-N 3.29Å; E288-K290 PolarHBondContact O-N 2.82Å; E288-T291 WeakPolarHBondContact CA-OG1 3.48Å; E288-T291 PolarHBondContact O-N 3.3Å; E288-T291 PolarHBondContact O-OG1 2.98Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 VanDerWaalsContact O-CG 3.29Å; E288-L292 WeakPolarHBondContact O-CG 3.41Å; E288-L292 PolarHBondContact O-N 3.26Å
289I97.9Very high97.5Very high90 Ų90100 Ų10046%0.46250%0.503SS..Hα-helixtrans-62.8-38.7175.5-72.3167.4000111Q285 E287 K293Q285-I289 VanDerWaalsContact O-CG1 3.28Å; Q285-I289 WeakPolarHBondContact O-CG1 3.47Å; Q285-I289 PolarHBondContact O-N 3.07Å; E287-I289 VanDerWaalsContact C-N 3.34Å; E287-I289 PolarHBondContact O-N 3.39Å; I289-K293 HydrophobicContact CG2-CD 4.19Å; I289-K293 WeakPolarHBondContact O-CB 3.31Å; I289-K293 VanDerWaalsContact O-CG 3.28Å; I289-K293 WeakPolarHBondContact O-CG 3.48Å; I289-K293 PolarHBondContact O-N 3.02Å
290K98.3Very high97.5Very high148 Ų148101 Ų10164%0.64351%0.513SS*.Hα-helixtrans-66.1-43.4176.7-72.5172.5-175.3179.60111.4S286 E287 E288 K293 M294S286-K290 WeakPolarHBondContact O-CG 3.35Å; S286-K290 PolarHBondContact O-N 2.92Å; S286-K290 VanDerWaalsContact O-N 3.15Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 3.46Å; E287-K290 VanDerWaalsContact O-N 3.09Å; E288-K290 VanDerWaalsContact C-N 3.29Å; E288-K290 PolarHBondContact O-N 2.82Å; K290-K293 PolarHBondContact O-N 3.23Å; K290-M294 WeakPolarHBondContact O-CB 3.34Å; K290-M294 PolarHBondContact O-N 3.41Å
291T97.7Very high97.5Very high64 Ų64102.9 Ų102.939%0.39351%0.513SS..Hα-helixtrans-65.6-42.9178.459.60000111.4E287 E288 K293 M294 Q295E287-T291 WeakPolarHBondContact O-CG2 3.37Å; E287-T291 PolarHBondContact O-N 2.93Å; E288-T291 WeakPolarHBondContact CA-OG1 3.48Å; E288-T291 PolarHBondContact O-N 3.3Å; E288-T291 PolarHBondContact O-OG1 2.98Å; T291-K293 PolarHBondContact O-N 2.76Å; T291-M294 WeakPolarHBondContact O-CB 3.47Å; T291-M294 PolarHBondContact O-N 2.89Å; T291-Q295 WeakPolarHBondContact O-CG 3.32Å; T291-Q295 PolarHBondContact O-N 3.34Å
292L98.2Very high97.5Very high92 Ų92100.8 Ų100.848%0.48251%0.508SS..Hα-helixtrans-62.7-42.5175.5-72.1173.6000112.1E288 M294 Q295 I296E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 VanDerWaalsContact O-CG 3.29Å; E288-L292 WeakPolarHBondContact O-CG 3.41Å; E288-L292 PolarHBondContact O-N 3.26Å; L292-M294 VanDerWaalsContact C-N 3.32Å; L292-M294 PolarHBondContact O-N 3.31Å; L292-Q295 PolarHBondContact O-N 3.27Å; L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 2.84Å
293K98.4Very high97.7Very high137 Ų13799.2 Ų99.260%0.59650%0.502SS*.Hα-helixtrans-59.2-44.3174.1-79.2178.8177.7-173.40111.8I289 K290 T291 Q295 I296 S297I289-K293 HydrophobicContact CG2-CD 4.19Å; I289-K293 WeakPolarHBondContact O-CB 3.31Å; I289-K293 VanDerWaalsContact O-CG 3.28Å; I289-K293 WeakPolarHBondContact O-CG 3.48Å; I289-K293 PolarHBondContact O-N 3.02Å; K290-K293 PolarHBondContact O-N 3.23Å; T291-K293 PolarHBondContact O-N 2.76Å; K293-Q295 VanDerWaalsContact C-N 3.35Å; K293-Q295 PolarHBondContact O-N 3.36Å; K293-I296 PolarHBondContact O-N 3.27Å; K293-S297 PolarHBondContact O-N 3.09Å; K293-S297 PolarHBondContact O-OG 3.3Å
294M97.8Very high97.6Very high129 Ų12997.6 Ų97.664%0.63550%0.499SS*.Hα-helixtrans-63-40.5177-176.9173.652.100112K290 T291 L292 S297 S298K290-M294 WeakPolarHBondContact O-CB 3.34Å; K290-M294 PolarHBondContact O-N 3.41Å; T291-M294 WeakPolarHBondContact O-CB 3.47Å; T291-M294 PolarHBondContact O-N 2.89Å; L292-M294 VanDerWaalsContact C-N 3.32Å; L292-M294 PolarHBondContact O-N 3.31Å; M294-S297 PolarHBondContact O-N 3.46Å; M294-S298 PolarHBondContact O-N 3.17Å
295Q98.2Very high97.6Very high114 Ų114100.4 Ų100.453%0.53351%0.508SS..Hα-helixtrans-62.6-45.1173.8-72.1176.7-1.500111.9T291 L292 K293 S298 L299T291-Q295 WeakPolarHBondContact O-CG 3.32Å; T291-Q295 PolarHBondContact O-N 3.34Å; L292-Q295 PolarHBondContact O-N 3.27Å; K293-Q295 VanDerWaalsContact C-N 3.35Å; K293-Q295 PolarHBondContact O-N 3.36Å; Q295-S298 PolarHBondContact O-N 2.92Å; Q295-L299 WeakPolarHBondContact O-CG 3.47Å; Q295-L299 PolarHBondContact O-N 3.48Å
296I98.1Very high97.6Very high99 Ų9999.6 Ų99.651%0.50851%0.507SS..Hα-helixtrans-60.6-46.3176.1-69.1166.3000110.5L292 K293 S298 L299 L300L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 2.84Å; K293-I296 PolarHBondContact O-N 3.27Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 3.44Å; I296-L299 PolarHBondContact O-N 3.41Å; I296-L300 HydrophobicContact CG2-CD1 4Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.05Å
297S98.1Very high97.6Very high69 Ų69100.9 Ų100.948%0.48351%0.513SS..Hα-helixtrans-59-41.2176.5-65.40000112.2K293 M294 L300 E301K293-S297 PolarHBondContact O-N 3.09Å; K293-S297 PolarHBondContact O-OG 3.3Å; M294-S297 PolarHBondContact O-N 3.46Å; S297-L300 PolarHBondContact O-N 2.83Å; S297-E301 PolarHBondContact O-N 3.48Å
298S97.6Very high97.5Very high61 Ų6197.2 Ų97.243%0.42751%0.506SS..Hα-helixtrans-64-42.1175.4-178.70000112.4M294 Q295 I296 L300 E301 K302M294-S298 PolarHBondContact O-N 3.17Å; Q295-S298 PolarHBondContact O-N 2.92Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 3.44Å; S298-L300 VanDerWaalsContact C-N 3.34Å; S298-E301 PolarHBondContact O-N 2.86Å; S298-K302 WeakPolarHBondContact O-CG 3.46Å; S298-K302 PolarHBondContact O-N 2.95Å
299L97.6Very high97.6Very high113 Ų11397 Ų9759%0.59251%0.508SS*.Hα-helixtrans-65.6-37.6176.1-71.1173.7000112.1Q295 I296 K302 G303Q295-L299 WeakPolarHBondContact O-CG 3.47Å; Q295-L299 PolarHBondContact O-N 3.48Å; I296-L299 PolarHBondContact O-N 3.41Å; L299-K302 PolarHBondContact O-N 3.45Å; L299-G303 PolarHBondContact O-N 3.35Å
300L97.6Very high97.6Very high108 Ų10896.5 Ų96.557%0.56551%0.509SS*.Hα-helixtrans-64-42.1175-73.4172.9000111.9I296 S297 S298 G303 K304I296-L300 HydrophobicContact CG2-CD1 4Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.05Å; S297-L300 PolarHBondContact O-N 2.83Å; S298-L300 VanDerWaalsContact C-N 3.34Å; L300-G303 PolarHBondContact O-N 3.26Å; L300-K304 WeakPolarHBondContact O-CG 3.38Å; L300-K304 PolarHBondContact O-N 3.38Å
301E97.3Very high97.5Very high87 Ų8794 Ų9441%0.40750%0.503SS..Hα-helixtrans-61.9-43.2173.6-76.9-57.1142.800111.9S297 S298 G303 K304 H305S297-E301 PolarHBondContact O-N 3.48Å; S298-E301 PolarHBondContact O-N 2.86Å; E301-G303 VanDerWaalsContact C-N 3.33Å; E301-G303 PolarHBondContact O-N 3.45Å; E301-K304 WeakPolarHBondContact O-CB 3.32Å; E301-K304 PolarHBondContact O-N 2.87Å; E301-K304 VanDerWaalsContact O-N 3.16Å; E301-K304 IonicContact OE1-NZ 3.37Å; E301-K304 PolarHBondContact OE1-NZ 2.96Å; E301-K304 IonicContact OE2-NZ 3.48Å; E301-H305 PolarHBondContact O-CD2 3.06Å; E301-H305 PolarHBondContact O-N 2.89Å
302K96.9Very high97.5Very high119 Ų11993.4 Ų93.452%0.51750%0.504SS..Hα-helixtrans-57.8-45.4173-69.5178-176.2-176.60111.8S298 L299 K304 H305 D306S298-K302 WeakPolarHBondContact O-CG 3.46Å; S298-K302 PolarHBondContact O-N 2.95Å; L299-K302 PolarHBondContact O-N 3.45Å; K302-K304 VanDerWaalsContact C-N 3.3Å; K302-K304 PolarHBondContact O-N 3.35Å; K302-H305 WeakPolarHBondContact O-CB 3.37Å; K302-H305 PolarHBondContact O-N 3.27Å; K302-H305 VanDerWaalsContact O-N 3.1Å; K302-D306 PolarHBondContact O-N 3.16Å
303G96.9Very high97.4Very high30 Ų3093.4 Ų93.431%0.30950%0.504SS..Hα-helixtrans-60.5-35.5176.600000113.6L299 L300 E301 D306 T307L299-G303 PolarHBondContact O-N 3.35Å; L300-G303 PolarHBondContact O-N 3.26Å; E301-G303 VanDerWaalsContact C-N 3.33Å; E301-G303 PolarHBondContact O-N 3.45Å; G303-D306 PolarHBondContact O-N 3.44Å; G303-T307 WeakPolarHBondContact O-CB 3.46Å; G303-T307 PolarHBondContact O-N 2.97Å; G303-T307 PolarHBondContact O-OG1 3.49Å
304K96.6Very high97.4Very high127 Ų12791.1 Ų91.155%0.55250%0.498SS*.Hα-helixtrans-65.3-43.3172.8-68.2174.6-171.6171.40111.6L300 E301 K302 T307 G308L300-K304 WeakPolarHBondContact O-CG 3.38Å; L300-K304 PolarHBondContact O-N 3.38Å; E301-K304 WeakPolarHBondContact O-CB 3.32Å; E301-K304 PolarHBondContact O-N 2.87Å; E301-K304 VanDerWaalsContact O-N 3.16Å; E301-K304 IonicContact OE1-NZ 3.37Å; E301-K304 PolarHBondContact OE1-NZ 2.96Å; E301-K304 IonicContact OE2-NZ 3.48Å; K302-K304 VanDerWaalsContact C-N 3.3Å; K302-K304 PolarHBondContact O-N 3.35Å; K304-T307 PolarHBondContact O-N 3.29Å; K304-G308 PolarHBondContact O-N 3.47Å
305H96.8Very high97.4Very high128 Ų12891.5 Ų91.559%0.59350%0.496SS*.Hα-helixtrans-62.3-43.7176.1-63.7-49.1000111.8E301 K302 G308 L309E301-H305 PolarHBondContact O-CD2 3.06Å; E301-H305 PolarHBondContact O-N 2.89Å; K302-H305 WeakPolarHBondContact O-CB 3.37Å; K302-H305 PolarHBondContact O-N 3.27Å; K302-H305 VanDerWaalsContact O-N 3.1Å; H305-G308 PolarHBondContact O-N 2.89Å; H305-L309 PolarHBondContact O-N 3.42Å
306D97.3Very high97.3Very high100 Ų10091.8 Ų91.854%0.53550%0.497SS..Hα-helixtrans-63.7-42.4177.1-65.9-29.1000111.5K302 G303 L309 V310K302-D306 PolarHBondContact O-N 3.16Å; G303-D306 PolarHBondContact O-N 3.44Å; D306-L309 WeakPolarHBondContact O-CB 3.5Å; D306-L309 PolarHBondContact O-N 3.43Å; D306-V310 WeakPolarHBondContact O-CG2 3.47Å; D306-V310 PolarHBondContact O-N 3.47Å
307T96.6Very high97.2Very high81 Ų8191.6 Ų91.650%0.49749%0.494SS..Hα-helixtrans-61.4-45.5175.2-53.60000110.9G303 K304 L309 V310 D311G303-T307 WeakPolarHBondContact O-CB 3.46Å; G303-T307 PolarHBondContact O-N 2.97Å; G303-T307 PolarHBondContact O-OG1 3.49Å; K304-T307 PolarHBondContact O-N 3.29Å; T307-L309 VanDerWaalsContact C-N 3.3Å; T307-L309 PolarHBondContact O-N 3.29Å; T307-V310 PolarHBondContact O-N 3Å; T307-D311 PolarHBondContact O-N 3.35Å
308G97.1Very high97.1Very high39 Ų3990.9 Ų90.940%0.40249%0.489SS..Hα-helixtrans-62.6-35.5176.100000113.3K304 H305 A312K304-G308 PolarHBondContact O-N 3.47Å; H305-G308 PolarHBondContact O-N 2.89Å; G308-A312 WeakPolarHBondContact O-CB 3.49Å; G308-A312 PolarHBondContact O-N 3.47Å
309L97.9Very high97Very high103 Ų10393 Ų9354%0.53949%0.492SS..Hα-helixtrans-65.2-45172.7177.162.8000111.4H305 D306 T307 D311 A312 L313H305-L309 PolarHBondContact O-N 3.42Å; D306-L309 WeakPolarHBondContact O-CB 3.5Å; D306-L309 PolarHBondContact O-N 3.43Å; T307-L309 VanDerWaalsContact C-N 3.3Å; T307-L309 PolarHBondContact O-N 3.29Å; L309-D311 VanDerWaalsContact C-N 3.34Å; L309-D311 PolarHBondContact O-N 3.24Å; L309-A312 PolarHBondContact O-N 2.83Å; L309-L313 HydrophobicContact CD1-CD1 4.42Å; L309-L313 HydrophobicContact CD1-CG 4.41Å; L309-L313 HydrophobicContact CG-CD1 4.27Å; L309-L313 WeakPolarHBondContact O-CG 3.26Å; L309-L313 PolarHBondContact O-N 3.06Å
310V97.9Very high97Very high78 Ų7892.8 Ų92.847%0.47349%0.489SS..Hα-helixtrans-59.7-45.2175.9170.90000110.8D306 T307 A312 L313 L314D306-V310 WeakPolarHBondContact O-CG2 3.47Å; D306-V310 PolarHBondContact O-N 3.47Å; T307-V310 PolarHBondContact O-N 3Å; V310-A312 VanDerWaalsContact C-N 3.34Å; V310-A312 PolarHBondContact O-N 3.41Å; V310-L313 PolarHBondContact O-N 3.36Å; V310-L314 HydrophobicContact CG1-CD1 3.89Å; V310-L314 HydrophobicContact CG1-CG 4.28Å; V310-L314 WeakPolarHBondContact O-CB 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 3.18Å
311D97.5Very high96.9Very high97 Ų9792.1 Ų92.152%0.51948%0.483SS..Hα-helixtrans-61.3-41.7177.1-73.1-19.7000112.1T307 L309 L314 K315T307-D311 PolarHBondContact O-N 3.35Å; L309-D311 VanDerWaalsContact C-N 3.34Å; L309-D311 PolarHBondContact O-N 3.24Å; D311-L314 PolarHBondContact O-N 2.87Å; D311-K315 VanDerWaalsContact O-CB 3.32Å; D311-K315 WeakPolarHBondContact O-CB 3.25Å; D311-K315 PolarHBondContact O-N 3.25Å
312A97.2Very high96.8Very high50 Ų5091.4 Ų91.441%0.41349%0.485SS..Hα-helixtrans-62.7-43.817600000111.9G308 L309 V310 K315 Q316G308-A312 WeakPolarHBondContact O-CB 3.49Å; G308-A312 PolarHBondContact O-N 3.47Å; L309-A312 PolarHBondContact O-N 2.83Å; V310-A312 VanDerWaalsContact C-N 3.34Å; V310-A312 PolarHBondContact O-N 3.41Å; A312-K315 PolarHBondContact O-N 3.42Å; A312-Q316 WeakPolarHBondContact O-CG 3.42Å; A312-Q316 PolarHBondContact O-N 3.34Å
313L97.2Very high96.6Very high92 Ų9291.5 Ų91.548%0.48249%0.489SS..Hα-helixtrans-65.4-43.4176.6-71.3173.9000112L309 V310 K315 Q316 Q317L309-L313 HydrophobicContact CD1-CD1 4.42Å; L309-L313 HydrophobicContact CD1-CG 4.41Å; L309-L313 HydrophobicContact CG-CD1 4.27Å; L309-L313 WeakPolarHBondContact O-CG 3.26Å; L309-L313 PolarHBondContact O-N 3.06Å; V310-L313 PolarHBondContact O-N 3.36Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.07Å; L313-Q316 PolarHBondContact O-N 3.46Å; L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 2.78Å
314L97.2Very high96.4Very high90 Ų9095.3 Ų95.347%0.47150%0.502SS..Hα-helixtrans-61.5-39.8174.8-74.3173.7000111.4V310 D311 Q317 S318V310-L314 HydrophobicContact CG1-CD1 3.89Å; V310-L314 HydrophobicContact CG1-CG 4.28Å; V310-L314 WeakPolarHBondContact O-CB 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 3.18Å; D311-L314 PolarHBondContact O-N 2.87Å; L314-Q317 PolarHBondContact O-N 2.89Å; L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.05Å
315K97.1Very high96.3Very high136 Ų13696.1 Ų96.159%0.59151%0.505SS*.Hα-helixtrans-62.8-46.2174.7-169.1175.2-176.9177.40111.3D311 A312 L313 Q317 S318 Q319D311-K315 VanDerWaalsContact O-CB 3.32Å; D311-K315 WeakPolarHBondContact O-CB 3.25Å; D311-K315 PolarHBondContact O-N 3.25Å; A312-K315 PolarHBondContact O-N 3.42Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.07Å; K315-Q317 PolarHBondContact O-N 3.23Å; K315-S318 PolarHBondContact O-N 3.5Å; K315-S318 PolarHBondContact O-OG 2.89Å; K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.91Å
316Q96.4Very high96Very high121 Ų12195.3 Ų95.357%0.56550%0.501SS*.Hα-helixtrans-60-43.7174.5-74.2-176.9-19.100112.1A312 L313 S318 Q319 M320A312-Q316 WeakPolarHBondContact O-CG 3.42Å; A312-Q316 PolarHBondContact O-N 3.34Å; L313-Q316 PolarHBondContact O-N 3.46Å; Q316-S318 VanDerWaalsContact C-N 3.34Å; Q316-S318 PolarHBondContact O-N 3.47Å; Q316-Q319 PolarHBondContact O-N 3.23Å; Q316-M320 WeakPolarHBondContact O-CB 3.49Å; Q316-M320 PolarHBondContact O-N 3.38Å
317Q96.3Very high95.6Very high95 Ų9595.5 Ų95.544%0.44450%0.502SS..Hα-helixtrans-60.2-43.7176.3-173.4-175.36.800111.6L313 L314 K315 M320 Q321L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 2.78Å; L314-Q317 PolarHBondContact O-N 2.89Å; K315-Q317 PolarHBondContact O-N 3.23Å; Q317-M320 PolarHBondContact O-N 2.93Å; Q317-Q321 WeakPolarHBondContact O-CG 3.37Å; Q317-Q321 PolarHBondContact O-N 3.41Å
318S96.3Very high95.2Very high54 Ų5493.5 Ų93.538%0.37850%0.497SS..Hα-helixtrans-65.1-39.7178.276.30000112.6L314 K315 Q316 Q321 T322L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.05Å; K315-S318 PolarHBondContact O-N 3.5Å; K315-S318 PolarHBondContact O-OG 2.89Å; Q316-S318 VanDerWaalsContact C-N 3.34Å; Q316-S318 PolarHBondContact O-N 3.47Å; S318-Q321 PolarHBondContact O-N 3.41Å; S318-T322 WeakPolarHBondContact O-CB 3.41Å; S318-T322 PolarHBondContact O-N 2.69Å; S318-T322 PolarHBondContact O-OG1 2.88Å
319Q96.3Very high94.5Very high106 Ų10697.7 Ų97.750%0.49551%0.506SS..Hα-helixtrans-63.6-46.3175.5-74176-16.600110.7K315 Q316 Q321 T322 M323K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.91Å; Q316-Q319 PolarHBondContact O-N 3.23Å; Q319-Q321 PolarHBondContact O-N 2.98Å; Q319-T322 WeakPolarHBondContact O-CB 3.44Å; Q319-T322 PolarHBondContact O-N 3.08Å; Q319-T322 VanDerWaalsContact O-N 3.15Å; Q319-M323 PolarHBondContact O-N 2.94Å
320M95.9Very high93.6Very high107 Ų10799 Ų9953%0.52751%0.51SS..Hα-helixtrans-62.1-43.5176.7-174.6176.163.200112Q316 Q317 T322 M323 L324Q316-M320 WeakPolarHBondContact O-CB 3.49Å; Q316-M320 PolarHBondContact O-N 3.38Å; Q317-M320 PolarHBondContact O-N 2.93Å; M320-T322 VanDerWaalsContact C-N 3.27Å; M320-T322 PolarHBondContact O-N 3.46Å; M320-M323 PolarHBondContact O-N 2.87Å; M320-L324 HydrophobicContact CG-CD1 4.33Å; M320-L324 WeakPolarHBondContact O-CB 3.48Å; M320-L324 WeakPolarHBondContact O-CG 3.35Å; M320-L324 PolarHBondContact O-N 3.44Å
321Q96.1Very high92.3Very high94 Ų94101.3 Ų101.344%0.43952%0.515SS..Hα-helixtrans-61-37.2173.7-77.6-177.60.500112.4Q317 S318 Q319 L324 K325Q317-Q321 WeakPolarHBondContact O-CG 3.37Å; Q317-Q321 PolarHBondContact O-N 3.41Å; S318-Q321 PolarHBondContact O-N 3.41Å; Q319-Q321 PolarHBondContact O-N 2.98Å; Q321-L324 PolarHBondContact O-N 2.93Å; Q321-K325 WeakPolarHBondContact O-CB 3.24Å; Q321-K325 WeakPolarHBondContact O-CG 3.36Å; Q321-K325 PolarHBondContact O-N 3.37Å
322T94.8Very high90.7Very high72 Ų7299.3 Ų99.344%0.44251%0.509SS..Hα-helixtrans-67.5-45.6177.3-56.40000111S318 Q319 M320 L324 K325 Q326S318-T322 WeakPolarHBondContact O-CB 3.41Å; S318-T322 PolarHBondContact O-N 2.69Å; S318-T322 PolarHBondContact O-OG1 2.88Å; Q319-T322 WeakPolarHBondContact O-CB 3.44Å; Q319-T322 PolarHBondContact O-N 3.08Å; Q319-T322 VanDerWaalsContact O-N 3.15Å; M320-T322 VanDerWaalsContact C-N 3.27Å; M320-T322 PolarHBondContact O-N 3.46Å; T322-L324 VanDerWaalsContact C-N 3.35Å; T322-L324 PolarHBondContact O-N 3.25Å; T322-K325 PolarHBondContact O-N 2.86Å; T322-Q326 WeakPolarHBondContact O-CG 3.49Å; T322-Q326 PolarHBondContact O-N 2.83Å
323M93.6Very high89Confident122 Ų12299.5 Ų99.560%0.60151%0.51SS*.Hα-helixtrans-61.3-41.8174.6-70.1-162.3-65.300111.8Q319 M320 K325 Q326 L327Q319-M323 PolarHBondContact O-N 2.94Å; M320-M323 PolarHBondContact O-N 2.87Å; M323-K325 PolarHBondContact O-N 3.29Å; M323-Q326 PolarHBondContact O-N 3.38Å; M323-L327 WeakPolarHBondContact O-CB 3.46Å; M323-L327 PolarHBondContact O-N 2.76Å
324L92.8Very high87.2Confident110 Ų110102 Ų10258%0.57652%0.52SS*.Hα-helixtrans-61.8-42.1174.8-76.9169.6000112.2M320 Q321 T322 L327 G328M320-L324 HydrophobicContact CG-CD1 4.33Å; M320-L324 WeakPolarHBondContact O-CB 3.48Å; M320-L324 WeakPolarHBondContact O-CG 3.35Å; M320-L324 PolarHBondContact O-N 3.44Å; Q321-L324 PolarHBondContact O-N 2.93Å; T322-L324 VanDerWaalsContact C-N 3.35Å; T322-L324 PolarHBondContact O-N 3.25Å; L324-L327 PolarHBondContact O-N 3.33Å; L324-G328 PolarHBondContact O-N 2.99Å
325K93.4Very high85.4Confident143 Ų143104.1 Ų104.162%0.62253%0.53SS*.Hα-helixtrans-63-44.4174.6-77.2176.1-178.4177.20111.8Q321 T322 M323 G328 Q329Q321-K325 WeakPolarHBondContact O-CB 3.24Å; Q321-K325 WeakPolarHBondContact O-CG 3.36Å; Q321-K325 PolarHBondContact O-N 3.37Å; T322-K325 PolarHBondContact O-N 2.86Å; M323-K325 PolarHBondContact O-N 3.29Å; K325-G328 PolarHBondContact O-N 2.99Å; K325-Q329 WeakPolarHBondContact O-CB 3.32Å; K325-Q329 VanDerWaalsContact O-CG 3.29Å; K325-Q329 WeakPolarHBondContact O-CG 3.47Å; K325-Q329 PolarHBondContact O-N 3.45Å
326Q92.1Very high83.3Confident111 Ų111106 Ų10652%0.51954%0.538SS..Hα-helixtrans-63.2-43177.1-73.4174.9-8.500111.7T322 M323 Q329 Q330T322-Q326 WeakPolarHBondContact O-CG 3.49Å; T322-Q326 PolarHBondContact O-N 2.83Å; M323-Q326 PolarHBondContact O-N 3.38Å; Q326-Q329 PolarHBondContact O-N 3.48Å; Q326-Q330 PolarHBondContact O-N 2.89Å
327L88.3Confident80.9Confident105 Ų105104.2 Ų104.255%0.5554%0.539SS..Hα-helixtrans-66-42.7177.6-164.770.1000111.2M323 L324 Q329 Q330 Q331M323-L327 WeakPolarHBondContact O-CB 3.46Å; M323-L327 PolarHBondContact O-N 2.76Å; L324-L327 PolarHBondContact O-N 3.33Å; L327-Q329 VanDerWaalsContact C-N 3.32Å; L327-Q329 PolarHBondContact O-N 2.98Å; L327-Q330 PolarHBondContact O-N 3.13Å; L327-Q331 WeakPolarHBondContact O-CB 3.5Å; L327-Q331 PolarHBondContact O-N 2.84Å
328G87.1Confident78.4Confident38 Ų38101 Ų10139%0.39253%0.531SS..Hα-helixtrans-62.2-38.2173.500000112.7L324 K325 S332L324-G328 PolarHBondContact O-N 2.99Å; K325-G328 PolarHBondContact O-N 2.99Å; G328-S332 WeakPolarHBondContact O-CB 3.29Å; G328-S332 PolarHBondContact O-N 2.93Å
329Q82.8Confident76.2Confident128 Ų128100.2 Ų100.260%0.59853%0.526SS*.Hα-helixtrans-66.3-45.4173.3-76.9175.6-2.400111.9K325 Q326 L327 Q331 S332 A333K325-Q329 WeakPolarHBondContact O-CB 3.32Å; K325-Q329 VanDerWaalsContact O-CG 3.29Å; K325-Q329 WeakPolarHBondContact O-CG 3.47Å; K325-Q329 PolarHBondContact O-N 3.45Å; Q326-Q329 PolarHBondContact O-N 3.48Å; L327-Q329 VanDerWaalsContact C-N 3.32Å; L327-Q329 PolarHBondContact O-N 2.98Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.4Å; Q329-S332 PolarHBondContact O-N 3.09Å; Q329-S332 PolarHBondContact O-OG 3.35Å; Q329-A333 WeakPolarHBondContact O-CB 3.33Å; Q329-A333 PolarHBondContact O-N 3.02Å
330Q78.3Confident74.5Confident131 Ų131100.3 Ų100.361%0.61254%0.535SS*.Hα-helixtrans-58.4-45174-89.4-179.5-19.800111.7Q326 L327 S332 A333 Q334Q326-Q330 PolarHBondContact O-N 2.89Å; L327-Q330 PolarHBondContact O-N 3.13Å; Q330-S332 PolarHBondContact O-N 3.21Å; Q330-A333 PolarHBondContact O-N 3.3Å; Q330-Q334 WeakPolarHBondContact O-CB 3.36Å; Q330-Q334 PolarHBondContact O-N 3.25Å
331Q72.3Confident72.7Confident126 Ų126102 Ų10259%0.58954%0.542SS*.Hα-helixtrans-63.1-42.7177.3-140.5174.725.900111.1L327 Q329 A333 Q334 I335L327-Q331 WeakPolarHBondContact O-CB 3.5Å; L327-Q331 PolarHBondContact O-N 2.84Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.4Å; Q331-A333 VanDerWaalsContact C-N 3.33Å; Q331-A333 PolarHBondContact O-N 3.13Å; Q331-Q334 PolarHBondContact O-N 3.11Å; Q331-I335 WeakPolarHBondContact O-CD1 3.48Å; Q331-I335 WeakPolarHBondContact O-CG1 3.45Å; Q331-I335 PolarHBondContact O-N 2.96Å
332S62.6Low71.2Confident54 Ų54101.7 Ų101.738%0.37854%0.544SS..Hα-helixtrans-65.8-34.2175.781.30000113.1G328 Q329 Q330 K336G328-S332 WeakPolarHBondContact O-CB 3.29Å; G328-S332 PolarHBondContact O-N 2.93Å; Q329-S332 PolarHBondContact O-N 3.09Å; Q329-S332 PolarHBondContact O-OG 3.35Å; Q330-S332 PolarHBondContact O-N 3.21Å; S332-K336 WeakPolarHBondContact O-CB 3.24Å; S332-K336 WeakPolarHBondContact O-CG 3.38Å; S332-K336 PolarHBondContact O-N 3.34Å
333A61.8Low70Confident54 Ų54103 Ų10345%0.44655%0.548SS..Hα-helixtrans-72.7-40.4176.800000111Q329 Q330 Q331 I335 K336 S337Q329-A333 WeakPolarHBondContact O-CB 3.33Å; Q329-A333 PolarHBondContact O-N 3.02Å; Q330-A333 PolarHBondContact O-N 3.3Å; Q331-A333 VanDerWaalsContact C-N 3.33Å; Q331-A333 PolarHBondContact O-N 3.13Å; A333-I335 VanDerWaalsContact C-N 3.33Å; A333-I335 PolarHBondContact O-N 3.45Å; A333-K336 CarbonylContact O-C 3.3Å; A333-K336 PolarHBondContact O-N 2.89Å; A333-S337 VanDerWaalsContact O-CB 3.27Å; A333-S337 WeakPolarHBondContact O-CB 3.49Å; A333-S337 PolarHBondContact O-N 3.15Å; A333-S337 PolarHBondContact O-OG 2.9Å; A333-S337 VanDerWaalsContact O-OG 3.09Å
334Q59.2Low69.1Low146 Ų146101 Ų10168%0.68255%0.545SS*.Hα-helixtrans-62.8-37.6173.4-117.2175.5-11.200112.5Q330 Q331 S337Q330-Q334 WeakPolarHBondContact O-CB 3.36Å; Q330-Q334 PolarHBondContact O-N 3.25Å; Q331-Q334 PolarHBondContact O-N 3.11Å; Q334-S337 PolarHBondContact O-OG 3.47Å
335I59Low68.6Low134 Ų134100.4 Ų100.469%0.68754%0.542SS*.Hα-helixtrans-71.3-37.1175.8-66163.6000111Q331 A333Q331-I335 WeakPolarHBondContact O-CD1 3.48Å; Q331-I335 WeakPolarHBondContact O-CG1 3.45Å; Q331-I335 PolarHBondContact O-N 2.96Å; A333-I335 VanDerWaalsContact C-N 3.33Å; A333-I335 PolarHBondContact O-N 3.45Å
336K54.9Low68Low176 Ų17697.6 Ų97.677%0.76553%0.533SS*.Hα-helixtrans-78.3-23.7176.8-75.6176.8177.3179.40113.8S332 A333 G338S332-K336 WeakPolarHBondContact O-CB 3.24Å; S332-K336 WeakPolarHBondContact O-CG 3.38Å; S332-K336 PolarHBondContact O-N 3.34Å; A333-K336 CarbonylContact O-C 3.3Å; A333-K336 PolarHBondContact O-N 2.89Å; K336-G338 VanDerWaalsContact C-N 3.27Å
337S44.3Very low67.5Low83 Ų8398.7 Ų98.758%0.5854%0.538SS*.THydrogen-bonded Turntrans-92.123.8172.676.10000112.5A333 Q334 S339A333-S337 VanDerWaalsContact O-CB 3.27Å; A333-S337 WeakPolarHBondContact O-CB 3.49Å; A333-S337 PolarHBondContact O-N 3.15Å; A333-S337 PolarHBondContact O-OG 2.9Å; A333-S337 VanDerWaalsContact O-OG 3.09Å; Q334-S337 PolarHBondContact O-OG 3.47Å; S337-S339 PolarHBondContact O-N 3.3Å; S337-S339 VanDerWaalsContact O-N 3.08Å
338G44.3Very low67.3Low27 Ų27100.3 Ų100.328%0.27854%0.54SS..  trans-47.7122.3163.500000108.2K336K336-G338 VanDerWaalsContact C-N 3.27Å
339S51.3Low67.4Low37 Ų37102.9 Ų102.926%0.25955%0.545SS..  trans-37138.3-1761660000111.2S337 E341 N342 N343S337-S339 PolarHBondContact O-N 3.3Å; S337-S339 VanDerWaalsContact O-N 3.08Å; S339-E341 PolarHBondContact O-N 2.87Å; S339-E341 VanDerWaalsContact OG-CB 3.23Å; S339-E341 WeakPolarHBondContact OG-CB 3.47Å; S339-E341 WeakPolarHBondContact OG-CG 3.4Å; S339-E341 PolarHBondContact OG-N 3.39Å; S339-E341 PolarHBondContact OG-OE2 2.86Å; S339-N342 WeakPolarHBondContact O-CA 3.24Å; S339-N342 WeakPolarHBondContact O-CB 3.46Å; S339-N342 PolarHBondContact O-N 2.9Å; S339-N343 PolarHBondContact O-N 2.95Å
340P59.3Low67.6Low108 Ų108103.9 Ų103.970%0.70155%0.547SS*.Hα-helixtrans-52.9-23.7171.323-32.6000111.9C344P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 3.46Å
341E57.8Low68.2Low142 Ų142103.5 Ų103.566%0.66455%0.548SS*.Hα-helixtrans-68.3-38.2172.1-57.7167.8143.400112.5S339 C344 L345S339-E341 PolarHBondContact O-N 2.87Å; S339-E341 VanDerWaalsContact OG-CB 3.23Å; S339-E341 WeakPolarHBondContact OG-CB 3.47Å; S339-E341 WeakPolarHBondContact OG-CG 3.4Å; S339-E341 PolarHBondContact OG-N 3.39Å; S339-E341 PolarHBondContact OG-OE2 2.86Å; E341-C344 PolarHBondContact O-N 2.8Å; E341-L345 WeakPolarHBondContact O-CB 3.47Å; E341-L345 PolarHBondContact O-N 2.96Å
342N65.8Low68.9Low89 Ų89101.5 Ų101.548%0.47654%0.54SS..Hα-helixtrans-67.4-41.6176.1-73.2-12.8000110.9S339 L345 I346S339-N342 WeakPolarHBondContact O-CA 3.24Å; S339-N342 WeakPolarHBondContact O-CB 3.46Å; S339-N342 PolarHBondContact O-N 2.9Å; N342-L345 PolarHBondContact O-N 2.71Å; N342-I346 WeakPolarHBondContact O-CB 3.29Å; N342-I346 WeakPolarHBondContact O-CD1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.36Å; N342-I346 PolarHBondContact O-N 3.27Å
343N69.6Low70.3Confident100 Ų100102.8 Ų102.854%0.53555%0.545SS..Hα-helixtrans-67.1-40.7175-82.6-29000112.3S339 I346 Q347S339-N343 PolarHBondContact O-N 2.95Å; N343-I346 PolarHBondContact O-N 2.96Å; N343-Q347 WeakPolarHBondContact O-CB 3.27Å; N343-Q347 PolarHBondContact O-N 3.42Å
344C75Confident71.7Confident79 Ų79103 Ų10353%0.53455%0.547SS..Hα-helixtrans-65.4-41.3175-172.80000112P340 E341 Q347 K348P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 3.46Å; E341-C344 PolarHBondContact O-N 2.8Å; C344-Q347 PolarHBondContact O-N 3.21Å; C344-K348 WeakPolarHBondContact O-CB 3.27Å; C344-K348 PolarHBondContact O-N 3.48Å
345L81.4Confident73.1Confident97 Ų97102.4 Ų102.451%0.50855%0.545SS..Hα-helixtrans-65.5-43.4176.2-170.973.9000111.2E341 N342 Q347 K348 L349E341-L345 WeakPolarHBondContact O-CB 3.47Å; E341-L345 PolarHBondContact O-N 2.96Å; N342-L345 PolarHBondContact O-N 2.71Å; L345-Q347 VanDerWaalsContact C-N 3.3Å; L345-Q347 PolarHBondContact O-N 3.47Å; L345-K348 PolarHBondContact O-N 3.26Å; L345-L349 HydrophobicContact CG-CD1 4.19Å; L345-L349 WeakPolarHBondContact O-CB 3.38Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 3.42Å
346I81.1Confident74.6Confident84 Ų84101.3 Ų101.343%0.43154%0.535SS..Hα-helixtrans-59.9-42.5173.8-71.9163.7000110.3N342 N343 L349 K350N342-I346 WeakPolarHBondContact O-CB 3.29Å; N342-I346 WeakPolarHBondContact O-CD1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.36Å; N342-I346 PolarHBondContact O-N 3.27Å; N343-I346 PolarHBondContact O-N 2.96Å; I346-L349 PolarHBondContact O-N 2.92Å; I346-K350 HydrophobicContact CG2-CD 4.37Å; I346-K350 WeakPolarHBondContact O-CB 3.22Å; I346-K350 VanDerWaalsContact O-CG 3.32Å; I346-K350 WeakPolarHBondContact O-CG 3.25Å; I346-K350 PolarHBondContact O-N 2.88Å
347Q80.8Confident76.2Confident134 Ų13497.3 Ų97.363%0.62652%0.522SS*.Hα-helixtrans-68.2-39.4178.9-158.5170.322.500112N343 C344 L345 K350 L351N343-Q347 WeakPolarHBondContact O-CB 3.27Å; N343-Q347 PolarHBondContact O-N 3.42Å; C344-Q347 PolarHBondContact O-N 3.21Å; L345-Q347 VanDerWaalsContact C-N 3.3Å; L345-Q347 PolarHBondContact O-N 3.47Å; Q347-K350 PolarHBondContact O-N 3.47Å; Q347-L351 PolarHBondContact O-N 3.05Å
348K85.6Confident78.4Confident139 Ų13996.3 Ų96.360%0.60452%0.519SS*.Hα-helixtrans-65.6-41.5174.4-171.7173.4-177.4176.70112.3C344 L345 L351 M352C344-K348 WeakPolarHBondContact O-CB 3.27Å; C344-K348 PolarHBondContact O-N 3.48Å; L345-K348 PolarHBondContact O-N 3.26Å; K348-L351 PolarHBondContact O-N 3.5Å; K348-M352 WeakPolarHBondContact O-CB 3.32Å; K348-M352 PolarHBondContact O-N 3.4Å
349L87.2Confident80.6Confident92 Ų92100 Ų10048%0.48253%0.53SS..Hα-helixtrans-64.8-41.1174.7-73.6170.6000111.2L345 I346 L351 M352 V353L345-L349 HydrophobicContact CG-CD1 4.19Å; L345-L349 WeakPolarHBondContact O-CB 3.38Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 3.42Å; I346-L349 PolarHBondContact O-N 2.92Å; L349-L351 PolarHBondContact O-N 3.43Å; L349-M352 PolarHBondContact O-N 3.32Å; L349-V353 WeakPolarHBondContact O-CB 3.38Å; L349-V353 VanDerWaalsContact O-CG2 3.25Å; L349-V353 WeakPolarHBondContact O-CG2 3.31Å; L349-V353 PolarHBondContact O-N 3.33Å
350K88.5Confident82.5Confident149 Ų149102.1 Ų102.165%0.64854%0.538SS*.Hα-helixtrans-60.5-43.1174-77.4179178.7-174.30112.6I346 Q347 V353 A354I346-K350 HydrophobicContact CG2-CD 4.37Å; I346-K350 WeakPolarHBondContact O-CB 3.22Å; I346-K350 VanDerWaalsContact O-CG 3.32Å; I346-K350 WeakPolarHBondContact O-CG 3.25Å; I346-K350 PolarHBondContact O-N 2.88Å; Q347-K350 PolarHBondContact O-N 3.47Å; K350-V353 PolarHBondContact O-N 3.48Å; K350-A354 PolarHBondContact O-N 2.86Å
351L90.7Very high84Confident123 Ų123103 Ų10364%0.64453%0.531SS*.Hα-helixtrans-62.8-45.9176.1-109.4161.8000111.6Q347 K348 L349 V353 A354 E355Q347-L351 PolarHBondContact O-N 3.05Å; K348-L351 PolarHBondContact O-N 3.5Å; L349-L351 PolarHBondContact O-N 3.43Å; L351-V353 VanDerWaalsContact C-N 3.33Å; L351-V353 PolarHBondContact O-N 2.97Å; L351-A354 PolarHBondContact O-N 3.48Å; L351-E355 WeakPolarHBondContact O-CB 3.29Å; L351-E355 PolarHBondContact O-N 3.37Å
352M87.1Confident85.4Confident84 Ų84100.3 Ų100.341%0.41452%0.518SS..Hα-helixtrans-65.8-36.1178.4-168.9179.8-62.500112.2K348 L349 E355 K356K348-M352 WeakPolarHBondContact O-CB 3.32Å; K348-M352 PolarHBondContact O-N 3.4Å; L349-M352 PolarHBondContact O-N 3.32Å; M352-E355 PolarHBondContact O-N 2.85Å; M352-K356 HydrophobicContact CG-CG 4.45Å; M352-K356 WeakPolarHBondContact O-CB 3.35Å; M352-K356 WeakPolarHBondContact O-CG 3.46Å; M352-K356 PolarHBondContact O-N 2.89Å
353V90.8Very high86.4Confident81 Ų81100.5 Ų100.549%0.49152%0.518SS..Hα-helixtrans-64.2-47173.5168.90000110.3L349 K350 L351 E355 K356 D357L349-V353 WeakPolarHBondContact O-CB 3.38Å; L349-V353 VanDerWaalsContact O-CG2 3.25Å; L349-V353 WeakPolarHBondContact O-CG2 3.31Å; L349-V353 PolarHBondContact O-N 3.33Å; K350-V353 PolarHBondContact O-N 3.48Å; L351-V353 VanDerWaalsContact C-N 3.33Å; L351-V353 PolarHBondContact O-N 2.97Å; V353-E355 VanDerWaalsContact C-N 3.29Å; V353-E355 PolarHBondContact O-N 3.14Å; V353-K356 PolarHBondContact O-N 2.96Å; V353-K356 VanDerWaalsContact O-N 3.16Å; V353-D357 WeakPolarHBondContact CG1-OD2 3.31Å; V353-D357 WeakPolarHBondContact O-CB 3.5Å; V353-D357 VanDerWaalsContact O-CG 3.26Å; V353-D357 PolarHBondContact O-N 3.41Å
354A91Very high87.1Confident59 Ų59100.9 Ų100.949%0.48852%0.517SS..Hα-helixtrans-60.3-38.717700000112.8K350 L351 A358K350-A354 PolarHBondContact O-N 2.86Å; L351-A354 PolarHBondContact O-N 3.48Å; A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.09Å
355E89.4Confident87.7Confident134 Ų134102 Ų10263%0.62651%0.514SS*.Hα-helixtrans-67.6-41.5175.7-169.1179.2-165.100111.9L351 M352 V353 A358 M359L351-E355 WeakPolarHBondContact O-CB 3.29Å; L351-E355 PolarHBondContact O-N 3.37Å; M352-E355 PolarHBondContact O-N 2.85Å; V353-E355 VanDerWaalsContact C-N 3.29Å; V353-E355 PolarHBondContact O-N 3.14Å; E355-A358 PolarHBondContact O-N 3.38Å; E355-M359 PolarHBondContact O-N 3.37Å
356K90.3Very high87.8Confident111 Ų111104.9 Ų104.948%0.48352%0.518SS..Hα-helixtrans-68.2-37.8176-68.2-70.4155.669.60111.8M352 V353 M359 I360M352-K356 HydrophobicContact CG-CG 4.45Å; M352-K356 WeakPolarHBondContact O-CB 3.35Å; M352-K356 WeakPolarHBondContact O-CG 3.46Å; M352-K356 PolarHBondContact O-N 2.89Å; V353-K356 PolarHBondContact O-N 2.96Å; V353-K356 VanDerWaalsContact O-N 3.16Å; K356-M359 PolarHBondContact O-N 2.95Å; K356-I360 WeakPolarHBondContact O-CB 3.42Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.98Å
357D89.1Confident87.6Confident91 Ų91107.2 Ų107.249%0.48753%0.527SS..Hα-helixtrans-66-39.4175-71.4-22.9000111.5V353 M359 I360 K361V353-D357 WeakPolarHBondContact CG1-OD2 3.31Å; V353-D357 WeakPolarHBondContact O-CB 3.5Å; V353-D357 VanDerWaalsContact O-CG 3.26Å; V353-D357 PolarHBondContact O-N 3.41Å; D357-M359 VanDerWaalsContact C-N 3.34Å; D357-I360 PolarHBondContact O-N 3.24Å; D357-K361 WeakPolarHBondContact O-CB 3.29Å; D357-K361 PolarHBondContact O-N 2.9Å
358A90.8Very high87.5Confident62 Ų62106.7 Ų106.751%0.51253%0.525SS..Hα-helixtrans-62.4-42.2172.400000111.6A354 E355 K361 E362A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.09Å; E355-A358 PolarHBondContact O-N 3.38Å; A358-K361 WeakPolarHBondContact O-CB 3.26Å; A358-K361 PolarHBondContact O-N 2.83Å; A358-E362 PolarHBondContact O-N 3.45Å
359M90.4Very high87.2Confident105 Ų105106.3 Ų106.352%0.51752%0.524SS..Hα-helixtrans-70.3-36.3177.9-165.6154.7-155.700112.6E355 K356 D357 K361 E362 L363E355-M359 PolarHBondContact O-N 3.37Å; K356-M359 PolarHBondContact O-N 2.95Å; D357-M359 VanDerWaalsContact C-N 3.34Å; M359-K361 VanDerWaalsContact C-N 3.29Å; M359-K361 PolarHBondContact O-N 2.91Å; M359-E362 PolarHBondContact O-N 3.25Å; M359-L363 HydrophobicContact CG-CD1 4.33Å; M359-L363 WeakPolarHBondContact O-CB 3.28Å; M359-L363 VanDerWaalsContact O-CG 3.26Å; M359-L363 WeakPolarHBondContact O-CG 3.48Å; M359-L363 PolarHBondContact O-N 3.27Å
360I90.6Very high86.5Confident82 Ų82105.3 Ų105.342%0.42152%0.524SS..Hα-helixtrans-60.3-44.1171.3-73.1163.9000109.6K356 D357 L363 Q364K356-I360 WeakPolarHBondContact O-CB 3.42Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.98Å; D357-I360 PolarHBondContact O-N 3.24Å; I360-L363 PolarHBondContact O-N 2.88Å; I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.35Å; I360-Q364 VanDerWaalsContact O-CG 3.25Å; I360-Q364 WeakPolarHBondContact O-CG 3.34Å; I360-Q364 PolarHBondContact O-N 2.9Å
361K90.6Very high85.8Confident127 Ų127102 Ų10255%0.55252%0.517SS*.Hα-helixtrans-62.5-45178-167.8-179.2176.8-172.80112D357 A358 M359 L363 Q364 E365D357-K361 WeakPolarHBondContact O-CB 3.29Å; D357-K361 PolarHBondContact O-N 2.9Å; A358-K361 WeakPolarHBondContact O-CB 3.26Å; A358-K361 PolarHBondContact O-N 2.83Å; M359-K361 VanDerWaalsContact C-N 3.29Å; M359-K361 PolarHBondContact O-N 2.91Å; K361-L363 PolarHBondContact O-N 2.94Å; K361-Q364 WeakPolarHBondContact O-CB 3.47Å; K361-Q364 PolarHBondContact O-N 3.03Å; K361-E365 WeakPolarHBondContact O-CG 3.48Å; K361-E365 PolarHBondContact O-N 3.31Å
362E87.9Confident84.9Confident84 Ų84102.1 Ų102.139%0.39351%0.514SS..Hα-helixtrans-63.4-41.6176.3-168.4-171.1169.400112A358 M359 Q364 E365 R366A358-E362 PolarHBondContact O-N 3.45Å; M359-E362 PolarHBondContact O-N 3.25Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-E365 PolarHBondContact O-N 3.48Å; E362-R366 WeakPolarHBondContact O-CG 3.43Å; E362-R366 PolarHBondContact O-N 2.86Å; E362-R366 IonicContact OE1-CZ 2.9Å; E362-R366 IonicContact OE1-NE 2.88Å; E362-R366 PolarHBondContact OE1-NE 3.23Å; E362-R366 IonicContact OE1-NH2 3.47Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å
363L86.4Confident84.2Confident94 Ų94102.2 Ų102.249%0.49252%0.515SS..Hα-helixtrans-65.1-37.6175.5-73.3172.1000111.8M359 I360 K361 R366 Q367M359-L363 HydrophobicContact CG-CD1 4.33Å; M359-L363 WeakPolarHBondContact O-CB 3.28Å; M359-L363 VanDerWaalsContact O-CG 3.26Å; M359-L363 WeakPolarHBondContact O-CG 3.48Å; M359-L363 PolarHBondContact O-N 3.27Å; I360-L363 PolarHBondContact O-N 2.88Å; K361-L363 PolarHBondContact O-N 2.94Å; L363-R366 PolarHBondContact O-N 3.48Å; L363-Q367 WeakPolarHBondContact O-CB 3.35Å; L363-Q367 PolarHBondContact O-N 3.35Å
364Q85.6Confident83.1Confident107 Ų107105.7 Ų105.750%0.552%0.524SS..Hα-helixtrans-65.2-41.2173.8-76.6174.5-16.500111.7I360 K361 E362 Q367 Q368I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.35Å; I360-Q364 VanDerWaalsContact O-CG 3.25Å; I360-Q364 WeakPolarHBondContact O-CG 3.34Å; I360-Q364 PolarHBondContact O-N 2.9Å; K361-Q364 WeakPolarHBondContact O-CB 3.47Å; K361-Q364 PolarHBondContact O-N 3.03Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; Q364-Q367 PolarHBondContact O-N 3.47Å; Q364-Q368 WeakPolarHBondContact O-CB 3.41Å; Q364-Q368 WeakPolarHBondContact O-CG 3.41Å; Q364-Q368 PolarHBondContact O-N 3.47Å
365E86.6Confident81.7Confident104 Ų104106.3 Ų106.349%0.48653%0.525SS..Hα-helixtrans-63.8-43175.1-73.7172.2-171.300111.4K361 E362 Q367 Q368 F369K361-E365 WeakPolarHBondContact O-CG 3.48Å; K361-E365 PolarHBondContact O-N 3.31Å; E362-E365 PolarHBondContact O-N 3.48Å; E365-Q367 PolarHBondContact O-N 2.8Å; E365-Q368 PolarHBondContact O-N 3.49Å; E365-F369 WeakPolarHBondContact O-CB 3.39Å; E365-F369 PolarHBondContact O-N 2.89Å
366R83.2Confident80.4Confident156 Ų156102.4 Ų102.459%0.58952%0.515SS*.Hα-helixtrans-64.7-38.3173.7-71.1-178.7-171.4-173.93.2112.4E362 L363 F369 S370E362-R366 WeakPolarHBondContact O-CG 3.43Å; E362-R366 PolarHBondContact O-N 2.86Å; E362-R366 IonicContact OE1-CZ 2.9Å; E362-R366 IonicContact OE1-NE 2.88Å; E362-R366 PolarHBondContact OE1-NE 3.23Å; E362-R366 IonicContact OE1-NH2 3.47Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å; L363-R366 PolarHBondContact O-N 3.48Å; R366-F369 PolarHBondContact O-N 3.2Å; R366-S370 WeakPolarHBondContact O-CB 3.43Å; R366-S370 PolarHBondContact O-N 3.44Å
367Q77.8Confident79.1Confident133 Ų133100.6 Ų100.662%0.62151%0.513SS*.Hα-helixtrans-68.2-41.5176.6-163.8-176.88.100110.8L363 Q364 E365 S370 T371L363-Q367 WeakPolarHBondContact O-CB 3.35Å; L363-Q367 PolarHBondContact O-N 3.35Å; Q364-Q367 PolarHBondContact O-N 3.47Å; E365-Q367 PolarHBondContact O-N 2.8Å; Q367-S370 PolarHBondContact O-N 2.74Å; Q367-T371 WeakPolarHBondContact O-CG2 3.48Å; Q367-T371 PolarHBondContact O-N 3.17Å; Q367-T371 PolarHBondContact O-OG1 3.32Å; Q367-T371 VanDerWaalsContact O-OG1 3.1Å
368Q79.3Confident77.7Confident124 Ų12498.3 Ų98.358%0.57951%0.508SS*.Hα-helixtrans-58.8-48.1172.9-81.4179.8-12.500111.3Q364 E365 S370 T371 E372Q364-Q368 WeakPolarHBondContact O-CB 3.41Å; Q364-Q368 WeakPolarHBondContact O-CG 3.41Å; Q364-Q368 PolarHBondContact O-N 3.47Å; E365-Q368 PolarHBondContact O-N 3.49Å; Q368-S370 VanDerWaalsContact C-N 3.33Å; Q368-S370 PolarHBondContact O-N 2.87Å; Q368-T371 VanDerWaalsContact CA-OG1 3.29Å; Q368-T371 WeakPolarHBondContact CA-OG1 3.17Å; Q368-T371 PolarHBondContact O-N 2.91Å; Q368-T371 VanDerWaalsContact O-N 3.14Å; Q368-T371 PolarHBondContact O-OG1 3.35Å; Q368-E372 WeakPolarHBondContact O-CG 3.39Å; Q368-E372 PolarHBondContact O-N 2.69Å
369F78.1Confident76.2Confident131 Ų13199.9 Ų99.958%0.57551%0.511SS*.Hα-helixtrans-61.2-41.1176.2-166.6-105.4000112.2E365 R366 E372 I373E365-F369 WeakPolarHBondContact O-CB 3.39Å; E365-F369 PolarHBondContact O-N 2.89Å; R366-F369 PolarHBondContact O-N 3.2Å; F369-E372 PolarHBondContact O-N 2.92Å; F369-I373 HydrophobicContact CD1-CD1 3.65Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.38Å; F369-I373 HydrophobicContact CZ-CD1 4.13Å; F369-I373 WeakPolarHBondContact O-CG1 3.24Å; F369-I373 PolarHBondContact O-N 2.86Å
370S73.4Confident74.5Confident70 Ų7099 Ų9949%0.4951%0.511SS..Hα-helixtrans-65.9-37.1174.6-171.30000112.3R366 Q367 Q368 F374R366-S370 WeakPolarHBondContact O-CB 3.43Å; R366-S370 PolarHBondContact O-N 3.44Å; Q367-S370 PolarHBondContact O-N 2.74Å; Q368-S370 VanDerWaalsContact C-N 3.33Å; Q368-S370 PolarHBondContact O-N 2.87Å; S370-F374 VanDerWaalsContact O-CB 3.3Å; S370-F374 WeakPolarHBondContact O-CB 3.22Å; S370-F374 PolarHBondContact O-N 3.27Å
371T72.8Confident72.9Confident81 Ų8199 Ų9950%0.49752%0.515SS..Hα-helixtrans-71.1-34.4175.349.20000112.4Q367 Q368 F374 S375Q367-T371 WeakPolarHBondContact O-CG2 3.48Å; Q367-T371 PolarHBondContact O-N 3.17Å; Q367-T371 PolarHBondContact O-OG1 3.32Å; Q367-T371 VanDerWaalsContact O-OG1 3.1Å; Q368-T371 VanDerWaalsContact CA-OG1 3.29Å; Q368-T371 WeakPolarHBondContact CA-OG1 3.17Å; Q368-T371 PolarHBondContact O-N 2.91Å; Q368-T371 VanDerWaalsContact O-N 3.14Å; Q368-T371 PolarHBondContact O-OG1 3.35Å; T371-F374 PolarHBondContact O-N 2.98Å; T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 3.24Å
372E73Confident71Confident125 Ų125101.1 Ų101.158%0.58452%0.524SS*.Hα-helixtrans-63.7-46.7172.3-76.4179.9176.600110.7Q368 F369 F374 S375 A376Q368-E372 WeakPolarHBondContact O-CG 3.39Å; Q368-E372 PolarHBondContact O-N 2.69Å; F369-E372 PolarHBondContact O-N 2.92Å; E372-F374 PolarHBondContact O-N 3.41Å; E372-S375 PolarHBondContact O-N 2.85Å; E372-S375 PolarHBondContact O-OG 3.24Å; E372-A376 PolarHBondContact O-N 2.85Å
373I71.8Confident69.3Low86 Ų86105 Ų10544%0.44154%0.543SS..Hα-helixtrans-61.1-43.9173.3-68.3169.7000111.1F369 S375 A376 V377F369-I373 HydrophobicContact CD1-CD1 3.65Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.38Å; F369-I373 HydrophobicContact CZ-CD1 4.13Å; F369-I373 WeakPolarHBondContact O-CG1 3.24Å; F369-I373 PolarHBondContact O-N 2.86Å; I373-S375 VanDerWaalsContact C-N 3.3Å; I373-S375 PolarHBondContact O-N 3.41Å; I373-A376 PolarHBondContact O-N 3.48Å; I373-V377 HydrophobicContact CG2-CG2 4.36Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 3.25Å
374F66.4Low67.6Low153 Ų153107.3 Ų107.367%0.67155%0.554SS**Hα-helixtrans-65.9-33.9178.9-147.5-88.8000111.8S370 T371 E372 V377 A378S370-F374 VanDerWaalsContact O-CB 3.3Å; S370-F374 WeakPolarHBondContact O-CB 3.22Å; S370-F374 PolarHBondContact O-N 3.27Å; T371-F374 PolarHBondContact O-N 2.98Å; E372-F374 PolarHBondContact O-N 3.41Å; F374-V377 PolarHBondContact O-N 3.45Å; F374-A378 WeakPolarHBondContact O-CB 3.5Å; F374-A378 PolarHBondContact O-N 2.87Å
375S62.7Low65.5Low72 Ų72107.2 Ų107.250%0.50356%0.564SS.*Hα-helixtrans-68.6-36.1173.683.50000112.4T371 E372 I373 A378 T379T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 3.24Å; E372-S375 PolarHBondContact O-N 2.85Å; E372-S375 PolarHBondContact O-OG 3.24Å; I373-S375 VanDerWaalsContact C-N 3.3Å; I373-S375 PolarHBondContact O-N 3.41Å; S375-A378 PolarHBondContact O-N 3.43Å; S375-T379 PolarHBondContact O-N 3.22Å; S375-T379 PolarHBondContact O-OG1 3.28Å
376A62.6Low63.5Low52 Ų52109.5 Ų109.543%0.4358%0.578SS.*Hα-helixtrans-71.5-35.2175.200000112.4E372 I373 T379 T380E372-A376 PolarHBondContact O-N 2.85Å; I373-A376 PolarHBondContact O-N 3.48Å; A376-T379 WeakPolarHBondContact CA-OG1 3.32Å; A376-T379 PolarHBondContact O-OG1 2.88Å; A376-T379 VanDerWaalsContact O-OG1 3.06Å; A376-T380 PolarHBondContact O-N 3.13Å; A376-T380 PolarHBondContact O-OG1 3.45Å
377V63Low61.2Low73 Ų73109.8 Ų109.844%0.44259%0.591SS.*Hα-helixtrans-75-37.1172.4176.10000111I373 F374 T379 T380 V381I373-V377 HydrophobicContact CG2-CG2 4.36Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 3.25Å; F374-V377 PolarHBondContact O-N 3.45Å; V377-T379 VanDerWaalsContact C-N 3.3Å; V377-T379 PolarHBondContact O-N 3Å; V377-T380 WeakPolarHBondContact CA-OG1 3.38Å; V377-T380 PolarHBondContact O-N 3.4Å; V377-T380 PolarHBondContact O-OG1 3.48Å; V377-V381 HydrophobicContact CG1-CG2 3.97Å; V377-V381 WeakPolarHBondContact O-CB 3.45Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.48Å; V377-V381 PolarHBondContact O-N 2.82Å
378A59.7Low59.3Low44 Ų44111.9 Ų111.936%0.36460%0.6SS.*Hα-helixtrans-65.8-31.2175.900000112.7F374 S375 K382F374-A378 WeakPolarHBondContact O-CB 3.5Å; F374-A378 PolarHBondContact O-N 2.87Å; S375-A378 PolarHBondContact O-N 3.43Å; A378-K382 VanDerWaalsContact O-CB 3.28Å; A378-K382 WeakPolarHBondContact O-CB 3.35Å; A378-K382 WeakPolarHBondContact O-CG 3.44Å; A378-K382 PolarHBondContact O-N 3Å
379T57.6Low57.1Low95 Ų95112.7 Ų112.758%0.58361%0.607SS**Hα-helixtrans-73.3-33.3173.427.20000112.6S375 A376 V377S375-T379 PolarHBondContact O-N 3.22Å; S375-T379 PolarHBondContact O-OG1 3.28Å; A376-T379 WeakPolarHBondContact CA-OG1 3.32Å; A376-T379 PolarHBondContact O-OG1 2.88Å; A376-T379 VanDerWaalsContact O-OG1 3.06Å; V377-T379 VanDerWaalsContact C-N 3.3Å; V377-T379 PolarHBondContact O-N 3Å
380T56.4Low54.9Low86 Ų86115 Ų11553%0.52862%0.617SS.*Hα-helixtrans-79.4-33175.251.80000113.2A376 V377 Q383A376-T380 PolarHBondContact O-N 3.13Å; A376-T380 PolarHBondContact O-OG1 3.45Å; V377-T380 WeakPolarHBondContact CA-OG1 3.38Å; V377-T380 PolarHBondContact O-N 3.4Å; V377-T380 PolarHBondContact O-OG1 3.48Å; T380-Q383 PolarHBondContact O-N 3.02Å
381V55.4Low52.8Low81 Ų81120.7 Ų120.749%0.49163%0.633SS.*Hα-helixtrans-76.1-31.6175.6174.30000112.3V377 Q383 I384 C385V377-V381 HydrophobicContact CG1-CG2 3.97Å; V377-V381 WeakPolarHBondContact O-CB 3.45Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.48Å; V377-V381 PolarHBondContact O-N 2.82Å; V381-Q383 PolarHBondContact O-N 3.47Å; V381-I384 PolarHBondContact O-N 3.43Å; V381-I384 VanDerWaalsContact O-N 3.12Å; V381-C385 PolarHBondContact O-N 2.84Å
382K52.4Low50.7Low173 Ų173122.5 Ų122.575%0.75265%0.649SS**THydrogen-bonded Turntrans-62.5-21.9170.5-94.8179.7172.4176.20113.6A378A378-K382 VanDerWaalsContact O-CB 3.28Å; A378-K382 WeakPolarHBondContact O-CB 3.35Å; A378-K382 WeakPolarHBondContact O-CG 3.44Å; A378-K382 PolarHBondContact O-N 3Å
383Q50.8Low48.6Very low166 Ų166122.7 Ų122.778%0.77666%0.659SS**THydrogen-bonded Turntrans-82.3-16.6176.3-159.570.521.700112.8T380 V381T380-Q383 PolarHBondContact O-N 3.02Å; V381-Q383 PolarHBondContact O-N 3.47Å
384I50.8Low46.6Very low141 Ų141126.6 Ų126.672%0.72367%0.673SS**THydrogen-bonded Turntrans-109.6-23.5-170.5-67.6175.7000113.6V381V381-I384 PolarHBondContact O-N 3.43Å; V381-I384 VanDerWaalsContact O-N 3.12Å
385C42.7Very low44.8Very low106 Ų106124 Ų12472%0.71667%0.67SS**  trans-10561.8176.9-81.60000112.9V381V381-C385 PolarHBondContact O-N 2.84Å
386L42.9Very low43.1Very low151 Ų151128.1 Ų128.179%0.79168%0.681SS**  trans-110.337.9168.1-132.9173.1000111.6
387L36.3Very low41.4Very low162 Ų162130.8 Ų130.885%0.84869%0.692SS**  trans-145.4131.5167.6-78.4172.3000109.5
388E37.3Very low39.7Very low177 Ų177136.1 Ų136.183%0.82771%0.712SS**  trans91.881.9169.1-60.7-173.8154.300120.4
389I33.5Very low38.2Very low141 Ų141137.3 Ų137.372%0.72373%0.729SS**  66.9116.2117.5-64.1171.7000119.9
390K30.9Very low37.4Very low181 Ų181144.7 Ų144.779%0.78775%0.746SS**  trans85.6116.9145.2-84167.4-1751720120.7
391K30.8Very low35.9Very low188 Ų188149.6 Ų149.682%0.81776%0.763SS**  trans93.4127.9134.1-82.4-178.2172.5-177.30118.7
392S27.5Very low34.6Very low120 Ų120151.2 Ų151.284%0.83978%0.776SS**  trans63.583.6165.657.40000117.5
393V29.7Very low33.5Very low129 Ų129145.4 Ų145.478%0.78277%0.766SS**  trans-86.7143.1152.6161.80000106.5
394F29.5Very low32.5Very low167 Ų167145.9 Ų145.973%0.73277%0.768SS**  cis-176165.6-0-126-132.9000104.2
395T28.3Very low31.4Very low100 Ų100144.2 Ų144.261%0.61377%0.765SS**  trans60.5150.4139.6580000120.3
396E27.4Very low31Very low157 Ų157147.5 Ų147.573%0.73477%0.767SS**  cis-158.8156.418.2-131.2156.5-147.600108.4
397T26.5Very low30.4Very low109 Ų109147 Ų14767%0.66977%0.765SS**  trans22.4145.914343.10000122.9
398E26.3Very low30.1Very low185 Ų185142.9 Ų142.986%0.86476%0.761SS**  trans83.6116.6148-77.9177.2-16900117.5
399G28.3Very low29.8Very low69 Ų69141.4 Ų141.471%0.71176%0.759SS**  84.2112.2112.100000115.7
400R41.2Very low29.7Very low250 Ų250138.9 Ų138.994%0.94375%0.754SS**  trans52.789141.1-71.6-177.4179.4-154.8-0.3115.3
401E26.2Very low29.8Very low188 Ų188136.1 Ų136.188%0.87975%0.752SS**  trans-72.1154136.4-81.4-169.8149.700109.6
402C27.5Very low30Very low115 Ų115132.8 Ų132.878%0.77775%0.748SS**  cis166.6145.4-8.8-178.30000100.7
403G29.3Very low30.1Very low52 Ų52138 Ų13854%0.53675%0.749SS.*  cis176.9139.29.400000103.7
404Q30.2Very low30.2Very low175 Ų175139.5 Ų139.582%0.81875%0.751SS**  69.5123.5109.5-59.9-172.1-11.600113
405T27.8Very low30.3Very low106 Ų106137.6 Ų137.665%0.6575%0.753SS**  -175.2143.572.629.20000110.8
406K32.6Very low31Very low176 Ų176137.6 Ų137.677%0.76576%0.755SS**  trans68.1143.7134.4-66.8-179.7-175.8-168.10117.9
407D32.1Very low31Very low140 Ų140136.2 Ų136.275%0.74975%0.753SS**  cis-153.7156-0.2-87.7-34.2000104.2
408G29.3Very low31.3Very low75 Ų75139.8 Ų139.877%0.77376%0.759SS**  46125.588.100000112.4
409D30.4Very low31.6Very low147 Ų147136.2 Ų136.279%0.78675%0.754SS**  cis-178.6161.823.4-171.218.6000107.9
410S32.1Very low31.9Very low88 Ų88138.7 Ų138.762%0.61576%0.761SS**  trans40.9132.7152.961.20000121.1
411V33.5Very low31.4Very low122 Ų122133.3 Ų133.374%0.73976%0.756SS**  -174.4130.176.7159.50000110.4
412T33.9Very low31.9Very low118 Ų118129.9 Ų129.972%0.72475%0.752SS**  trans19.7122.5154.556.50000121.2
413R30.6Very low33Very low230 Ų230133.6 Ų133.687%0.86876%0.755SS**  57.3105.389.3-157.8-171.8-83.2-177-3.8111.4
414I31.6Very low34Very low160 Ų160138.7 Ų138.782%0.82177%0.769SS**  -165.3127.596.5-79.6148.9000109.2
415T30.1Very low35Very low127 Ų127133.9 Ų133.978%0.77977%0.767SS**  trans-96169.4151.437.80000108.6
416P43.6Very low35.9Very low100 Ų100137.6 Ų137.665%0.64978%0.776SS**  cis-128168.6-1.526.6-1.7000111.4
417D27.8Very low36.2Very low129 Ų129138.7 Ų138.769%0.6978%0.781SS**  -173.7136.292.4-90.5-24.4000113
418F32Very low36.5Very low184 Ų184140.2 Ų140.281%0.80779%0.788SS**  trans30103.5146.1-67.2-90.9000119.5
419S33.2Very low36.9Very low109 Ų109142.5 Ų142.576%0.76279%0.787SS**  167.6123.595.649.30000112
420S35Very low37.2Very low121 Ų121142.9 Ų142.985%0.84679%0.787SS**  trans-3.7117.8162.250.60000119.5
421V30.1Very low37.3Very low138 Ų138143.2 Ų143.284%0.83680%0.795SS**  trans-75.7129.8162.2-179.30000110.1
422S37.9Very low37.2Very low115 Ų115143.8 Ų143.880%0.80480%0.799SS**  trans-103.2129.6159.1-174.10000109.6L424S422-L424 PolarHBondContact O-N 2.88Å
423K50.8Low37.5Very low193 Ų193145.5 Ų145.584%0.83981%0.809SS**SBendtrans-72.887.7-175.3-72.8174.1174.6174.90111.2
424L49.8Very low37.8Very low159 Ų159138.1 Ų138.183%0.83281%0.805SS**SBendtrans-176.289.8153.9-98.3137.4000107S422 H426S422-L424 PolarHBondContact O-N 2.88Å; L424-H426 PolarHBondContact O-N 2.71Å; L424-H426 VanDerWaalsContact O-N 3.1Å
425G50.7Low37.9Very low74 Ų74134 Ų13476%0.76380%0.802SS**  trans-62.4110.2-171.100000113.4
426H45.8Very low38.4Very low185 Ų185137.8 Ų137.886%0.85681%0.811SS**  trans-140.5136.2155.2-73.6-38.1000110.5L424L424-H426 PolarHBondContact O-N 2.71Å; L424-H426 VanDerWaalsContact O-N 3.1Å
427K40.5Very low37.9Very low199 Ų199140.5 Ų140.587%0.86582%0.816SS**  trans-87.8110.6178.8-161.1-179.9-169.5-175.30107.9V429K427-V429 PolarHBondContact O-N 2.93Å
428L37.8Very low38.6Very low172 Ų172144 Ų14490%0.90183%0.829SS**  trans-75110.7170.2-92.4155000108.8
429V38Very low38.8Very low123 Ų123141.4 Ų141.475%0.74582%0.823SS**PPolyproline II helixtrans-84120.4166.2176.80000107.6K427 A431K427-V429 PolarHBondContact O-N 2.93Å; V429-A431 PolarHBondContact O-N 3.43Å
430I36.3Very low39.3Very low154 Ų154146.2 Ų146.279%0.7983%0.83SS**PPolyproline II helixtrans-74.5118.4170.3-62.1171.3000107.2
431A34.2Very low39.3Very low95 Ų95144.7 Ų144.779%0.78582%0.819SS**PPolyproline II helixtrans-100.4117.5167.600000109.5V429V429-A431 PolarHBondContact O-N 3.43Å
432T32.3Very low40.2Very low134 Ų134147.5 Ų147.582%0.82282%0.823SS**PPolyproline II helixtrans-69.3151.6174.236.60000112.6
433V39.6Very low40.5Very low154 Ų154147.1 Ų147.193%0.93382%0.82SS**SBendtrans-54142177.4171.30000113.7
434G36.9Very low40Very low76 Ų76148.4 Ų148.478%0.78483%0.826SS**  trans122108.1150.500000114.9
435G32.4Very low39.6Very low72 Ų72144.9 Ų144.974%0.74281%0.813SS**  trans16099169.700000113.3M437G435-M437 PolarHBondContact O-N 3.32Å
436E40.6Very low39.4Very low207 Ų207148 Ų14897%0.96782%0.82SS**  trans-58.5122.5162.7-143.6170-169.300108.6
437M35.2Very low39.7Very low157 Ų157142.3 Ų142.377%0.77381%0.812SS**  trans-142.2100.5179.9-151.5164.2170.600109.5G435 L439G435-M437 PolarHBondContact O-N 3.32Å; M437-L439 HydrophobicContact CG-CD1 4.3Å; M437-L439 PolarHBondContact O-N 3.02Å
438E41.3Very low40.4Very low204 Ų204138.1 Ų138.195%0.95381%0.806SS**  trans-61.8115.2164.4-85.5-174.5141.200108.9
439L35.8Very low40.8Very low129 Ų129134.4 Ų134.468%0.67579%0.794SS**  trans-116.394.5173.5-102.6139000109.1M437M437-L439 HydrophobicContact CG-CD1 4.3Å; M437-L439 PolarHBondContact O-N 3.02Å
440K44.1Very low41.5Very low209 Ų209132.5 Ų132.591%0.90979%0.792SS**  trans-77114.2153.3-87.8175.9176.1169.80107.6
441S35.9Very low42.8Very low89 Ų89129.4 Ų129.462%0.62278%0.777SS**  trans-142109.2167.740.20000111.6S443S441-S443 PolarHBondContact O-N 3.42Å
442H47.8Very low44.3Very low198 Ų198129.7 Ų129.792%0.91777%0.768SS**  trans-76.3105160.5-73.8-85.2000108.7
443S43.8Very low46Very low107 Ų107126.5 Ų126.575%0.74875%0.752SS**  trans-164120.715352.10000110.7S441 C445S441-S443 PolarHBondContact O-N 3.42Å; S443-C445 PolarHBondContact O-N 3.4Å
444K42Very low47.5Very low220 Ų220121.4 Ų121.496%0.95773%0.726SS**  trans-80.8107.1174.2-77.4175.7174.91780108.8
445C39.6Very low49.2Very low85 Ų85122.7 Ų122.757%0.57471%0.714SS**  trans-103115.6163.6-179.60000108.8S443 G447S443-C445 PolarHBondContact O-N 3.4Å; C445-G447 PolarHBondContact O-N 3.49Å; C445-G447 VanDerWaalsContact O-N 3.08Å
446P48.3Very low51.2Low140 Ų140124.6 Ų124.691%0.90971%0.706SS**THydrogen-bonded Turntrans-85.336.7-171.233.8-34.1000114.1
447G50.6Low52.8Low65 Ų65119 Ų11967%0.6769%0.686SS**THydrogen-bonded Turntrans-154-5.9-178.800000117C445C445-G447 PolarHBondContact O-N 3.49Å; C445-G447 VanDerWaalsContact O-N 3.08Å
448C55.4Low54.9Low110 Ų110118 Ų11874%0.74368%0.679SS**  trans-133.177.7-179.6-530000109.4
449S46.3Very low56.6Low94 Ų94111.3 Ų111.366%0.65766%0.656SS**  trans-13473173.6-174.10000109.8D451S449-D451 PolarHBondContact O-N 3.17Å
450A54.1Low58.6Low84 Ų84108.1 Ų108.169%0.69464%0.644SS**  trans-67111.214300000104.9V452A450-V452 PolarHBondContact O-N 2.94Å
451D61.8Low60.4Low88 Ų88100.4 Ų100.447%0.47162%0.619SS.*  trans-61.991.2-161.9-151.8-12.4000111.2S449 S453 A454 L455S449-D451 PolarHBondContact O-N 3.17Å; D451-S453 PolarHBondContact O-N 3.2Å; D451-S453 VanDerWaalsContact O-N 3.13Å; D451-S453 PolarHBondContact OD1-OG 2.94Å; D451-A454 HydrophobicContact CB-CB 3.81Å; D451-A454 WeakPolarHBondContact O-CA 3.25Å; D451-A454 WeakPolarHBondContact O-CB 3.45Å; D451-A454 PolarHBondContact O-N 3.34Å; D451-L455 PolarHBondContact O-N 3.37Å; D451-L455 VanDerWaalsContact O-N 3.09Å
452V66.9Low62.8Low101 Ų101104.5 Ų104.561%0.61262%0.622SS**Hα-helixtrans-56.8-31.1-178.3178.20000110.4A450 L455 I456A450-V452 PolarHBondContact O-N 2.94Å; V452-L455 PolarHBondContact O-N 2.95Å; V452-I456 HydrophobicContact CG1-CD1 3.95Å; V452-I456 HydrophobicContact CG1-CG1 4.48Å; V452-I456 WeakPolarHBondContact O-CD1 3.47Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.4Å; V452-I456 PolarHBondContact O-N 3.06Å
453S68.1Low64.8Low68 Ų68102.1 Ų102.148%0.47661%0.609SS.*Hα-helixtrans-63.3-40.5173.278.90000112.8D451 I456 T457D451-S453 PolarHBondContact O-N 3.2Å; D451-S453 VanDerWaalsContact O-N 3.13Å; D451-S453 PolarHBondContact OD1-OG 2.94Å; S453-I456 PolarHBondContact O-N 3.32Å; S453-T457 WeakPolarHBondContact O-CB 3.32Å; S453-T457 PolarHBondContact O-N 3.37Å; S453-T457 PolarHBondContact O-OG1 3.44Å
454A69.8Low67Low47 Ų47101.5 Ų101.539%0.38860%0.601SS.*Hα-helixtrans-69.7-38.4176.800000111.5D451 T457 Q458D451-A454 HydrophobicContact CB-CB 3.81Å; D451-A454 WeakPolarHBondContact O-CA 3.25Å; D451-A454 WeakPolarHBondContact O-CB 3.45Å; D451-A454 PolarHBondContact O-N 3.34Å; A454-T457 PolarHBondContact O-N 3.48Å; A454-Q458 WeakPolarHBondContact O-CB 3.45Å; A454-Q458 PolarHBondContact O-N 3.41Å
455L72.8Confident69.2Low102 Ų10296.7 Ų96.753%0.53459%0.585SS.*Hα-helixtrans-65.7-40.3174.8-84.8161.9000112.5D451 V452 T457 Q458 S459D451-L455 PolarHBondContact O-N 3.37Å; D451-L455 VanDerWaalsContact O-N 3.09Å; V452-L455 PolarHBondContact O-N 2.95Å; L455-T457 VanDerWaalsContact C-N 3.34Å; L455-Q458 PolarHBondContact O-N 2.89Å; L455-S459 WeakPolarHBondContact O-CB 2.8Å; L455-S459 PolarHBondContact O-N 3.36Å
456I74.6Confident71.5Confident112 Ų11295.1 Ų95.157%0.57458%0.575SS**Hα-helixtrans-64.3-42.1174.1-69.5165.6000110.5V452 S453 S459 S460V452-I456 HydrophobicContact CG1-CD1 3.95Å; V452-I456 HydrophobicContact CG1-CG1 4.48Å; V452-I456 WeakPolarHBondContact O-CD1 3.47Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.4Å; V452-I456 PolarHBondContact O-N 3.06Å; S453-I456 PolarHBondContact O-N 3.32Å; I456-S459 PolarHBondContact O-N 3.25Å; I456-S460 PolarHBondContact O-N 3.4Å; I456-S460 PolarHBondContact O-OG 3.05Å
457T75Confident73.8Confident91 Ų9192.9 Ų92.956%0.55856%0.558SS**Hα-helixtrans-64.1-42176.5-54.20000111.2S453 A454 L455 S460 A461S453-T457 WeakPolarHBondContact O-CB 3.32Å; S453-T457 PolarHBondContact O-N 3.37Å; S453-T457 PolarHBondContact O-OG1 3.44Å; A454-T457 PolarHBondContact O-N 3.48Å; L455-T457 VanDerWaalsContact C-N 3.34Å; T457-S460 PolarHBondContact O-N 2.92Å; T457-S460 PolarHBondContact O-OG 2.98Å; T457-A461 WeakPolarHBondContact O-CB 3.3Å; T457-A461 PolarHBondContact O-N 2.99Å
458Q78.9Confident75.8Confident134 Ų13493.8 Ų93.863%0.62655%0.545SS*.Hα-helixtrans-66.2-39176.3-168.117715.100112.3A454 L455 A461 Y462A454-Q458 WeakPolarHBondContact O-CB 3.45Å; A454-Q458 PolarHBondContact O-N 3.41Å; L455-Q458 PolarHBondContact O-N 2.89Å; Q458-A461 PolarHBondContact O-N 3.22Å; Q458-Y462 PolarHBondContact O-N 2.91Å
459S76.8Confident77.6Confident65 Ų6595 Ų9546%0.45554%0.538SS..Hα-helixtrans-65.9-42.4176.5-178.30000112.3L455 I456 Y462 K463L455-S459 WeakPolarHBondContact O-CB 2.8Å; L455-S459 PolarHBondContact O-N 3.36Å; I456-S459 PolarHBondContact O-N 3.25Å; S459-Y462 PolarHBondContact O-N 3.45Å; S459-K463 WeakPolarHBondContact O-CG 3.48Å; S459-K463 PolarHBondContact O-N 3.34Å; S459-K463 VanDerWaalsContact O-N 3.11Å
460S78.7Confident79.9Confident61 Ų6195 Ų9543%0.42753%0.53SS..Hα-helixtrans-66.2-40.3174.863.40000112.2I456 T457 Y462 K463 V464I456-S460 PolarHBondContact O-N 3.4Å; I456-S460 PolarHBondContact O-OG 3.05Å; T457-S460 PolarHBondContact O-N 2.92Å; T457-S460 PolarHBondContact O-OG 2.98Å; S460-Y462 VanDerWaalsContact C-N 3.34Å; S460-Y462 PolarHBondContact O-N 3.13Å; S460-K463 PolarHBondContact O-N 3.36Å; S460-V464 WeakPolarHBondContact O-CG2 3.25Å; S460-V464 PolarHBondContact O-N 3.02Å; S460-V464 VanDerWaalsContact O-N 3.13Å
461A81.9Confident81.9Confident47 Ų4798.9 Ų98.939%0.38853%0.527SS..Hα-helixtrans-61.2-40.9173.400000112.2T457 Q458 K463 V464 L465T457-A461 WeakPolarHBondContact O-CB 3.3Å; T457-A461 PolarHBondContact O-N 2.99Å; Q458-A461 PolarHBondContact O-N 3.22Å; A461-K463 VanDerWaalsContact C-N 3.34Å; A461-K463 PolarHBondContact O-N 2.96Å; A461-V464 PolarHBondContact O-N 3.34Å; A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CG 3.32Å; A461-L465 PolarHBondContact O-N 3.43Å
462Y86.3Confident83.5Confident176 Ų17699.8 Ų99.869%0.6953%0.531SS*.Hα-helixtrans-64.9-36.4176.9-167.3-95.9000112.6Q458 S459 S460 L465 S466Q458-Y462 PolarHBondContact O-N 2.91Å; S459-Y462 PolarHBondContact O-N 3.45Å; S460-Y462 VanDerWaalsContact C-N 3.34Å; S460-Y462 PolarHBondContact O-N 3.13Å; Y462-L465 PolarHBondContact O-N 2.7Å; Y462-S466 WeakPolarHBondContact O-CB 3.48Å; Y462-S466 PolarHBondContact O-N 2.91Å
463K89.8Confident84.9Confident148 Ų14899.1 Ų99.164%0.64352%0.524SS*.Hα-helixtrans-62.7-45.5173.7-72.9176.4-179.2179.90111.6S459 S460 A461 S466 V467S459-K463 WeakPolarHBondContact O-CG 3.48Å; S459-K463 PolarHBondContact O-N 3.34Å; S459-K463 VanDerWaalsContact O-N 3.11Å; S460-K463 PolarHBondContact O-N 3.36Å; A461-K463 VanDerWaalsContact C-N 3.34Å; A461-K463 PolarHBondContact O-N 2.96Å; K463-S466 WeakPolarHBondContact O-CB 3.26Å; K463-S466 PolarHBondContact O-N 3.08Å; K463-V467 WeakPolarHBondContact O-CG2 3.24Å; K463-V467 PolarHBondContact O-N 3.49Å; K463-V467 VanDerWaalsContact O-N 3.15Å
464V90Very high86.3Confident94 Ų94101.8 Ų101.857%0.5753%0.529SS*.Hα-helixtrans-62.3-46.5176.8175.70000110.8S460 A461 S466 V467 E468S460-V464 WeakPolarHBondContact O-CG2 3.25Å; S460-V464 PolarHBondContact O-N 3.02Å; S460-V464 VanDerWaalsContact O-N 3.13Å; A461-V464 PolarHBondContact O-N 3.34Å; V464-S466 VanDerWaalsContact C-N 3.29Å; V464-S466 PolarHBondContact O-N 3.03Å; V464-V467 PolarHBondContact O-N 3.34Å; V464-E468 PolarHBondContact O-N 3.13Å
465L88.8Confident87.6Confident118 Ų118104 Ų10462%0.61853%0.533SS*.Hα-helixtrans-62.3-34.7177.3-72171.4000112.9A461 Y462 E468 K469A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CG 3.32Å; A461-L465 PolarHBondContact O-N 3.43Å; Y462-L465 PolarHBondContact O-N 2.7Å; L465-E468 PolarHBondContact O-N 2.83Å; L465-K469 VanDerWaalsContact O-CB 3.31Å; L465-K469 WeakPolarHBondContact O-CB 3.19Å; L465-K469 PolarHBondContact O-N 3.25Å
466S87.6Confident88.7Confident52 Ų52102.5 Ų102.536%0.36453%0.529SS..Hα-helixtrans-65.2-41.6175.7-174.60000112.1Y462 K463 V464 K469 N470Y462-S466 WeakPolarHBondContact O-CB 3.48Å; Y462-S466 PolarHBondContact O-N 2.91Å; K463-S466 WeakPolarHBondContact O-CB 3.26Å; K463-S466 PolarHBondContact O-N 3.08Å; V464-S466 VanDerWaalsContact C-N 3.29Å; V464-S466 PolarHBondContact O-N 3.03Å; S466-K469 PolarHBondContact O-N 3.45Å; S466-N470 VanDerWaalsContact O-CG 3.31Å; S466-N470 PolarHBondContact O-N 3.28Å; S466-N470 PolarHBondContact O-ND2 3.42Å
467V95.5Very high89.8Confident94 Ų94103.6 Ų103.657%0.5753%0.529SS*.Hα-helixtrans-65.2-45.3175.7176.20000110.8K463 V464 K469 N470 R471K463-V467 WeakPolarHBondContact O-CG2 3.24Å; K463-V467 PolarHBondContact O-N 3.49Å; K463-V467 VanDerWaalsContact O-N 3.15Å; V464-V467 PolarHBondContact O-N 3.34Å; V467-K469 PolarHBondContact O-N 2.82Å; V467-N470 PolarHBondContact O-N 2.74Å; V467-N470 VanDerWaalsContact O-N 3.16Å; V467-R471 PolarHBondContact O-N 2.83Å
468E93.3Very high90.9Very high83 Ų83103.9 Ų103.939%0.38853%0.527SS..Hα-helixtrans-65-37.8177.4-71.9-59.1151.200112.2V464 L465 N470 R471 L472V464-E468 PolarHBondContact O-N 3.13Å; L465-E468 PolarHBondContact O-N 2.83Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 2.79Å; E468-R471 PolarHBondContact O-N 3.26Å; E468-R471 IonicContact OE1-NH1 3.13Å; E468-L472 WeakPolarHBondContact O-CB 3.24Å; E468-L472 WeakPolarHBondContact O-CG 3.34Å; E468-L472 PolarHBondContact O-N 2.91Å
469K93.4Very high91.6Very high135 Ų135102.6 Ų102.659%0.58752%0.524SS*.Hα-helixtrans-57.6-44.9171.3177.6-175.1174-179.40111.4L465 S466 V467 L472 L473L465-K469 VanDerWaalsContact O-CB 3.31Å; L465-K469 WeakPolarHBondContact O-CB 3.19Å; L465-K469 PolarHBondContact O-N 3.25Å; S466-K469 PolarHBondContact O-N 3.45Å; V467-K469 PolarHBondContact O-N 2.82Å; K469-L472 PolarHBondContact O-N 3.42Å; K469-L473 HydrophobicContact CG-CD1 4.3Å; K469-L473 WeakPolarHBondContact O-CG 3.41Å; K469-L473 PolarHBondContact O-N 3.31Å
470N94.4Very high92.5Very high94 Ų94104.5 Ų104.550%0.50353%0.525SS..Hα-helixtrans-65.3-41.2178.7-69.7-26.1000111.7S466 V467 E468 L472 L473 E474S466-N470 VanDerWaalsContact O-CG 3.31Å; S466-N470 PolarHBondContact O-N 3.28Å; S466-N470 PolarHBondContact O-ND2 3.42Å; V467-N470 PolarHBondContact O-N 2.74Å; V467-N470 VanDerWaalsContact O-N 3.16Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 2.79Å; N470-L472 PolarHBondContact O-N 3.3Å; N470-L473 PolarHBondContact O-N 2.8Å; N470-E474 PolarHBondContact O-N 2.7Å
471R96.6Very high93.4Very high167 Ų167105.8 Ų105.863%0.6353%0.526SS*.Hα-helixtrans-62.5-41.1175.1-170.4-179.5-176.2179.52.6112.3V467 E468 E474 L475V467-R471 PolarHBondContact O-N 2.83Å; E468-R471 PolarHBondContact O-N 3.26Å; E468-R471 IonicContact OE1-NH1 3.13Å; R471-E474 PolarHBondContact O-N 3.49Å; R471-L475 PolarHBondContact O-N 2.78Å
472L95.6Very high94Very high106 Ų106110.2 Ų110.256%0.55554%0.537SS*.Hα-helixtrans-65.4-40.7175.3-74.1172.5000111.8E468 K469 N470 E474 L475 V476E468-L472 WeakPolarHBondContact O-CB 3.24Å; E468-L472 WeakPolarHBondContact O-CG 3.34Å; E468-L472 PolarHBondContact O-N 2.91Å; K469-L472 PolarHBondContact O-N 3.42Å; N470-L472 PolarHBondContact O-N 3.3Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.97Å; L472-L475 PolarHBondContact O-N 3.49Å; L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.46Å
473L95.6Very high94.5Very high87 Ų87106.6 Ų106.646%0.45553%0.526SS..Hα-helixtrans-62.1-39.3174.9-75.1170000111.9K469 N470 V476 K477K469-L473 HydrophobicContact CG-CD1 4.3Å; K469-L473 WeakPolarHBondContact O-CG 3.41Å; K469-L473 PolarHBondContact O-N 3.31Å; N470-L473 PolarHBondContact O-N 2.8Å; L473-V476 PolarHBondContact O-N 2.94Å; L473-K477 WeakPolarHBondContact O-CG 3.28Å; L473-K477 PolarHBondContact O-N 3.27Å
474E97.3Very high94.8Very high125 Ų125106.8 Ų106.858%0.58453%0.527SS*.Hα-helixtrans-65.5-42.9174.8-170171.5-165.500111.8N470 R471 L472 V476 K477 L478N470-E474 PolarHBondContact O-N 2.7Å; R471-E474 PolarHBondContact O-N 3.49Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.97Å; E474-V476 VanDerWaalsContact C-N 3.33Å; E474-V476 PolarHBondContact O-N 3.24Å; E474-K477 WeakPolarHBondContact O-CB 3.47Å; E474-K477 PolarHBondContact O-N 3.44Å; E474-L478 WeakPolarHBondContact O-CG 3.39Å; E474-L478 PolarHBondContact O-N 3Å
475L97Very high95.2Very high92 Ų92107.7 Ų107.748%0.48253%0.525SS..Hα-helixtrans-61.3-41.2175-175.362.9000112R471 L472 K477 L478 L479R471-L475 PolarHBondContact O-N 2.78Å; L472-L475 PolarHBondContact O-N 3.49Å; L475-K477 VanDerWaalsContact C-N 3.34Å; L475-K477 PolarHBondContact O-N 3.42Å; L475-L478 PolarHBondContact O-N 2.96Å; L475-L479 HydrophobicContact CG-CD1 4.33Å; L475-L479 WeakPolarHBondContact O-CG 3.4Å; L475-L479 PolarHBondContact O-N 2.83Å
476V96.7Very high95.5Very high72 Ų72107.9 Ų107.944%0.43652%0.524SS..Hα-helixtrans-61.3-42.8175.3169.40000111L472 L473 E474 L478 L479 Q480L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.46Å; L473-V476 PolarHBondContact O-N 2.94Å; E474-V476 VanDerWaalsContact C-N 3.33Å; E474-V476 PolarHBondContact O-N 3.24Å; V476-L478 PolarHBondContact O-N 2.85Å; V476-L479 PolarHBondContact O-N 2.88Å; V476-Q480 WeakPolarHBondContact O-CG 3.27Å; V476-Q480 PolarHBondContact O-N 3.32Å
477K96.8Very high95.9Very high135 Ų135111 Ų11159%0.58753%0.531SS*.Hα-helixtrans-61.3-44.8175.6-71.5173.4-177179.10111.8L473 E474 L475 L479 Q480 I481L473-K477 WeakPolarHBondContact O-CG 3.28Å; L473-K477 PolarHBondContact O-N 3.27Å; E474-K477 WeakPolarHBondContact O-CB 3.47Å; E474-K477 PolarHBondContact O-N 3.44Å; L475-K477 VanDerWaalsContact C-N 3.34Å; L475-K477 PolarHBondContact O-N 3.42Å; K477-L479 VanDerWaalsContact C-N 3.34Å; K477-L479 PolarHBondContact O-N 3.42Å; K477-Q480 PolarHBondContact O-N 3.04Å; K477-I481 WeakPolarHBondContact O-CG1 3.45Å; K477-I481 PolarHBondContact O-N 3.33Å
478L97.7Very high96Very high97 Ų97111 Ų11151%0.50853%0.525SS..Hα-helixtrans-62.6-40.9177.1-70.4175.9000112.1E474 L475 V476 I481 K482E474-L478 WeakPolarHBondContact O-CG 3.39Å; E474-L478 PolarHBondContact O-N 3Å; L475-L478 PolarHBondContact O-N 2.96Å; V476-L478 PolarHBondContact O-N 2.85Å; L478-I481 PolarHBondContact O-N 2.95Å; L478-K482 PolarHBondContact O-N 3.02Å
479L93.2Very high96.1Very high106 Ų106111.1 Ų111.156%0.55553%0.531SS*.Hα-helixtrans-64.9-40.5176.1-72.8174.8000111.9L475 V476 K477 I481 K482 E483L475-L479 HydrophobicContact CG-CD1 4.33Å; L475-L479 WeakPolarHBondContact O-CG 3.4Å; L475-L479 PolarHBondContact O-N 2.83Å; V476-L479 PolarHBondContact O-N 2.88Å; K477-L479 VanDerWaalsContact C-N 3.34Å; K477-L479 PolarHBondContact O-N 3.42Å; L479-I481 VanDerWaalsContact C-N 3.34Å; L479-I481 PolarHBondContact O-N 3.38Å; L479-K482 PolarHBondContact O-N 2.74Å; L479-E483 WeakPolarHBondContact O-CB 3.44Å; L479-E483 PolarHBondContact O-N 3.01Å
480Q96Very high96Very high105 Ų105108.3 Ų108.349%0.49153%0.528SS..Hα-helixtrans-63.8-38.1175.2-74.5176-11.700112.5V476 K477 K484V476-Q480 WeakPolarHBondContact O-CG 3.27Å; V476-Q480 PolarHBondContact O-N 3.32Å; K477-Q480 PolarHBondContact O-N 3.04Å; Q480-K484 WeakPolarHBondContact O-CG 3.49Å; Q480-K484 PolarHBondContact O-N 3.26Å; Q480-K484 VanDerWaalsContact O-N 3.11Å
481I97.6Very high96.1Very high88 Ų88108.1 Ų108.145%0.45153%0.526SS..Hα-helixtrans-64.1-50.4174.7-68.1165.7000109.8K477 L478 L479 E483 K484 E485K477-I481 WeakPolarHBondContact O-CG1 3.45Å; K477-I481 PolarHBondContact O-N 3.33Å; L478-I481 PolarHBondContact O-N 2.95Å; L479-I481 VanDerWaalsContact C-N 3.34Å; L479-I481 PolarHBondContact O-N 3.38Å; I481-E483 VanDerWaalsContact C-N 3.28Å; I481-E483 PolarHBondContact O-N 3.31Å; I481-K484 WeakPolarHBondContact O-CB 3.29Å; I481-K484 PolarHBondContact O-N 3.43Å; I481-K484 VanDerWaalsContact O-N 3.08Å; I481-E485 HydrophobicContact CG2-CG 4.45Å; I481-E485 WeakPolarHBondContact O-CG 3.29Å; I481-E485 PolarHBondContact O-N 2.88Å
482K96.1Very high96.2Very high141 Ų141104.4 Ų104.461%0.61352%0.516SS*.Hα-helixtrans-61.4-35.5178-74.8-156.2173.5-167.30113.2L478 L479 E485 M486L478-K482 PolarHBondContact O-N 3.02Å; L479-K482 PolarHBondContact O-N 2.74Å; K482-E485 PolarHBondContact O-N 2.9Å; K482-M486 VanDerWaalsContact O-CB 3.3Å; K482-M486 WeakPolarHBondContact O-CB 3.42Å; K482-M486 PolarHBondContact O-N 3.45Å
483E95.3Very high96.2Very high99 Ų99102.1 Ų102.146%0.46351%0.512SS..Hα-helixtrans-63.4-42.9174.9-170.2-168.7162.300111.2L479 I481 M486 K487L479-E483 WeakPolarHBondContact O-CB 3.44Å; L479-E483 PolarHBondContact O-N 3.01Å; I481-E483 VanDerWaalsContact C-N 3.28Å; I481-E483 PolarHBondContact O-N 3.31Å; E483-M486 PolarHBondContact O-N 3.44Å; E483-K487 WeakPolarHBondContact O-CB 3.49Å; E483-K487 WeakPolarHBondContact O-CG 3.35Å; E483-K487 PolarHBondContact O-N 3.33Å; E483-K487 VanDerWaalsContact OE1-CE 3.22Å; E483-K487 WeakPolarHBondContact OE1-CE 3.48Å; E483-K487 IonicContact OE1-NZ 3.79Å; E483-K487 PolarHBondContact OE1-NZ 3.29Å
484K96.9Very high96.1Very high153 Ų153103 Ų10367%0.66551%0.514SS*.Hα-helixtrans-64.9-44.6176.1-71.8176.2-178.3-177.30112Q480 I481 K487 Q488Q480-K484 WeakPolarHBondContact O-CG 3.49Å; Q480-K484 PolarHBondContact O-N 3.26Å; Q480-K484 VanDerWaalsContact O-N 3.11Å; I481-K484 WeakPolarHBondContact O-CB 3.29Å; I481-K484 PolarHBondContact O-N 3.43Å; I481-K484 VanDerWaalsContact O-N 3.08Å; K484-K487 PolarHBondContact O-N 3.33Å; K484-Q488 PolarHBondContact O-N 2.91Å
485E97.4Very high96.1Very high112 Ų112103.1 Ų103.152%0.52351%0.513SS..Hα-helixtrans-60.4-45.4175.8-71172.7174.100111.3I481 K482 K487 Q488 V489I481-E485 HydrophobicContact CG2-CG 4.45Å; I481-E485 WeakPolarHBondContact O-CG 3.29Å; I481-E485 PolarHBondContact O-N 2.88Å; K482-E485 PolarHBondContact O-N 2.9Å; E485-K487 PolarHBondContact O-N 3.46Å; E485-Q488 WeakPolarHBondContact O-CB 3.21Å; E485-Q488 PolarHBondContact O-N 3.27Å; E485-V489 WeakPolarHBondContact O-CG2 3.47Å; E485-V489 PolarHBondContact O-N 3.12Å
486M94.8Very high96.1Very high122 Ų122105.2 Ų105.260%0.60152%0.518SS*.Hα-helixtrans-63.7-42.4178.5-166.564.86500111.7K482 E483 Q488 V489 C490K482-M486 VanDerWaalsContact O-CB 3.3Å; K482-M486 WeakPolarHBondContact O-CB 3.42Å; K482-M486 PolarHBondContact O-N 3.45Å; E483-M486 PolarHBondContact O-N 3.44Å; M486-Q488 VanDerWaalsContact C-N 3.29Å; M486-Q488 PolarHBondContact O-N 2.92Å; M486-V489 PolarHBondContact O-N 3Å; M486-C490 PolarHBondContact O-N 2.96Å; M486-C490 PolarHBondContact O-SG 3.4Å
487K96.1Very high96.1Very high117 Ų117108.9 Ų108.951%0.50953%0.525SS..Hα-helixtrans-59-41.9174.1-76.7175.7-175.6171.10111.6E483 K484 E485 C490 L491E483-K487 WeakPolarHBondContact O-CB 3.49Å; E483-K487 WeakPolarHBondContact O-CG 3.35Å; E483-K487 PolarHBondContact O-N 3.33Å; E483-K487 VanDerWaalsContact OE1-CE 3.22Å; E483-K487 WeakPolarHBondContact OE1-CE 3.48Å; E483-K487 IonicContact OE1-NZ 3.79Å; E483-K487 PolarHBondContact OE1-NZ 3.29Å; K484-K487 PolarHBondContact O-N 3.33Å; E485-K487 PolarHBondContact O-N 3.46Å; K487-C490 PolarHBondContact O-N 3.21Å; K487-L491 WeakPolarHBondContact O-CG 3.37Å; K487-L491 PolarHBondContact O-N 3.2Å
488Q97.5Very high96Very high95 Ų95106.4 Ų106.444%0.44452%0.516SS..Hα-helixtrans-62.4-46.5176.8-17860.826.200111.7K484 E485 M486 C490 L491 E492K484-Q488 PolarHBondContact O-N 2.91Å; E485-Q488 WeakPolarHBondContact O-CB 3.21Å; E485-Q488 PolarHBondContact O-N 3.27Å; M486-Q488 VanDerWaalsContact C-N 3.29Å; M486-Q488 PolarHBondContact O-N 2.92Å; Q488-C490 VanDerWaalsContact C-N 3.33Å; Q488-C490 PolarHBondContact O-N 3.03Å; Q488-L491 PolarHBondContact O-N 3.46Å; Q488-E492 PolarHBondContact NE2-OE1 3.44Å; Q488-E492 WeakPolarHBondContact O-CG 3.36Å; Q488-E492 PolarHBondContact O-N 3.36Å
489V97.1Very high96Very high85 Ų85106.5 Ų106.552%0.51551%0.513SS..Hα-helixtrans-60.5-42.1176.5172.70000111.4E485 M486 L491 E492 A493E485-V489 WeakPolarHBondContact O-CG2 3.47Å; E485-V489 PolarHBondContact O-N 3.12Å; M486-V489 PolarHBondContact O-N 3Å; V489-L491 PolarHBondContact O-N 2.98Å; V489-E492 PolarHBondContact O-N 3.02Å; V489-A493 WeakPolarHBondContact O-CB 3.25Å; V489-A493 PolarHBondContact O-N 2.97Å
490C91.3Very high96.1Very high76 Ų76106.1 Ų106.151%0.51451%0.509SS..Hα-helixtrans-61.2-43.8175.6-70.50000112.2M486 K487 Q488 E492 A493 E494M486-C490 PolarHBondContact O-N 2.96Å; M486-C490 PolarHBondContact O-SG 3.4Å; K487-C490 PolarHBondContact O-N 3.21Å; Q488-C490 VanDerWaalsContact C-N 3.33Å; Q488-C490 PolarHBondContact O-N 3.03Å; C490-E492 VanDerWaalsContact C-N 3.34Å; C490-E492 PolarHBondContact O-N 2.9Å; C490-A493 PolarHBondContact O-N 3.11Å; C490-E494 PolarHBondContact O-N 2.93Å
491L96.5Very high96.2Very high90 Ų90108.6 Ų108.647%0.47151%0.514SS..Hα-helixtrans-63.7-39177.7-71.9170.8000112.2K487 Q488 V489 E494 K495K487-L491 WeakPolarHBondContact O-CG 3.37Å; K487-L491 PolarHBondContact O-N 3.2Å; Q488-L491 PolarHBondContact O-N 3.46Å; V489-L491 PolarHBondContact O-N 2.98Å; L491-E494 PolarHBondContact O-N 3.37Å; L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 3.4Å
492E97.3Very high96.1Very high90 Ų90111.6 Ų111.642%0.42152%0.519SS..Hα-helixtrans-67.2-40.8175.9-72.9173.9-163.900112.2Q488 V489 C490 E494 K495 K496Q488-E492 PolarHBondContact NE2-OE1 3.44Å; Q488-E492 WeakPolarHBondContact O-CG 3.36Å; Q488-E492 PolarHBondContact O-N 3.36Å; V489-E492 PolarHBondContact O-N 3.02Å; C490-E492 VanDerWaalsContact C-N 3.34Å; C490-E492 PolarHBondContact O-N 2.9Å; E492-E494 VanDerWaalsContact C-N 3.34Å; E492-K495 PolarHBondContact O-N 2.94Å; E492-K496 WeakPolarHBondContact O-CG 3.36Å; E492-K496 PolarHBondContact O-N 3.46Å
493A95.2Very high96.1Very high57 Ų57110 Ų11047%0.47151%0.512SS..Hα-helixtrans-62.8-41174.700000111.7V489 C490 K496 Y497V489-A493 WeakPolarHBondContact O-CB 3.25Å; V489-A493 PolarHBondContact O-N 2.97Å; C490-A493 PolarHBondContact O-N 3.11Å; A493-K496 PolarHBondContact O-N 3.17Å; A493-Y497 WeakPolarHBondContact O-CB 3.46Å; A493-Y497 PolarHBondContact O-N 3.28Å
494E94.5Very high96.1Very high105 Ų105108.5 Ų108.549%0.49151%0.51SS..Hα-helixtrans-64.1-42.2176.8-171.1174.4-174.100111.9C490 L491 E492 Y497 Q498C490-E494 PolarHBondContact O-N 2.93Å; L491-E494 PolarHBondContact O-N 3.37Å; E492-E494 VanDerWaalsContact C-N 3.34Å; E494-Y497 PolarHBondContact O-N 2.88Å; E494-Q498 WeakPolarHBondContact O-CG 3.5Å; E494-Q498 PolarHBondContact O-N 3.46Å
495K97.3Very high96.1Very high128 Ų128105.9 Ų105.956%0.55750%0.503SS*.Hα-helixtrans-59.9-47.3174.1-74.4178-176.9179.90112L491 E492 Y497 Q498 E499L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 3.4Å; E492-K495 PolarHBondContact O-N 2.94Å; K495-Y497 VanDerWaalsContact C-N 3.32Å; K495-Y497 PolarHBondContact O-N 2.94Å; K495-Q498 PolarHBondContact O-N 3.37Å; K495-E499 WeakPolarHBondContact O-CG 3.19Å; K495-E499 PolarHBondContact O-N 2.97Å
496K97.6Very high96Very high137 Ų137104.9 Ų104.960%0.59650%0.5SS*.Hα-helixtrans-60.4-42.3176.8-72.9-179.7-1781780111.9E492 A493 Q498 E499 E500E492-K496 WeakPolarHBondContact O-CG 3.36Å; E492-K496 PolarHBondContact O-N 3.46Å; A493-K496 PolarHBondContact O-N 3.17Å; K496-Q498 VanDerWaalsContact C-N 3.34Å; K496-Q498 PolarHBondContact O-N 2.97Å; K496-E499 PolarHBondContact O-N 2.74Å; K496-E500 PolarHBondContact O-N 2.79Å
497Y95.3Very high96Very high149 Ų149103.9 Ų103.958%0.58450%0.497SS*.Hα-helixtrans-61.2-42.8175.9174.6-105.9000112.1A493 E494 K495 E500 R501A493-Y497 WeakPolarHBondContact O-CB 3.46Å; A493-Y497 PolarHBondContact O-N 3.28Å; E494-Y497 PolarHBondContact O-N 2.88Å; K495-Y497 VanDerWaalsContact C-N 3.32Å; K495-Y497 PolarHBondContact O-N 2.94Å; Y497-E500 PolarHBondContact O-N 3.41Å; Y497-R501 WeakPolarHBondContact O-CB 3.33Å; Y497-R501 PolarHBondContact O-N 2.92Å
498Q96.3Very high95.8Very high83 Ų83103.1 Ų103.139%0.38850%0.495SS..Hα-helixtrans-64.5-38.6175.7-70.3179.51200112.3E494 K495 K496 R501 R502E494-Q498 WeakPolarHBondContact O-CG 3.5Å; E494-Q498 PolarHBondContact O-N 3.46Å; K495-Q498 PolarHBondContact O-N 3.37Å; K496-Q498 VanDerWaalsContact C-N 3.34Å; K496-Q498 PolarHBondContact O-N 2.97Å; Q498-R501 PolarHBondContact O-N 2.87Å; Q498-R502 WeakPolarHBondContact O-CG 3.27Å; Q498-R502 PolarHBondContact O-N 3.5Å
499E97.3Very high95.6Very high98 Ų98103.3 Ų103.346%0.45850%0.496SS..Hα-helixtrans-63.9-47.4175.2-74.2174-171.100112.2K495 K496 R501 R502 K503K495-E499 WeakPolarHBondContact O-CG 3.19Å; K495-E499 PolarHBondContact O-N 2.97Å; K496-E499 PolarHBondContact O-N 2.74Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 3.35Å; E499-R502 WeakPolarHBondContact O-CB 3.44Å; E499-R502 PolarHBondContact O-N 3.29Å; E499-R502 VanDerWaalsContact O-N 3.15Å; E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.11Å
500E95.4Very high95.4Very high98 Ų98104.7 Ų104.746%0.45850%0.497SS..Hα-helixtrans-60.8-42.4175.7-72.5-54.7132.900111.2K496 Y497 R502 K503 T504K496-E500 PolarHBondContact O-N 2.79Å; Y497-E500 PolarHBondContact O-N 3.41Å; E500-R502 VanDerWaalsContact C-N 3.29Å; E500-R502 PolarHBondContact O-N 3.04Å; E500-K503 WeakPolarHBondContact O-CB 3.36Å; E500-K503 PolarHBondContact O-N 3.37Å; E500-K503 IonicContact OE1-NZ 2.66Å; E500-K503 PolarHBondContact OE1-NZ 2.94Å; E500-T504 PolarHBondContact O-N 3.41Å; E500-T504 PolarHBondContact O-OG1 2.97Å
501R96.3Very high95.1Very high157 Ų157107.3 Ų107.359%0.59251%0.505SS*.Hα-helixtrans-59.2-39.3175-172.3171.8179.5177.50.4112.5Y497 Q498 E499 T504 L505Y497-R501 WeakPolarHBondContact O-CB 3.33Å; Y497-R501 PolarHBondContact O-N 2.92Å; Q498-R501 PolarHBondContact O-N 2.87Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 3.35Å; R501-T504 PolarHBondContact O-N 2.94Å; R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.32Å; R501-L505 VanDerWaalsContact O-N 3.08Å
502R96.6Very high94.5Very high152 Ų152110.8 Ų110.857%0.57452%0.519SS*.Hα-helixtrans-65.2-42.5174-70.9172.9-171.8153.24.7111.5Q498 E499 E500 L505 I506Q498-R502 WeakPolarHBondContact O-CG 3.27Å; Q498-R502 PolarHBondContact O-N 3.5Å; E499-R502 WeakPolarHBondContact O-CB 3.44Å; E499-R502 PolarHBondContact O-N 3.29Å; E499-R502 VanDerWaalsContact O-N 3.15Å; E500-R502 VanDerWaalsContact C-N 3.29Å; E500-R502 PolarHBondContact O-N 3.04Å; R502-L505 PolarHBondContact O-N 3.37Å; R502-I506 WeakPolarHBondContact O-CG1 3.49Å; R502-I506 PolarHBondContact O-N 3.28Å; R502-I506 VanDerWaalsContact O-N 3.08Å
503K96.8Very high93.8Very high106 Ų106115.4 Ų115.446%0.46153%0.532SS..Hα-helixtrans-61.6-44.3176.1-67.5175.5-169.4167.90111.5E499 E500 L505 I506 L507E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.11Å; E500-K503 WeakPolarHBondContact O-CB 3.36Å; E500-K503 PolarHBondContact O-N 3.37Å; E500-K503 IonicContact OE1-NZ 2.66Å; E500-K503 PolarHBondContact OE1-NZ 2.94Å; K503-L505 PolarHBondContact O-N 3.45Å; K503-I506 PolarHBondContact O-N 3.02Å; K503-L507 WeakPolarHBondContact O-CG 3.39Å; K503-L507 PolarHBondContact O-N 3.2Å
504T95.1Very high92.3Very high69 Ų69119.1 Ų119.142%0.42356%0.563SS.*Hα-helixtrans-59.1-45.7176.2-52.10000111.4E500 R501 I506 L507 E508E500-T504 PolarHBondContact O-N 3.41Å; E500-T504 PolarHBondContact O-OG1 2.97Å; R501-T504 PolarHBondContact O-N 2.94Å; T504-I506 VanDerWaalsContact C-N 3.31Å; T504-I506 PolarHBondContact O-N 2.95Å; T504-L507 PolarHBondContact O-N 3.39Å; T504-E508 HydrophobicContact CG2-CG 4.47Å; T504-E508 WeakPolarHBondContact O-CG 3.35Å; T504-E508 PolarHBondContact O-N 3.25Å
505L96.3Very high92.2Very high98 Ų98119.9 Ų119.951%0.51357%0.567SS.*Hα-helixtrans-60.7-39.2177-72.9171.2000112.6R501 R502 K503 Q509R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.32Å; R501-L505 VanDerWaalsContact O-N 3.08Å; R502-L505 PolarHBondContact O-N 3.37Å; K503-L505 PolarHBondContact O-N 3.45Å; L505-Q509 WeakPolarHBondContact O-CB 3.46Å; L505-Q509 PolarHBondContact O-N 3.46Å
506I95.7Very high91.9Very high90 Ų90119.4 Ų119.446%0.46257%0.567SS.*Hα-helixtrans-65.5-43.9176.2-66.6165.7000110.5R502 K503 T504 Q509 Q510R502-I506 WeakPolarHBondContact O-CG1 3.49Å; R502-I506 PolarHBondContact O-N 3.28Å; R502-I506 VanDerWaalsContact O-N 3.08Å; K503-I506 PolarHBondContact O-N 3.02Å; T504-I506 VanDerWaalsContact C-N 3.31Å; T504-I506 PolarHBondContact O-N 2.95Å; I506-Q509 PolarHBondContact O-N 3.04Å; I506-Q510 WeakPolarHBondContact O-CG 3.31Å; I506-Q510 PolarHBondContact O-N 3.04Å
507L93.9Very high91.6Very high102 Ų102118.4 Ų118.453%0.53457%0.566SS.*Hα-helixtrans-63.8-42.2177.4-70.9172.1000111.9K503 T504 Q509 Q510 L511K503-L507 WeakPolarHBondContact O-CG 3.39Å; K503-L507 PolarHBondContact O-N 3.2Å; T504-L507 PolarHBondContact O-N 3.39Å; L507-Q509 VanDerWaalsContact C-N 3.33Å; L507-Q509 PolarHBondContact O-N 3.44Å; L507-Q510 PolarHBondContact O-N 3.17Å; L507-L511 WeakPolarHBondContact O-CG 3.36Å; L507-L511 PolarHBondContact O-N 3.31Å
508E92.3Very high91.4Very high101 Ų101116.6 Ų116.647%0.47257%0.565SS.*Hα-helixtrans-60.4-42.4173.9-75.8177.9174.600111.5T504 Q510 L511 Q512T504-E508 HydrophobicContact CG2-CG 4.47Å; T504-E508 WeakPolarHBondContact O-CG 3.35Å; T504-E508 PolarHBondContact O-N 3.25Å; E508-Q510 VanDerWaalsContact C-N 3.34Å; E508-Q510 PolarHBondContact O-N 2.96Å; E508-L511 PolarHBondContact O-N 3.48Å; E508-Q512 WeakPolarHBondContact O-CG 3.47Å; E508-Q512 PolarHBondContact O-N 3.19Å
509Q93.5Very high91.1Very high99 Ų99118.8 Ų118.846%0.46358%0.576SS.*Hα-helixtrans-66.8-35177-170.5176.749.900112.5L505 I506 L507 R513L505-Q509 WeakPolarHBondContact O-CB 3.46Å; L505-Q509 PolarHBondContact O-N 3.46Å; I506-Q509 PolarHBondContact O-N 3.04Å; L507-Q509 VanDerWaalsContact C-N 3.33Å; L507-Q509 PolarHBondContact O-N 3.44Å; Q509-R513 VanDerWaalsContact CD-NH2 3.33Å; Q509-R513 WeakPolarHBondContact O-CG 3.38Å; Q509-R513 PolarHBondContact O-N 3.49Å
510Q92.5Very high90.7Very high114 Ų114120.1 Ų120.153%0.53358%0.583SS.*Hα-helixtrans-68.3-41.4174.2-73.8176.5-7.700111.6I506 L507 E508 Q512 R513 A514I506-Q510 WeakPolarHBondContact O-CG 3.31Å; I506-Q510 PolarHBondContact O-N 3.04Å; L507-Q510 PolarHBondContact O-N 3.17Å; E508-Q510 VanDerWaalsContact C-N 3.34Å; E508-Q510 PolarHBondContact O-N 2.96Å; Q510-Q512 VanDerWaalsContact C-N 3.31Å; Q510-Q512 PolarHBondContact O-N 3.32Å; Q510-R513 PolarHBondContact O-N 3.5Å; Q510-R513 VanDerWaalsContact O-N 3.16Å; Q510-A514 PolarHBondContact O-N 3.29Å; Q510-A514 VanDerWaalsContact O-N 3.16Å
511L85.6Confident90.4Very high130 Ų130121.7 Ų121.768%0.68159%0.592SS**Hα-helixtrans-64.6-32.2175.7-77.3169.9000113.1L507 E508 R513L507-L511 WeakPolarHBondContact O-CG 3.36Å; L507-L511 PolarHBondContact O-N 3.31Å; E508-L511 PolarHBondContact O-N 3.48Å; L511-R513 VanDerWaalsContact C-N 3.29Å
512Q84.6Confident89.9Confident164 Ų164119 Ų11977%0.76659%0.592SS**THydrogen-bonded Turntrans-75.2-17.2175.1-74.9178.9-1.800113.8E508 Q510E508-Q512 WeakPolarHBondContact O-CG 3.47Å; E508-Q512 PolarHBondContact O-N 3.19Å; Q510-Q512 VanDerWaalsContact C-N 3.31Å; Q510-Q512 PolarHBondContact O-N 3.32Å
513R81.8Confident89.3Confident187 Ų187116.3 Ų116.371%0.70659%0.594SS**THydrogen-bonded Turntrans-96-17.9178.6-72179.1-173.3168.55.3113.3Q509 Q510 L511Q509-R513 VanDerWaalsContact CD-NH2 3.33Å; Q509-R513 WeakPolarHBondContact O-CG 3.38Å; Q509-R513 PolarHBondContact O-N 3.49Å; Q510-R513 PolarHBondContact O-N 3.5Å; Q510-R513 VanDerWaalsContact O-N 3.16Å; L511-R513 VanDerWaalsContact C-N 3.29Å
514A64.1Low88.7Confident135 Ų135117.2 Ų117.2100%1.11661%0.606SS**  trans-82.60169.500000109.8Q510Q510-A514 PolarHBondContact O-N 3.29Å; Q510-A514 VanDerWaalsContact O-N 3.16Å

Retrieved 514 of 514 residues in 646.5 ms (Link to these results)