A0A087Y1Q9_POEFO Loading...

Golgin subfamily A member 5

Involved in maintaining Golgi structure. Stimulates the formation of Golgi stacks and ribbons. Involved in intra-Golgi retrograde transport.

AlphaFold DB , UniProt , Accession A0A087Y1Q9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 751 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.5Low71.1Confident200 Ų200104.5 Ų104.599%0.98557%0.569SS**  0-14.50-74.9175.2168.300113.9W3 F4M1-W3 VanDerWaalsContact C-N 3.29Å; M1-W3 PolarHBondContact O-N 2.65Å; M1-W3 VanDerWaalsContact O-N 3.15Å; M1-F4 PolarHBondContact O-N 3.15Å; M1-F4 VanDerWaalsContact O-N 3.15Å
2S55Low72.6Confident91 Ų91106.4 Ų106.464%0.63657%0.571SS**Hα-helixtrans-57.2-27.4-175.944.70000116.6F4 T5 D6S2-F4 PolarHBondContact O-N 3.12Å; S2-T5 WeakPolarHBondContact CA-OG1 3.28Å; S2-T5 PolarHBondContact O-N 3.05Å; S2-T5 PolarHBondContact O-OG1 3.09Å; S2-D6 WeakPolarHBondContact O-CB 3.25Å; S2-D6 PolarHBondContact O-N 3.14Å
3W62.8Low73.5Confident174 Ų174104.9 Ų104.966%0.65956%0.563SS**Hα-helixtrans-65-28.7178.278.2-88000113.1M1 L7M1-W3 VanDerWaalsContact C-N 3.29Å; M1-W3 PolarHBondContact O-N 2.65Å; M1-W3 VanDerWaalsContact O-N 3.15Å; W3-L7 HydrophobicContact CZ3-CD2 4.35Å; W3-L7 VanDerWaalsContact O-CB 3.24Å; W3-L7 WeakPolarHBondContact O-CB 3.42Å; W3-L7 PolarHBondContact O-N 3.48Å
4F62.8Low74.6Confident133 Ų133107.6 Ų107.658%0.58357%0.567SS**Hα-helixtrans-74.1-36.7174.9-111.7-80.7000112.3M1 S2 A8M1-F4 PolarHBondContact O-N 3.15Å; M1-F4 VanDerWaalsContact O-N 3.15Å; S2-F4 PolarHBondContact O-N 3.12Å; F4-A8 VanDerWaalsContact O-CB 3.23Å; F4-A8 WeakPolarHBondContact O-CB 3.41Å; F4-A8 PolarHBondContact O-N 3.2Å
5T75.7Confident75.3Confident100 Ų100107.8 Ų107.861%0.61357%0.568SS**Hα-helixtrans-71.7-36.1175.149.30000112S2 A8 G9S2-T5 WeakPolarHBondContact CA-OG1 3.28Å; S2-T5 PolarHBondContact O-N 3.05Å; S2-T5 PolarHBondContact O-OG1 3.09Å; T5-A8 PolarHBondContact O-N 2.68Å; T5-G9 PolarHBondContact O-N 3.5Å
6D69.8Low76Confident89 Ų89105.9 Ų105.948%0.47656%0.558SS.*Hα-helixtrans-70.6-36.9175.6-178.460.4000111.9S2 K10S2-D6 WeakPolarHBondContact O-CB 3.25Å; S2-D6 PolarHBondContact O-N 3.14Å; D6-K10 WeakPolarHBondContact O-CB 3.32Å; D6-K10 WeakPolarHBondContact O-CD 3.4Å; D6-K10 VanDerWaalsContact O-CG 3.28Å; D6-K10 WeakPolarHBondContact O-CG 3.33Å; D6-K10 PolarHBondContact O-N 2.66Å; D6-K10 VanDerWaalsContact O-N 3.1Å; D6-K10 WeakPolarHBondContact OD1-CE 3.26Å; D6-K10 IonicContact OD1-NZ 2.76Å; D6-K10 PolarHBondContact OD1-NZ 3.49Å; D6-K10 VanDerWaalsContact OD1-NZ 3.13Å; D6-K10 IonicContact OD2-NZ 3.26Å; D6-K10 PolarHBondContact OD2-NZ 2.71Å
7L75.8Confident76.6Confident96 Ų96106.8 Ų106.850%0.50356%0.556SS.*Hα-helixtrans-68.9-39.3170.7-175.362.3000112.4W3 K10 A11W3-L7 HydrophobicContact CZ3-CD2 4.35Å; W3-L7 VanDerWaalsContact O-CB 3.24Å; W3-L7 WeakPolarHBondContact O-CB 3.42Å; W3-L7 PolarHBondContact O-N 3.48Å; L7-K10 PolarHBondContact O-N 3.28Å; L7-A11 WeakPolarHBondContact O-CB 3.38Å; L7-A11 PolarHBondContact O-N 3.41Å
8A76.8Confident77.1Confident57 Ų57104.8 Ų104.847%0.47155%0.549SS..Hα-helixtrans-63.7-46.3175.400000111.6F4 T5 K10 A11 E12F4-A8 VanDerWaalsContact O-CB 3.23Å; F4-A8 WeakPolarHBondContact O-CB 3.41Å; F4-A8 PolarHBondContact O-N 3.2Å; T5-A8 PolarHBondContact O-N 2.68Å; A8-K10 VanDerWaalsContact C-N 3.31Å; A8-K10 PolarHBondContact O-N 3.32Å; A8-A11 WeakPolarHBondContact O-CB 3.22Å; A8-A11 PolarHBondContact O-N 3.43Å; A8-A11 VanDerWaalsContact O-N 3.11Å; A8-E12 PolarHBondContact O-N 2.94Å
9G82.4Confident77.4Confident32 Ų32104.4 Ų104.433%0.3355%0.548SS..Hα-helixtrans-59.3-40.4174.300000112.3T5 A11 E12 D13T5-G9 PolarHBondContact O-N 3.5Å; G9-A11 VanDerWaalsContact C-N 3.35Å; G9-A11 PolarHBondContact O-N 3.25Å; G9-E12 PolarHBondContact O-N 2.78Å; G9-D13 WeakPolarHBondContact O-CB 3.44Å; G9-D13 PolarHBondContact O-N 2.82Å
10K84.7Confident77.5Confident121 Ų121105.7 Ų105.753%0.52655%0.551SS.*Hα-helixtrans-67.9-31174.9-73.8163.8-172.9166.70113.4D6 L7 A8 F14D6-K10 WeakPolarHBondContact O-CB 3.32Å; D6-K10 WeakPolarHBondContact O-CD 3.4Å; D6-K10 VanDerWaalsContact O-CG 3.28Å; D6-K10 WeakPolarHBondContact O-CG 3.33Å; D6-K10 PolarHBondContact O-N 2.66Å; D6-K10 VanDerWaalsContact O-N 3.1Å; D6-K10 WeakPolarHBondContact OD1-CE 3.26Å; D6-K10 IonicContact OD1-NZ 2.76Å; D6-K10 PolarHBondContact OD1-NZ 3.49Å; D6-K10 VanDerWaalsContact OD1-NZ 3.13Å; D6-K10 IonicContact OD2-NZ 3.26Å; D6-K10 PolarHBondContact OD2-NZ 2.71Å; L7-K10 PolarHBondContact O-N 3.28Å; A8-K10 VanDerWaalsContact C-N 3.31Å; A8-K10 PolarHBondContact O-N 3.32Å; K10-F14 WeakPolarHBondContact O-CB 3.29Å; K10-F14 PolarHBondContact O-N 2.7Å; K10-F14 VanDerWaalsContact O-N 3.11Å
11A85.4Confident77.7Confident57 Ų57102.4 Ų102.447%0.47154%0.542SS..Hα-helixtrans-72.7-38.9172.400000112.1L7 A8 G9 F14 L15L7-A11 WeakPolarHBondContact O-CB 3.38Å; L7-A11 PolarHBondContact O-N 3.41Å; A8-A11 WeakPolarHBondContact O-CB 3.22Å; A8-A11 PolarHBondContact O-N 3.43Å; A8-A11 VanDerWaalsContact O-N 3.11Å; G9-A11 VanDerWaalsContact C-N 3.35Å; G9-A11 PolarHBondContact O-N 3.25Å; A11-F14 PolarHBondContact O-N 3.47Å; A11-L15 PolarHBondContact O-N 3.34Å
12E88.2Confident78.8Confident127 Ų12795.1 Ų95.159%0.59351%0.514SS*.Hα-helixtrans-64.3-44.4173.4-176.1174.4-174.800111.4A8 G9 F14 L15 N16A8-E12 PolarHBondContact O-N 2.94Å; G9-E12 PolarHBondContact O-N 2.78Å; E12-F14 VanDerWaalsContact C-N 3.27Å; E12-F14 PolarHBondContact O-N 2.76Å; E12-L15 PolarHBondContact O-N 3.02Å; E12-N16 WeakPolarHBondContact O-CB 3.13Å; E12-N16 PolarHBondContact O-N 3.43Å; E12-N16 PolarHBondContact O-ND2 2.82Å
13D85.3Confident79.5Confident87 Ų8793.5 Ų93.547%0.46551%0.506SS..Hα-helixtrans-59-37.2172.7-124.536.7000112.6G9 K17G9-D13 WeakPolarHBondContact O-CB 3.44Å; G9-D13 PolarHBondContact O-N 2.82Å; D13-K17 WeakPolarHBondContact O-CB 3.45Å; D13-K17 VanDerWaalsContact O-CD 3.27Å; D13-K17 WeakPolarHBondContact O-CD 3.19Å; D13-K17 VanDerWaalsContact O-CG 3.24Å; D13-K17 WeakPolarHBondContact O-CG 3.31Å; D13-K17 PolarHBondContact O-N 2.94Å; D13-K17 IonicContact OD2-NZ 3.66Å; D13-K17 PolarHBondContact OD2-NZ 3.1Å
14F87.8Confident79.9Confident143 Ų14389.3 Ų89.363%0.62750%0.5SS*.Hα-helixtrans-71.8-43.6175.6-175.1-97000111.4K10 A11 E12 K17 V18K10-F14 WeakPolarHBondContact O-CB 3.29Å; K10-F14 PolarHBondContact O-N 2.7Å; K10-F14 VanDerWaalsContact O-N 3.11Å; A11-F14 PolarHBondContact O-N 3.47Å; E12-F14 VanDerWaalsContact C-N 3.27Å; E12-F14 PolarHBondContact O-N 2.76Å; F14-K17 PolarHBondContact O-N 2.97Å; F14-V18 HydrophobicContact CD1-CG2 4.1Å; F14-V18 HydrophobicContact CE1-CG2 3.73Å; F14-V18 HydrophobicContact CZ-CG2 4.04Å; F14-V18 WeakPolarHBondContact O-CG2 3.26Å; F14-V18 PolarHBondContact O-N 3.04Å
15L85.9Confident80.3Confident110 Ų11085.6 Ų85.658%0.57649%0.493SS*.Hα-helixtrans-61.4-46.6177.1-146.381.6000111.2A11 E12 K17 V18 D19A11-L15 PolarHBondContact O-N 3.34Å; E12-L15 PolarHBondContact O-N 3.02Å; L15-K17 VanDerWaalsContact C-N 3.28Å; L15-K17 PolarHBondContact O-N 3.48Å; L15-V18 PolarHBondContact O-N 3.25Å; L15-V18 VanDerWaalsContact O-N 3.09Å; L15-D19 PolarHBondContact O-N 2.92Å
16N85.8Confident79.6Confident77 Ų7786.8 Ų86.841%0.41250%0.496SS..Hα-helixtrans-59.5-36.7175.5-78.6-48.8000112.5E12 Q20E12-N16 WeakPolarHBondContact O-CB 3.13Å; E12-N16 PolarHBondContact O-N 3.43Å; E12-N16 PolarHBondContact O-ND2 2.82Å; N16-Q20 WeakPolarHBondContact O-CB 3.21Å; N16-Q20 VanDerWaalsContact O-CG 3.23Å; N16-Q20 WeakPolarHBondContact O-CG 3.3Å; N16-Q20 PolarHBondContact O-N 3.35Å
17K86.3Confident79.3Confident122 Ų12285.8 Ų85.853%0.5350%0.495SS..Hα-helixtrans-71.7-34.8174.4-74.4163.2-170145.70112.5D13 F14 L15 G21D13-K17 WeakPolarHBondContact O-CB 3.45Å; D13-K17 VanDerWaalsContact O-CD 3.27Å; D13-K17 WeakPolarHBondContact O-CD 3.19Å; D13-K17 VanDerWaalsContact O-CG 3.24Å; D13-K17 WeakPolarHBondContact O-CG 3.31Å; D13-K17 PolarHBondContact O-N 2.94Å; D13-K17 IonicContact OD2-NZ 3.66Å; D13-K17 PolarHBondContact OD2-NZ 3.1Å; F14-K17 PolarHBondContact O-N 2.97Å; L15-K17 VanDerWaalsContact C-N 3.28Å; L15-K17 PolarHBondContact O-N 3.48Å; K17-G21 PolarHBondContact O-N 3.12Å
18V86.8Confident78.5Confident71 Ų7189 Ų8943%0.4351%0.505SS..Hα-helixtrans-66.9-45.4173.1169.70000110.8F14 L15 G21 A22F14-V18 HydrophobicContact CD1-CG2 4.1Å; F14-V18 HydrophobicContact CE1-CG2 3.73Å; F14-V18 HydrophobicContact CZ-CG2 4.04Å; F14-V18 WeakPolarHBondContact O-CG2 3.26Å; F14-V18 PolarHBondContact O-N 3.04Å; L15-V18 PolarHBondContact O-N 3.25Å; L15-V18 VanDerWaalsContact O-N 3.09Å; V18-G21 CarbonylContact O-C 3.59Å; V18-G21 WeakPolarHBondContact O-CA 3.36Å; V18-G21 PolarHBondContact O-N 3.23Å; V18-G21 VanDerWaalsContact O-N 3.17Å; V18-A22 WeakPolarHBondContact O-CB 3.33Å; V18-A22 PolarHBondContact O-N 3.5Å
19D82.4Confident77.3Confident97 Ų9792.3 Ų92.352%0.51952%0.515SS..Hα-helixtrans-68.2-38.9178.6-80.3-4.8000112.3L15 G21 A22 A23L15-D19 PolarHBondContact O-N 2.92Å; D19-G21 VanDerWaalsContact C-N 3.32Å; D19-G21 PolarHBondContact O-N 3.19Å; D19-A22 PolarHBondContact O-N 3.43Å; D19-A23 VanDerWaalsContact O-CB 3.25Å; D19-A23 WeakPolarHBondContact O-CB 3.28Å; D19-A23 PolarHBondContact O-N 2.96Å
20Q79.8Confident75.9Confident130 Ų13098.6 Ų98.661%0.60754%0.536SS*.Hα-helixtrans-63.8-36.9169.8-73.9176.414.800112.1N16 T24N16-Q20 WeakPolarHBondContact O-CB 3.21Å; N16-Q20 VanDerWaalsContact O-CG 3.23Å; N16-Q20 WeakPolarHBondContact O-CG 3.3Å; N16-Q20 PolarHBondContact O-N 3.35Å; Q20-T24 WeakPolarHBondContact O-CB 3.41Å; Q20-T24 WeakPolarHBondContact O-CG2 3.25Å; Q20-T24 PolarHBondContact O-N 3.18Å; Q20-T24 PolarHBondContact O-OG1 3.41Å
21G81.2Confident74.3Confident36 Ų3696.1 Ų96.137%0.37154%0.538SS..Hα-helixtrans-64.5-42.7172.800000112.8K17 V18 D19 T24 A25K17-G21 PolarHBondContact O-N 3.12Å; V18-G21 CarbonylContact O-C 3.59Å; V18-G21 WeakPolarHBondContact O-CA 3.36Å; V18-G21 PolarHBondContact O-N 3.23Å; V18-G21 VanDerWaalsContact O-N 3.17Å; D19-G21 VanDerWaalsContact C-N 3.32Å; D19-G21 PolarHBondContact O-N 3.19Å; G21-T24 PolarHBondContact O-OG1 3.4Å; G21-A25 WeakPolarHBondContact O-CB 3.27Å; G21-A25 PolarHBondContact O-N 2.97Å
22A73.7Confident72.5Confident47 Ų4797.1 Ų97.139%0.38855%0.546SS..Hα-helixtrans-67.3-44.2176.300000111.7V18 D19 A25 L26V18-A22 WeakPolarHBondContact O-CB 3.33Å; V18-A22 PolarHBondContact O-N 3.5Å; D19-A22 PolarHBondContact O-N 3.43Å; A22-A25 PolarHBondContact O-N 3.39Å; A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.25Å
23A69.6Low70.4Confident58 Ų5894.5 Ų94.548%0.47955%0.554SS.*Hα-helixtrans-63.8-40.2176.900000112.3D19 L26 S27D19-A23 VanDerWaalsContact O-CB 3.25Å; D19-A23 WeakPolarHBondContact O-CB 3.28Å; D19-A23 PolarHBondContact O-N 2.96Å; A23-L26 PolarHBondContact O-N 2.88Å; A23-S27 PolarHBondContact O-N 3.34Å; A23-S27 PolarHBondContact O-OG 2.76Å
24T72.9Confident68.3Low86 Ų8694.8 Ų94.853%0.52856%0.562SS.*Hα-helixtrans-73.1-31.7175.250.30000113Q20 G21 S27 K28Q20-T24 WeakPolarHBondContact O-CB 3.41Å; Q20-T24 WeakPolarHBondContact O-CG2 3.25Å; Q20-T24 PolarHBondContact O-N 3.18Å; Q20-T24 PolarHBondContact O-OG1 3.41Å; G21-T24 PolarHBondContact O-OG1 3.4Å; T24-S27 PolarHBondContact O-OG 3.13Å; T24-K28 WeakPolarHBondContact O-CB 3.38Å; T24-K28 PolarHBondContact O-N 3.31Å
25A69.9Low66.1Low54 Ų5492.6 Ų92.645%0.44657%0.571SS.*Hα-helixtrans-66.1-40.7169.900000112.1G21 A22 N29G21-A25 WeakPolarHBondContact O-CB 3.27Å; G21-A25 PolarHBondContact O-N 2.97Å; A22-A25 PolarHBondContact O-N 3.39Å; A25-N29 PolarHBondContact O-N 2.72Å; A25-N29 VanDerWaalsContact O-N 3.13Å
26L61Low63.6Low126 Ų12696.5 Ų96.566%0.6658%0.584SS**Hα-helixtrans-65.5-46.7175.1-82.2161.8000112.2A22 A23 K28 N29 Q30A22-L26 WeakPolarHBondContact O-CB 3.47Å; A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.25Å; A23-L26 PolarHBondContact O-N 2.88Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 2.77Å; L26-N29 PolarHBondContact O-N 3.45Å; L26-Q30 PolarHBondContact O-N 2.61Å
27S63.1Low61Low67 Ų6798.5 Ų98.547%0.46960%0.604SS.*Hα-helixtrans-64.8-36.9177.7710000112.2A23 T24 Q30 A31A23-S27 PolarHBondContact O-N 3.34Å; A23-S27 PolarHBondContact O-OG 2.76Å; T24-S27 PolarHBondContact O-OG 3.13Å; S27-Q30 PolarHBondContact O-N 2.8Å; S27-A31 WeakPolarHBondContact O-CB 3.37Å; S27-A31 PolarHBondContact O-N 2.82Å
28K59.9Low58.4Low163 Ų163100.6 Ų100.671%0.70962%0.62SS**Hα-helixtrans-65-37.7176-170.6171.1-175.7175.70113T24 L26 A32T24-K28 WeakPolarHBondContact O-CB 3.38Å; T24-K28 PolarHBondContact O-N 3.31Å; L26-K28 VanDerWaalsContact C-N 3.33Å; L26-K28 PolarHBondContact O-N 2.77Å; K28-A32 PolarHBondContact O-N 3.35Å
29N52.2Low57Low128 Ų128102.4 Ų102.468%0.68463%0.633SS**Hα-helixtrans-70.9-35.3172-86.7-25000112.4A25 L26 A32A25-N29 PolarHBondContact O-N 2.72Å; A25-N29 VanDerWaalsContact O-N 3.13Å; L26-N29 PolarHBondContact O-N 3.45Å; N29-A32 PolarHBondContact O-N 3.23Å
30Q52.9Low54.5Low163 Ų163108.3 Ų108.376%0.76265%0.649SS**Hα-helixtrans-69.9-37178.1-161.2170.197.600112.1L26 S27 A32 G33L26-Q30 PolarHBondContact O-N 2.61Å; S27-Q30 PolarHBondContact O-N 2.8Å; Q30-A32 VanDerWaalsContact C-N 3.31Å; Q30-A32 PolarHBondContact O-N 2.81Å; Q30-G33 PolarHBondContact O-N 2.86Å
31A49.6Very low52.2Low70 Ų70105 Ų10558%0.57965%0.651SS**Hα-helixtrans-68.7-24174.600000113.9S27 G33S27-A31 WeakPolarHBondContact O-CB 3.37Å; S27-A31 PolarHBondContact O-N 2.82Å; A31-G33 VanDerWaalsContact C-N 3.3Å; A31-G33 PolarHBondContact O-N 3Å
32A47.9Very low49.9Very low77 Ų77111.6 Ų111.664%0.63667%0.672SS**Hα-helixtrans-74.8-17.8176.400000113.4K28 N29 Q30K28-A32 PolarHBondContact O-N 3.35Å; N29-A32 PolarHBondContact O-N 3.23Å; Q30-A32 VanDerWaalsContact C-N 3.31Å; Q30-A32 PolarHBondContact O-N 2.81Å
33G44.3Very low47.8Very low73 Ų73117.7 Ų117.775%0.75369%0.692SS**THydrogen-bonded Turntrans-87.5-4.6-176.100000116Q30 A31Q30-G33 PolarHBondContact O-N 2.86Å; A31-G33 VanDerWaalsContact C-N 3.3Å; A31-G33 PolarHBondContact O-N 3Å
34S40.9Very low45.9Very low92 Ų92119.8 Ų119.864%0.64370%0.703SS**  trans-125.819-167.153.50000115F36S34-F36 VanDerWaalsContact C-N 3.34Å; S34-F36 PolarHBondContact O-N 3.25Å
35A41.2Very low43.9Very low97 Ų97120 Ų12080%0.80271%0.713SS**  trans-76.969-176.400000114.4
36F34.6Very low42Very low193 Ų193123.6 Ų123.685%0.84673%0.73SS**  trans-145.375.2165.8-165.7-96.4000113.7S34S34-F36 VanDerWaalsContact C-N 3.34Å; S34-F36 PolarHBondContact O-N 3.25Å
37S30.9Very low40.6Very low119 Ų119123.4 Ų123.483%0.83273%0.734SS**  trans177.1159141.735.80000111.8
38L32.6Very low39.1Very low166 Ų166126.6 Ų126.687%0.86975%0.746SS**  trans-142.9161.3178.9-79.2166.5000107.3
39P56.7Low37.7Very low109 Ų109129.2 Ų129.271%0.70875%0.753SS**  cis-137.5-155.5-30.838.7-19.9000111.5
40Y29.9Very low37.3Very low220 Ų220129.8 Ų129.886%0.86376%0.756SS**  trans97.3143.9149.9-136.7-89.1000119.9
41G31.3Very low36.8Very low62 Ų62127.4 Ų127.464%0.63975%0.754SS**  trans77.7117.2173.700000114.5
42E32.1Very low36Very low173 Ų173128.3 Ų128.381%0.80876%0.762SS**  cis87123.833.9-165.9163.3-133.900114.6
43E30.7Very low35.2Very low175 Ų175128.8 Ų128.882%0.81877%0.766SS**  trans51.5152.8171.2-72.7-164.4144.100118.9
44S29.9Very low34.7Very low102 Ų102135 Ų13571%0.71377%0.768SS**  cis170.6164.1-23.2-97.60000105.6
45A30.8Very low34.3Very low90 Ų90139.4 Ų139.474%0.74478%0.776SS**  trans73.5112.3160.500000121
46V30.7Very low33.9Very low131 Ų131139.7 Ų139.779%0.79477%0.767SS**  54.5119.6123.2-175.10000119.2
47T31Very low33.6Very low121 Ų121139 Ų13974%0.74277%0.767SS**  -168.1149.7103.1-620000110
48D30.6Very low33.7Very low134 Ų134142.6 Ų142.672%0.71777%0.767SS**  trans-56156.3169.2-58.4-91.1000113.4
49Y31.3Very low33.6Very low219 Ų219138.8 Ų138.886%0.85976%0.76SS**  -173.1125.7104.6-113.3-82.2000111.4
50N43.8Very low32.4Very low139 Ų139139.2 Ų139.274%0.74376%0.761SS**  trans-112.3131.4164-179.94.5000108.1A52N50-A52 PolarHBondContact OD1-N 2.87Å
51P41.9Very low32.5Very low113 Ų113135.7 Ų135.773%0.73476%0.762SS**  trans-129.1128.7144.632.7-20.6000112.3
52A33Very low32.4Very low89 Ų89139.9 Ų139.974%0.73677%0.765SS**  trans-76148.5176.300000112.9N50N50-A52 PolarHBondContact OD1-N 2.87Å
53A31.9Very low32.4Very low87 Ų87139.6 Ų139.672%0.71976%0.763SS**  trans-154.698.3161.700000113.9
54Y33.3Very low32.2Very low203 Ų203135 Ų13580%0.79676%0.763SS**  trans45.3129.4133.5-61.9-65.1000123.7
55K33.2Very low32.4Very low186 Ų186140 Ų14081%0.80977%0.767SS**  trans72.5157.9134.3-68.9-178.8179.5-178.30117.8
56T31.4Very low33.4Very low102 Ų102141 Ų14163%0.62677%0.766SS**  cis-165.1153.6-18.8-97.80000109.9
57E29.2Very low33.5Very low179 Ų179140.3 Ų140.384%0.83677%0.767SS**  trans80.4157.3157.3-95.1161.6-125.400124.6
58K32.5Very low33.7Very low194 Ų194138.9 Ų138.984%0.84376%0.762SS**  trans-63.1170.4172.3-51.7157.4179.8170.50109.7
59A30.6Very low33.9Very low86 Ų86143.5 Ų143.571%0.71177%0.77SS**  cis-166.6158.931.900000114.4
60V31.4Very low34Very low119 Ų119139.8 Ų139.872%0.72177%0.765SS**  trans23.8118.7138.8-174.90000119.4
61T31.5Very low33.6Very low145 Ų145137.2 Ų137.289%0.8976%0.763SS**  -156.9170.6125.4-7.70000112.5
62H30.2Very low34.2Very low151 Ų151137.7 Ų137.770%0.69977%0.766SS**  trans-115.5171.8-166.6-86-134.5000114.4
63H31.9Very low34.1Very low167 Ų167138.2 Ų138.277%0.77376%0.764SS**  trans88.2136.2153-61.9-65000120
64G26.6Very low34.3Very low79 Ų79144 Ų14481%0.81477%0.769SS**  trans173.962-178.300000114.3
65Y34.4Very low34.5Very low205 Ų205141.2 Ų141.280%0.80477%0.766SS**  trans-64.6179.3173.7-85.7-67000114.3
66P52Low34.4Very low111 Ų111137.6 Ų137.672%0.72176%0.764SS**  cis-141.2-169.3-25.833.3-11.6000115.3
67S31.9Very low34.5Very low117 Ų117137.4 Ų137.482%0.81877%0.774SS**  trans92.5156.6136.7-158.80000120.5
68S35.2Very low35Very low91 Ų91133.5 Ų133.564%0.63677%0.771SS**  cis-178.3141.8-44.1-166.60000110.7
69R34.5Very low35.1Very low231 Ų231129.4 Ų129.487%0.87277%0.774SS**  trans164.2129.8154-97170.8142.7118-1.2108.1
70D34.5Very low35.2Very low141 Ų141128.4 Ų128.475%0.75477%0.772SS**  cis74.6129.848.3-63.4-44000114.3
71A35.2Very low35.4Very low86 Ų86130.7 Ų130.771%0.71178%0.78SS**  cis-157.6-140.2-900000111.7
72P53.2Low35.5Very low122 Ų122130.3 Ų130.379%0.79278%0.777SS**  -132.5175.8-119.341.5-22000117.6
73S31.8Very low35.6Very low101 Ų101132.3 Ų132.371%0.70678%0.784SS**  trans-171.8120.6148.7-173.10000114.6
74Y36.4Very low35.8Very low208 Ų208134 Ų13482%0.81679%0.789SS**  trans19.3152.3138.4-53.6-65.8000122.5
75I36Very low36.1Very low144 Ų144136.1 Ų136.174%0.73879%0.791SS**  cis-160.5169.98.4-129.6161.9000112.8
76S32.6Very low35.9Very low110 Ų110132.2 Ų132.277%0.76979%0.794SS**  trans69.6136.2168.9-73.60000119.2
77A33.5Very low34.9Very low99 Ų99131.9 Ų131.982%0.81880%0.801SS**  cis136.193.9-19.600000113.4
78A38.4Very low34.9Very low96 Ų96132.3 Ų132.379%0.79380%0.798SS**  trans-171.7103.5151.300000106.6
79A35.8Very low34.9Very low109 Ų109135.4 Ų135.490%0.90181%0.807SS**  58.5114.170.900000113.2
80G31.9Very low34.9Very low64 Ų64132.6 Ų132.666%0.6681%0.808SS**  cis143.7117.3-14.200000114.3
81N35.4Very low34.9Very low167 Ų167131 Ų13189%0.89382%0.815SS**  trans66170.8172.6-55.2-40.6000114.1
82V33.7Very low34.8Very low137 Ų137129.8 Ų129.883%0.8381%0.811SS**  cis-137.6146.914.4-158.60000114.3
83K33.6Very low33.9Very low193 Ų193131 Ų13184%0.83982%0.816SS**  trans-39.2152.6159.9-123.6165.4178.1172.30116.8
84K36.3Very low33.9Very low202 Ų202130.4 Ų130.488%0.87882%0.817SS**  trans-17.6138.4158.4-55.5177.2176.9-1750118.3
85S32Very low33.8Very low124 Ų124128.1 Ų128.187%0.86782%0.819SS**  trans-159.5157.813655.10000111.7
86S31.1Very low33.8Very low124 Ų124127.5 Ų127.587%0.86782%0.822SS**  trans-91157.1-179.6-47.60000112.5
87A30.7Very low34.6Very low104 Ų104128.1 Ų128.186%0.8682%0.823SS**  trans-142.2155.1163.100000110.8
88T32.3Very low34.7Very low125 Ų125128.1 Ų128.177%0.76782%0.817SS**  trans-120.2171.5-169.3-51.30000110.6
89L34.3Very low34.7Very low156 Ų156130.3 Ų130.382%0.81782%0.816SS**  trans81146.7178.8-44.2172000112.4
90L35Very low35.5Very low172 Ų172129.6 Ų129.690%0.90180%0.801SS**  cis-127.6-174.721.4-79.8161.7000113.7
91A33.3Very low35.6Very low108 Ų108132.5 Ų132.589%0.89381%0.812SS**  trans-122.7161.5-170.200000115
92G32.7Very low35.3Very low60 Ų60128.5 Ų128.562%0.61981%0.81SS**  trans161.2115170.500000108.7
93T35.2Very low35.3Very low149 Ų149128.2 Ų128.291%0.91481%0.814SS**  57.1127.168.471.80000112.8
94A31.8Very low35.2Very low87 Ų87122.7 Ų122.772%0.71981%0.812SS**  cis-158.1175.817.700000115
95N33.8Very low35.2Very low161 Ų161120 Ų12086%0.86181%0.812SS**  trans72.6132.1153.4-74.516.3000122.9
96V35.7Very low35.4Very low131 Ų131119.8 Ų119.879%0.79481%0.811SS**  trans-116.1156.8162.8170.50000107.1
97P49.3Very low35.7Very low122 Ų122121.5 Ų121.579%0.79281%0.81SS**  trans-125.1144.8141.135.6-27.9000112.9
98S37.1Very low36.7Very low99 Ų99122.2 Ų122.269%0.69281%0.806SS**  trans-79.6178.9166.557.20000110.2
99N37.7Very low36.6Very low143 Ų143121.2 Ų121.277%0.76581%0.811SS**  cis-172.2-166.429.7-136.67.5000107.2
100P53.8Low36.8Very low93 Ų93123.4 Ų123.460%0.60481%0.813SS**  cis-130.4-176.3-49.336.2-18.8000114.3
101S32.5Very low36.6Very low125 Ų125122.4 Ų122.487%0.87482%0.815SS**  trans74.7126147.2-630000121.6
102G30.3Very low36.6Very low83 Ų83122.4 Ų122.486%0.85681%0.808SS**  trans167.699.3165.100000112
103S34.1Very low37Very low132 Ų132124.7 Ų124.792%0.92382%0.821SS**  trans-93.1144.7-176.246.60000113.3
104G31Very low36.8Very low77 Ų77121.4 Ų121.479%0.79482%0.817SS**  trans-169.6122172.800000112.2
105V36.6Very low36.9Very low144 Ų144126.2 Ų126.287%0.87382%0.822SS**  trans-124.1132-178.2172.90000109.6
106S34.5Very low36.8Very low121 Ų121125.1 Ų125.185%0.84682%0.821SS**  trans174.8167.1141.239.40000111.7
107N37.2Very low36.9Very low160 Ų160128.9 Ų128.986%0.85682%0.821SS**  trans-108.3169.9-167.6-114.7-5.7000112.7
108P52.8Low36.5Very low119 Ų119128.5 Ų128.577%0.77382%0.818SS**  trans-86.6162.6-165.435-37.7000115
109A31.1Very low36.5Very low104 Ų104133.6 Ų133.686%0.8683%0.828SS**  trans-137.5149.4168.600000111.9
110K36.5Very low36.5Very low201 Ų201134.3 Ų134.387%0.87482%0.824SS**  trans-86.4152.2175.2-56.5169.5-179.2173.90110.4
111T32.5Very low35.5Very low152 Ų152135.3 Ų135.393%0.93383%0.833SS**  trans-162.4173.4139.812.30000111.4
112S32.3Very low35.9Very low107 Ų107136.5 Ų136.575%0.74883%0.825SS**  trans-131.7149.5-158.4550000115.1
113A41.3Very low36Very low108 Ų108142 Ų14289%0.89383%0.829SS**  trans63.5142.3151.100000120
114G30.4Very low36.3Very low81 Ų81143.4 Ų143.484%0.83583%0.826SS**  trans170.2111170.200000112.8
115F33.6Very low36.8Very low188 Ų188145.9 Ų145.983%0.82583%0.825SS**  trans-116.3126.8176.9171.9-85.7000109.6
116V32.6Very low37Very low137 Ų137144.8 Ų144.883%0.8381%0.814SS**  trans-142.8148.1-178.7-176.50000110.9
117R38.8Very low37.5Very low211 Ų211145 Ų14580%0.79681%0.806SS**  trans-148.5127.8-175.9177.3-166.3-172.9-173.36.4112
118P40.4Very low38.2Very low113 Ų113144 Ų14473%0.73480%0.801SS**  trans-107.1152.4151.733.4-23.6000110.8
119K36Very low38Very low207 Ų207145.7 Ų145.790%0.980%0.8SS**  cis106.1156.124.8-89.1-94.2-177.8168.30113.1
120K39.3Very low38.9Very low157 Ų157145.9 Ų145.968%0.68379%0.786SS**  trans-132.8153.7-149179.4-161.8176.5-1610110.5E122K120-E122 HydrophobicContact CD-CG 4.37Å; K120-E122 IonicContact NZ-OE1 3.65Å; K120-E122 PolarHBondContact NZ-OE1 3.28Å
121S30.9Very low39.3Very low114 Ų114142.6 Ų142.680%0.79777%0.772SS**  trans-129166.1161.353.20000111.3
122E40.9Very low39.9Very low150 Ų150142.1 Ų142.170%0.70176%0.764SS**  trans-139.6157.7-169.4-70.8156.4148.100109.6K120K120-E122 HydrophobicContact CD-CG 4.37Å; K120-E122 IonicContact NZ-OE1 3.65Å; K120-E122 PolarHBondContact NZ-OE1 3.28Å
123E34.1Very low40.7Very low199 Ų199145 Ų14593%0.9376%0.763SS**  trans-159.6138.3160.7-118.6165.917900109.8
124D40.6Very low41.3Very low162 Ų162145.5 Ų145.587%0.86675%0.751SS**  trans-105.3145.5-175.8-65.5-55.4000111.8
125V39.6Very low41.9Very low129 Ų129147.9 Ų147.978%0.78274%0.744SS**  trans-150.9122.4156.3-172.50000112
126D40.6Very low41.9Very low120 Ų120143.4 Ų143.464%0.64274%0.736SS**  trans42.1101.1154.7-50.8-15.1000122.5
127D46.4Very low42.2Very low126 Ų126141.9 Ų141.967%0.67473%0.731SS**SBendtrans-80.5-23.2162.3-85.3-47.9000113.9M129 L130D127-M129 VanDerWaalsContact C-N 3.3Å; D127-M129 PolarHBondContact O-N 3.45Å; D127-L130 VanDerWaalsContact O-CB 3.24Å; D127-L130 WeakPolarHBondContact O-CB 3.44Å; D127-L130 PolarHBondContact O-N 3.45Å
128D51.3Low41.8Very low140 Ų140139.5 Ų139.575%0.74973%0.734SS**Hα-helixtrans-65.4-26.9-165.4-77.1-25.8000114.2L130D128-L130 PolarHBondContact O-N 2.83Å
129M48.1Very low42.5Very low153 Ų153139.3 Ų139.375%0.75473%0.733SS**Hα-helixtrans-69.6-14.9174-72.9-168.3-71.800113.6D127D127-M129 VanDerWaalsContact C-N 3.3Å; D127-M129 PolarHBondContact O-N 3.45Å
130L49.9Very low42.9Very low109 Ų109134.4 Ų134.457%0.57172%0.722SS**Hα-helixtrans-81.4-27.5-177-147.974.7000112.7D127 D128 L134D127-L130 VanDerWaalsContact O-CB 3.24Å; D127-L130 WeakPolarHBondContact O-CB 3.44Å; D127-L130 PolarHBondContact O-N 3.45Å; D128-L130 PolarHBondContact O-N 2.83Å; L130-L134 WeakPolarHBondContact O-CG 3.23Å
131F45.8Very low42.4Very low131 Ų131134.5 Ų134.558%0.57573%0.731SS**Hα-helixtrans-75.7-32.7-175.6-81.4-83.1000114.1L134 N135F131-L134 PolarHBondContact O-N 2.84Å; F131-N135 PolarHBondContact O-ND2 3.45Å
132D44.1Very low42.5Very low142 Ų142134.5 Ų134.576%0.75973%0.73SS**Hα-helixtrans-69.9-33.5175.5-90.8-0.7000112.1L134D132-L134 VanDerWaalsContact C-N 3.32Å; D132-L134 PolarHBondContact O-N 3.46Å
133F50Low42Very low168 Ų168130.9 Ų130.974%0.73773%0.733SS**Hα-helixtrans-66.6-33.6177.3-170.4-101.8000112.6N135F133-N135 PolarHBondContact O-N 2.81Å
134L52.9Low41.8Very low119 Ų119127.6 Ų127.662%0.62373%0.732SS**THydrogen-bonded Turntrans-80.1-10.1-175.6-70.5170.3000114.8L130 F131 D132L130-L134 WeakPolarHBondContact O-CG 3.23Å; F131-L134 PolarHBondContact O-N 2.84Å; D132-L134 VanDerWaalsContact C-N 3.32Å; D132-L134 PolarHBondContact O-N 3.46Å
135N43.2Very low41.2Very low130 Ų130125.4 Ų125.470%0.69573%0.73SS**THydrogen-bonded Turntrans-104.37.1-172.1-82.1-56.4000115.3F131 F133F131-N135 PolarHBondContact O-ND2 3.45Å; F133-N135 PolarHBondContact O-N 2.81Å
136S33.7Very low40.8Very low94 Ų94130.3 Ų130.366%0.65773%0.734SS**  trans-103.5132.3172.6640000111.2
137S39.3Very low40.4Very low105 Ų105135.4 Ų135.473%0.73474%0.744SS**  trans-138.3119-173.3-65.20000111.3
138D31.7Very low39.5Very low161 Ų161136 Ų13686%0.86175%0.747SS**  -178.2161126.5-99.5-17.9000112.9
139P54.9Low38.6Very low109 Ų109134.2 Ų134.271%0.70875%0.746SS**  trans-89.2-174-177.441.3-39.5000111.9
140P43.2Very low37.7Very low104 Ų104139 Ų13968%0.67576%0.756SS**  cis-152.8-17022.745.2-22.5000119.8
141D28.3Very low36.9Very low160 Ų160144.2 Ų144.286%0.85677%0.768SS**  trans79.3172.2142.9-77-19.1000122.9
142S34Very low36.1Very low113 Ų113146.1 Ų146.179%0.7978%0.779SS**  trans-125.4138.6-144.163.90000115.6
143G30.3Very low35.3Very low74 Ų74147.1 Ų147.176%0.76378%0.783SS**  trans112.7147.2131.400000119.1
144S29.9Very low35.1Very low130 Ų130144 Ų14491%0.90978%0.78SS**  trans79.4153.3158.9-155.70000120.1
145S28.1Very low33.9Very low116 Ų116147.7 Ų147.781%0.81179%0.791SS**  trans91.6164.7161.3-146.60000119.9
146R30.2Very low33Very low233 Ų233145.9 Ų145.988%0.87979%0.794SS**  trans-96.7-179.9-166.1-64.3165.7164.5166.7-7.1111.5
147R32.7Very low33.5Very low226 Ų226146.8 Ų146.885%0.85380%0.797SS**  trans-2.5141.9149.3-73.7-174.6-178.5170-2116.1
148D28.4Very low32.9Very low138 Ų138147.6 Ų147.674%0.73880%0.798SS**  cis-157.3-167.943.6-137.2-51.8000114.9
149S32.5Very low32.8Very low103 Ų103147.1 Ų147.172%0.7279%0.792SS**  trans-95.7128.3-164.2-42.40000113.9
150R28.3Very low31.6Very low253 Ų253149.2 Ų149.296%0.95579%0.793SS**  trans-158158.9149.3-133.3177.1179-164.2-3.9114
151R34.1Very low30.8Very low220 Ų220149.2 Ų149.283%0.8379%0.79SS**  trans-110.6179.2178.4-152.8-178.2-164.2170.33.5109.6
152E28Very low30.9Very low170 Ų170149.6 Ų149.679%0.79479%0.786SS**  trans101.3148.8169.2-51.5-70.4107.500116.8
153L28.1Very low30.5Very low164 Ų164148.9 Ų148.986%0.85978%0.781SS**  trans-122.5-179.6-176.6-104.877.2000108.5
154P44.5Very low31.2Very low103 Ų103150.9 Ų150.967%0.66978%0.781SS**  cis-136.2-168.1-17.434.9-13.5000114.8
155K28.2Very low31.3Very low196 Ų196150.8 Ų150.885%0.85278%0.775SS**  trans75.3100.2156.4-70.7-180176.4179.80121.6
156A25.2Very low32.3Very low91 Ų91150.5 Ų150.575%0.75277%0.771SS**  33.515510700000122.3
157P42.8Very low33.6Very low113 Ų113144.7 Ų144.773%0.73476%0.763SS**  cis-148.6-176.8-23.939.7-19.4000117.6
158V28Very low34.4Very low123 Ų123139 Ų13975%0.74576%0.755SS**  trans85.7143141147.40000123.3
159M29.9Very low34.5Very low151 Ų151137.3 Ų137.374%0.74475%0.754SS**  trans68.8120.3163.1-84.1159.187.900118.4
160E28Very low34.5Very low153 Ų153138.9 Ų138.972%0.71576%0.759SS**  110.1156.175.4-96.8-160.8135.600110.7
161V28.3Very low34.8Very low103 Ų103132.5 Ų132.562%0.62475%0.749SS**  cis-168.1173.1-17.869.80000110.9
162H29.5Very low35.5Very low168 Ų168127 Ų12778%0.77874%0.741SS**  trans81.8144.3157-83.768.4000123
163S25.4Very low35.8Very low98 Ų98127.1 Ų127.169%0.68574%0.741SS**  trans-86.4-170.4171.657.40000112.7
164P45.8Very low36Very low117 Ų117123 Ų12376%0.7673%0.731SS**  cis-139.1-1613.537.5-13.2000116.3
165T30.6Very low35.1Very low128 Ų128124.4 Ų124.479%0.78573%0.733SS**  trans-62.8179.7175.723.10000117.2
166P49.8Very low35.2Very low110 Ų110122.2 Ų122.271%0.71473%0.73SS**  cis-130.8-128.3-2337.1-15.4000110.2
167P58.2Low35.6Very low111 Ų111123.3 Ų123.372%0.72173%0.732SS**  -103.8-135.3-61.338.2-20.4000109.8
168P47.9Very low35Very low105 Ų105122.3 Ų122.368%0.68273%0.733SS**  cis-134.7169.8-26.141-23.3000117.7
169S31.6Very low35.8Very low103 Ų103121.9 Ų121.972%0.7273%0.733SS**  trans23.4136.5145.667.30000125.2
170V31.9Very low35.8Very low136 Ų136120 Ų12082%0.82474%0.735SS**  -147.1138.7104.1174.10000110.1
171T36.1Very low36.2Very low120 Ų120119 Ų11974%0.73674%0.739SS**  trans-132.6147.4165.754.40000109.5
172P46.9Very low37.8Very low103 Ų103119.9 Ų119.967%0.66975%0.747SS**  -147.2169.1108.831.3-12.8000112.8
173H35.5Very low38.7Very low173 Ų173117.2 Ų117.280%0.80174%0.744SS**  cis-176.3176.1-13.3-95.8-27.3000105.7
174A31.1Very low38.9Very low77 Ų77117.3 Ų117.364%0.63675%0.745SS**  cis-177.3158.5-19.600000104.6
175N27.2Very low38.3Very low133 Ų133117.9 Ų117.971%0.71175%0.747SS**  cis-153.3171-6.2-102.72.5000105.9
176L29.7Very low38.4Very low151 Ų151123.6 Ų123.679%0.79175%0.754SS**  cis64.4133.949.4-48.2177.4000112.9
177S32.8Very low37.4Very low114 Ų114121.6 Ų121.680%0.79775%0.753SS**  cis-150.7175.825.7-61.60000114.5
178A30.7Very low36.3Very low92 Ų92122.6 Ų122.676%0.7676%0.757SS**  trans-85.2-161.1166.300000111
179P44.8Very low35.5Very low114 Ų114122.6 Ų122.674%0.7476%0.759SS**  cis-143.9-167.85.543.8-23.1000117
180S30.5Very low35.8Very low111 Ų111128.6 Ų128.678%0.77677%0.766SS**  trans123.8150.2151-50.80000117.2
181T36.1Very low35.7Very low133 Ų133126.4 Ų126.482%0.81676%0.762SS**  trans-153.4173.7-174.854.90000111.6
182P61.2Low35.5Very low120 Ų120125.9 Ų125.978%0.77976%0.764SS**  cis-108.9-96.3-1928.6-7.6000110.9
183P48.4Very low34.9Very low112 Ų112126 Ų12673%0.72777%0.767SS**  cis-124.5146.3-1637.8-19.6000117.4
184S30.6Very low34.8Very low101 Ų101125.7 Ų125.771%0.70677%0.768SS**  trans38.2105.7149.8-138.30000124.2
185T32Very low34.7Very low128 Ų128126.7 Ų126.779%0.78577%0.77SS**  46.1137.1124.967.10000124.1
186R32.9Very low34.8Very low249 Ų249126.1 Ų126.194%0.9478%0.777SS**  120.9110.4127.6-164.9175.9-172.6156.91.9117.1
187G29.8Very low35Very low67 Ų67126.9 Ų126.969%0.69178%0.781SS**  trans173.291.1169.400000110.9
188V34.2Very low34.9Very low132 Ų132127.3 Ų127.380%0.878%0.783SS**  60.786.7100.2-179.10000111.8
189S32.3Very low34.8Very low105 Ų105126.3 Ų126.373%0.73478%0.776SS**  88.515478.4-66.90000114.7
190R38Very low34.1Very low229 Ų229129.4 Ų129.486%0.86478%0.78SS**  trans81.8146175.5-60.4176.6167-167.3-7.7115.5
191A29.6Very low34.1Very low90 Ų90129.5 Ų129.574%0.74478%0.78SS**  cis-160.5172.3-15.800000112.2
192S32.1Very low34.2Very low110 Ų110131.6 Ų131.677%0.76979%0.785SS**  trans-52.3166.6158.121.40000113.5
193S33.7Very low32.9Very low106 Ų106135.2 Ų135.274%0.74179%0.788SS**  cis-159.4142.7-2.9-102.20000108
194M33.7Very low32.1Very low165 Ų165135.9 Ų135.981%0.81379%0.79SS**  51.5129.693.9-79.4-67.5-71.300118.3
195S29.3Very low32Very low99 Ų99135.3 Ų135.369%0.69279%0.786SS**  trans81.6106.9154-60.90000121.5
196S28.7Very low31.9Very low121 Ų121137.8 Ų137.885%0.84679%0.789SS**  -150139.9115.4-78.10000110.3
197L33.5Very low31.7Very low167 Ų167133.7 Ų133.787%0.87478%0.781SS**  trans-146.1160.3-179-80176.4000109.9
198S29.9Very low31.8Very low122 Ų122137 Ų13785%0.85378%0.783SS**  trans77.3149.3171.3-45.70000115.9
199A30.3Very low31.7Very low72 Ų72135.8 Ų135.860%0.59578%0.78SS**  cis-168.6172.5-21.400000109.7
200H29.1Very low32Very low179 Ų179135 Ų13583%0.82978%0.78SS**  trans71.5129.9176.6-48-73.5000115.2
201S31.6Very low32Very low113 Ų113133 Ų13379%0.7978%0.777SS**  cis77.692.711.9-1590000117.6
202I37.8Very low31.9Very low177 Ų177136.3 Ų136.391%0.90878%0.777SS**  trans-140.6162.7149.5-50.7-178.9000107.5
203K33.5Very low32.3Very low196 Ų196139.3 Ų139.385%0.85278%0.779SS**  trans-139.6131.8-162163.5-163.2168.1-172.40113.2
204T30.6Very low32.3Very low126 Ų126138.4 Ų138.477%0.77377%0.773SS**  trans-158.6123.3161.839.70000106.8
205S29.7Very low32.4Very low88 Ų88138.3 Ų138.362%0.61577%0.77SS**  61.1134.174.471.30000113.4
206E30Very low32.8Very low181 Ų181139.2 Ų139.285%0.84677%0.767SS**  cis-164.8177.40.9-125.6162.8155.800111.6
207E28.6Very low33.1Very low163 Ų163139.6 Ų139.676%0.76277%0.765SS**  trans79.8118.1145.8-167.9149.2-158.300125
208N30.9Very low34.1Very low137 Ų137136.7 Ų136.773%0.73376%0.756SS**  trans46.7125.3138.4-64.4-27.2000127.6
209S33.1Very low34.2Very low106 Ų106139.6 Ų139.674%0.74176%0.756SS**  79.1102.7115-170.70000125.2
210A39Very low34.2Very low89 Ų89140.6 Ų140.674%0.73676%0.759SS**  66.9147.112500000124.5
211K36.6Very low34.5Very low187 Ų187137.5 Ų137.581%0.81376%0.757SS**  trans67.4163.5171.1-85.7179.5150.8-148.90115.7
212E28.9Very low34.4Very low159 Ų159139 Ų13974%0.74376%0.757SS**  cis-140.5-146.89.7-152.2143.2-134.300114
213Q39Very low34.5Very low173 Ų173135.4 Ų135.481%0.80875%0.747SS**  trans-147.2153.2-162.3-167.8-171.2-23.900113.9
214S35.3Very low34.4Very low87 Ų87128.9 Ų128.961%0.60874%0.735SS**  trans90136.4152.5-0.50000123.9
215Q35.8Very low34.6Very low163 Ų163131.4 Ų131.476%0.76274%0.743SS**  trans89.9112.9137.7-74.8-175.8-94.700125.6
216D36.4Very low34.5Very low117 Ų117131.4 Ų131.463%0.62675%0.748SS**  97.3128.6114.1-70.10.9000127.6
217T35.7Very low35.7Very low130 Ų130128.3 Ų128.380%0.79874%0.744SS**  trans73.2169.4145.860.50000120.4
218P54.8Low36.6Very low105 Ų105125.8 Ų125.868%0.68274%0.742SS**  cis-137.6-177.23.943.6-25.5000118.7
219E31.8Very low36.5Very low183 Ų183127 Ų12786%0.85574%0.743SS**  trans68.7154.5149.7-87178.4-160.600122.2
220S29.8Very low36.2Very low93 Ų93129.8 Ų129.865%0.6575%0.745SS**  cis-162.8150-4.6177.70000113.5
221S36.4Very low35.7Very low115 Ų115130.7 Ų130.780%0.80475%0.745SS**  trans55.3149157.1-70.60000122
222D29.7Very low35.3Very low145 Ų145126.6 Ų126.678%0.77574%0.74SS**  cis-176.6163.5-11.9-173.838000106.3
223S38.6Very low35.4Very low101 Ų101130.6 Ų130.671%0.70675%0.748SS**  cis-154.1-1683.5-136.30000108.3
224G31.1Very low35.9Very low59 Ų59126.8 Ų126.861%0.60874%0.739SS**  cis156.8150-3.100000113.6
225L35.4Very low35.8Very low178 Ų178131.2 Ų131.293%0.93275%0.75SS**  trans67145166.5-66.5165.6000119.1
226A28.4Very low36.4Very low88 Ų88128.2 Ų128.273%0.72774%0.744SS**  cis-151.81653.200000114.5
227P53.5Low36Very low116 Ų116128.9 Ų128.975%0.75375%0.753SS**  trans-105.3-155.4177.144.4-36.9000112.6
228P48.5Very low36Very low111 Ų111129.1 Ų129.172%0.72175%0.754SS**  cis-146.6-164.72.543.3-20.3000119.3
229Q29.4Very low35.5Very low162 Ų162129.6 Ų129.676%0.75776%0.757SS**  trans98.9108.2149.1-82.6-166.8-68.800126.2
230E26.5Very low35.4Very low165 Ų165125.8 Ų125.877%0.77175%0.747SS**  44.6128.7121-60.3-178.6117.200127.1
231S28.1Very low35.4Very low107 Ų107129.8 Ų129.875%0.74876%0.755SS**  132.1126.2113.2-154.10000122.1
232S27.8Very low35.2Very low101 Ų101132.6 Ų132.671%0.70676%0.755SS**  trans57.9106.8136.664.80000128.4
233R31.8Very low36.2Very low243 Ų243130 Ų13092%0.91775%0.747SS**  73.2-173.4116-123.6-161.8160.8173.3-5.4122.4
234P49.7Very low36.1Very low94 Ų94134.1 Ų134.161%0.6175%0.754SS**  -134.5178.2-12547.6-28.5000120.1
235E31.9Very low36.8Very low179 Ų179136.1 Ų136.184%0.83676%0.759SS**  trans40.4172.8147.5-91.4-168.5146.700123.5
236P49.5Very low37.6Very low100 Ų100136.8 Ų136.865%0.64976%0.758SS**  cis-137.8-152.9-26.132.9-7.5000114.8
237T28.6Very low38.8Very low131 Ų131139.7 Ų139.780%0.80476%0.759SS**  trans88.9172.9156.257.70000124.7
238V34.8Very low38.6Very low135 Ų135140.4 Ų140.482%0.81876%0.756SS**  trans-159172.3-155.9-85.30000110.2
239P44.2Very low38.9Very low115 Ų115140.2 Ų140.275%0.74776%0.757SS**  cis-134.8-140.533.929.6-0.2000114.6
240T30Very low40.1Very low104 Ų104136.4 Ų136.464%0.63875%0.749SS**  cis-164.7172.812.8-16.80000113.3
241E29.4Very low41.7Very low177 Ų177134.1 Ų134.183%0.82774%0.741SS**  trans37.1153.5148-77.4164.3-138.200124.1
242E32.3Very low43.4Very low173 Ų173138.7 Ų138.781%0.80874%0.742SS**  cis-152.9-141.6-23.9-154.2-163.1-138.600111.3
243P51.6Low45.2Very low91 Ų91139.4 Ų139.459%0.59174%0.737SS**  trans-122.4167-131.842.3-25.1000118.3
244Q36Very low47Very low187 Ų187133.5 Ų133.587%0.87472%0.72SS**  trans-160.5136.8132.7-111.6170.141.500111.3
245S46.4Very low47.9Very low101 Ų101133.3 Ų133.371%0.70671%0.714SS**  trans-126.7114.3-162460000113.9
246Q51Low49.9Very low193 Ų193130.4 Ų130.490%0.90270%0.7SS**SBendtrans-174.5-8.5144.6-104.4155.919.500115.8
247I54.5Low51.1Low149 Ų149130.8 Ų130.876%0.76470%0.696SS**SBendtrans-100.8-16-177.6-60.5174.1000113.5S249I247-S249 VanDerWaalsContact C-N 3.3Å; I247-S249 PolarHBondContact O-N 3.25Å; I247-S249 VanDerWaalsContact O-N 3.09Å
248L47.9Very low53.3Low131 Ų131128.8 Ų128.869%0.68668%0.68SS**THydrogen-bonded Turntrans-73.2-0.2-165.4-69.3171.7000117.3
249S55.1Low55.2Low106 Ų106130.9 Ų130.974%0.74167%0.673SS**THydrogen-bonded Turntrans-72.6-30-178.152.80000113.8I247I247-S249 VanDerWaalsContact C-N 3.3Å; I247-S249 PolarHBondContact O-N 3.25Å; I247-S249 VanDerWaalsContact O-N 3.09Å
250S55Low56.9Low83 Ų83130.2 Ų130.258%0.5866%0.664SS**THydrogen-bonded Turntrans-73.5-55.8-176.6171.50000112.9R252 L253S250-R252 PolarHBondContact O-N 2.87Å; S250-R252 VanDerWaalsContact O-N 3.14Å; S250-L253 PolarHBondContact O-N 3.46Å
251L60.5Low59.4Low117 Ų117131.6 Ų131.661%0.61366%0.663SS**Hα-helixtrans-63.6-22.4-173.8-9365.5000114.3L253 N255L251-L253 PolarHBondContact O-N 2.81Å; L251-N255 PolarHBondContact O-N 3.39Å
252R63Low61.8Low202 Ų202127.8 Ų127.876%0.76265%0.652SS**Hα-helixtrans-70.2-31.8-175-165.2177.2-176.8102.1-1.6112.9S250S250-R252 PolarHBondContact O-N 2.87Å; S250-R252 VanDerWaalsContact O-N 3.14Å
253L66.8Low64Low116 Ų116122.2 Ų122.261%0.60764%0.635SS**Hα-helixtrans-73.9-44.2-178.2-170.869.7000111.7S250 L251 N255 Q256 L257S250-L253 PolarHBondContact O-N 3.46Å; L251-L253 PolarHBondContact O-N 2.81Å; L253-N255 PolarHBondContact O-N 3.48Å; L253-Q256 PolarHBondContact O-N 2.83Å; L253-L257 PolarHBondContact O-N 3.02Å; L253-L257 VanDerWaalsContact O-N 3.12Å
254E68.7Low65.3Low119 Ų119121 Ų12156%0.55663%0.629SS**Hα-helixtrans-59.7-46.8178.6-175.8-179.6-177.500111.9Q256 L257 L258E254-Q256 PolarHBondContact O-N 2.68Å; E254-L257 PolarHBondContact O-N 3.47Å; E254-L258 HydrophobicContact CG-CD1 4.41Å; E254-L258 PolarHBondContact O-N 2.86Å; E254-L258 VanDerWaalsContact O-N 3.1Å
255N69.6Low67.6Low91 Ų91117.9 Ų117.949%0.48762%0.617SS.*Hα-helixtrans-65.5-24.5179.4-148.1-95.1000113.1L251 L253 R259L251-N255 PolarHBondContact O-N 3.39Å; L253-N255 PolarHBondContact O-N 3.48Å; N255-R259 WeakPolarHBondContact O-CG 3.33Å; N255-R259 PolarHBondContact OD1-NE 2.83Å
256Q74.1Confident69.2Low117 Ų117117.6 Ų117.655%0.54761%0.608SS.*Hα-helixtrans-79-36.8175.5-170.7170.7-1.700112L253 E254 N260L253-Q256 PolarHBondContact O-N 2.83Å; E254-Q256 PolarHBondContact O-N 2.68Å; Q256-N260 PolarHBondContact O-N 3.1Å
257L74.4Confident70.8Confident108 Ų108115.4 Ų115.457%0.56560%0.598SS**Hα-helixtrans-65.5-48.2175.3-73.2166000111.7L253 E254 R259 N260 E261L253-L257 PolarHBondContact O-N 3.02Å; L253-L257 VanDerWaalsContact O-N 3.12Å; E254-L257 PolarHBondContact O-N 3.47Å; L257-R259 VanDerWaalsContact C-N 3.26Å; L257-R259 PolarHBondContact O-N 2.81Å; L257-N260 WeakPolarHBondContact O-CB 3.31Å; L257-N260 PolarHBondContact O-N 3.21Å; L257-E261 PolarHBondContact O-N 2.93Å
258L73.9Confident72.3Confident89 Ų89114 Ų11447%0.46659%0.588SS.*Hα-helixtrans-58.8-35.5178.3-70170000112.8E254 E261 V262E254-L258 HydrophobicContact CG-CD1 4.41Å; E254-L258 PolarHBondContact O-N 2.86Å; E254-L258 VanDerWaalsContact O-N 3.1Å; L258-E261 PolarHBondContact O-N 2.91Å; L258-V262 WeakPolarHBondContact O-CB 3.29Å; L258-V262 WeakPolarHBondContact O-CG2 3.12Å; L258-V262 PolarHBondContact O-N 3.22Å
259R76.1Confident74.1Confident179 Ų179112.7 Ų112.768%0.67558%0.58SS**Hα-helixtrans-67.9-38.5174.8-74.4175.5-177.9-132.9-2.2112.6N255 L257 A263N255-R259 WeakPolarHBondContact O-CG 3.33Å; N255-R259 PolarHBondContact OD1-NE 2.83Å; L257-R259 VanDerWaalsContact C-N 3.26Å; L257-R259 PolarHBondContact O-N 2.81Å; R259-A263 VanDerWaalsContact O-CB 3.27Å; R259-A263 WeakPolarHBondContact O-CB 3.38Å; R259-A263 PolarHBondContact O-N 3.13Å
260N79.4Confident75.5Confident102 Ų102110.4 Ų110.455%0.54557%0.567SS.*Hα-helixtrans-68.4-39.4175.1-73-9.7000111.5Q256 L257 A263 S264Q256-N260 PolarHBondContact O-N 3.1Å; L257-N260 WeakPolarHBondContact O-CB 3.31Å; L257-N260 PolarHBondContact O-N 3.21Å; N260-A263 PolarHBondContact O-N 2.98Å; N260-S264 WeakPolarHBondContact O-CB 3.39Å; N260-S264 PolarHBondContact O-N 2.98Å
261E82.3Confident77Confident132 Ų132108.5 Ų108.562%0.61755%0.554SS**Hα-helixtrans-65.8-46.1177.2-171.5168.9-155.300111.6L257 L258 A263 S264 L265L257-E261 PolarHBondContact O-N 2.93Å; L258-E261 PolarHBondContact O-N 2.91Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 2.84Å; E261-S264 PolarHBondContact O-N 2.86Å; E261-L265 WeakPolarHBondContact O-CB 3.21Å; E261-L265 PolarHBondContact O-N 3.14Å
262V79Confident78.4Confident97 Ų97106.6 Ų106.659%0.58855%0.547SS*.Hα-helixtrans-62.6-39.3173.4170.70000111.9L258 N266L258-V262 WeakPolarHBondContact O-CB 3.29Å; L258-V262 WeakPolarHBondContact O-CG2 3.12Å; L258-V262 PolarHBondContact O-N 3.22Å; V262-N266 VanDerWaalsContact O-CB 3.25Å; V262-N266 WeakPolarHBondContact O-CB 3.43Å; V262-N266 PolarHBondContact O-N 2.93Å
263A78.8Confident79.6Confident56 Ų56101 Ų10146%0.46353%0.531SS..Hα-helixtrans-64.3-44.1175.200000111.9R259 N260 E261 N266 Q267R259-A263 VanDerWaalsContact O-CB 3.27Å; R259-A263 WeakPolarHBondContact O-CB 3.38Å; R259-A263 PolarHBondContact O-N 3.13Å; N260-A263 PolarHBondContact O-N 2.98Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 2.84Å; A263-N266 PolarHBondContact O-N 2.86Å; A263-Q267 WeakPolarHBondContact O-CB 3.39Å; A263-Q267 PolarHBondContact O-N 3.41Å
264S79.8Confident80.6Confident66 Ų66100.1 Ų100.146%0.46252%0.524SS..Hα-helixtrans-62.7-46.8175.9-168.10000111.5N260 E261 N266 Q267 E268N260-S264 WeakPolarHBondContact O-CB 3.39Å; N260-S264 PolarHBondContact O-N 2.98Å; E261-S264 PolarHBondContact O-N 2.86Å; S264-N266 VanDerWaalsContact C-N 3.31Å; S264-N266 PolarHBondContact O-N 2.93Å; S264-Q267 PolarHBondContact O-N 3.16Å; S264-E268 WeakPolarHBondContact O-CG 3.35Å; S264-E268 PolarHBondContact O-N 2.85Å
265L83.4Confident81.5Confident121 Ų121101 Ų10163%0.63452%0.522SS*.Hα-helixtrans-62.8-38178.4-163.584.1000111.7E261 E268 M269E261-L265 WeakPolarHBondContact O-CB 3.21Å; E261-L265 PolarHBondContact O-N 3.14Å; L265-E268 PolarHBondContact O-N 3.36Å; L265-M269 VanDerWaalsContact O-CB 3.26Å; L265-M269 WeakPolarHBondContact O-CB 3.47Å; L265-M269 PolarHBondContact O-N 2.68Å
266N81.1Confident82.4Confident95 Ų9599.2 Ų99.251%0.50852%0.52SS..Hα-helixtrans-71.8-35.2176.8-161.214.2000111.8V262 A263 S264 M269 A270V262-N266 VanDerWaalsContact O-CB 3.25Å; V262-N266 WeakPolarHBondContact O-CB 3.43Å; V262-N266 PolarHBondContact O-N 2.93Å; A263-N266 PolarHBondContact O-N 2.86Å; S264-N266 VanDerWaalsContact C-N 3.31Å; S264-N266 PolarHBondContact O-N 2.93Å; N266-M269 WeakPolarHBondContact OD1-CE 3.35Å; N266-A270 VanDerWaalsContact O-CB 3.31Å; N266-A270 WeakPolarHBondContact O-CB 3.26Å; N266-A270 PolarHBondContact O-N 3.43Å
267Q83.6Confident83.3Confident148 Ų14899.2 Ų99.269%0.69252%0.518SS*.Hα-helixtrans-67-41.6171.3-175.6174.1-1.500111.9A263 S264 A270 S271A263-Q267 WeakPolarHBondContact O-CB 3.39Å; A263-Q267 PolarHBondContact O-N 3.41Å; S264-Q267 PolarHBondContact O-N 3.16Å; Q267-A270 PolarHBondContact O-N 2.94Å; Q267-S271 WeakPolarHBondContact O-CB 3.45Å; Q267-S271 PolarHBondContact O-N 2.7Å
268E86.6Confident84Confident120 Ų12097.9 Ų97.956%0.56151%0.512SS*.Hα-helixtrans-62.7-48.4172.5-72.8-140.7136.100111S264 L265 A270 S271 V272S264-E268 WeakPolarHBondContact O-CG 3.35Å; S264-E268 PolarHBondContact O-N 2.85Å; L265-E268 PolarHBondContact O-N 3.36Å; E268-A270 VanDerWaalsContact C-N 3.33Å; E268-A270 PolarHBondContact O-N 2.85Å; E268-S271 CarbonylContact O-C 3.5Å; E268-S271 WeakPolarHBondContact O-CA 3.44Å; E268-S271 WeakPolarHBondContact O-CB 3.37Å; E268-S271 PolarHBondContact O-N 2.83Å; E268-S271 PolarHBondContact O-OG 2.82Å; E268-V272 WeakPolarHBondContact O-CG2 3.31Å; E268-V272 PolarHBondContact O-N 2.9Å
269M85.6Confident84.8Confident103 Ų10398.9 Ų98.951%0.50752%0.517SS..Hα-helixtrans-58.7-42.8177.1-175.5173.26500111.7L265 N266 S271 V272 I273L265-M269 VanDerWaalsContact O-CB 3.26Å; L265-M269 WeakPolarHBondContact O-CB 3.47Å; L265-M269 PolarHBondContact O-N 2.68Å; N266-M269 WeakPolarHBondContact OD1-CE 3.35Å; M269-S271 PolarHBondContact O-N 3.22Å; M269-V272 PolarHBondContact O-N 2.89Å; M269-I273 HydrophobicContact CG-CD1 3.87Å; M269-I273 HydrophobicContact CG-CG1 4.46Å; M269-I273 WeakPolarHBondContact O-CB 3.44Å; M269-I273 VanDerWaalsContact O-CG1 3.28Å; M269-I273 WeakPolarHBondContact O-CG1 3.34Å; M269-I273 PolarHBondContact O-N 2.98Å
270A83.7Confident85.5Confident57 Ų5795.4 Ų95.447%0.47151%0.509SS..Hα-helixtrans-61.1-42.1172.500000112N266 Q267 E268 V272 I273 Q274N266-A270 VanDerWaalsContact O-CB 3.31Å; N266-A270 WeakPolarHBondContact O-CB 3.26Å; N266-A270 PolarHBondContact O-N 3.43Å; Q267-A270 PolarHBondContact O-N 2.94Å; E268-A270 VanDerWaalsContact C-N 3.33Å; E268-A270 PolarHBondContact O-N 2.85Å; A270-V272 VanDerWaalsContact C-N 3.32Å; A270-V272 PolarHBondContact O-N 3.36Å; A270-I273 PolarHBondContact O-N 2.78Å; A270-Q274 WeakPolarHBondContact O-CB 3.22Å; A270-Q274 PolarHBondContact O-N 3.04Å
271S87.6Confident86.1Confident44 Ų4494.7 Ų94.731%0.30851%0.505SS..Hα-helixtrans-68.2-28.4176.384.20000113.6Q267 E268 M269 R275Q267-S271 WeakPolarHBondContact O-CB 3.45Å; Q267-S271 PolarHBondContact O-N 2.7Å; E268-S271 CarbonylContact O-C 3.5Å; E268-S271 WeakPolarHBondContact O-CA 3.44Å; E268-S271 WeakPolarHBondContact O-CB 3.37Å; E268-S271 PolarHBondContact O-N 2.83Å; E268-S271 PolarHBondContact O-OG 2.82Å; M269-S271 PolarHBondContact O-N 3.22Å; S271-R275 WeakPolarHBondContact O-CB 3.21Å; S271-R275 VanDerWaalsContact O-CG 3.32Å; S271-R275 WeakPolarHBondContact O-CG 3.26Å; S271-R275 PolarHBondContact O-N 3.33Å; S271-R275 PolarHBondContact O-NE 3.33Å; S271-R275 PolarHBondContact OG-NH2 2.89Å
272V89.2Confident86.6Confident77 Ų7794 Ų9447%0.46750%0.501SS..Hα-helixtrans-78.6-41.8176169.50000110.1E268 M269 A270 Q274 R275 A276E268-V272 WeakPolarHBondContact O-CG2 3.31Å; E268-V272 PolarHBondContact O-N 2.9Å; M269-V272 PolarHBondContact O-N 2.89Å; A270-V272 VanDerWaalsContact C-N 3.32Å; A270-V272 PolarHBondContact O-N 3.36Å; V272-Q274 VanDerWaalsContact C-N 3.33Å; V272-R275 PolarHBondContact O-N 3.45Å; V272-A276 WeakPolarHBondContact O-CB 3.08Å; V272-A276 PolarHBondContact O-N 3.39Å
273I87.4Confident87.2Confident85 Ų8593 Ų9344%0.43649%0.492SS..Hα-helixtrans-62.8-40.7172.6-70166.6000110.6M269 A270 A276 K277M269-I273 HydrophobicContact CG-CD1 3.87Å; M269-I273 HydrophobicContact CG-CG1 4.46Å; M269-I273 WeakPolarHBondContact O-CB 3.44Å; M269-I273 VanDerWaalsContact O-CG1 3.28Å; M269-I273 WeakPolarHBondContact O-CG1 3.34Å; M269-I273 PolarHBondContact O-N 2.98Å; A270-I273 PolarHBondContact O-N 2.78Å; I273-A276 PolarHBondContact O-N 3.26Å; I273-K277 WeakPolarHBondContact O-CG 3.21Å; I273-K277 PolarHBondContact O-N 2.87Å
274Q88Confident87.8Confident97 Ų9793.4 Ų93.445%0.45349%0.487SS..Hα-helixtrans-66-51.4176-169.557.642.200110.9A270 V272 A276 K277 D278A270-Q274 WeakPolarHBondContact O-CB 3.22Å; A270-Q274 PolarHBondContact O-N 3.04Å; V272-Q274 VanDerWaalsContact C-N 3.33Å; Q274-A276 PolarHBondContact O-N 2.78Å; Q274-K277 CarbonylContact O-C 3.55Å; Q274-K277 WeakPolarHBondContact O-CA 3.37Å; Q274-K277 WeakPolarHBondContact O-CB 3.41Å; Q274-K277 PolarHBondContact O-N 3.33Å; Q274-D278 PolarHBondContact NE2-OD1 2.85Å; Q274-D278 PolarHBondContact O-N 3.44Å
275R89.1Confident88.4Confident136 Ų13695 Ų9551%0.51349%0.487SS..Hα-helixtrans-56.4-36.9174.1-79.5176.3-76.4164.4-10.5113S271 V272 D278 L279S271-R275 WeakPolarHBondContact O-CB 3.21Å; S271-R275 VanDerWaalsContact O-CG 3.32Å; S271-R275 WeakPolarHBondContact O-CG 3.26Å; S271-R275 PolarHBondContact O-N 3.33Å; S271-R275 PolarHBondContact O-NE 3.33Å; S271-R275 PolarHBondContact OG-NH2 2.89Å; V272-R275 PolarHBondContact O-N 3.45Å; R275-D278 PolarHBondContact O-N 2.87Å; R275-L279 VanDerWaalsContact O-CB 3.3Å; R275-L279 WeakPolarHBondContact O-CB 3.41Å; R275-L279 WeakPolarHBondContact O-CD1 3.37Å; R275-L279 WeakPolarHBondContact O-CG 3.46Å; R275-L279 PolarHBondContact O-N 3.47Å
276A88.3Confident88.8Confident54 Ų5491.5 Ų91.545%0.44648%0.476SS..Hα-helixtrans-67.1-37.2175.800000112.2V272 I273 Q274 Q280V272-A276 WeakPolarHBondContact O-CB 3.08Å; V272-A276 PolarHBondContact O-N 3.39Å; I273-A276 PolarHBondContact O-N 3.26Å; Q274-A276 PolarHBondContact O-N 2.78Å; A276-Q280 WeakPolarHBondContact O-CB 3.46Å; A276-Q280 PolarHBondContact O-N 3.38Å
277K91.2Very high89.3Confident117 Ų11793.6 Ų93.651%0.50948%0.476SS..Hα-helixtrans-67.6-46.7170.9-73.1176178.7-178.80111.9I273 Q274 L279 Q280 D281I273-K277 WeakPolarHBondContact O-CG 3.21Å; I273-K277 PolarHBondContact O-N 2.87Å; Q274-K277 CarbonylContact O-C 3.55Å; Q274-K277 WeakPolarHBondContact O-CA 3.37Å; Q274-K277 WeakPolarHBondContact O-CB 3.41Å; Q274-K277 PolarHBondContact O-N 3.33Å; K277-L279 VanDerWaalsContact C-N 3.29Å; K277-L279 PolarHBondContact O-N 2.88Å; K277-Q280 CarbonylContact O-C 3.55Å; K277-Q280 WeakPolarHBondContact O-CB 3.49Å; K277-Q280 PolarHBondContact O-N 2.82Å; K277-Q280 VanDerWaalsContact O-N 3.07Å; K277-D281 PolarHBondContact O-N 3.07Å
278D91.2Very high89.8Confident80 Ų8092.4 Ų92.443%0.42847%0.474SS..Hα-helixtrans-58.9-42.7179.5-56-30.3000110.6Q274 R275 D281 E282Q274-D278 PolarHBondContact NE2-OD1 2.85Å; Q274-D278 PolarHBondContact O-N 3.44Å; R275-D278 PolarHBondContact O-N 2.87Å; D278-D281 PolarHBondContact O-N 3.35Å; D278-E282 WeakPolarHBondContact O-CB 3.41Å; D278-E282 PolarHBondContact O-N 2.92Å
279L90.4Very high90.1Very high110 Ų11093 Ų9358%0.57647%0.471SS*.Hα-helixtrans-69.4-35.9173.7-71.9169000113.3R275 K277 L283R275-L279 VanDerWaalsContact O-CB 3.3Å; R275-L279 WeakPolarHBondContact O-CB 3.41Å; R275-L279 WeakPolarHBondContact O-CD1 3.37Å; R275-L279 WeakPolarHBondContact O-CG 3.46Å; R275-L279 PolarHBondContact O-N 3.47Å; K277-L279 VanDerWaalsContact C-N 3.29Å; K277-L279 PolarHBondContact O-N 2.88Å; L279-L283 VanDerWaalsContact O-CB 3.23Å; L279-L283 WeakPolarHBondContact O-CB 3.38Å; L279-L283 PolarHBondContact O-N 2.81Å
280Q90Very high90.3Very high107 Ų10790 Ų9050%0.546%0.464SS..Hα-helixtrans-64.8-41.2174.3-175.383-8.800110.7A276 K277 L283 N284A276-Q280 WeakPolarHBondContact O-CB 3.46Å; A276-Q280 PolarHBondContact O-N 3.38Å; K277-Q280 CarbonylContact O-C 3.55Å; K277-Q280 WeakPolarHBondContact O-CB 3.49Å; K277-Q280 PolarHBondContact O-N 2.82Å; K277-Q280 VanDerWaalsContact O-N 3.07Å; Q280-L283 PolarHBondContact O-N 3.03Å; Q280-N284 WeakPolarHBondContact O-CB 3.3Å; Q280-N284 PolarHBondContact O-N 2.83Å; Q280-N284 PolarHBondContact O-ND2 2.77Å; Q280-N284 VanDerWaalsContact O-ND2 3.13Å
281D91.6Very high90.7Very high86 Ų8692.2 Ų92.246%0.4647%0.467SS..Hα-helixtrans-75.2-35178-74-24.1000112K277 D278 N284 Q285K277-D281 PolarHBondContact O-N 3.07Å; D278-D281 PolarHBondContact O-N 3.35Å; D281-N284 PolarHBondContact O-N 2.8Å; D281-Q285 WeakPolarHBondContact O-CB 3.29Å; D281-Q285 VanDerWaalsContact O-CG 3.23Å; D281-Q285 WeakPolarHBondContact O-CG 3.48Å; D281-Q285 PolarHBondContact O-N 2.92Å
282E93.2Very high90.9Very high117 Ų11795.9 Ų95.955%0.54748%0.477SS..Hα-helixtrans-62.1-44168.3-174.9172.5-156.800111.2D278 Q285 A286D278-E282 WeakPolarHBondContact O-CB 3.41Å; D278-E282 PolarHBondContact O-N 2.92Å; E282-Q285 PolarHBondContact O-N 3.46Å; E282-A286 VanDerWaalsContact O-CB 3.26Å; E282-A286 WeakPolarHBondContact O-CB 3.2Å; E282-A286 PolarHBondContact O-N 3.46Å
283L91.6Very high91.1Very high77 Ų77100.6 Ų100.640%0.40349%0.487SS..Hα-helixtrans-61.3-43.2174.4-178.472.4000111.7L279 Q280 A286 R287L279-L283 VanDerWaalsContact O-CB 3.23Å; L279-L283 WeakPolarHBondContact O-CB 3.38Å; L279-L283 PolarHBondContact O-N 2.81Å; Q280-L283 PolarHBondContact O-N 3.03Å; L283-A286 PolarHBondContact O-N 2.78Å; L283-R287 WeakPolarHBondContact O-CB 3.36Å; L283-R287 WeakPolarHBondContact O-CG 3.35Å; L283-R287 PolarHBondContact O-N 3.26Å
284N91.4Very high91.4Very high65 Ų65101.1 Ų101.135%0.34849%0.49SS..Hα-helixtrans-64.9-43.4176.8-72.8-29.1000111.5Q280 D281 R287 L288Q280-N284 WeakPolarHBondContact O-CB 3.3Å; Q280-N284 PolarHBondContact O-N 2.83Å; Q280-N284 PolarHBondContact O-ND2 2.77Å; Q280-N284 VanDerWaalsContact O-ND2 3.13Å; D281-N284 PolarHBondContact O-N 2.8Å; N284-R287 PolarHBondContact O-N 2.76Å; N284-L288 WeakPolarHBondContact O-CB 3.34Å; N284-L288 PolarHBondContact O-N 3.5Å
285Q92.9Very high91.6Very high98 Ų9899 Ų9946%0.45849%0.486SS..Hα-helixtrans-65.6-37173.7-69.3174.640.200112.2D281 E282 L288 R289D281-Q285 WeakPolarHBondContact O-CB 3.29Å; D281-Q285 VanDerWaalsContact O-CG 3.23Å; D281-Q285 WeakPolarHBondContact O-CG 3.48Å; D281-Q285 PolarHBondContact O-N 2.92Å; E282-Q285 PolarHBondContact O-N 3.46Å; Q285-L288 PolarHBondContact O-N 2.85Å; Q285-R289 WeakPolarHBondContact O-CB 3.31Å; Q285-R289 WeakPolarHBondContact O-CD 3.25Å; Q285-R289 WeakPolarHBondContact O-CG 3.29Å; Q285-R289 PolarHBondContact O-N 3.46Å
286A90.9Very high91.8Very high48 Ų4896.5 Ų96.540%0.39748%0.481SS..Hα-helixtrans-65.6-42.217600000111.6E282 L283 R289 A290E282-A286 VanDerWaalsContact O-CB 3.26Å; E282-A286 WeakPolarHBondContact O-CB 3.2Å; E282-A286 PolarHBondContact O-N 3.46Å; L283-A286 PolarHBondContact O-N 2.78Å; A286-R289 PolarHBondContact O-N 2.86Å; A286-A290 WeakPolarHBondContact O-CB 3.36Å; A286-A290 PolarHBondContact O-N 2.84Å
287R92.2Very high92.1Very high139 Ų13999.3 Ų99.353%0.52548%0.484SS..Hα-helixtrans-59.3-51.9170.6-75.7171.6173.1169.3-3.2111.5L283 N284 R289 A290 D291L283-R287 WeakPolarHBondContact O-CB 3.36Å; L283-R287 WeakPolarHBondContact O-CG 3.35Å; L283-R287 PolarHBondContact O-N 3.26Å; N284-R287 PolarHBondContact O-N 2.76Å; R287-R289 VanDerWaalsContact C-N 3.27Å; R287-R289 PolarHBondContact O-N 2.95Å; R287-A290 CarbonylContact O-C 3.52Å; R287-A290 WeakPolarHBondContact O-CA 3.32Å; R287-A290 WeakPolarHBondContact O-CB 3.33Å; R287-A290 PolarHBondContact O-N 3.31Å; R287-D291 PolarHBondContact O-N 2.91Å
288L93.4Very high92.2Very high124 Ų12495.8 Ų95.865%0.64948%0.475SS*.Hα-helixtrans-63-33.3-178.6-156.7154.2000112.2N284 Q285 K292N284-L288 WeakPolarHBondContact O-CB 3.34Å; N284-L288 PolarHBondContact O-N 3.5Å; Q285-L288 PolarHBondContact O-N 2.85Å; L288-K292 VanDerWaalsContact O-CB 3.29Å; L288-K292 WeakPolarHBondContact O-CB 3.36Å; L288-K292 PolarHBondContact O-N 2.89Å
289R93.1Very high92.3Very high131 Ų13197.5 Ų97.549%0.49448%0.48SS..Hα-helixtrans-67.2-37.6168.8-71.3166.1-170.7127.77.4112.8Q285 A286 R287 R293Q285-R289 WeakPolarHBondContact O-CB 3.31Å; Q285-R289 WeakPolarHBondContact O-CD 3.25Å; Q285-R289 WeakPolarHBondContact O-CG 3.29Å; Q285-R289 PolarHBondContact O-N 3.46Å; A286-R289 PolarHBondContact O-N 2.86Å; R287-R289 VanDerWaalsContact C-N 3.27Å; R287-R289 PolarHBondContact O-N 2.95Å; R289-R293 WeakPolarHBondContact O-CG 3.22Å; R289-R293 PolarHBondContact O-N 3.39Å
290A89.8Confident92.5Very high42 Ų4295.6 Ų95.635%0.34747%0.473SS..Hα-helixtrans-70.6-43.7176.300000111.8A286 R287 R293 N294A286-A290 WeakPolarHBondContact O-CB 3.36Å; A286-A290 PolarHBondContact O-N 2.84Å; R287-A290 CarbonylContact O-C 3.52Å; R287-A290 WeakPolarHBondContact O-CA 3.32Å; R287-A290 WeakPolarHBondContact O-CB 3.33Å; R287-A290 PolarHBondContact O-N 3.31Å; A290-R293 CarbonylContact O-C 3.5Å; A290-R293 PolarHBondContact O-N 3.21Å; A290-N294 WeakPolarHBondContact O-CB 3.4Å; A290-N294 PolarHBondContact O-N 2.8Å; A290-N294 PolarHBondContact O-ND2 2.84Å
291D91.5Very high92.7Very high102 Ų10293.5 Ų93.555%0.54547%0.465SS..Hα-helixtrans-64.9-40.2176.4-65.7-36.9000111.4R287 N294 S295R287-D291 PolarHBondContact O-N 2.91Å; D291-N294 PolarHBondContact O-N 3.07Å; D291-S295 WeakPolarHBondContact O-CB 3.37Å; D291-S295 PolarHBondContact O-N 3.37Å; D291-S295 PolarHBondContact O-OG 2.78Å
292K93.4Very high92.8Very high121 Ų12197.3 Ų97.353%0.52647%0.473SS..Hα-helixtrans-56.7-53.2169.3178.3167.9172.6172.40111.1L288 N294 S295 E296L288-K292 VanDerWaalsContact O-CB 3.29Å; L288-K292 WeakPolarHBondContact O-CB 3.36Å; L288-K292 PolarHBondContact O-N 2.89Å; K292-N294 VanDerWaalsContact C-N 3.32Å; K292-N294 PolarHBondContact O-N 2.8Å; K292-S295 PolarHBondContact O-N 3.32Å; K292-S295 VanDerWaalsContact O-N 3.12Å; K292-S295 PolarHBondContact O-OG 3.35Å; K292-E296 WeakPolarHBondContact CE-OE1 3.49Å; K292-E296 HydrophobicContact CG-CG 4.38Å; K292-E296 IonicContact NZ-OE1 3.58Å; K292-E296 WeakPolarHBondContact O-CG 3.37Å; K292-E296 PolarHBondContact O-N 3.21Å
293R92.9Very high92.9Very high177 Ų17795 Ų9567%0.66847%0.467SS*.Hα-helixtrans-58.5-40176.7-76.5173.4176.5172.5-1.1113R289 A290 E296 Q297R289-R293 WeakPolarHBondContact O-CG 3.22Å; R289-R293 PolarHBondContact O-N 3.39Å; A290-R293 CarbonylContact O-C 3.5Å; A290-R293 PolarHBondContact O-N 3.21Å; R293-E296 PolarHBondContact O-N 2.94Å; R293-Q297 WeakPolarHBondContact O-CB 3.23Å; R293-Q297 PolarHBondContact O-N 3.42Å
294N93.1Very high93.1Very high95 Ų9595.3 Ų95.351%0.50847%0.469SS..Hα-helixtrans-63.6-41.7175.7-72.7-25.1000111.1A290 D291 K292 S298A290-N294 WeakPolarHBondContact O-CB 3.4Å; A290-N294 PolarHBondContact O-N 2.8Å; A290-N294 PolarHBondContact O-ND2 2.84Å; D291-N294 PolarHBondContact O-N 3.07Å; K292-N294 VanDerWaalsContact C-N 3.32Å; K292-N294 PolarHBondContact O-N 2.8Å; N294-S298 VanDerWaalsContact O-CB 3.32Å; N294-S298 WeakPolarHBondContact O-CB 3.23Å; N294-S298 PolarHBondContact O-N 3.16Å
295S92.5Very high93.2Very high52 Ų5299.9 Ų99.936%0.36448%0.481SS..Hα-helixtrans-66.1-45.317672.90000112.2D291 K292 S298 Q299D291-S295 WeakPolarHBondContact O-CB 3.37Å; D291-S295 PolarHBondContact O-N 3.37Å; D291-S295 PolarHBondContact O-OG 2.78Å; K292-S295 PolarHBondContact O-N 3.32Å; K292-S295 VanDerWaalsContact O-N 3.12Å; K292-S295 PolarHBondContact O-OG 3.35Å; S295-S298 PolarHBondContact O-N 3.45Å; S295-S298 PolarHBondContact O-OG 2.75Å; S295-Q299 WeakPolarHBondContact O-CG 3.32Å; S295-Q299 PolarHBondContact O-N 3.01Å
296E94.2Very high93.4Very high85 Ų85100.4 Ų100.440%0.39748%0.484SS..Hα-helixtrans-60.3-46.8174.9-71.4171.3153.100110.6K292 R293 S298 Q299 T300K292-E296 WeakPolarHBondContact CE-OE1 3.49Å; K292-E296 HydrophobicContact CG-CG 4.38Å; K292-E296 IonicContact NZ-OE1 3.58Å; K292-E296 WeakPolarHBondContact O-CG 3.37Å; K292-E296 PolarHBondContact O-N 3.21Å; R293-E296 PolarHBondContact O-N 2.94Å; E296-S298 VanDerWaalsContact C-N 3.35Å; E296-S298 PolarHBondContact O-N 2.79Å; E296-Q299 WeakPolarHBondContact O-CB 3.28Å; E296-Q299 PolarHBondContact O-N 3.38Å; E296-Q299 VanDerWaalsContact O-N 3.1Å; E296-T300 PolarHBondContact O-N 3.24Å; E296-T300 PolarHBondContact O-OG1 3.44Å
297Q93.3Very high93.6Very high112 Ų112102.8 Ų102.852%0.52349%0.489SS..Hα-helixtrans-63.5-38.5176.4-173.6169.2-5.900111.9R293 Q299 T300 D301R293-Q297 WeakPolarHBondContact O-CB 3.23Å; R293-Q297 PolarHBondContact O-N 3.42Å; Q297-Q299 VanDerWaalsContact C-N 3.26Å; Q297-Q299 PolarHBondContact O-N 3.1Å; Q297-T300 WeakPolarHBondContact CA-OG1 3.39Å; Q297-T300 PolarHBondContact O-N 3.44Å; Q297-T300 PolarHBondContact O-OG1 2.69Å; Q297-D301 WeakPolarHBondContact O-CB 3.48Å; Q297-D301 PolarHBondContact O-N 3.47Å
298S93.1Very high93.7Very high44 Ų44104.3 Ų104.331%0.30850%0.495SS..Hα-helixtrans-66.2-28.2174.581.70000112.9N294 S295 E296 R302N294-S298 VanDerWaalsContact O-CB 3.32Å; N294-S298 WeakPolarHBondContact O-CB 3.23Å; N294-S298 PolarHBondContact O-N 3.16Å; S295-S298 PolarHBondContact O-N 3.45Å; S295-S298 PolarHBondContact O-OG 2.75Å; E296-S298 VanDerWaalsContact C-N 3.35Å; E296-S298 PolarHBondContact O-N 2.79Å; S298-R302 WeakPolarHBondContact O-CD 3.23Å; S298-R302 WeakPolarHBondContact O-CG 3.41Å; S298-R302 PolarHBondContact O-N 3.35Å
299Q94.2Very high93.8Very high116 Ų116100.9 Ų100.954%0.54248%0.482SS..Hα-helixtrans-75.9-45.9173.6-69.8172.418.100110.8S295 E296 Q297 D301 R302 T303S295-Q299 WeakPolarHBondContact O-CG 3.32Å; S295-Q299 PolarHBondContact O-N 3.01Å; E296-Q299 WeakPolarHBondContact O-CB 3.28Å; E296-Q299 PolarHBondContact O-N 3.38Å; E296-Q299 VanDerWaalsContact O-N 3.1Å; Q297-Q299 VanDerWaalsContact C-N 3.26Å; Q297-Q299 PolarHBondContact O-N 3.1Å; Q299-D301 VanDerWaalsContact C-N 3.28Å; Q299-D301 PolarHBondContact O-N 2.73Å; Q299-R302 WeakPolarHBondContact O-CB 3.35Å; Q299-R302 PolarHBondContact O-N 2.87Å; Q299-R302 VanDerWaalsContact O-N 3.1Å; Q299-T303 PolarHBondContact O-N 2.93Å; Q299-T303 PolarHBondContact O-OG1 3.21Å
300T94Very high93.9Very high70 Ų7099 Ų9943%0.42948%0.478SS..Hα-helixtrans-63.1-35.3174.656.50000112.3E296 Q297 R302 T303 L304E296-T300 PolarHBondContact O-N 3.24Å; E296-T300 PolarHBondContact O-OG1 3.44Å; Q297-T300 WeakPolarHBondContact CA-OG1 3.39Å; Q297-T300 PolarHBondContact O-N 3.44Å; Q297-T300 PolarHBondContact O-OG1 2.69Å; T300-R302 VanDerWaalsContact C-N 3.31Å; T300-R302 PolarHBondContact O-N 3.05Å; T300-T303 PolarHBondContact O-OG1 2.9Å; T300-L304 WeakPolarHBondContact O-CB 3.46Å; T300-L304 WeakPolarHBondContact O-CG 3.38Å; T300-L304 PolarHBondContact O-N 2.71Å
301D94.8Very high94.3Very high62 Ų62101 Ų10133%0.33249%0.486SS..Hα-helixtrans-70.6-25.7175.4-83.910.4000112.5Q297 Q299 R305Q297-D301 WeakPolarHBondContact O-CB 3.48Å; Q297-D301 PolarHBondContact O-N 3.47Å; Q299-D301 VanDerWaalsContact C-N 3.28Å; Q299-D301 PolarHBondContact O-N 2.73Å; D301-R305 VanDerWaalsContact C-NH1 3.32Å; D301-R305 WeakPolarHBondContact O-CG 3.29Å; D301-R305 PolarHBondContact O-N 3.12Å; D301-R305 PolarHBondContact O-NH1 3.22Å
302R94.1Very high94.5Very high166 Ų166101.2 Ų101.263%0.62649%0.487SS*.Hα-helixtrans-75.1-51.3171.5-75.8166.2-170.4172.85.1110.5S298 Q299 T300 L304 R305 E306S298-R302 WeakPolarHBondContact O-CD 3.23Å; S298-R302 WeakPolarHBondContact O-CG 3.41Å; S298-R302 PolarHBondContact O-N 3.35Å; Q299-R302 WeakPolarHBondContact O-CB 3.35Å; Q299-R302 PolarHBondContact O-N 2.87Å; Q299-R302 VanDerWaalsContact O-N 3.1Å; T300-R302 VanDerWaalsContact C-N 3.31Å; T300-R302 PolarHBondContact O-N 3.05Å; R302-L304 VanDerWaalsContact C-N 3.29Å; R302-L304 PolarHBondContact O-N 2.98Å; R302-R305 PolarHBondContact O-N 3.47Å; R302-E306 PolarHBondContact O-N 2.89Å
303T94.7Very high94.7Very high69 Ų69100.4 Ų100.442%0.42349%0.489SS..Hα-helixtrans-64.6-33178.758.40000112.1Q299 T300 E306 L307Q299-T303 PolarHBondContact O-N 2.93Å; Q299-T303 PolarHBondContact O-OG1 3.21Å; T300-T303 PolarHBondContact O-OG1 2.9Å; T303-E306 PolarHBondContact O-N 3.34Å; T303-L307 VanDerWaalsContact O-CB 3.24Å; T303-L307 WeakPolarHBondContact O-CB 3.35Å; T303-L307 WeakPolarHBondContact O-CD1 3.23Å; T303-L307 VanDerWaalsContact O-CG 3.28Å; T303-L307 WeakPolarHBondContact O-CG 3.42Å; T303-L307 PolarHBondContact O-N 3.03Å
304L94.8Very high94.8Very high83 Ų8397.9 Ų97.944%0.43549%0.488SS..Hα-helixtrans-66.4-32.5171.2-81169.6000113.4T300 R302 R308T300-L304 WeakPolarHBondContact O-CB 3.46Å; T300-L304 WeakPolarHBondContact O-CG 3.38Å; T300-L304 PolarHBondContact O-N 2.71Å; R302-L304 VanDerWaalsContact C-N 3.29Å; R302-L304 PolarHBondContact O-N 2.98Å; L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 WeakPolarHBondContact O-CD 3.21Å; L304-R308 WeakPolarHBondContact O-CG 3.4Å; L304-R308 PolarHBondContact O-N 3.43Å
305R94.9Very high95Very high161 Ų16197.2 Ų97.261%0.60849%0.487SS*.Hα-helixtrans-72.8-42.8172.8-75.9179.6-168.491.8-3111.1D301 R302 R308 S309D301-R305 VanDerWaalsContact C-NH1 3.32Å; D301-R305 WeakPolarHBondContact O-CG 3.29Å; D301-R305 PolarHBondContact O-N 3.12Å; D301-R305 PolarHBondContact O-NH1 3.22Å; R302-R305 PolarHBondContact O-N 3.47Å; R305-R308 WeakPolarHBondContact O-CB 3.43Å; R305-R308 PolarHBondContact O-N 3.15Å; R305-S309 PolarHBondContact O-N 2.77Å; R305-S309 PolarHBondContact O-OG 3.3Å
306E95.7Very high95.1Very high110 Ų110101.5 Ų101.551%0.51450%0.502SS..Hα-helixtrans-64.9-44.1178.9-172.4177.3179.900112.3R302 T303 R308 S309 Q310R302-E306 PolarHBondContact O-N 2.89Å; T303-E306 PolarHBondContact O-N 3.34Å; E306-R308 VanDerWaalsContact C-N 3.31Å; E306-R308 PolarHBondContact O-N 2.84Å; E306-S309 WeakPolarHBondContact CA-OG 3.48Å; E306-S309 PolarHBondContact O-N 2.72Å; E306-S309 PolarHBondContact O-OG 2.79Å; E306-Q310 WeakPolarHBondContact O-CB 3.42Å; E306-Q310 VanDerWaalsContact O-CG 3.29Å; E306-Q310 WeakPolarHBondContact O-CG 3.2Å; E306-Q310 PolarHBondContact O-N 3.29Å
307L95Very high95.3Very high97 Ų97100 Ų10051%0.50850%0.503SS..Hα-helixtrans-64-34.3172.5-76.9164.1000112.2T303 V311T303-L307 VanDerWaalsContact O-CB 3.24Å; T303-L307 WeakPolarHBondContact O-CB 3.35Å; T303-L307 WeakPolarHBondContact O-CD1 3.23Å; T303-L307 VanDerWaalsContact O-CG 3.28Å; T303-L307 WeakPolarHBondContact O-CG 3.42Å; T303-L307 PolarHBondContact O-N 3.03Å; L307-V311 WeakPolarHBondContact O-CB 3.48Å; L307-V311 VanDerWaalsContact O-CG2 3.29Å; L307-V311 WeakPolarHBondContact O-CG2 3.07Å; L307-V311 PolarHBondContact O-N 2.8Å
308R95.4Very high95.3Very high171 Ų17199.9 Ų99.965%0.64551%0.506SS*.Hα-helixtrans-67.6-49.5173.3-78.6171.4-172.5-155.52.6111.5L304 R305 E306 Q310 V311 D312L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 WeakPolarHBondContact O-CD 3.21Å; L304-R308 WeakPolarHBondContact O-CG 3.4Å; L304-R308 PolarHBondContact O-N 3.43Å; R305-R308 WeakPolarHBondContact O-CB 3.43Å; R305-R308 PolarHBondContact O-N 3.15Å; E306-R308 VanDerWaalsContact C-N 3.31Å; E306-R308 PolarHBondContact O-N 2.84Å; R308-Q310 VanDerWaalsContact C-N 3.28Å; R308-Q310 PolarHBondContact O-N 3.26Å; R308-V311 CarbonylContact O-C 3.56Å; R308-V311 WeakPolarHBondContact O-CA 3.45Å; R308-V311 WeakPolarHBondContact O-CB 3.26Å; R308-V311 PolarHBondContact O-N 2.77Å; R308-D312 VanDerWaalsContact O-CG 3.23Å; R308-D312 PolarHBondContact O-N 2.9Å
309S95.2Very high95.5Very high53 Ų53101.1 Ų101.137%0.37151%0.514SS..Hα-helixtrans-59.3-39.4175.948.40000112R305 E306 V311 D312 D313R305-S309 PolarHBondContact O-N 2.77Å; R305-S309 PolarHBondContact O-OG 3.3Å; E306-S309 WeakPolarHBondContact CA-OG 3.48Å; E306-S309 PolarHBondContact O-N 2.72Å; E306-S309 PolarHBondContact O-OG 2.79Å; S309-V311 VanDerWaalsContact C-N 3.33Å; S309-V311 PolarHBondContact O-N 3.34Å; S309-D312 PolarHBondContact O-N 3.21Å; S309-D313 VanDerWaalsContact O-CB 3.31Å; S309-D313 WeakPolarHBondContact O-CB 3.33Å; S309-D313 PolarHBondContact O-N 3.22Å
310Q96.3Very high95.5Very high91 Ų9197.8 Ų97.843%0.42551%0.507SS..Hα-helixtrans-63.5-36.3173.7-72173.115.900112.8E306 R308 L314E306-Q310 WeakPolarHBondContact O-CB 3.42Å; E306-Q310 VanDerWaalsContact O-CG 3.29Å; E306-Q310 WeakPolarHBondContact O-CG 3.2Å; E306-Q310 PolarHBondContact O-N 3.29Å; R308-Q310 VanDerWaalsContact C-N 3.28Å; R308-Q310 PolarHBondContact O-N 3.26Å; Q310-L314 VanDerWaalsContact O-CB 3.28Å; Q310-L314 WeakPolarHBondContact O-CB 3.38Å; Q310-L314 WeakPolarHBondContact O-CD1 3.4Å; Q310-L314 WeakPolarHBondContact O-CG 3.5Å; Q310-L314 PolarHBondContact O-N 2.83Å
311V96.9Very high95.6Very high85 Ų85100.5 Ų100.552%0.51551%0.513SS..Hα-helixtrans-70.1-39.9173.7165.90000111.5L307 R308 S309 T315L307-V311 WeakPolarHBondContact O-CB 3.48Å; L307-V311 VanDerWaalsContact O-CG2 3.29Å; L307-V311 WeakPolarHBondContact O-CG2 3.07Å; L307-V311 PolarHBondContact O-N 2.8Å; R308-V311 CarbonylContact O-C 3.56Å; R308-V311 WeakPolarHBondContact O-CA 3.45Å; R308-V311 WeakPolarHBondContact O-CB 3.26Å; R308-V311 PolarHBondContact O-N 2.77Å; S309-V311 VanDerWaalsContact C-N 3.33Å; S309-V311 PolarHBondContact O-N 3.34Å; V311-T315 VanDerWaalsContact O-CB 3.31Å; V311-T315 WeakPolarHBondContact O-CB 3.39Å; V311-T315 PolarHBondContact O-N 3.48Å; V311-T315 PolarHBondContact O-OG1 3.1Å
312D96.3Very high95.7Very high105 Ų105102 Ų10256%0.56152%0.521SS*.Hα-helixtrans-66.2-47.9177.7-63.6-33.9000110.6R308 S309 L314 T315 E316R308-D312 VanDerWaalsContact O-CG 3.23Å; R308-D312 PolarHBondContact O-N 2.9Å; S309-D312 PolarHBondContact O-N 3.21Å; D312-L314 PolarHBondContact O-N 2.97Å; D312-T315 WeakPolarHBondContact O-CB 3.29Å; D312-T315 PolarHBondContact O-N 2.94Å; D312-T315 VanDerWaalsContact O-N 3.09Å; D312-E316 PolarHBondContact O-N 3.41Å
313D96.6Very high95.7Very high105 Ų10595.8 Ų95.856%0.56151%0.509SS*.Hα-helixtrans-56.8-45.7174-69.9-24.9000111.7S309 T315 E316 A317S309-D313 VanDerWaalsContact O-CB 3.31Å; S309-D313 WeakPolarHBondContact O-CB 3.33Å; S309-D313 PolarHBondContact O-N 3.22Å; D313-T315 VanDerWaalsContact C-N 3.32Å; D313-T315 PolarHBondContact O-N 2.89Å; D313-E316 PolarHBondContact O-N 3.03Å; D313-A317 VanDerWaalsContact O-CB 3.27Å; D313-A317 WeakPolarHBondContact O-CB 3.44Å; D313-A317 PolarHBondContact O-N 3.36Å
314L95.9Very high95.8Very high123 Ų12397.2 Ų97.264%0.64451%0.51SS*.Hα-helixtrans-67.6-31.9176.7-75.2171.1000112.2Q310 D312 L318Q310-L314 VanDerWaalsContact O-CB 3.28Å; Q310-L314 WeakPolarHBondContact O-CB 3.38Å; Q310-L314 WeakPolarHBondContact O-CD1 3.4Å; Q310-L314 WeakPolarHBondContact O-CG 3.5Å; Q310-L314 PolarHBondContact O-N 2.83Å; D312-L314 PolarHBondContact O-N 2.97Å; L314-L318 WeakPolarHBondContact O-CB 3.17Å; L314-L318 PolarHBondContact O-N 3.19Å
315T96.3Very high95.9Very high82 Ų8297.3 Ų97.350%0.50351%0.511SS..Hα-helixtrans-72.9-41.2176.2-58.90000111.1V311 D312 D313 L318 S319V311-T315 VanDerWaalsContact O-CB 3.31Å; V311-T315 WeakPolarHBondContact O-CB 3.39Å; V311-T315 PolarHBondContact O-N 3.48Å; V311-T315 PolarHBondContact O-OG1 3.1Å; D312-T315 WeakPolarHBondContact O-CB 3.29Å; D312-T315 PolarHBondContact O-N 2.94Å; D312-T315 VanDerWaalsContact O-N 3.09Å; D313-T315 VanDerWaalsContact C-N 3.32Å; D313-T315 PolarHBondContact O-N 2.89Å; T315-L318 PolarHBondContact O-N 3.37Å; T315-S319 PolarHBondContact O-N 2.82Å
316E96.4Very high96Very high142 Ų14292.1 Ų92.166%0.66450%0.503SS*.Hα-helixtrans-63.4-45.9171.9-173.2172.1168.800110.6D312 D313 L318 S319 A320D312-E316 PolarHBondContact O-N 3.41Å; D313-E316 PolarHBondContact O-N 3.03Å; E316-L318 VanDerWaalsContact C-N 3.31Å; E316-L318 PolarHBondContact O-N 3.39Å; E316-S319 PolarHBondContact O-N 2.96Å; E316-S319 VanDerWaalsContact O-N 3.1Å; E316-S319 PolarHBondContact O-OG 3.47Å; E316-A320 WeakPolarHBondContact O-CB 3.09Å; E316-A320 PolarHBondContact O-N 3.36Å
317A96.4Very high96Very high52 Ų5290.6 Ų90.643%0.4350%0.5SS..Hα-helixtrans-59.8-38.217600000113D313 K321D313-A317 VanDerWaalsContact O-CB 3.27Å; D313-A317 WeakPolarHBondContact O-CB 3.44Å; D313-A317 PolarHBondContact O-N 3.36Å; A317-K321 VanDerWaalsContact O-CG 3.3Å; A317-K321 WeakPolarHBondContact O-CG 3.44Å; A317-K321 PolarHBondContact O-N 2.64Å
318L95.3Very high96.1Very high110 Ų11091.5 Ų91.558%0.57651%0.505SS*.Hα-helixtrans-63.2-48.7171.9-170.575.7000110.8L314 T315 E316 A320 K321 D322L314-L318 WeakPolarHBondContact O-CB 3.17Å; L314-L318 PolarHBondContact O-N 3.19Å; T315-L318 PolarHBondContact O-N 3.37Å; E316-L318 VanDerWaalsContact C-N 3.31Å; E316-L318 PolarHBondContact O-N 3.39Å; L318-A320 VanDerWaalsContact C-N 3.28Å; L318-A320 PolarHBondContact O-N 2.91Å; L318-K321 CarbonylContact O-C 3.59Å; L318-K321 WeakPolarHBondContact O-CA 2.77Å; L318-K321 WeakPolarHBondContact O-CB 3.36Å; L318-K321 PolarHBondContact O-N 3.43Å; L318-D322 PolarHBondContact O-N 2.76Å
319S95.6Very high96.1Very high70 Ų7089.3 Ų89.349%0.4950%0.5SS..Hα-helixtrans-61.3-36.4179.180.50000112.7T315 E316 K321 D322 G323T315-S319 PolarHBondContact O-N 2.82Å; E316-S319 PolarHBondContact O-N 2.96Å; E316-S319 VanDerWaalsContact O-N 3.1Å; E316-S319 PolarHBondContact O-OG 3.47Å; S319-K321 VanDerWaalsContact C-N 3.34Å; S319-D322 PolarHBondContact O-N 3.35Å; S319-G323 PolarHBondContact O-N 3.46Å
320A95.4Very high96.3Very high47 Ų4790.5 Ų90.539%0.38851%0.505SS..Hα-helixtrans-68.4-32.4173.900000112E316 L318 Q324E316-A320 WeakPolarHBondContact O-CB 3.09Å; E316-A320 PolarHBondContact O-N 3.36Å; L318-A320 VanDerWaalsContact C-N 3.28Å; L318-A320 PolarHBondContact O-N 2.91Å; A320-Q324 VanDerWaalsContact O-CG 3.26Å; A320-Q324 WeakPolarHBondContact O-CG 3.13Å; A320-Q324 PolarHBondContact O-N 2.8Å
321K95.4Very high96.2Very high127 Ų12794 Ų9455%0.55251%0.514SS*.Hα-helixtrans-71.7-41.4172.8-73.2-73.4161.9-160.60112.2A317 L318 S319 G323 Q324 L325A317-K321 VanDerWaalsContact O-CG 3.3Å; A317-K321 WeakPolarHBondContact O-CG 3.44Å; A317-K321 PolarHBondContact O-N 2.64Å; L318-K321 CarbonylContact O-C 3.59Å; L318-K321 WeakPolarHBondContact O-CA 2.77Å; L318-K321 WeakPolarHBondContact O-CB 3.36Å; L318-K321 PolarHBondContact O-N 3.43Å; S319-K321 VanDerWaalsContact C-N 3.34Å; K321-G323 VanDerWaalsContact C-N 3.33Å; K321-G323 PolarHBondContact O-N 2.84Å; K321-Q324 WeakPolarHBondContact O-CB 3.46Å; K321-Q324 PolarHBondContact O-N 3.43Å; K321-L325 WeakPolarHBondContact O-CB 3.36Å; K321-L325 PolarHBondContact O-N 3.06Å
322D96.2Very high96.2Very high93 Ų9395.2 Ų95.250%0.49752%0.517SS..Hα-helixtrans-63.7-39.1173.3-74-36000111.7L318 S319 L325 A326L318-D322 PolarHBondContact O-N 2.76Å; S319-D322 PolarHBondContact O-N 3.35Å; D322-L325 PolarHBondContact O-N 2.9Å; D322-A326 WeakPolarHBondContact O-CB 3.45Å; D322-A326 PolarHBondContact O-N 2.9Å
323G95.8Very high96.3Very high36 Ų3695 Ų9537%0.37152%0.517SS..Hα-helixtrans-61.1-44.4170.900000113.1S319 K321 L325 A326 V327S319-G323 PolarHBondContact O-N 3.46Å; K321-G323 VanDerWaalsContact C-N 3.33Å; K321-G323 PolarHBondContact O-N 2.84Å; G323-L325 VanDerWaalsContact C-N 3.33Å; G323-L325 PolarHBondContact O-N 2.78Å; G323-A326 PolarHBondContact O-N 3.47Å; G323-V327 WeakPolarHBondContact O-CG2 3.49Å; G323-V327 PolarHBondContact O-N 3.09Å
324Q96.9Very high96.2Very high98 Ų9895 Ų9546%0.45851%0.513SS..Hα-helixtrans-61.2-41.3173.1-75.1168.217.300111.7A320 K321 V327 L328A320-Q324 VanDerWaalsContact O-CG 3.26Å; A320-Q324 WeakPolarHBondContact O-CG 3.13Å; A320-Q324 PolarHBondContact O-N 2.8Å; K321-Q324 WeakPolarHBondContact O-CB 3.46Å; K321-Q324 PolarHBondContact O-N 3.43Å; Q324-V327 PolarHBondContact O-N 2.85Å; Q324-L328 WeakPolarHBondContact O-CB 3.38Å; Q324-L328 VanDerWaalsContact O-CG 3.31Å; Q324-L328 WeakPolarHBondContact O-CG 3.27Å; Q324-L328 PolarHBondContact O-N 2.8Å
325L95.9Very high96.2Very high86 Ų8691.2 Ų91.245%0.4550%0.499SS..Hα-helixtrans-67.4-39179.3-158.2163.2000111.3K321 D322 G323 L328 K329K321-L325 WeakPolarHBondContact O-CB 3.36Å; K321-L325 PolarHBondContact O-N 3.06Å; D322-L325 PolarHBondContact O-N 2.9Å; G323-L325 VanDerWaalsContact C-N 3.33Å; G323-L325 PolarHBondContact O-N 2.78Å; L325-L328 PolarHBondContact O-N 3.42Å; L325-K329 HydrophobicContact CD2-CD 3.79Å; L325-K329 HydrophobicContact CD2-CG 4.19Å; L325-K329 WeakPolarHBondContact O-CG 3.24Å; L325-K329 PolarHBondContact O-N 3.49Å
326A96.4Very high96.2Very high52 Ų5290.2 Ų90.243%0.4349%0.491SS..Hα-helixtrans-63-45.5172.800000112.4D322 G323 L328 K329 V330D322-A326 WeakPolarHBondContact O-CB 3.45Å; D322-A326 PolarHBondContact O-N 2.9Å; G323-A326 PolarHBondContact O-N 3.47Å; A326-L328 VanDerWaalsContact C-N 3.33Å; A326-L328 PolarHBondContact O-N 3Å; A326-K329 PolarHBondContact O-N 2.8Å; A326-V330 WeakPolarHBondContact O-CG2 3.33Å; A326-V330 PolarHBondContact O-N 2.92Å
327V97.3Very high96.2Very high77 Ų7790.2 Ų90.247%0.46749%0.491SS..Hα-helixtrans-64.1-37176.11720000111.9G323 Q324 R331G323-V327 WeakPolarHBondContact O-CG2 3.49Å; G323-V327 PolarHBondContact O-N 3.09Å; Q324-V327 PolarHBondContact O-N 2.85Å; V327-R331 WeakPolarHBondContact O-CG 3.21Å; V327-R331 PolarHBondContact O-N 3.25Å
328L96Very high96.3Very high116 Ų11692.8 Ų92.861%0.60750%0.497SS*.Hα-helixtrans-69.2-36.3175.3-73.1171.8000112.6Q324 L325 A326 L332Q324-L328 WeakPolarHBondContact O-CB 3.38Å; Q324-L328 VanDerWaalsContact O-CG 3.31Å; Q324-L328 WeakPolarHBondContact O-CG 3.27Å; Q324-L328 PolarHBondContact O-N 2.8Å; L325-L328 PolarHBondContact O-N 3.42Å; A326-L328 VanDerWaalsContact C-N 3.33Å; A326-L328 PolarHBondContact O-N 3Å; L328-L332 WeakPolarHBondContact O-CB 3.2Å; L328-L332 PolarHBondContact O-N 2.83Å
329K96.7Very high96.3Very high125 Ų12592.8 Ų92.854%0.54350%0.497SS..Hα-helixtrans-60.9-52.7171.1-80.1171.2171.8168.80111.4L325 A326 R331 L332 D333L325-K329 HydrophobicContact CD2-CD 3.79Å; L325-K329 HydrophobicContact CD2-CG 4.19Å; L325-K329 WeakPolarHBondContact O-CG 3.24Å; L325-K329 PolarHBondContact O-N 3.49Å; A326-K329 PolarHBondContact O-N 2.8Å; K329-R331 VanDerWaalsContact C-N 3.3Å; K329-R331 PolarHBondContact O-N 3.17Å; K329-L332 WeakPolarHBondContact O-CA 3.41Å; K329-L332 WeakPolarHBondContact O-CB 3.47Å; K329-L332 PolarHBondContact O-N 3.02Å; K329-D333 PolarHBondContact O-N 3.32Å
330V97.4Very high96.4Very high78 Ų7895.3 Ų95.347%0.47350%0.499SS..Hα-helixtrans-57-43.6178.9173.80000111.4A326 L332 D333 E334A326-V330 WeakPolarHBondContact O-CG2 3.33Å; A326-V330 PolarHBondContact O-N 2.92Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 3.39Å; V330-D333 PolarHBondContact O-N 3.45Å; V330-E334 HydrophobicContact CG1-CG 4.36Å; V330-E334 WeakPolarHBondContact O-CB 3.43Å; V330-E334 VanDerWaalsContact O-CG 3.26Å; V330-E334 WeakPolarHBondContact O-CG 3.17Å; V330-E334 PolarHBondContact O-N 3.49Å
331R96.3Very high96.5Very high164 Ų16496.1 Ų96.162%0.61950%0.502SS*.Hα-helixtrans-65.9-31.1175.5-77.3-178.7174.6167.60.7114.1V327 K329 A335V327-R331 WeakPolarHBondContact O-CG 3.21Å; V327-R331 PolarHBondContact O-N 3.25Å; K329-R331 VanDerWaalsContact C-N 3.3Å; K329-R331 PolarHBondContact O-N 3.17Å; R331-A335 VanDerWaalsContact O-CB 3.28Å; R331-A335 WeakPolarHBondContact O-CB 3.36Å; R331-A335 PolarHBondContact O-N 3.41Å
332L96.4Very high96.6Very high111 Ų11199.1 Ų99.158%0.58151%0.51SS*.Hα-helixtrans-70.3-46.6173.7-176.763.4000110.2L328 K329 V330 E334 A335 D336L328-L332 WeakPolarHBondContact O-CB 3.2Å; L328-L332 PolarHBondContact O-N 2.83Å; K329-L332 WeakPolarHBondContact O-CA 3.41Å; K329-L332 WeakPolarHBondContact O-CB 3.47Å; K329-L332 PolarHBondContact O-N 3.02Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 3.39Å; L332-E334 PolarHBondContact O-N 2.81Å; L332-A335 PolarHBondContact O-N 3.15Å; L332-D336 WeakPolarHBondContact O-CB 3.22Å; L332-D336 PolarHBondContact O-N 2.83Å
333D97.1Very high96.6Very high102 Ų10298 Ų9855%0.54551%0.509SS..Hα-helixtrans-60.9-42.1176.4-65.9-41.5000111.8K329 V330 D336 Q337K329-D333 PolarHBondContact O-N 3.32Å; V330-D333 PolarHBondContact O-N 3.45Å; D333-D336 PolarHBondContact O-N 3.43Å; D333-Q337 WeakPolarHBondContact O-CB 3.27Å; D333-Q337 PolarHBondContact O-N 3.11Å
334E95.6Very high96.7Very high103 Ų103102.3 Ų102.348%0.48152%0.518SS..Hα-helixtrans-60.2-47.2171.8-76.6172.5172.800111.8V330 L332 D336 Q337 L338V330-E334 HydrophobicContact CG1-CG 4.36Å; V330-E334 WeakPolarHBondContact O-CB 3.43Å; V330-E334 VanDerWaalsContact O-CG 3.26Å; V330-E334 WeakPolarHBondContact O-CG 3.17Å; V330-E334 PolarHBondContact O-N 3.49Å; L332-E334 PolarHBondContact O-N 2.81Å; E334-D336 VanDerWaalsContact C-N 3.34Å; E334-D336 PolarHBondContact O-N 3.48Å; E334-Q337 PolarHBondContact O-N 3.27Å; E334-L338 WeakPolarHBondContact O-CB 3.21Å; E334-L338 VanDerWaalsContact O-CG 3.31Å; E334-L338 WeakPolarHBondContact O-CG 3.49Å; E334-L338 PolarHBondContact O-N 2.91Å
335A95.4Very high96.7Very high44 Ų44100.3 Ų100.336%0.36452%0.518SS..Hα-helixtrans-63.9-40.4178.100000111.8R331 L332 L338 L339R331-A335 VanDerWaalsContact O-CB 3.28Å; R331-A335 WeakPolarHBondContact O-CB 3.36Å; R331-A335 PolarHBondContact O-N 3.41Å; L332-A335 PolarHBondContact O-N 3.15Å; A335-L338 PolarHBondContact O-N 3.05Å; A335-L339 WeakPolarHBondContact O-CG 3.43Å; A335-L339 PolarHBondContact O-N 2.99Å
336D97Very high96.7Very high62 Ų62101.7 Ų101.733%0.33253%0.526SS..Hα-helixtrans-64.8-39.5175-113.936.7000111.9L332 D333 E334 L339 K340L332-D336 WeakPolarHBondContact O-CB 3.22Å; L332-D336 PolarHBondContact O-N 2.83Å; D333-D336 PolarHBondContact O-N 3.43Å; E334-D336 VanDerWaalsContact C-N 3.34Å; E334-D336 PolarHBondContact O-N 3.48Å; D336-L339 PolarHBondContact O-N 3.31Å; D336-K340 WeakPolarHBondContact O-CB 3.45Å; D336-K340 VanDerWaalsContact O-CD 3.24Å; D336-K340 WeakPolarHBondContact O-CD 3.37Å; D336-K340 WeakPolarHBondContact O-CG 3.43Å; D336-K340 PolarHBondContact O-N 2.85Å; D336-K340 IonicContact OD2-NZ 3.84Å; D336-K340 PolarHBondContact OD2-NZ 2.86Å
337Q96.6Very high96.8Very high142 Ų142105.8 Ų105.866%0.66454%0.536SS*.Hα-helixtrans-69.2-36.7175.3-167.1175.226.400111.7D333 E334 K340 S341D333-Q337 WeakPolarHBondContact O-CB 3.27Å; D333-Q337 PolarHBondContact O-N 3.11Å; E334-Q337 PolarHBondContact O-N 3.27Å; Q337-K340 PolarHBondContact O-N 2.74Å; Q337-S341 WeakPolarHBondContact O-CB 3.14Å; Q337-S341 PolarHBondContact O-N 2.98Å; Q337-S341 PolarHBondContact O-OG 3.35Å
338L97.3Very high96.7Very high105 Ų105107.8 Ų107.855%0.5554%0.54SS..Hα-helixtrans-67.3-36.2171.5-72.7171.8000112.4E334 A335 S341 R342E334-L338 WeakPolarHBondContact O-CB 3.21Å; E334-L338 VanDerWaalsContact O-CG 3.31Å; E334-L338 WeakPolarHBondContact O-CG 3.49Å; E334-L338 PolarHBondContact O-N 2.91Å; A335-L338 PolarHBondContact O-N 3.05Å; L338-S341 WeakPolarHBondContact CA-OG 3.49Å; L338-S341 PolarHBondContact O-OG 3.38Å; L338-S341 VanDerWaalsContact O-OG 3.09Å; L338-R342 WeakPolarHBondContact O-CB 3.27Å; L338-R342 VanDerWaalsContact O-CG 3.24Å; L338-R342 WeakPolarHBondContact O-CG 3.46Å; L338-R342 PolarHBondContact O-N 2.91Å
339L96.1Very high96.7Very high111 Ų111105 Ų10558%0.58153%0.534SS*.Hα-helixtrans-66.6-46.4172.1-76.4169.6000111.5A335 D336 S341 R342 S343A335-L339 WeakPolarHBondContact O-CG 3.43Å; A335-L339 PolarHBondContact O-N 2.99Å; D336-L339 PolarHBondContact O-N 3.31Å; L339-S341 PolarHBondContact O-N 3.1Å; L339-R342 PolarHBondContact O-N 2.69Å; L339-S343 PolarHBondContact O-N 2.91Å; L339-S343 PolarHBondContact O-OG 3.22Å
340K97.8Very high96.6Very high123 Ų123105.3 Ų105.354%0.53554%0.537SS..Hα-helixtrans-62.3-40.8178.8-71.7157-164.3158.70112.5D336 Q337 S343 F344D336-K340 WeakPolarHBondContact O-CB 3.45Å; D336-K340 VanDerWaalsContact O-CD 3.24Å; D336-K340 WeakPolarHBondContact O-CD 3.37Å; D336-K340 WeakPolarHBondContact O-CG 3.43Å; D336-K340 PolarHBondContact O-N 2.85Å; D336-K340 IonicContact OD2-NZ 3.84Å; D336-K340 PolarHBondContact OD2-NZ 2.86Å; Q337-K340 PolarHBondContact O-N 2.74Å; K340-S343 WeakPolarHBondContact CA-OG 3.47Å; K340-S343 PolarHBondContact O-OG 2.94Å; K340-F344 WeakPolarHBondContact O-CB 3.29Å; K340-F344 PolarHBondContact O-N 2.89Å
341S96.9Very high96.6Very high63 Ų63109 Ų10944%0.44155%0.547SS..Hα-helixtrans-69.5-38.7174.953.90000112.6Q337 L338 L339 A345Q337-S341 WeakPolarHBondContact O-CB 3.14Å; Q337-S341 PolarHBondContact O-N 2.98Å; Q337-S341 PolarHBondContact O-OG 3.35Å; L338-S341 WeakPolarHBondContact CA-OG 3.49Å; L338-S341 PolarHBondContact O-OG 3.38Å; L338-S341 VanDerWaalsContact O-OG 3.09Å; L339-S341 PolarHBondContact O-N 3.1Å; S341-A345 WeakPolarHBondContact O-CB 3.36Å; S341-A345 PolarHBondContact O-N 2.95Å
342R96.9Very high96.6Very high190 Ų190107.2 Ų107.272%0.71755%0.545SS*.Hα-helixtrans-65.8-40.9173-77177.9175.9-156.8-0.5112.8L338 L339 A345 L346L338-R342 WeakPolarHBondContact O-CB 3.27Å; L338-R342 VanDerWaalsContact O-CG 3.24Å; L338-R342 WeakPolarHBondContact O-CG 3.46Å; L338-R342 PolarHBondContact O-N 2.91Å; L339-R342 PolarHBondContact O-N 2.69Å; R342-A345 PolarHBondContact O-N 2.81Å; R342-L346 WeakPolarHBondContact O-CB 3.31Å; R342-L346 PolarHBondContact O-N 3.35Å
343S97.4Very high96.6Very high70 Ų70108.9 Ų108.949%0.4955%0.548SS..Hα-helixtrans-66.5-41177.660.20000111.7L339 K340 L346 E347L339-S343 PolarHBondContact O-N 2.91Å; L339-S343 PolarHBondContact O-OG 3.22Å; K340-S343 WeakPolarHBondContact CA-OG 3.47Å; K340-S343 PolarHBondContact O-OG 2.94Å; S343-L346 PolarHBondContact O-N 3.14Å; S343-E347 WeakPolarHBondContact O-CB 3.48Å; S343-E347 PolarHBondContact O-N 2.9Å
344F97.7Very high96.5Very high126 Ų126107.4 Ų107.455%0.55355%0.546SS*.Hα-helixtrans-60.8-47.4174.3-177.1-89.7000111.9K340 L346 E347 E348K340-F344 WeakPolarHBondContact O-CB 3.29Å; K340-F344 PolarHBondContact O-N 2.89Å; F344-L346 VanDerWaalsContact C-N 3.28Å; F344-L346 PolarHBondContact O-N 3.17Å; F344-E347 PolarHBondContact O-N 3.43Å; F344-E348 WeakPolarHBondContact O-CB 3.49Å; F344-E348 PolarHBondContact O-N 3.37Å
345A96.6Very high96.6Very high56 Ų56110.2 Ų110.246%0.46355%0.552SS.*Hα-helixtrans-63.2-32.5177.300000113S341 R342 A349S341-A345 WeakPolarHBondContact O-CB 3.36Å; S341-A345 PolarHBondContact O-N 2.95Å; R342-A345 PolarHBondContact O-N 2.81Å; A345-A349 VanDerWaalsContact O-CB 3.3Å; A345-A349 WeakPolarHBondContact O-CB 3.28Å; A345-A349 PolarHBondContact O-N 2.84Å
346L95.9Very high96.6Very high116 Ų116112.8 Ų112.861%0.60756%0.559SS**Hα-helixtrans-72.4-41.9175.9-154.4167.4000111.1R342 S343 F344 A349 Q350R342-L346 WeakPolarHBondContact O-CB 3.31Å; R342-L346 PolarHBondContact O-N 3.35Å; S343-L346 PolarHBondContact O-N 3.14Å; F344-L346 VanDerWaalsContact C-N 3.28Å; F344-L346 PolarHBondContact O-N 3.17Å; L346-A349 PolarHBondContact O-N 2.88Å; L346-Q350 VanDerWaalsContact O-CB 3.28Å; L346-Q350 WeakPolarHBondContact O-CB 3.48Å; L346-Q350 PolarHBondContact O-N 3.33Å
347E97.6Very high96.5Very high137 Ų137115.2 Ų115.264%0.6457%0.569SS**Hα-helixtrans-62-44.4173.5-172.3-178.3168.900111.7S343 F344 Q350 K351S343-E347 WeakPolarHBondContact O-CB 3.48Å; S343-E347 PolarHBondContact O-N 2.9Å; F344-E347 PolarHBondContact O-N 3.43Å; E347-Q350 PolarHBondContact O-N 2.88Å; E347-K351 WeakPolarHBondContact O-CB 3.29Å; E347-K351 PolarHBondContact O-N 2.96Å
348E96.9Very high96.4Very high119 Ų119113.8 Ų113.856%0.55656%0.563SS**Hα-helixtrans-64-44.2177-172.6160-134.800111.7F344 Q350 K351 E352F344-E348 WeakPolarHBondContact O-CB 3.49Å; F344-E348 PolarHBondContact O-N 3.37Å; E348-Q350 PolarHBondContact O-N 3.45Å; E348-K351 WeakPolarHBondContact O-CB 3.24Å; E348-K351 PolarHBondContact O-N 3.06Å; E348-E352 PolarHBondContact O-N 3.39Å
349A94.6Very high96.3Very high57 Ų57112.3 Ų112.347%0.47156%0.555SS.*Hα-helixtrans-65.1-35.2173.800000113A345 L346 K353A345-A349 VanDerWaalsContact O-CB 3.3Å; A345-A349 WeakPolarHBondContact O-CB 3.28Å; A345-A349 PolarHBondContact O-N 2.84Å; L346-A349 PolarHBondContact O-N 2.88Å; A349-K353 WeakPolarHBondContact O-CB 3.47Å; A349-K353 PolarHBondContact O-N 2.9Å
350Q96.3Very high96.2Very high132 Ų132113.4 Ų113.462%0.61756%0.557SS**Hα-helixtrans-68.3-36174.8-179.5170.3-32.200111.6L346 E347 E348 S354L346-Q350 VanDerWaalsContact O-CB 3.28Å; L346-Q350 WeakPolarHBondContact O-CB 3.48Å; L346-Q350 PolarHBondContact O-N 3.33Å; E347-Q350 PolarHBondContact O-N 2.88Å; E348-Q350 PolarHBondContact O-N 3.45Å; Q350-S354 PolarHBondContact O-N 3.26Å; Q350-S354 PolarHBondContact O-OG 3.4Å
351K97Very high96.1Very high155 Ų155111.7 Ų111.767%0.67456%0.557SS**Hα-helixtrans-71.6-38.2174.4-177.1-179.6179.7-179.40112.6E347 E348 S354 R355E347-K351 WeakPolarHBondContact O-CB 3.29Å; E347-K351 PolarHBondContact O-N 2.96Å; E348-K351 WeakPolarHBondContact O-CB 3.24Å; E348-K351 PolarHBondContact O-N 3.06Å; K351-S354 PolarHBondContact O-N 3.05Å; K351-S354 PolarHBondContact O-OG 3.4Å; K351-R355 WeakPolarHBondContact O-CB 3.4Å; K351-R355 PolarHBondContact O-N 3.42Å
352E95.8Very high96Very high127 Ų127113.6 Ų113.659%0.59356%0.559SS**Hα-helixtrans-65.4-43.4171.6-175.9169.5-140.300110.8E348 S354 R355 I356E348-E352 PolarHBondContact O-N 3.39Å; E352-S354 PolarHBondContact O-N 2.84Å; E352-R355 PolarHBondContact O-N 3.24Å; E352-I356 HydrophobicContact CG-CD1 3.86Å; E352-I356 HydrophobicContact CG-CG1 4.45Å; E352-I356 WeakPolarHBondContact O-CG1 3.32Å; E352-I356 PolarHBondContact O-N 3.48Å
353K95.9Very high95.9Very high146 Ų146106.6 Ų106.664%0.63555%0.546SS*.Hα-helixtrans-59.5-45.4173.6-179.8-179.8176.4-177.60112.6A349 R355 I356 M357A349-K353 WeakPolarHBondContact O-CB 3.47Å; A349-K353 PolarHBondContact O-N 2.9Å; K353-R355 VanDerWaalsContact C-N 3.34Å; K353-I356 PolarHBondContact O-N 3.44Å; K353-M357 WeakPolarHBondContact O-CG 3.17Å; K353-M357 PolarHBondContact O-N 3.5Å
354S96.1Very high95.7Very high71 Ų71106.5 Ų106.550%0.49755%0.545SS..Hα-helixtrans-65.8-38.9179.365.80000111.6Q350 K351 E352 M357 Q358Q350-S354 PolarHBondContact O-N 3.26Å; Q350-S354 PolarHBondContact O-OG 3.4Å; K351-S354 PolarHBondContact O-N 3.05Å; K351-S354 PolarHBondContact O-OG 3.4Å; E352-S354 PolarHBondContact O-N 2.84Å; S354-M357 PolarHBondContact O-N 3.38Å; S354-Q358 PolarHBondContact O-N 3.34Å
355R97Very high95.6Very high162 Ų162104.2 Ų104.261%0.61155%0.545SS*.Hα-helixtrans-60.5-50.2171.5-179.6-175.2169.3-178.21.8112.2K351 E352 K353 M357 Q358 D359K351-R355 WeakPolarHBondContact O-CB 3.4Å; K351-R355 PolarHBondContact O-N 3.42Å; E352-R355 PolarHBondContact O-N 3.24Å; K353-R355 VanDerWaalsContact C-N 3.34Å; R355-M357 PolarHBondContact O-N 2.87Å; R355-Q358 CarbonylContact O-C 3.55Å; R355-Q358 WeakPolarHBondContact O-CA 3.15Å; R355-Q358 WeakPolarHBondContact O-CB 3.28Å; R355-Q358 PolarHBondContact O-N 2.86Å; R355-D359 IonicContact NE-OD2 2.74Å; R355-D359 PolarHBondContact NE-OD2 3.37Å; R355-D359 IonicContact NH2-OD2 3.59Å; R355-D359 WeakPolarHBondContact O-CB 3.33Å; R355-D359 VanDerWaalsContact O-CG 3.31Å; R355-D359 PolarHBondContact O-N 3.03Å
356I95.5Very high95.4Very high99 Ų99107.3 Ų107.351%0.50855%0.551SS.*Hα-helixtrans-60-38.1179.5-69.4166.8000111E352 K353 H360E352-I356 HydrophobicContact CG-CD1 3.86Å; E352-I356 HydrophobicContact CG-CG1 4.45Å; E352-I356 WeakPolarHBondContact O-CG1 3.32Å; E352-I356 PolarHBondContact O-N 3.48Å; K353-I356 PolarHBondContact O-N 3.44Å; I356-H360 VanDerWaalsContact O-CB 3.23Å; I356-H360 WeakPolarHBondContact O-CB 3.26Å; I356-H360 PolarHBondContact O-N 2.82Å
357M94.7Very high95.3Very high113 Ų113107.4 Ų107.456%0.55755%0.549SS*.Hα-helixtrans-65.7-38.4173.6-72-62.4-54.600112.7K353 S354 R355 T361K353-M357 WeakPolarHBondContact O-CG 3.17Å; K353-M357 PolarHBondContact O-N 3.5Å; S354-M357 PolarHBondContact O-N 3.38Å; R355-M357 PolarHBondContact O-N 2.87Å; M357-T361 WeakPolarHBondContact O-CB 3.1Å; M357-T361 PolarHBondContact O-N 2.82Å; M357-T361 PolarHBondContact O-OG1 3.5Å
358Q95.2Very high95.3Very high111 Ų111104.3 Ų104.352%0.51954%0.542SS..Hα-helixtrans-67-53.7174.1179.5174.4-9.900111.2S354 R355 H360 T361 E362S354-Q358 PolarHBondContact O-N 3.34Å; R355-Q358 CarbonylContact O-C 3.55Å; R355-Q358 WeakPolarHBondContact O-CA 3.15Å; R355-Q358 WeakPolarHBondContact O-CB 3.28Å; R355-Q358 PolarHBondContact O-N 2.86Å; Q358-H360 PolarHBondContact O-N 3.1Å; Q358-T361 CarbonylContact O-C 3.6Å; Q358-T361 WeakPolarHBondContact O-CA 3.31Å; Q358-T361 WeakPolarHBondContact O-CB 3.35Å; Q358-T361 PolarHBondContact O-N 3.37Å; Q358-E362 HydrophobicContact CG-CG 4.36Å; Q358-E362 VanDerWaalsContact CG-OE1 3.27Å; Q358-E362 WeakPolarHBondContact CG-OE1 3.26Å; Q358-E362 PolarHBondContact NE2-OE1 2.89Å; Q358-E362 PolarHBondContact O-N 2.84Å
359D95.1Very high95.2Very high75 Ų75104.1 Ų104.140%0.40154%0.541SS..Hα-helixtrans-54.4-38.7178.3-66.6-3.4000110.8R355 G363R355-D359 IonicContact NE-OD2 2.74Å; R355-D359 PolarHBondContact NE-OD2 3.37Å; R355-D359 IonicContact NH2-OD2 3.59Å; R355-D359 WeakPolarHBondContact O-CB 3.33Å; R355-D359 VanDerWaalsContact O-CG 3.31Å; R355-D359 PolarHBondContact O-N 3.03Å; D359-G363 PolarHBondContact O-N 3.39Å
360H93.9Very high95.3Very high134 Ų134103.6 Ų103.662%0.6254%0.537SS*.Hα-helixtrans-71.6-35.8173.7-173.5-71.1000113.4I356 Q358 S364I356-H360 VanDerWaalsContact O-CB 3.23Å; I356-H360 WeakPolarHBondContact O-CB 3.26Å; I356-H360 PolarHBondContact O-N 2.82Å; Q358-H360 PolarHBondContact O-N 3.1Å; H360-S364 VanDerWaalsContact O-CB 3.22Å; H360-S364 WeakPolarHBondContact O-CB 3.49Å; H360-S364 PolarHBondContact O-N 3.39Å
361T95.1Very high95.2Very high87 Ų87101 Ų10153%0.53453%0.526SS..Hα-helixtrans-70.4-43177.9-58.40000110.9M357 Q358 S364 S365M357-T361 WeakPolarHBondContact O-CB 3.1Å; M357-T361 PolarHBondContact O-N 2.82Å; M357-T361 PolarHBondContact O-OG1 3.5Å; Q358-T361 CarbonylContact O-C 3.6Å; Q358-T361 WeakPolarHBondContact O-CA 3.31Å; Q358-T361 WeakPolarHBondContact O-CB 3.35Å; Q358-T361 PolarHBondContact O-N 3.37Å; T361-S364 PolarHBondContact O-N 3.29Å; T361-S365 WeakPolarHBondContact O-CB 3.49Å; T361-S365 PolarHBondContact O-N 2.85Å
362E94.7Very high95.2Very high103 Ų10399.8 Ų99.848%0.48152%0.524SS..Hα-helixtrans-63.9-45.6173-68.8-179.6-162.100111Q358 S364 S365 M366Q358-E362 HydrophobicContact CG-CG 4.36Å; Q358-E362 VanDerWaalsContact CG-OE1 3.27Å; Q358-E362 WeakPolarHBondContact CG-OE1 3.26Å; Q358-E362 PolarHBondContact NE2-OE1 2.89Å; Q358-E362 PolarHBondContact O-N 2.84Å; E362-S364 PolarHBondContact O-N 3.49Å; E362-S365 WeakPolarHBondContact O-CB 3.3Å; E362-S365 PolarHBondContact O-N 3.47Å; E362-M366 WeakPolarHBondContact O-CB 3.42Å; E362-M366 VanDerWaalsContact O-CG 3.32Å; E362-M366 WeakPolarHBondContact O-CG 3.31Å; E362-M366 PolarHBondContact O-N 3.3Å
363G94.1Very high95.2Very high43 Ų43100.1 Ų100.144%0.44352%0.523SS..Hα-helixtrans-59.4-42.2174.400000113.5D359 H367D359-G363 PolarHBondContact O-N 3.39Å; G363-H367 WeakPolarHBondContact O-CB 3.43Å; G363-H367 PolarHBondContact O-N 3.32Å
364S93.9Very high95.2Very high68 Ų6898.5 Ų98.548%0.47652%0.52SS..Hα-helixtrans-65.6-42.5175.2-171.90000112H360 T361 E362 H367 S368H360-S364 VanDerWaalsContact O-CB 3.22Å; H360-S364 WeakPolarHBondContact O-CB 3.49Å; H360-S364 PolarHBondContact O-N 3.39Å; T361-S364 PolarHBondContact O-N 3.29Å; E362-S364 PolarHBondContact O-N 3.49Å; S364-H367 PolarHBondContact O-N 3.42Å; S364-S368 WeakPolarHBondContact O-CB 3.15Å; S364-S368 PolarHBondContact O-N 3.27Å
365S95.6Very high95.2Very high78 Ų78100.1 Ų100.155%0.54552%0.52SS..Hα-helixtrans-61.3-49.3175.4-174.70000111.8T361 E362 H367 S368 Q369T361-S365 WeakPolarHBondContact O-CB 3.49Å; T361-S365 PolarHBondContact O-N 2.85Å; E362-S365 WeakPolarHBondContact O-CB 3.3Å; E362-S365 PolarHBondContact O-N 3.47Å; S365-H367 VanDerWaalsContact C-N 3.31Å; S365-H367 PolarHBondContact O-N 3.01Å; S365-S368 WeakPolarHBondContact O-CB 3.49Å; S365-S368 PolarHBondContact O-N 2.93Å; S365-Q369 PolarHBondContact O-N 3.2Å
366M93.5Very high95.2Very high120 Ų12097.9 Ų97.959%0.59152%0.516SS*.Hα-helixtrans-62.4-36.6176.2-69.7-59.3-59.500112.3E362 A370E362-M366 WeakPolarHBondContact O-CB 3.42Å; E362-M366 VanDerWaalsContact O-CG 3.32Å; E362-M366 WeakPolarHBondContact O-CG 3.31Å; E362-M366 PolarHBondContact O-N 3.3Å; M366-A370 VanDerWaalsContact O-CB 3.31Å; M366-A370 WeakPolarHBondContact O-CB 3.49Å; M366-A370 PolarHBondContact O-N 3.02Å
367H93.6Very high95.2Very high119 Ų119100.5 Ų100.555%0.55152%0.52SS*.Hα-helixtrans-67.7-42.9174-174.161000111.9G363 S364 S365 A370 L371G363-H367 WeakPolarHBondContact O-CB 3.43Å; G363-H367 PolarHBondContact O-N 3.32Å; S364-H367 PolarHBondContact O-N 3.42Å; S365-H367 VanDerWaalsContact C-N 3.31Å; S365-H367 PolarHBondContact O-N 3.01Å; H367-A370 PolarHBondContact O-N 2.86Å; H367-L371 WeakPolarHBondContact O-CG 3.44Å; H367-L371 PolarHBondContact O-N 2.98Å
368S96.3Very high95.2Very high72 Ų7299.8 Ų99.850%0.50352%0.518SS..Hα-helixtrans-60.5-46175.2-167.90000111.6S364 S365 A370 L371 E372S364-S368 WeakPolarHBondContact O-CB 3.15Å; S364-S368 PolarHBondContact O-N 3.27Å; S365-S368 WeakPolarHBondContact O-CB 3.49Å; S365-S368 PolarHBondContact O-N 2.93Å; S368-A370 VanDerWaalsContact C-N 3.34Å; S368-A370 PolarHBondContact O-N 2.99Å; S368-L371 PolarHBondContact O-N 2.9Å; S368-E372 WeakPolarHBondContact O-CB 3.47Å; S368-E372 PolarHBondContact O-N 3.22Å
369Q96.2Very high95.3Very high114 Ų114101.6 Ų101.653%0.53352%0.52SS..Hα-helixtrans-64.7-36.9176.6-168.9-176.552.900112.1S365 K373S365-Q369 PolarHBondContact O-N 3.2Å; Q369-K373 VanDerWaalsContact O-CB 3.28Å; Q369-K373 WeakPolarHBondContact O-CB 3.29Å; Q369-K373 PolarHBondContact O-N 3.13Å
370A95.5Very high95.4Very high46 Ų46102.3 Ų102.338%0.3852%0.521SS..Hα-helixtrans-65.9-41.7174.300000112M366 H367 S368 I374M366-A370 VanDerWaalsContact O-CB 3.31Å; M366-A370 WeakPolarHBondContact O-CB 3.49Å; M366-A370 PolarHBondContact O-N 3.02Å; H367-A370 PolarHBondContact O-N 2.86Å; S368-A370 VanDerWaalsContact C-N 3.34Å; S368-A370 PolarHBondContact O-N 2.99Å; A370-I374 WeakPolarHBondContact O-CB 3.43Å; A370-I374 WeakPolarHBondContact O-CD1 3.42Å; A370-I374 VanDerWaalsContact O-CG1 3.24Å; A370-I374 WeakPolarHBondContact O-CG1 3.39Å; A370-I374 PolarHBondContact O-N 2.98Å
371L95.2Very high95.4Very high77 Ų7798.2 Ų98.240%0.40351%0.51SS..Hα-helixtrans-64.4-45.2174.3-73.1176000111.9H367 S368 K373 I374 Q375H367-L371 WeakPolarHBondContact O-CG 3.44Å; H367-L371 PolarHBondContact O-N 2.98Å; S368-L371 PolarHBondContact O-N 2.9Å; L371-K373 PolarHBondContact O-N 3.32Å; L371-I374 PolarHBondContact O-N 3.07Å; L371-Q375 WeakPolarHBondContact O-CG 3.47Å; L371-Q375 PolarHBondContact O-N 3.03Å
372E96.5Very high95.4Very high131 Ų13198.5 Ų98.561%0.61251%0.505SS*.Hα-helixtrans-58.9-46.8176.7-177.1170.6-144.100111.1S368 I374 Q375 E376S368-E372 WeakPolarHBondContact O-CB 3.47Å; S368-E372 PolarHBondContact O-N 3.22Å; E372-I374 VanDerWaalsContact C-N 3.32Å; E372-I374 PolarHBondContact O-N 3.31Å; E372-Q375 CarbonylContact O-C 3.6Å; E372-Q375 WeakPolarHBondContact O-CB 3.31Å; E372-Q375 PolarHBondContact O-N 3.21Å; E372-Q375 VanDerWaalsContact O-N 3.12Å; E372-E376 PolarHBondContact O-N 3.36Å
373K96.6Very high95.5Very high134 Ų13497.8 Ų97.858%0.58350%0.504SS*.Hα-helixtrans-63.7-33.5175.7-169169-171.7166.90113.2Q369 L371 R377Q369-K373 VanDerWaalsContact O-CB 3.28Å; Q369-K373 WeakPolarHBondContact O-CB 3.29Å; Q369-K373 PolarHBondContact O-N 3.13Å; L371-K373 PolarHBondContact O-N 3.32Å; K373-R377 WeakPolarHBondContact O-CB 3.35Å; K373-R377 WeakPolarHBondContact O-CG 3.42Å; K373-R377 PolarHBondContact O-N 3.02Å
374I94.6Very high95.6Very high112 Ų11298.6 Ų98.657%0.57450%0.503SS*.Hα-helixtrans-69.7-39.8172.8-71.8164.5000110.8A370 L371 E372 R377 L378A370-I374 WeakPolarHBondContact O-CB 3.43Å; A370-I374 WeakPolarHBondContact O-CD1 3.42Å; A370-I374 VanDerWaalsContact O-CG1 3.24Å; A370-I374 WeakPolarHBondContact O-CG1 3.39Å; A370-I374 PolarHBondContact O-N 2.98Å; L371-I374 PolarHBondContact O-N 3.07Å; E372-I374 VanDerWaalsContact C-N 3.32Å; E372-I374 PolarHBondContact O-N 3.31Å; I374-R377 PolarHBondContact O-N 2.81Å; I374-L378 WeakPolarHBondContact O-CB 3.44Å; I374-L378 PolarHBondContact O-N 3.4Å
375Q96.1Very high95.7Very high104 Ų10498.7 Ų98.749%0.48650%0.501SS..Hα-helixtrans-67.4-35174.7-69.6179.628.400112.7L371 E372 R379L371-Q375 WeakPolarHBondContact O-CG 3.47Å; L371-Q375 PolarHBondContact O-N 3.03Å; E372-Q375 CarbonylContact O-C 3.6Å; E372-Q375 WeakPolarHBondContact O-CB 3.31Å; E372-Q375 PolarHBondContact O-N 3.21Å; E372-Q375 VanDerWaalsContact O-N 3.12Å; Q375-R379 WeakPolarHBondContact O-CG 3.45Å; Q375-R379 PolarHBondContact O-N 3.09Å
376E96.6Very high95.7Very high116 Ų116102.4 Ų102.454%0.54250%0.503SS..Hα-helixtrans-63.9-52.9172.1-177.3178.1-129.600110.5E372 L378 R379 E380E372-E376 PolarHBondContact O-N 3.36Å; E376-L378 VanDerWaalsContact C-N 3.27Å; E376-L378 PolarHBondContact O-N 2.86Å; E376-R379 PolarHBondContact O-N 2.91Å; E376-R379 VanDerWaalsContact O-N 3.08Å; E376-E380 PolarHBondContact O-N 3.47Å
377R95.9Very high95.8Very high153 Ų153104.4 Ų104.458%0.57750%0.504SS*.Hα-helixtrans-58.4-36.2175.5-72.3-50-158-178.30.4113.2K373 I374 E380 A381K373-R377 WeakPolarHBondContact O-CB 3.35Å; K373-R377 WeakPolarHBondContact O-CG 3.42Å; K373-R377 PolarHBondContact O-N 3.02Å; I374-R377 PolarHBondContact O-N 2.81Å; R377-E380 WeakPolarHBondContact CD-OE2 3.37Å; R377-E380 IonicContact CZ-OE2 3.99Å; R377-E380 IonicContact NE-OE2 3.13Å; R377-E380 IonicContact NH1-OE1 2.75Å; R377-E380 IonicContact NH1-OE2 2.72Å; R377-E380 PolarHBondContact NH1-OE2 3.43Å; R377-A381 WeakPolarHBondContact O-CB 3.47Å; R377-A381 PolarHBondContact O-N 2.95Å
378L95.5Very high95.8Very high99 Ų99103.3 Ų103.352%0.51850%0.499SS..Hα-helixtrans-64.4-46.3174-179.361.8000111.2I374 E376 A381 E382I374-L378 WeakPolarHBondContact O-CB 3.44Å; I374-L378 PolarHBondContact O-N 3.4Å; E376-L378 VanDerWaalsContact C-N 3.27Å; E376-L378 PolarHBondContact O-N 2.86Å; L378-A381 PolarHBondContact O-N 2.87Å; L378-E382 WeakPolarHBondContact O-CG 3.26Å; L378-E382 PolarHBondContact O-N 3.38Å
379R96.9Very high95.7Very high149 Ų149104.6 Ų104.656%0.56250%0.497SS*.Hα-helixtrans-64.1-39.1175.4-77-175.8173.797.8-1.8112.8Q375 E376 A381 E382 L383Q375-R379 WeakPolarHBondContact O-CG 3.45Å; Q375-R379 PolarHBondContact O-N 3.09Å; E376-R379 PolarHBondContact O-N 2.91Å; E376-R379 VanDerWaalsContact O-N 3.08Å; R379-A381 VanDerWaalsContact C-N 3.34Å; R379-E382 PolarHBondContact O-N 2.85Å; R379-L383 VanDerWaalsContact O-CB 3.31Å; R379-L383 WeakPolarHBondContact O-CB 3.47Å; R379-L383 WeakPolarHBondContact O-CG 3.31Å; R379-L383 PolarHBondContact O-N 3.34Å
380E96.7Very high95.7Very high90 Ų90102.5 Ų102.542%0.42149%0.49SS..Hα-helixtrans-59-46173.2-73.8-175.8142.400111.5E376 R377 L383 S384E376-E380 PolarHBondContact O-N 3.47Å; R377-E380 WeakPolarHBondContact CD-OE2 3.37Å; R377-E380 IonicContact CZ-OE2 3.99Å; R377-E380 IonicContact NE-OE2 3.13Å; R377-E380 IonicContact NH1-OE1 2.75Å; R377-E380 IonicContact NH1-OE2 2.72Å; R377-E380 PolarHBondContact NH1-OE2 3.43Å; E380-L383 CarbonylContact O-C 3.59Å; E380-L383 PolarHBondContact O-N 2.84Å; E380-S384 PolarHBondContact O-N 3.44Å
381A93.6Very high95.7Very high48 Ų48102.7 Ų102.740%0.39749%0.488SS..Hα-helixtrans-67.5-42.5178.700000112.6R377 L378 R379 L383 S384 V385R377-A381 WeakPolarHBondContact O-CB 3.47Å; R377-A381 PolarHBondContact O-N 2.95Å; L378-A381 PolarHBondContact O-N 2.87Å; R379-A381 VanDerWaalsContact C-N 3.34Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 3.43Å; A381-S384 WeakPolarHBondContact CA-OG 3.36Å; A381-S384 PolarHBondContact O-N 3.06Å; A381-S384 PolarHBondContact O-OG 3.19Å; A381-V385 WeakPolarHBondContact O-CB 3.39Å; A381-V385 WeakPolarHBondContact O-CG2 3.45Å; A381-V385 PolarHBondContact O-N 3.26Å
382E96.4Very high95.7Very high93 Ų93105.4 Ų105.444%0.43549%0.494SS..Hα-helixtrans-59.4-40.7172.3-75.4179.5-166.800111.5L378 R379 R386L378-E382 WeakPolarHBondContact O-CG 3.26Å; L378-E382 PolarHBondContact O-N 3.38Å; R379-E382 PolarHBondContact O-N 2.85Å; E382-R386 WeakPolarHBondContact O-CB 3.31Å; E382-R386 VanDerWaalsContact O-CG 3.3Å; E382-R386 WeakPolarHBondContact O-CG 3.45Å; E382-R386 PolarHBondContact O-N 2.89Å
383L97.4Very high95.7Very high87 Ų87106.3 Ų106.346%0.45549%0.492SS..Hα-helixtrans-72.7-31.5176.9-71.3171.3000112.8R379 E380 A381 R387R379-L383 VanDerWaalsContact O-CB 3.31Å; R379-L383 WeakPolarHBondContact O-CB 3.47Å; R379-L383 WeakPolarHBondContact O-CG 3.31Å; R379-L383 PolarHBondContact O-N 3.34Å; E380-L383 CarbonylContact O-C 3.59Å; E380-L383 PolarHBondContact O-N 2.84Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 3.43Å; L383-R387 VanDerWaalsContact C-NH1 3.29Å; L383-R387 VanDerWaalsContact O-CG 3.26Å; L383-R387 WeakPolarHBondContact O-CG 3.38Å; L383-R387 PolarHBondContact O-N 2.91Å; L383-R387 VanDerWaalsContact O-N 3.15Å; L383-R387 PolarHBondContact O-NH1 3.02Å; L383-R387 VanDerWaalsContact O-NH1 3.16Å
384S95.7Very high95.7Very high61 Ų61106.1 Ų106.143%0.42749%0.493SS..Hα-helixtrans-69.7-45.6172.766.20000110.9E380 A381 R386 R387 E388E380-S384 PolarHBondContact O-N 3.44Å; A381-S384 WeakPolarHBondContact CA-OG 3.36Å; A381-S384 PolarHBondContact O-N 3.06Å; A381-S384 PolarHBondContact O-OG 3.19Å; S384-R386 VanDerWaalsContact C-N 3.33Å; S384-R386 PolarHBondContact O-N 3.43Å; S384-R387 PolarHBondContact O-N 3.44Å; S384-E388 PolarHBondContact O-N 2.9Å
385V94.5Very high95.7Very high70 Ų70104.4 Ų104.442%0.42448%0.484SS..Hα-helixtrans-60.7-40.2176.2171.60000111.5A381 E388 Q389A381-V385 WeakPolarHBondContact O-CB 3.39Å; A381-V385 WeakPolarHBondContact O-CG2 3.45Å; A381-V385 PolarHBondContact O-N 3.26Å; V385-E388 PolarHBondContact O-N 3.32Å; V385-Q389 HydrophobicContact CG1-CG 4.41Å; V385-Q389 WeakPolarHBondContact O-CB 3.46Å; V385-Q389 VanDerWaalsContact O-CG 3.31Å; V385-Q389 WeakPolarHBondContact O-CG 3.41Å; V385-Q389 PolarHBondContact O-N 2.9Å
386R96.7Very high95.5Very high155 Ų155105.9 Ų105.959%0.58549%0.49SS*.Hα-helixtrans-62.6-46.5173.8-76.2178-171.3-143.36112.5E382 S384 E388 Q389 D390E382-R386 WeakPolarHBondContact O-CB 3.31Å; E382-R386 VanDerWaalsContact O-CG 3.3Å; E382-R386 WeakPolarHBondContact O-CG 3.45Å; E382-R386 PolarHBondContact O-N 2.89Å; S384-R386 VanDerWaalsContact C-N 3.33Å; S384-R386 PolarHBondContact O-N 3.43Å; R386-E388 VanDerWaalsContact C-N 3.28Å; R386-E388 PolarHBondContact O-N 2.94Å; R386-Q389 PolarHBondContact O-N 3.01Å; R386-D390 PolarHBondContact O-N 3.42Å
387R95.6Very high95.5Very high162 Ų162103.4 Ų103.461%0.61149%0.486SS*.Hα-helixtrans-59.9-39.5176.1-71.1174.8-164.8109.8-9.5111.6L383 S384 S391L383-R387 VanDerWaalsContact C-NH1 3.29Å; L383-R387 VanDerWaalsContact O-CG 3.26Å; L383-R387 WeakPolarHBondContact O-CG 3.38Å; L383-R387 PolarHBondContact O-N 2.91Å; L383-R387 VanDerWaalsContact O-N 3.15Å; L383-R387 PolarHBondContact O-NH1 3.02Å; L383-R387 VanDerWaalsContact O-NH1 3.16Å; S384-R387 PolarHBondContact O-N 3.44Å; R387-S391 WeakPolarHBondContact O-CB 3.2Å; R387-S391 PolarHBondContact O-N 2.96Å
388E93.1Very high95.5Very high96 Ų96100.2 Ų100.245%0.44948%0.478SS..Hα-helixtrans-66.9-46.7177-153.1-169.8154.800111.3S384 V385 R386 D390 S391 Y392S384-E388 PolarHBondContact O-N 2.9Å; V385-E388 PolarHBondContact O-N 3.32Å; R386-E388 VanDerWaalsContact C-N 3.28Å; R386-E388 PolarHBondContact O-N 2.94Å; E388-D390 VanDerWaalsContact C-N 3.34Å; E388-D390 PolarHBondContact O-N 3.4Å; E388-S391 PolarHBondContact O-N 3.29Å; E388-S391 VanDerWaalsContact O-N 3.16Å; E388-S391 PolarHBondContact O-OG 2.92Å; E388-Y392 HydrophobicContact CG-CD2 4.16Å; E388-Y392 HydrophobicContact CG-CE2 3.59Å; E388-Y392 WeakPolarHBondContact O-CD2 3.45Å; E388-Y392 PolarHBondContact O-N 3.39Å; E388-Y392 WeakPolarHBondContact OE1-CE2 3.5Å; E388-Y392 PolarHBondContact OE1-OH 2.87Å
389Q95.1Very high95.4Very high99 Ų99102.5 Ų102.546%0.46348%0.48SS..Hα-helixtrans-58.1-42.6174.3-75.3177.76.100112.8V385 R386 Y392 R393V385-Q389 HydrophobicContact CG1-CG 4.41Å; V385-Q389 WeakPolarHBondContact O-CB 3.46Å; V385-Q389 VanDerWaalsContact O-CG 3.31Å; V385-Q389 WeakPolarHBondContact O-CG 3.41Å; V385-Q389 PolarHBondContact O-N 2.9Å; R386-Q389 PolarHBondContact O-N 3.01Å; Q389-Y392 PolarHBondContact O-N 3.25Å; Q389-R393 WeakPolarHBondContact O-CG 3.28Å; Q389-R393 PolarHBondContact O-N 2.93Å
390D96Very high95.3Very high71 Ų7198.2 Ų98.238%0.3848%0.477SS..Hα-helixtrans-72.1-31.3177.8-69.7-30.3000111.9R386 E388 R393 Q394R386-D390 PolarHBondContact O-N 3.42Å; E388-D390 VanDerWaalsContact C-N 3.34Å; E388-D390 PolarHBondContact O-N 3.4Å; D390-R393 PolarHBondContact O-N 3.05Å; D390-R393 IonicContact OD1-CZ 3.67Å; D390-R393 IonicContact OD1-NH1 3.49Å; D390-R393 PolarHBondContact OD1-NH1 3.01Å; D390-Q394 VanDerWaalsContact O-CG 3.29Å; D390-Q394 WeakPolarHBondContact O-CG 3.43Å; D390-Q394 PolarHBondContact O-N 3.45Å
391S95.8Very high95.3Very high50 Ų5098.3 Ų98.335%0.3548%0.48SS..Hα-helixtrans-68.4-39.7170.277.70000112.6R387 E388 R393 Q394 M395R387-S391 WeakPolarHBondContact O-CB 3.2Å; R387-S391 PolarHBondContact O-N 2.96Å; E388-S391 PolarHBondContact O-N 3.29Å; E388-S391 VanDerWaalsContact O-N 3.16Å; E388-S391 PolarHBondContact O-OG 2.92Å; S391-R393 VanDerWaalsContact C-N 3.33Å; S391-R393 PolarHBondContact O-N 3.48Å; S391-Q394 PolarHBondContact O-N 2.87Å; S391-M395 WeakPolarHBondContact O-CG 3.3Å; S391-M395 PolarHBondContact O-N 3.34Å
392Y94Very high95.4Very high133 Ų133102 Ų10252%0.52248%0.484SS..Hα-helixtrans-63-38.8172.2-75-58.5000111.6E388 Q389 M395 Q396E388-Y392 HydrophobicContact CG-CD2 4.16Å; E388-Y392 HydrophobicContact CG-CE2 3.59Å; E388-Y392 WeakPolarHBondContact O-CD2 3.45Å; E388-Y392 PolarHBondContact O-N 3.39Å; E388-Y392 WeakPolarHBondContact OE1-CE2 3.5Å; E388-Y392 PolarHBondContact OE1-OH 2.87Å; Q389-Y392 PolarHBondContact O-N 3.25Å; Y392-M395 PolarHBondContact O-N 3.28Å; Y392-Q396 WeakPolarHBondContact O-CB 3.14Å; Y392-Q396 VanDerWaalsContact O-CG 3.27Å; Y392-Q396 WeakPolarHBondContact O-CG 3.47Å; Y392-Q396 PolarHBondContact O-N 3.26Å
393R96.6Very high95.3Very high150 Ų150102.4 Ų102.457%0.56649%0.488SS*.Hα-helixtrans-63.7-42.8173.5-75.1168.1172.6156.8-1.6112.4Q389 D390 S391 Q396 S397Q389-R393 WeakPolarHBondContact O-CG 3.28Å; Q389-R393 PolarHBondContact O-N 2.93Å; D390-R393 PolarHBondContact O-N 3.05Å; D390-R393 IonicContact OD1-CZ 3.67Å; D390-R393 IonicContact OD1-NH1 3.49Å; D390-R393 PolarHBondContact OD1-NH1 3.01Å; S391-R393 VanDerWaalsContact C-N 3.33Å; S391-R393 PolarHBondContact O-N 3.48Å; R393-Q396 PolarHBondContact O-N 2.89Å; R393-S397 PolarHBondContact O-N 2.96Å
394Q96.8Very high95.2Very high131 Ų13199.9 Ų99.961%0.61248%0.484SS*.Hα-helixtrans-61.5-48.2175.3-74.3168.75.500110.8D390 S391 Q396 S397 E398D390-Q394 VanDerWaalsContact O-CG 3.29Å; D390-Q394 WeakPolarHBondContact O-CG 3.43Å; D390-Q394 PolarHBondContact O-N 3.45Å; S391-Q394 PolarHBondContact O-N 2.87Å; Q394-Q396 PolarHBondContact O-N 2.91Å; Q394-S397 WeakPolarHBondContact O-CB 3.44Å; Q394-S397 PolarHBondContact O-N 3.26Å; Q394-E398 PolarHBondContact O-N 2.83Å
395M94.6Very high95.3Very high76 Ų76103.2 Ų103.237%0.37449%0.491SS..Hα-helixtrans-60.1-42.2175-70.2-59.8-57.300112.4S391 Y392 E398 Y399S391-M395 WeakPolarHBondContact O-CG 3.3Å; S391-M395 PolarHBondContact O-N 3.34Å; Y392-M395 PolarHBondContact O-N 3.28Å; M395-E398 PolarHBondContact O-N 3Å; M395-Y399 HydrophobicContact CB-CE2 4.45Å; M395-Y399 HydrophobicContact CE-CE2 3.7Å; M395-Y399 WeakPolarHBondContact O-CD2 3.2Å; M395-Y399 PolarHBondContact O-N 3.46Å
396Q93.1Very high95.3Very high135 Ų135105 Ų10563%0.63150%0.497SS*.Hα-helixtrans-62.6-41.3175.1-77.71750.800112.2Y392 R393 Q394 Y399 A400Y392-Q396 WeakPolarHBondContact O-CB 3.14Å; Y392-Q396 VanDerWaalsContact O-CG 3.27Å; Y392-Q396 WeakPolarHBondContact O-CG 3.47Å; Y392-Q396 PolarHBondContact O-N 3.26Å; R393-Q396 PolarHBondContact O-N 2.89Å; Q394-Q396 PolarHBondContact O-N 2.91Å; Q396-Y399 PolarHBondContact O-N 3.15Å; Q396-A400 WeakPolarHBondContact O-CB 3.4Å; Q396-A400 PolarHBondContact O-N 3.07Å
397S95.4Very high95.2Very high64 Ų64103.2 Ų103.245%0.44850%0.496SS..Hα-helixtrans-62.2-47.6173.5-1640000111R393 Q394 Y399 A400 D401R393-S397 PolarHBondContact O-N 2.96Å; Q394-S397 WeakPolarHBondContact O-CB 3.44Å; Q394-S397 PolarHBondContact O-N 3.26Å; S397-Y399 VanDerWaalsContact C-N 3.33Å; S397-Y399 PolarHBondContact O-N 2.94Å; S397-A400 PolarHBondContact O-N 2.8Å; S397-A400 VanDerWaalsContact O-N 3.14Å; S397-D401 WeakPolarHBondContact O-CB 3.45Å; S397-D401 PolarHBondContact O-N 3.49Å
398E96.7Very high95.2Very high86 Ų8698.1 Ų98.140%0.40249%0.488SS..Hα-helixtrans-60.4-39.7176.8-79.2-161.8-13600112.8Q394 M395 D401 R402Q394-E398 PolarHBondContact O-N 2.83Å; M395-E398 PolarHBondContact O-N 3Å; E398-D401 PolarHBondContact O-N 2.75Å; E398-R402 VanDerWaalsContact O-CB 3.31Å; E398-R402 WeakPolarHBondContact O-CB 3.24Å; E398-R402 WeakPolarHBondContact O-CD 3.33Å; E398-R402 WeakPolarHBondContact O-CG 3.45Å; E398-R402 PolarHBondContact O-N 2.74Å; E398-R402 IonicContact OE2-CZ 3.55Å; E398-R402 IonicContact OE2-NE 2.67Å; E398-R402 IonicContact OE2-NH2 3.6Å; E398-R402 PolarHBondContact OE2-NH2 2.91Å
399Y92.4Very high95.3Very high146 Ų14698.7 Ų98.757%0.57349%0.49SS*.Hα-helixtrans-66.5-39.2174.7-77.1-59.3000112M395 Q396 S397 R402 L403M395-Y399 HydrophobicContact CB-CE2 4.45Å; M395-Y399 HydrophobicContact CE-CE2 3.7Å; M395-Y399 WeakPolarHBondContact O-CD2 3.2Å; M395-Y399 PolarHBondContact O-N 3.46Å; Q396-Y399 PolarHBondContact O-N 3.15Å; S397-Y399 VanDerWaalsContact C-N 3.33Å; S397-Y399 PolarHBondContact O-N 2.94Å; Y399-R402 PolarHBondContact O-N 2.83Å; Y399-L403 WeakPolarHBondContact O-CB 3.43Å; Y399-L403 PolarHBondContact O-N 2.84Å
400A95.6Very high95.1Very high60 Ų60102.7 Ų102.750%0.49650%0.501SS..Hα-helixtrans-65.3-43.5174.200000112.1Q396 S397 R402 L403 G404Q396-A400 WeakPolarHBondContact O-CB 3.4Å; Q396-A400 PolarHBondContact O-N 3.07Å; S397-A400 PolarHBondContact O-N 2.8Å; S397-A400 VanDerWaalsContact O-N 3.14Å; A400-R402 PolarHBondContact O-N 3.33Å; A400-L403 PolarHBondContact O-N 3.4Å; A400-G404 PolarHBondContact O-N 3.39Å
401D96.2Very high95.1Very high91 Ų91104.9 Ų104.949%0.48751%0.509SS..Hα-helixtrans-65.2-37.1176.9-71.9-38.9000112.2S397 E398 K405S397-D401 WeakPolarHBondContact O-CB 3.45Å; S397-D401 PolarHBondContact O-N 3.49Å; E398-D401 PolarHBondContact O-N 2.75Å; D401-K405 WeakPolarHBondContact O-CD 3.35Å; D401-K405 VanDerWaalsContact O-CG 3.23Å; D401-K405 WeakPolarHBondContact O-CG 3.37Å; D401-K405 PolarHBondContact O-N 3.07Å; D401-K405 VanDerWaalsContact O-N 3.16Å
402R95.8Very high95.1Very high127 Ų127106.1 Ų106.148%0.47952%0.515SS..Hα-helixtrans-69-40.8173.3-70.3165.2-165-147.99.9111.3E398 Y399 A400 K405 L406E398-R402 VanDerWaalsContact O-CB 3.31Å; E398-R402 WeakPolarHBondContact O-CB 3.24Å; E398-R402 WeakPolarHBondContact O-CD 3.33Å; E398-R402 WeakPolarHBondContact O-CG 3.45Å; E398-R402 PolarHBondContact O-N 2.74Å; E398-R402 IonicContact OE2-CZ 3.55Å; E398-R402 IonicContact OE2-NE 2.67Å; E398-R402 IonicContact OE2-NH2 3.6Å; E398-R402 PolarHBondContact OE2-NH2 2.91Å; Y399-R402 PolarHBondContact O-N 2.83Å; A400-R402 PolarHBondContact O-N 3.33Å; R402-K405 PolarHBondContact O-N 2.74Å; R402-L406 WeakPolarHBondContact O-CG 3.36Å; R402-L406 PolarHBondContact O-N 3.3Å; R402-L406 VanDerWaalsContact O-N 3.07Å
403L93.9Very high95.1Very high100 Ų100105.3 Ų105.352%0.52452%0.519SS..Hα-helixtrans-62.7-49.6176-165.681.9000110.9Y399 A400 K405 L406 E407Y399-L403 WeakPolarHBondContact O-CB 3.43Å; Y399-L403 PolarHBondContact O-N 2.84Å; A400-L403 PolarHBondContact O-N 3.4Å; L403-K405 VanDerWaalsContact C-N 3.29Å; L403-K405 PolarHBondContact O-N 3.5Å; L403-L406 PolarHBondContact O-N 3.4Å; L403-L406 VanDerWaalsContact O-N 3.11Å; L403-E407 WeakPolarHBondContact O-CG 3.47Å; L403-E407 PolarHBondContact O-N 3.38Å
404G96.3Very high95.1Very high35 Ų35100.7 Ų100.736%0.36151%0.513SS..Hα-helixtrans-61.7-33.6179.100000113.5A400 A408A400-G404 PolarHBondContact O-N 3.39Å; G404-A408 WeakPolarHBondContact O-CB 3.17Å; G404-A408 PolarHBondContact O-N 2.86Å
405K96.8Very high95Very high131 Ų13199.4 Ų99.457%0.5751%0.507SS*.Hα-helixtrans-65.1-48.8170.7-74.6165.2-172.7168.30111.8D401 R402 L403 E407 A408 E409D401-K405 WeakPolarHBondContact O-CD 3.35Å; D401-K405 VanDerWaalsContact O-CG 3.23Å; D401-K405 WeakPolarHBondContact O-CG 3.37Å; D401-K405 PolarHBondContact O-N 3.07Å; D401-K405 VanDerWaalsContact O-N 3.16Å; R402-K405 PolarHBondContact O-N 2.74Å; L403-K405 VanDerWaalsContact C-N 3.29Å; L403-K405 PolarHBondContact O-N 3.5Å; K405-E407 VanDerWaalsContact C-N 3.29Å; K405-E407 PolarHBondContact O-N 2.82Å; K405-A408 PolarHBondContact O-N 2.92Å; K405-E409 WeakPolarHBondContact O-CB 3.5Å; K405-E409 WeakPolarHBondContact O-CG 3.4Å; K405-E409 PolarHBondContact O-N 2.87Å
406L94.2Very high95.1Very high107 Ų107100 Ų10056%0.5652%0.515SS*.Hα-helixtrans-63.3-33.9177.1-70.4171.2000112.6R402 L403 R410R402-L406 WeakPolarHBondContact O-CG 3.36Å; R402-L406 PolarHBondContact O-N 3.3Å; R402-L406 VanDerWaalsContact O-N 3.07Å; L403-L406 PolarHBondContact O-N 3.4Å; L403-L406 VanDerWaalsContact O-N 3.11Å; L406-R410 VanDerWaalsContact O-CB 3.31Å; L406-R410 WeakPolarHBondContact O-CB 3.29Å; L406-R410 PolarHBondContact O-N 3.46Å
407E95Very high95.1Very high118 Ų11898.3 Ų98.355%0.55151%0.509SS*.Hα-helixtrans-69.8-40.6174.3-72.7-177.6163.400112.1L403 K405 R410 Q411L403-E407 WeakPolarHBondContact O-CG 3.47Å; L403-E407 PolarHBondContact O-N 3.38Å; K405-E407 VanDerWaalsContact C-N 3.29Å; K405-E407 PolarHBondContact O-N 2.82Å; E407-R410 PolarHBondContact O-N 3.28Å; E407-Q411 WeakPolarHBondContact O-CB 3.32Å; E407-Q411 PolarHBondContact O-N 2.85Å
408A95.9Very high95.1Very high54 Ų5497.8 Ų97.845%0.44650%0.504SS..Hα-helixtrans-67.2-39.5173.500000112.6G404 K405 Q411 T412G404-A408 WeakPolarHBondContact O-CB 3.17Å; G404-A408 PolarHBondContact O-N 2.86Å; K405-A408 PolarHBondContact O-N 2.92Å; A408-Q411 PolarHBondContact O-N 2.93Å; A408-T412 WeakPolarHBondContact O-CG2 3.35Å; A408-T412 PolarHBondContact O-N 3.33Å; A408-T412 PolarHBondContact O-OG1 3.48Å
409E94.9Very high95.1Very high108 Ų10895.2 Ų95.251%0.50550%0.497SS..Hα-helixtrans-61.8-45.2171-74.4169.7-159.900110.6K405 Q411 T412 L413K405-E409 WeakPolarHBondContact O-CB 3.5Å; K405-E409 WeakPolarHBondContact O-CG 3.4Å; K405-E409 PolarHBondContact O-N 2.87Å; E409-Q411 VanDerWaalsContact C-N 3.33Å; E409-Q411 PolarHBondContact O-N 3.01Å; E409-T412 WeakPolarHBondContact CA-OG1 3.34Å; E409-T412 PolarHBondContact O-N 2.85Å; E409-T412 PolarHBondContact O-OG1 3.25Å; E409-T412 VanDerWaalsContact O-OG1 3.07Å; E409-L413 WeakPolarHBondContact O-CB 3.27Å; E409-L413 VanDerWaalsContact O-CG 3.26Å; E409-L413 WeakPolarHBondContact O-CG 3.26Å; E409-L413 PolarHBondContact O-N 2.89Å
410R91Very high95.1Very high183 Ų18390.8 Ų90.869%0.69149%0.491SS*.Hα-helixtrans-62.9-37.6175.3-158.2-164.381.8167.35.4112.4L406 E407 A414L406-R410 VanDerWaalsContact O-CB 3.31Å; L406-R410 WeakPolarHBondContact O-CB 3.29Å; L406-R410 PolarHBondContact O-N 3.46Å; E407-R410 PolarHBondContact O-N 3.28Å; R410-A414 WeakPolarHBondContact O-CB 3.46Å; R410-A414 PolarHBondContact O-N 3.48Å
411Q95.6Very high95Very high118 Ų11893.2 Ų93.255%0.55149%0.492SS*.Hα-helixtrans-68.1-48.3176.9-179.8173.5-21.600111.2E407 A408 E409 L413 A414 E415E407-Q411 WeakPolarHBondContact O-CB 3.32Å; E407-Q411 PolarHBondContact O-N 2.85Å; A408-Q411 PolarHBondContact O-N 2.93Å; E409-Q411 VanDerWaalsContact C-N 3.33Å; E409-Q411 PolarHBondContact O-N 3.01Å; Q411-L413 VanDerWaalsContact C-N 3.3Å; Q411-L413 PolarHBondContact O-N 2.94Å; Q411-A414 WeakPolarHBondContact O-CB 3.24Å; Q411-A414 PolarHBondContact O-N 3.17Å; Q411-E415 HydrophobicContact CG-CG 4.41Å; Q411-E415 WeakPolarHBondContact CG-OE1 3.46Å; Q411-E415 PolarHBondContact NE2-OE1 2.85Å; Q411-E415 WeakPolarHBondContact O-CG 3.38Å; Q411-E415 PolarHBondContact O-N 3.09Å
412T96.4Very high95Very high75 Ų7597 Ų9746%0.4650%0.499SS..Hα-helixtrans-64.8-32.8177.850.80000112.6A408 E409 T416A408-T412 WeakPolarHBondContact O-CG2 3.35Å; A408-T412 PolarHBondContact O-N 3.33Å; A408-T412 PolarHBondContact O-OG1 3.48Å; E409-T412 WeakPolarHBondContact CA-OG1 3.34Å; E409-T412 PolarHBondContact O-N 2.85Å; E409-T412 PolarHBondContact O-OG1 3.25Å; E409-T412 VanDerWaalsContact O-OG1 3.07Å; T412-T416 WeakPolarHBondContact O-CB 3.28Å; T412-T416 WeakPolarHBondContact O-CG2 3.45Å; T412-T416 PolarHBondContact O-N 3.46Å; T412-T416 PolarHBondContact O-OG1 3.34Å
413L94.6Very high95Very high117 Ų11799.1 Ų99.161%0.61351%0.507SS*.Hα-helixtrans-65.6-40.5169-72.8171.8000112.4E409 Q411 T416 L417E409-L413 WeakPolarHBondContact O-CB 3.27Å; E409-L413 VanDerWaalsContact O-CG 3.26Å; E409-L413 WeakPolarHBondContact O-CG 3.26Å; E409-L413 PolarHBondContact O-N 2.89Å; Q411-L413 VanDerWaalsContact C-N 3.3Å; Q411-L413 PolarHBondContact O-N 2.94Å; L413-T416 WeakPolarHBondContact CA-OG1 3.4Å; L413-T416 PolarHBondContact O-OG1 3.22Å; L413-T416 VanDerWaalsContact O-OG1 3.13Å; L413-L417 WeakPolarHBondContact O-CB 3.47Å; L413-L417 PolarHBondContact O-N 3.07Å
414A95.1Very high94.9Very high53 Ų5397.4 Ų97.444%0.43851%0.508SS..Hα-helixtrans-68-38.3174.900000112.9R410 Q411 T418R410-A414 WeakPolarHBondContact O-CB 3.46Å; R410-A414 PolarHBondContact O-N 3.48Å; Q411-A414 WeakPolarHBondContact O-CB 3.24Å; Q411-A414 PolarHBondContact O-N 3.17Å; A414-T418 WeakPolarHBondContact O-CB 3.3Å; A414-T418 WeakPolarHBondContact O-CG2 3.5Å; A414-T418 PolarHBondContact O-N 2.95Å; A414-T418 PolarHBondContact O-OG1 2.91Å
415E95.8Very high94.9Very high104 Ų104100.2 Ų100.249%0.48652%0.518SS..Hα-helixtrans-67.2-40.2175.6-72.7174-169.800111.8Q411 T418 A419Q411-E415 HydrophobicContact CG-CG 4.41Å; Q411-E415 WeakPolarHBondContact CG-OE1 3.46Å; Q411-E415 PolarHBondContact NE2-OE1 2.85Å; Q411-E415 WeakPolarHBondContact O-CG 3.38Å; Q411-E415 PolarHBondContact O-N 3.09Å; E415-T418 PolarHBondContact O-OG1 3.07Å; E415-A419 VanDerWaalsContact O-CB 3.24Å; E415-A419 WeakPolarHBondContact O-CB 3.42Å; E415-A419 PolarHBondContact O-N 3.11Å
416T95.8Very high94.8Very high88 Ų8898.4 Ų98.454%0.5451%0.511SS..Hα-helixtrans-73-36.8175.749.10000112.8T412 L413 A419 A420T412-T416 WeakPolarHBondContact O-CB 3.28Å; T412-T416 WeakPolarHBondContact O-CG2 3.45Å; T412-T416 PolarHBondContact O-N 3.46Å; T412-T416 PolarHBondContact O-OG1 3.34Å; L413-T416 WeakPolarHBondContact CA-OG1 3.4Å; L413-T416 PolarHBondContact O-OG1 3.22Å; L413-T416 VanDerWaalsContact O-OG1 3.13Å; T416-A419 PolarHBondContact O-N 2.79Å; T416-A420 WeakPolarHBondContact O-CB 3.38Å; T416-A420 PolarHBondContact O-N 3.38Å
417L94.3Very high94.8Very high99 Ų9998.1 Ų98.152%0.51851%0.507SS..Hα-helixtrans-63.1-51.5173.6-170.6161.2000110.8L413 A419 A420 E421L413-L417 WeakPolarHBondContact O-CB 3.47Å; L413-L417 PolarHBondContact O-N 3.07Å; L417-A419 VanDerWaalsContact C-N 3.27Å; L417-A419 PolarHBondContact O-N 3.22Å; L417-A420 CarbonylContact O-C 3.5Å; L417-A420 WeakPolarHBondContact O-CA 3.25Å; L417-A420 WeakPolarHBondContact O-CB 3.47Å; L417-A420 PolarHBondContact O-N 2.94Å; L417-E421 VanDerWaalsContact CD2-CD 3.47Å; L417-E421 HydrophobicContact CD2-CG 3.92Å; L417-E421 WeakPolarHBondContact CD2-OE1 3.39Å; L417-E421 PolarHBondContact O-N 3.46Å
418T95.4Very high94.8Very high53 Ų5399.1 Ų99.133%0.32551%0.509SS..Hα-helixtrans-66.2-27.4178.154.40000113.2A414 E415 R422A414-T418 WeakPolarHBondContact O-CB 3.3Å; A414-T418 WeakPolarHBondContact O-CG2 3.5Å; A414-T418 PolarHBondContact O-N 2.95Å; A414-T418 PolarHBondContact O-OG1 2.91Å; E415-T418 PolarHBondContact O-OG1 3.07Å; T418-R422 VanDerWaalsContact O-CG 3.29Å; T418-R422 WeakPolarHBondContact O-CG 3.17Å; T418-R422 PolarHBondContact O-N 3.4Å
419A95.2Very high94.8Very high33 Ų33100.2 Ų100.227%0.27351%0.511SS..Hα-helixtrans-70.7-34.9168.900000112.8E415 T416 L417 R423E415-A419 VanDerWaalsContact O-CB 3.24Å; E415-A419 WeakPolarHBondContact O-CB 3.42Å; E415-A419 PolarHBondContact O-N 3.11Å; T416-A419 PolarHBondContact O-N 2.79Å; L417-A419 VanDerWaalsContact C-N 3.27Å; L417-A419 PolarHBondContact O-N 3.22Å; A419-R423 WeakPolarHBondContact O-CG 3.35Å; A419-R423 PolarHBondContact O-N 2.88Å
420A93.4Very high94.9Very high53 Ų53100.7 Ų100.744%0.43851%0.508SS..Hα-helixtrans-70.5-41.8174.400000111.9T416 L417 R422 R423 A424T416-A420 WeakPolarHBondContact O-CB 3.38Å; T416-A420 PolarHBondContact O-N 3.38Å; L417-A420 CarbonylContact O-C 3.5Å; L417-A420 WeakPolarHBondContact O-CA 3.25Å; L417-A420 WeakPolarHBondContact O-CB 3.47Å; L417-A420 PolarHBondContact O-N 2.94Å; A420-R422 PolarHBondContact O-N 3.38Å; A420-R423 PolarHBondContact O-N 2.86Å; A420-A424 WeakPolarHBondContact O-CB 3.38Å; A420-A424 PolarHBondContact O-N 3.33Å
421E93.1Very high95Very high110 Ų11095.5 Ų95.551%0.51450%0.496SS..Hα-helixtrans-57.1-47.2173.5-72.4176.4147.200111.8L417 R423 A424 V425L417-E421 VanDerWaalsContact CD2-CD 3.47Å; L417-E421 HydrophobicContact CD2-CG 3.92Å; L417-E421 WeakPolarHBondContact CD2-OE1 3.39Å; L417-E421 PolarHBondContact O-N 3.46Å; E421-R423 PolarHBondContact O-N 3.35Å; E421-A424 PolarHBondContact O-N 2.93Å; E421-V425 WeakPolarHBondContact O-CG2 3.41Å; E421-V425 PolarHBondContact O-N 2.92Å
422R95.8Very high95Very high170 Ų17093.9 Ų93.964%0.64249%0.492SS*.Hα-helixtrans-58.1-46.1176.3-72.7170.7-167.8160.18.3111.8T418 A420 A424 V425 E426T418-R422 VanDerWaalsContact O-CG 3.29Å; T418-R422 WeakPolarHBondContact O-CG 3.17Å; T418-R422 PolarHBondContact O-N 3.4Å; A420-R422 PolarHBondContact O-N 3.38Å; R422-A424 PolarHBondContact O-N 2.89Å; R422-V425 PolarHBondContact O-N 3.26Å; R422-E426 WeakPolarHBondContact O-CG 3.42Å; R422-E426 PolarHBondContact O-N 2.78Å
423R95.5Very high95Very high172 Ų17294.4 Ų94.465%0.64949%0.491SS*.Hα-helixtrans-62.6-40.2175.8-70.8173-175.5162.32.7112.4A419 A420 E421 V425 E426 E427A419-R423 WeakPolarHBondContact O-CG 3.35Å; A419-R423 PolarHBondContact O-N 2.88Å; A420-R423 PolarHBondContact O-N 2.86Å; E421-R423 PolarHBondContact O-N 3.35Å; R423-V425 VanDerWaalsContact C-N 3.31Å; R423-V425 PolarHBondContact O-N 2.93Å; R423-E426 PolarHBondContact O-N 3.39Å; R423-E427 WeakPolarHBondContact O-CG 3.46Å; R423-E427 PolarHBondContact O-N 3.02Å
424A93.4Very high95Very high64 Ų6493.7 Ų93.753%0.52949%0.488SS..Hα-helixtrans-64.5-36.3176.600000112.1A420 E421 R422 K428A420-A424 WeakPolarHBondContact O-CB 3.38Å; A420-A424 PolarHBondContact O-N 3.33Å; E421-A424 PolarHBondContact O-N 2.93Å; R422-A424 PolarHBondContact O-N 2.89Å; A424-K428 WeakPolarHBondContact O-CB 3.46Å; A424-K428 PolarHBondContact O-N 3.02Å
425V95.9Very high95Very high94 Ų9495 Ų9557%0.5749%0.487SS*.Hα-helixtrans-68.1-43.7172.2173.10000111.4E421 R422 R423 K428 V429E421-V425 WeakPolarHBondContact O-CG2 3.41Å; E421-V425 PolarHBondContact O-N 2.92Å; R422-V425 PolarHBondContact O-N 3.26Å; R423-V425 VanDerWaalsContact C-N 3.31Å; R423-V425 PolarHBondContact O-N 2.93Å; V425-K428 PolarHBondContact O-N 3.49Å; V425-V429 WeakPolarHBondContact O-CG2 3.33Å; V425-V429 PolarHBondContact O-N 2.88Å
426E95.4Very high95Very high94 Ų9496.6 Ų96.644%0.43949%0.494SS..Hα-helixtrans-60.6-45.8175.1-72.9176.6-141.100112.6R422 R423 K428 V429 R430R422-E426 WeakPolarHBondContact O-CG 3.42Å; R422-E426 PolarHBondContact O-N 2.78Å; R423-E426 PolarHBondContact O-N 3.39Å; E426-K428 VanDerWaalsContact C-N 3.35Å; E426-V429 PolarHBondContact O-N 3.2Å; E426-R430 WeakPolarHBondContact O-CG 3.32Å; E426-R430 PolarHBondContact O-N 3.03Å; E426-R430 IonicContact OE2-CZ 3.94Å; E426-R430 IonicContact OE2-NH1 2.75Å; E426-R430 IonicContact OE2-NH2 3.28Å; E426-R430 PolarHBondContact OE2-NH2 3.3Å
427E93.6Very high95Very high101 Ų10198 Ų9847%0.47250%0.495SS..Hα-helixtrans-65.4-37.1176.2-72.2-54.1125.900111.8R423 V429 R430 V431R423-E427 WeakPolarHBondContact O-CG 3.46Å; R423-E427 PolarHBondContact O-N 3.02Å; E427-V429 VanDerWaalsContact C-N 3.34Å; E427-V429 PolarHBondContact O-N 2.96Å; E427-R430 PolarHBondContact O-N 2.94Å; E427-R430 WeakPolarHBondContact OE1-CD 3.33Å; E427-R430 IonicContact OE1-CZ 3.67Å; E427-R430 IonicContact OE1-NE 3.87Å; E427-R430 IonicContact OE1-NH1 3.8Å; E427-R430 PolarHBondContact OE1-NH1 2.69Å; E427-V431 WeakPolarHBondContact O-CG2 3.24Å; E427-V431 PolarHBondContact O-N 3.39Å
428K95.4Very high94.9Very high138 Ų13898 Ų9860%0.650%0.498SS*.Hα-helixtrans-59.7-45.3172.4-175.7-177.7174-175.40111.4A424 V425 E426 R430 V431 D432A424-K428 WeakPolarHBondContact O-CB 3.46Å; A424-K428 PolarHBondContact O-N 3.02Å; V425-K428 PolarHBondContact O-N 3.49Å; E426-K428 VanDerWaalsContact C-N 3.35Å; K428-R430 VanDerWaalsContact C-N 3.34Å; K428-R430 PolarHBondContact O-N 2.76Å; K428-V431 PolarHBondContact O-N 2.9Å; K428-V431 VanDerWaalsContact O-N 3.16Å; K428-D432 PolarHBondContact O-N 3Å
429V96.1Very high94.9Very high78 Ų78102.4 Ų102.447%0.47351%0.513SS..Hα-helixtrans-61.5-42.1176.2173.40000111V425 E426 E427 V431 D432 D433V425-V429 WeakPolarHBondContact O-CG2 3.33Å; V425-V429 PolarHBondContact O-N 2.88Å; E426-V429 PolarHBondContact O-N 3.2Å; E427-V429 VanDerWaalsContact C-N 3.34Å; E427-V429 PolarHBondContact O-N 2.96Å; V429-V431 VanDerWaalsContact C-N 3.32Å; V429-V431 PolarHBondContact O-N 3.07Å; V429-D432 PolarHBondContact O-N 3.21Å; V429-D433 WeakPolarHBondContact O-CB 3.33Å; V429-D433 PolarHBondContact O-N 2.87Å
430R95.9Very high94.9Very high117 Ų117104.4 Ų104.444%0.44253%0.525SS..Hα-helixtrans-59.8-39.7173.6-70.3176.5-178107.519112.5E426 E427 K428 L434E426-R430 WeakPolarHBondContact O-CG 3.32Å; E426-R430 PolarHBondContact O-N 3.03Å; E426-R430 IonicContact OE2-CZ 3.94Å; E426-R430 IonicContact OE2-NH1 2.75Å; E426-R430 IonicContact OE2-NH2 3.28Å; E426-R430 PolarHBondContact OE2-NH2 3.3Å; E427-R430 PolarHBondContact O-N 2.94Å; E427-R430 WeakPolarHBondContact OE1-CD 3.33Å; E427-R430 IonicContact OE1-CZ 3.67Å; E427-R430 IonicContact OE1-NE 3.87Å; E427-R430 IonicContact OE1-NH1 3.8Å; E427-R430 PolarHBondContact OE1-NH1 2.69Å; K428-R430 VanDerWaalsContact C-N 3.34Å; K428-R430 PolarHBondContact O-N 2.76Å; R430-L434 WeakPolarHBondContact O-CB 3.33Å; R430-L434 VanDerWaalsContact O-CG 3.24Å; R430-L434 WeakPolarHBondContact O-CG 3.49Å; R430-L434 PolarHBondContact O-N 2.88Å
431V94.2Very high94.9Very high75 Ų75104.7 Ų104.746%0.45553%0.528SS..Hα-helixtrans-67.8-43.6176169.80000111.3E427 K428 V429 L434 L435E427-V431 WeakPolarHBondContact O-CG2 3.24Å; E427-V431 PolarHBondContact O-N 3.39Å; K428-V431 PolarHBondContact O-N 2.9Å; K428-V431 VanDerWaalsContact O-N 3.16Å; V429-V431 VanDerWaalsContact C-N 3.32Å; V429-V431 PolarHBondContact O-N 3.07Å; V431-L434 PolarHBondContact O-N 3.2Å; V431-L435 HydrophobicContact CG1-CD1 3.89Å; V431-L435 HydrophobicContact CG1-CG 4.32Å; V431-L435 WeakPolarHBondContact O-CB 3.34Å; V431-L435 VanDerWaalsContact O-CG 3.25Å; V431-L435 WeakPolarHBondContact O-CG 3.49Å; V431-L435 PolarHBondContact O-N 3.32Å
432D95.2Very high95Very high84 Ų84105.5 Ų105.545%0.44953%0.53SS..Hα-helixtrans-63.4-41.7177-75.6-36.4000111.5K428 V429 L435 Q436K428-D432 PolarHBondContact O-N 3Å; V429-D432 PolarHBondContact O-N 3.21Å; D432-L435 PolarHBondContact O-N 3.36Å; D432-Q436 PolarHBondContact O-N 3.3Å
433D95.6Very high94.9Very high85 Ų85100 Ų10046%0.45552%0.521SS..Hα-helixtrans-60.4-47.2172.5-82.4-24000112.2V429 Q436 Q437V429-D433 WeakPolarHBondContact O-CB 3.33Å; V429-D433 PolarHBondContact O-N 2.87Å; D433-Q436 WeakPolarHBondContact O-CB 3.48Å; D433-Q436 PolarHBondContact O-N 2.92Å; D433-Q437 WeakPolarHBondContact O-CG 3.23Å; D433-Q437 PolarHBondContact O-N 3.23Å
434L94.4Very high94.9Very high102 Ų10294.8 Ų94.853%0.53451%0.514SS..Hα-helixtrans-65.6-38.4177.8-74.6170.5000111.7R430 V431 Q436 Q437 V438R430-L434 WeakPolarHBondContact O-CB 3.33Å; R430-L434 VanDerWaalsContact O-CG 3.24Å; R430-L434 WeakPolarHBondContact O-CG 3.49Å; R430-L434 PolarHBondContact O-N 2.88Å; V431-L434 PolarHBondContact O-N 3.2Å; L434-Q436 VanDerWaalsContact C-N 3.31Å; L434-Q436 PolarHBondContact O-N 3.47Å; L434-Q437 PolarHBondContact O-N 3.41Å; L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 3.37Å
435L95.7Very high94.8Very high81 Ų8194.1 Ų94.142%0.42451%0.509SS..Hα-helixtrans-64.3-35.6173-74.3171.4000111.7V431 D432 K439V431-L435 HydrophobicContact CG1-CD1 3.89Å; V431-L435 HydrophobicContact CG1-CG 4.32Å; V431-L435 WeakPolarHBondContact O-CB 3.34Å; V431-L435 VanDerWaalsContact O-CG 3.25Å; V431-L435 WeakPolarHBondContact O-CG 3.49Å; V431-L435 PolarHBondContact O-N 3.32Å; D432-L435 PolarHBondContact O-N 3.36Å; L435-K439 WeakPolarHBondContact O-CB 3.42Å; L435-K439 WeakPolarHBondContact O-CD 3.44Å; L435-K439 WeakPolarHBondContact O-CG 3.35Å; L435-K439 PolarHBondContact O-N 3.03Å
436Q95.5Very high94.7Very high137 Ų13794.3 Ų94.364%0.6450%0.503SS*.Hα-helixtrans-67.5-40.6173-177.5166.1-33.900112.1D432 D433 L434 K439 S440D432-Q436 PolarHBondContact O-N 3.3Å; D433-Q436 WeakPolarHBondContact O-CB 3.48Å; D433-Q436 PolarHBondContact O-N 2.92Å; L434-Q436 VanDerWaalsContact C-N 3.31Å; L434-Q436 PolarHBondContact O-N 3.47Å; Q436-K439 PolarHBondContact O-N 3Å; Q436-S440 PolarHBondContact O-N 3.44Å; Q436-S440 PolarHBondContact O-OG 3.48Å
437Q95Very high94.6Very high118 Ų11892.7 Ų92.755%0.55150%0.503SS*.Hα-helixtrans-64.3-41.5173.7-69.117439.400112.4D433 L434 S440 A441D433-Q437 WeakPolarHBondContact O-CG 3.23Å; D433-Q437 PolarHBondContact O-N 3.23Å; L434-Q437 PolarHBondContact O-N 3.41Å; Q437-S440 PolarHBondContact O-N 3.04Å; Q437-S440 PolarHBondContact O-OG 2.89Å; Q437-S440 VanDerWaalsContact O-OG 3.07Å; Q437-A441 VanDerWaalsContact O-CB 3.25Å; Q437-A441 WeakPolarHBondContact O-CB 3.35Å; Q437-A441 PolarHBondContact O-N 2.86Å
438V93.3Very high94.5Very high98 Ų9890.5 Ų90.559%0.59450%0.501SS*.Hα-helixtrans-65.6-39.4175.4170.30000111.1L434 K442L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 3.37Å; V438-K442 VanDerWaalsContact O-CB 3.23Å; V438-K442 WeakPolarHBondContact O-CB 3.28Å; V438-K442 PolarHBondContact O-N 3.35Å
439K95.9Very high94.4Very high146 Ų14690.1 Ų90.164%0.63550%0.5SS*.Hα-helixtrans-62.7-45.7174.7-75164.6-173.4170.20112L435 Q436 K442 A443L435-K439 WeakPolarHBondContact O-CB 3.42Å; L435-K439 WeakPolarHBondContact O-CD 3.44Å; L435-K439 WeakPolarHBondContact O-CG 3.35Å; L435-K439 PolarHBondContact O-N 3.03Å; Q436-K439 PolarHBondContact O-N 3Å; K439-K442 PolarHBondContact O-N 3.29Å; K439-A443 WeakPolarHBondContact O-CB 3.46Å; K439-A443 PolarHBondContact O-N 3.13Å
440S94.9Very high94.3Very high75 Ų7591 Ų9152%0.52450%0.499SS..Hα-helixtrans-70.3-40.5179.764.10000112.4Q436 Q437 K442 A443 A444Q436-S440 PolarHBondContact O-N 3.44Å; Q436-S440 PolarHBondContact O-OG 3.48Å; Q437-S440 PolarHBondContact O-N 3.04Å; Q437-S440 PolarHBondContact O-OG 2.89Å; Q437-S440 VanDerWaalsContact O-OG 3.07Å; S440-K442 VanDerWaalsContact C-N 3.35Å; S440-K442 PolarHBondContact O-N 3Å; S440-A443 PolarHBondContact O-N 2.98Å; S440-A444 WeakPolarHBondContact O-CB 3.24Å; S440-A444 PolarHBondContact O-N 3.42Å
441A93.6Very high94.2Very high60 Ų6090 Ų9050%0.49650%0.499SS..Hα-helixtrans-62.6-39.9173.500000112.1Q437 A444 A445Q437-A441 VanDerWaalsContact O-CB 3.25Å; Q437-A441 WeakPolarHBondContact O-CB 3.35Å; Q437-A441 PolarHBondContact O-N 2.86Å; A441-A444 PolarHBondContact O-N 3.34Å; A441-A445 WeakPolarHBondContact O-CB 3.48Å; A441-A445 PolarHBondContact O-N 3.44Å
442K94.8Very high94Very high126 Ų12691 Ų9155%0.54850%0.501SS..Hα-helixtrans-63.2-47.2173.7-178.7-179.6168.8-175.70111.5V438 K439 S440 A444 A445 E446V438-K442 VanDerWaalsContact O-CB 3.23Å; V438-K442 WeakPolarHBondContact O-CB 3.28Å; V438-K442 PolarHBondContact O-N 3.35Å; K439-K442 PolarHBondContact O-N 3.29Å; S440-K442 VanDerWaalsContact C-N 3.35Å; S440-K442 PolarHBondContact O-N 3Å; K442-A444 VanDerWaalsContact C-N 3.34Å; K442-A444 PolarHBondContact O-N 3.25Å; K442-A445 CarbonylContact O-C 3.57Å; K442-A445 PolarHBondContact O-N 3.09Å; K442-A445 VanDerWaalsContact O-N 3.17Å; K442-E446 WeakPolarHBondContact CE-OE1 3.22Å; K442-E446 IonicContact NZ-OE1 3.56Å; K442-E446 WeakPolarHBondContact O-CG 3.27Å; K442-E446 PolarHBondContact O-N 2.83Å
443A94.5Very high93.9Very high56 Ų5691.7 Ų91.746%0.46350%0.502SS..Hα-helixtrans-61.2-40.717800000112.2K439 S440 E446 S447K439-A443 WeakPolarHBondContact O-CB 3.46Å; K439-A443 PolarHBondContact O-N 3.13Å; S440-A443 PolarHBondContact O-N 2.98Å; A443-E446 PolarHBondContact O-N 2.84Å; A443-S447 PolarHBondContact O-N 3.34Å
444A94.3Very high93.7Very high61 Ų6191.7 Ų91.750%0.50450%0.502SS..Hα-helixtrans-63.8-40.9173.600000112.3S440 A441 K442 E446 S447 A448S440-A444 WeakPolarHBondContact O-CB 3.24Å; S440-A444 PolarHBondContact O-N 3.42Å; A441-A444 PolarHBondContact O-N 3.34Å; K442-A444 VanDerWaalsContact C-N 3.34Å; K442-A444 PolarHBondContact O-N 3.25Å; A444-E446 VanDerWaalsContact C-N 3.3Å; A444-E446 PolarHBondContact O-N 3.45Å; A444-S447 PolarHBondContact O-N 3.37Å; A444-A448 WeakPolarHBondContact O-CB 3.47Å; A444-A448 PolarHBondContact O-N 3.33Å
445A91.1Very high93.7Very high50 Ų5094.5 Ų94.541%0.41351%0.507SS..Hα-helixtrans-68.2-27.317500000113.2A441 K442 K449A441-A445 WeakPolarHBondContact O-CB 3.48Å; A441-A445 PolarHBondContact O-N 3.44Å; K442-A445 CarbonylContact O-C 3.57Å; K442-A445 PolarHBondContact O-N 3.09Å; K442-A445 VanDerWaalsContact O-N 3.17Å; A445-K449 WeakPolarHBondContact O-CD 3.41Å; A445-K449 VanDerWaalsContact O-CG 3.23Å; A445-K449 WeakPolarHBondContact O-CG 3.4Å; A445-K449 PolarHBondContact O-N 3.2Å
446E93.9Very high93.5Very high98 Ų9897 Ų9746%0.45851%0.514SS..Hα-helixtrans-76.7-39.6173-74.8172.1169.700111.5K442 A443 A444 K449 Q450K442-E446 WeakPolarHBondContact CE-OE1 3.22Å; K442-E446 IonicContact NZ-OE1 3.56Å; K442-E446 WeakPolarHBondContact O-CG 3.27Å; K442-E446 PolarHBondContact O-N 2.83Å; A443-E446 PolarHBondContact O-N 2.84Å; A444-E446 VanDerWaalsContact C-N 3.3Å; A444-E446 PolarHBondContact O-N 3.45Å; E446-K449 WeakPolarHBondContact O-CB 3.39Å; E446-K449 PolarHBondContact O-N 2.92Å; E446-Q450 PolarHBondContact O-N 3.19Å
447S93.7Very high93.3Very high61 Ų6196 Ų9643%0.42751%0.509SS..Hα-helixtrans-57.5-51.5169-167.90000111.6A443 A444 K449 Q450 E451A443-S447 PolarHBondContact O-N 3.34Å; A444-S447 PolarHBondContact O-N 3.37Å; S447-K449 PolarHBondContact O-N 3.07Å; S447-Q450 WeakPolarHBondContact O-CB 3.47Å; S447-Q450 PolarHBondContact O-N 2.89Å; S447-E451 WeakPolarHBondContact O-CG 3.23Å; S447-E451 PolarHBondContact O-N 2.93Å; S447-E451 PolarHBondContact OG-OE1 3.27Å
448A92.6Very high93.2Very high54 Ų5497 Ų9745%0.44651%0.512SS..Hα-helixtrans-62.1-29.2179.600000113.1A444 L452A444-A448 WeakPolarHBondContact O-CB 3.47Å; A444-A448 PolarHBondContact O-N 3.33Å; A448-L452 VanDerWaalsContact O-CB 3.31Å; A448-L452 WeakPolarHBondContact O-CB 3.37Å; A448-L452 PolarHBondContact O-N 3.48Å; A448-L452 VanDerWaalsContact O-N 3.09Å
449K93Very high93Very high131 Ų13194.7 Ų94.757%0.5750%0.503SS*.Hα-helixtrans-71-42.7170.9-78.4169.7-176.3176.40112A445 E446 S447 L452 Q453A445-K449 WeakPolarHBondContact O-CD 3.41Å; A445-K449 VanDerWaalsContact O-CG 3.23Å; A445-K449 WeakPolarHBondContact O-CG 3.4Å; A445-K449 PolarHBondContact O-N 3.2Å; E446-K449 WeakPolarHBondContact O-CB 3.39Å; E446-K449 PolarHBondContact O-N 2.92Å; S447-K449 PolarHBondContact O-N 3.07Å; K449-L452 PolarHBondContact O-N 3.06Å; K449-Q453 WeakPolarHBondContact O-CG 3.15Å; K449-Q453 PolarHBondContact O-N 2.91Å
450Q93.7Very high92.6Very high96 Ų9690.1 Ų90.145%0.44949%0.489SS..Hα-helixtrans-63.1-47.4176.3-174.660.551.100110.8E446 S447 L452 Q453 D454E446-Q450 PolarHBondContact O-N 3.19Å; S447-Q450 WeakPolarHBondContact O-CB 3.47Å; S447-Q450 PolarHBondContact O-N 2.89Å; Q450-L452 VanDerWaalsContact C-N 3.3Å; Q450-L452 PolarHBondContact O-N 3.48Å; Q450-Q453 CarbonylContact O-C 3.53Å; Q450-Q453 WeakPolarHBondContact O-CA 3.33Å; Q450-Q453 WeakPolarHBondContact O-CB 3.38Å; Q450-Q453 PolarHBondContact O-N 2.76Å; Q450-D454 PolarHBondContact NE2-OD1 3.09Å; Q450-D454 PolarHBondContact O-N 3.19Å
451E92.8Very high92.4Very high96 Ų9695.2 Ų95.245%0.44950%0.497SS..Hα-helixtrans-55.8-44.8174.5-69.3162.5-127.200111.1S447 Q453 D454 Y455S447-E451 WeakPolarHBondContact O-CG 3.23Å; S447-E451 PolarHBondContact O-N 2.93Å; S447-E451 PolarHBondContact OG-OE1 3.27Å; E451-Q453 PolarHBondContact O-N 2.87Å; E451-D454 PolarHBondContact O-N 2.85Å; E451-Y455 WeakPolarHBondContact O-CB 3.26Å; E451-Y455 WeakPolarHBondContact O-CD2 3.25Å; E451-Y455 PolarHBondContact O-N 2.91Å
452L90.9Very high92.1Very high95 Ų9596.5 Ų96.550%0.49749%0.494SS..Hα-helixtrans-64.6-35.6175.5-17962.1000113A448 K449 Q450 K456A448-L452 VanDerWaalsContact O-CB 3.31Å; A448-L452 WeakPolarHBondContact O-CB 3.37Å; A448-L452 PolarHBondContact O-N 3.48Å; A448-L452 VanDerWaalsContact O-N 3.09Å; K449-L452 PolarHBondContact O-N 3.06Å; Q450-L452 VanDerWaalsContact C-N 3.3Å; Q450-L452 PolarHBondContact O-N 3.48Å; L452-K456 WeakPolarHBondContact O-CB 3.48Å; L452-K456 VanDerWaalsContact O-CG 3.31Å; L452-K456 WeakPolarHBondContact O-CG 3.38Å; L452-K456 PolarHBondContact O-N 3.07Å
453Q93.1Very high91.8Very high99 Ų9995 Ų9546%0.46349%0.492SS..Hα-helixtrans-66.3-45.8172-76-178.3-11.700110.9K449 Q450 E451 Y455 K456 H457K449-Q453 WeakPolarHBondContact O-CG 3.15Å; K449-Q453 PolarHBondContact O-N 2.91Å; Q450-Q453 CarbonylContact O-C 3.53Å; Q450-Q453 WeakPolarHBondContact O-CA 3.33Å; Q450-Q453 WeakPolarHBondContact O-CB 3.38Å; Q450-Q453 PolarHBondContact O-N 2.76Å; E451-Q453 PolarHBondContact O-N 2.87Å; Q453-Y455 VanDerWaalsContact C-N 3.34Å; Q453-Y455 PolarHBondContact O-N 3.32Å; Q453-K456 CarbonylContact O-C 3.5Å; Q453-K456 WeakPolarHBondContact O-CA 3.49Å; Q453-K456 WeakPolarHBondContact O-CB 3.41Å; Q453-K456 PolarHBondContact O-N 3.48Å; Q453-H457 PolarHBondContact O-CD2 2.93Å; Q453-H457 PolarHBondContact O-N 3.11Å
454D92.2Very high91.5Very high85 Ų8597 Ų9746%0.45549%0.492SS..Hα-helixtrans-62.3-40.5177.6-67-13.6000111.5Q450 E451 H457 K458Q450-D454 PolarHBondContact NE2-OD1 3.09Å; Q450-D454 PolarHBondContact O-N 3.19Å; E451-D454 PolarHBondContact O-N 2.85Å; D454-H457 PolarHBondContact O-N 3.33Å; D454-K458 WeakPolarHBondContact O-CB 3.43Å; D454-K458 PolarHBondContact O-N 3.27Å
455Y92.6Very high90.9Very high162 Ų16297.3 Ų97.364%0.63549%0.49SS*.Hα-helixtrans-61.3-43170.5-80.7-62.8000112.1E451 Q453 K458 A459E451-Y455 WeakPolarHBondContact O-CB 3.26Å; E451-Y455 WeakPolarHBondContact O-CD2 3.25Å; E451-Y455 PolarHBondContact O-N 2.91Å; Q453-Y455 VanDerWaalsContact C-N 3.34Å; Q453-Y455 PolarHBondContact O-N 3.32Å; Y455-K458 PolarHBondContact O-N 2.86Å; Y455-A459 VanDerWaalsContact O-CB 3.27Å; Y455-A459 WeakPolarHBondContact O-CB 3.39Å; Y455-A459 PolarHBondContact O-N 2.9Å
456K91.9Very high90.6Very high134 Ų134101 Ų10158%0.58350%0.497SS*.Hα-helixtrans-64.1-44.8175.1-78.5176.5177.9-175.60112.2L452 Q453 K458 A459 S460L452-K456 WeakPolarHBondContact O-CB 3.48Å; L452-K456 VanDerWaalsContact O-CG 3.31Å; L452-K456 WeakPolarHBondContact O-CG 3.38Å; L452-K456 PolarHBondContact O-N 3.07Å; Q453-K456 CarbonylContact O-C 3.5Å; Q453-K456 WeakPolarHBondContact O-CA 3.49Å; Q453-K456 WeakPolarHBondContact O-CB 3.41Å; Q453-K456 PolarHBondContact O-N 3.48Å; K456-K458 VanDerWaalsContact C-N 3.35Å; K456-A459 PolarHBondContact O-N 2.9Å; K456-S460 WeakPolarHBondContact O-CB 3.45Å; K456-S460 PolarHBondContact O-N 3.39Å
457H92Very high90.2Very high114 Ų114101 Ų10153%0.52850%0.497SS..Hα-helixtrans-65.3-38176.7-69.1-56.9000111.7Q453 D454 R461Q453-H457 PolarHBondContact O-CD2 2.93Å; Q453-H457 PolarHBondContact O-N 3.11Å; D454-H457 PolarHBondContact O-N 3.33Å; H457-R461 VanDerWaalsContact O-CB 3.23Å; H457-R461 WeakPolarHBondContact O-CB 3.26Å; H457-R461 PolarHBondContact O-N 2.83Å
458K92.1Very high89.8Confident140 Ų140105.3 Ų105.361%0.60951%0.508SS*.Hα-helixtrans-67.2-44.6174.9-167.7173.3-171.3173.60111.6D454 Y455 K456 R461 I462D454-K458 WeakPolarHBondContact O-CB 3.43Å; D454-K458 PolarHBondContact O-N 3.27Å; Y455-K458 PolarHBondContact O-N 2.86Å; K456-K458 VanDerWaalsContact C-N 3.35Å; K458-R461 PolarHBondContact O-N 2.86Å; K458-I462 HydrophobicContact CG-CD1 4.29Å; K458-I462 WeakPolarHBondContact O-CB 3.39Å; K458-I462 WeakPolarHBondContact O-CD1 3.28Å; K458-I462 VanDerWaalsContact O-CG1 3.24Å; K458-I462 WeakPolarHBondContact O-CG1 3.4Å; K458-I462 PolarHBondContact O-N 3.25Å
459A89.1Confident89.1Confident50 Ų50107.6 Ų107.641%0.41351%0.512SS..Hα-helixtrans-64.3-43.9174.900000112Y455 K456 I462 L463Y455-A459 VanDerWaalsContact O-CB 3.27Å; Y455-A459 WeakPolarHBondContact O-CB 3.39Å; Y455-A459 PolarHBondContact O-N 2.9Å; K456-A459 PolarHBondContact O-N 2.9Å; A459-I462 PolarHBondContact O-N 3.06Å; A459-L463 WeakPolarHBondContact O-CB 3.32Å; A459-L463 PolarHBondContact O-N 3.47Å
460S88.1Confident88.3Confident49 Ų49106.5 Ų106.534%0.34351%0.511SS..Hα-helixtrans-62-43.9174.8177.40000111.7K456 I462 L463 Q464K456-S460 WeakPolarHBondContact O-CB 3.45Å; K456-S460 PolarHBondContact O-N 3.39Å; S460-I462 VanDerWaalsContact C-N 3.31Å; S460-I462 PolarHBondContact O-N 3.43Å; S460-L463 WeakPolarHBondContact O-CB 3.45Å; S460-L463 PolarHBondContact O-N 3.42Å; S460-Q464 WeakPolarHBondContact O-CB 3.28Å; S460-Q464 WeakPolarHBondContact O-CG 3.43Å; S460-Q464 PolarHBondContact O-N 2.96Å
461R91Very high87.4Confident182 Ų182104.4 Ų104.469%0.68751%0.508SS*.Hα-helixtrans-62.9-36.6174.8-170.5-180-631711.8112.3H457 K458 S465H457-R461 VanDerWaalsContact O-CB 3.23Å; H457-R461 WeakPolarHBondContact O-CB 3.26Å; H457-R461 PolarHBondContact O-N 2.83Å; K458-R461 PolarHBondContact O-N 2.86Å; R461-S465 WeakPolarHBondContact O-CB 3.38Å; R461-S465 PolarHBondContact O-N 3.06Å; R461-S465 PolarHBondContact O-OG 3.11Å
462I87.9Confident86.3Confident87 Ų87103 Ų10345%0.44651%0.508SS..Hα-helixtrans-70.1-41.1174.8-70164.1000111.2K458 A459 S460 S465 K466K458-I462 HydrophobicContact CG-CD1 4.29Å; K458-I462 WeakPolarHBondContact O-CB 3.39Å; K458-I462 WeakPolarHBondContact O-CD1 3.28Å; K458-I462 VanDerWaalsContact O-CG1 3.24Å; K458-I462 WeakPolarHBondContact O-CG1 3.4Å; K458-I462 PolarHBondContact O-N 3.25Å; A459-I462 PolarHBondContact O-N 3.06Å; S460-I462 VanDerWaalsContact C-N 3.31Å; S460-I462 PolarHBondContact O-N 3.43Å; I462-S465 WeakPolarHBondContact CA-OG 3.44Å; I462-S465 PolarHBondContact O-N 3.38Å; I462-S465 PolarHBondContact O-OG 3.13Å; I462-K466 HydrophobicContact CG2-CD 4.39Å; I462-K466 WeakPolarHBondContact O-CB 3.35Å; I462-K466 WeakPolarHBondContact O-CG 3.33Å; I462-K466 PolarHBondContact O-N 2.86Å
463L87.8Confident85.1Confident96 Ų96104.6 Ų104.650%0.50352%0.517SS..Hα-helixtrans-60.4-56172.3-85.4160.4000110.4A459 S460 S465 K466 E467A459-L463 WeakPolarHBondContact O-CB 3.32Å; A459-L463 PolarHBondContact O-N 3.47Å; S460-L463 WeakPolarHBondContact O-CB 3.45Å; S460-L463 PolarHBondContact O-N 3.42Å; L463-S465 VanDerWaalsContact C-N 3.28Å; L463-S465 PolarHBondContact O-N 3.44Å; L463-K466 CarbonylContact O-C 3.5Å; L463-K466 WeakPolarHBondContact O-CA 3.27Å; L463-K466 WeakPolarHBondContact O-CB 3.37Å; L463-K466 PolarHBondContact O-N 3.04Å; L463-E467 WeakPolarHBondContact O-CB 3.36Å; L463-E467 WeakPolarHBondContact O-CG 3.49Å; L463-E467 PolarHBondContact O-N 3.31Å
464Q87.9Confident83.8Confident98 Ų98107.5 Ų107.546%0.45853%0.528SS..Hα-helixtrans-57.4-35.3176.5-72.6-179.2-4.100113.2S460 K468S460-Q464 WeakPolarHBondContact O-CB 3.28Å; S460-Q464 WeakPolarHBondContact O-CG 3.43Å; S460-Q464 PolarHBondContact O-N 2.96Å; Q464-K468 VanDerWaalsContact O-CB 3.24Å; Q464-K468 WeakPolarHBondContact O-CB 3.45Å; Q464-K468 VanDerWaalsContact O-CG 3.23Å; Q464-K468 WeakPolarHBondContact O-CG 3.38Å; Q464-K468 PolarHBondContact O-N 3.1Å
465S81.6Confident82.3Confident67 Ų67110.2 Ų110.247%0.46954%0.537SS..Hα-helixtrans-72.2-33.9174.569.10000112.6R461 I462 L463 L469R461-S465 WeakPolarHBondContact O-CB 3.38Å; R461-S465 PolarHBondContact O-N 3.06Å; R461-S465 PolarHBondContact O-OG 3.11Å; I462-S465 WeakPolarHBondContact CA-OG 3.44Å; I462-S465 PolarHBondContact O-N 3.38Å; I462-S465 PolarHBondContact O-OG 3.13Å; L463-S465 VanDerWaalsContact C-N 3.28Å; L463-S465 PolarHBondContact O-N 3.44Å; S465-L469 WeakPolarHBondContact O-CB 3.47Å; S465-L469 PolarHBondContact O-N 2.86Å
466K85.6Confident80.3Confident126 Ų126106 Ų10655%0.54854%0.544SS..Hα-helixtrans-72.8-38.5173.3-76.6-179.1175.5-170.80111.5I462 L463 L469 I470I462-K466 HydrophobicContact CG2-CD 4.39Å; I462-K466 WeakPolarHBondContact O-CB 3.35Å; I462-K466 WeakPolarHBondContact O-CG 3.33Å; I462-K466 PolarHBondContact O-N 2.86Å; L463-K466 CarbonylContact O-C 3.5Å; L463-K466 WeakPolarHBondContact O-CA 3.27Å; L463-K466 WeakPolarHBondContact O-CB 3.37Å; L463-K466 PolarHBondContact O-N 3.04Å; K466-L469 WeakPolarHBondContact O-CB 3.4Å; K466-L469 PolarHBondContact O-N 2.8Å; K466-I470 WeakPolarHBondContact O-CB 3.32Å; K466-I470 WeakPolarHBondContact O-CD1 3.5Å; K466-I470 WeakPolarHBondContact O-CG1 3.43Å; K466-I470 PolarHBondContact O-N 3.43Å
467E85.8Confident78.4Confident100 Ų100104.8 Ų104.847%0.46755%0.552SS.*Hα-helixtrans-66.8-43.2174.4-72.8164.2176.600110.6L463 L469 I470 S471L463-E467 WeakPolarHBondContact O-CB 3.36Å; L463-E467 WeakPolarHBondContact O-CG 3.49Å; L463-E467 PolarHBondContact O-N 3.31Å; E467-L469 VanDerWaalsContact C-N 3.31Å; E467-L469 PolarHBondContact O-N 2.79Å; E467-I470 PolarHBondContact O-N 2.93Å; E467-S471 VanDerWaalsContact O-CB 3.31Å; E467-S471 WeakPolarHBondContact O-CB 3.17Å; E467-S471 PolarHBondContact O-N 3.26Å; E467-S471 PolarHBondContact O-OG 2.64Å; E467-S471 VanDerWaalsContact O-OG 3.14Å
468K84.2Confident76.4Confident151 Ų151101.3 Ų101.366%0.65755%0.547SS*.Hα-helixtrans-64.6-33.3171.1-75.3174.6178.2-178.80112.6Q464 S472Q464-K468 VanDerWaalsContact O-CB 3.24Å; Q464-K468 WeakPolarHBondContact O-CB 3.45Å; Q464-K468 VanDerWaalsContact O-CG 3.23Å; Q464-K468 WeakPolarHBondContact O-CG 3.38Å; Q464-K468 PolarHBondContact O-N 3.1Å; K468-S472 VanDerWaalsContact O-CB 3.3Å; K468-S472 WeakPolarHBondContact O-CB 3.46Å; K468-S472 PolarHBondContact O-N 2.91Å; K468-S472 PolarHBondContact O-OG 3.49Å
469L77.6Confident74.1Confident102 Ų102102.5 Ų102.553%0.53456%0.559SS.*Hα-helixtrans-67.2-48.1171.5-176.764.1000111.3S465 K466 E467 S471 S472 L473S465-L469 WeakPolarHBondContact O-CB 3.47Å; S465-L469 PolarHBondContact O-N 2.86Å; K466-L469 WeakPolarHBondContact O-CB 3.4Å; K466-L469 PolarHBondContact O-N 2.8Å; E467-L469 VanDerWaalsContact C-N 3.31Å; E467-L469 PolarHBondContact O-N 2.79Å; L469-S471 VanDerWaalsContact C-N 3.35Å; L469-S471 PolarHBondContact O-N 3.4Å; L469-S472 WeakPolarHBondContact CA-OG 3.09Å; L469-S472 PolarHBondContact O-N 3.35Å; L469-S472 PolarHBondContact O-OG 2.95Å; L469-L473 HydrophobicContact CD1-CD1 4.49Å; L469-L473 HydrophobicContact CG-CD1 4.2Å; L469-L473 WeakPolarHBondContact O-CB 3.32Å; L469-L473 VanDerWaalsContact O-CG 3.29Å; L469-L473 WeakPolarHBondContact O-CG 3.44Å; L469-L473 PolarHBondContact O-N 2.64Å
470I75.8Confident71.9Confident107 Ų107106.7 Ų106.755%0.54958%0.575SS.*Hα-helixtrans-60.3-43.4175.6-70.3161.2000110.9K466 E467 L473 K474K466-I470 WeakPolarHBondContact O-CB 3.32Å; K466-I470 WeakPolarHBondContact O-CD1 3.5Å; K466-I470 WeakPolarHBondContact O-CG1 3.43Å; K466-I470 PolarHBondContact O-N 3.43Å; E467-I470 PolarHBondContact O-N 2.93Å; I470-L473 PolarHBondContact O-N 3.13Å; I470-K474 VanDerWaalsContact O-CB 3.26Å; I470-K474 WeakPolarHBondContact O-CB 3.37Å; I470-K474 PolarHBondContact O-N 3.1Å
471S76.1Confident70.1Confident53 Ų53111.1 Ų111.137%0.37160%0.599SS.*Hα-helixtrans-64.2-47173.9-68.20000110.6E467 L469 L473 K474 E475E467-S471 VanDerWaalsContact O-CB 3.31Å; E467-S471 WeakPolarHBondContact O-CB 3.17Å; E467-S471 PolarHBondContact O-N 3.26Å; E467-S471 PolarHBondContact O-OG 2.64Å; E467-S471 VanDerWaalsContact O-OG 3.14Å; L469-S471 VanDerWaalsContact C-N 3.35Å; L469-S471 PolarHBondContact O-N 3.4Å; S471-L473 PolarHBondContact O-N 2.89Å; S471-L473 VanDerWaalsContact O-N 3.16Å; S471-K474 CarbonylContact O-C 3.6Å; S471-K474 WeakPolarHBondContact O-CA 3.46Å; S471-K474 PolarHBondContact O-N 2.75Å; S471-E475 WeakPolarHBondContact O-CA 3.46Å; S471-E475 WeakPolarHBondContact O-CB 3.32Å; S471-E475 PolarHBondContact O-N 3.35Å
472S69.7Low67.9Low65 Ų65105.8 Ų105.846%0.45560%0.601SS.*Hα-helixtrans-59.7-30.6175.471.30000113.4K468 L469 G476K468-S472 VanDerWaalsContact O-CB 3.3Å; K468-S472 WeakPolarHBondContact O-CB 3.46Å; K468-S472 PolarHBondContact O-N 2.91Å; K468-S472 PolarHBondContact O-OG 3.49Å; L469-S472 WeakPolarHBondContact CA-OG 3.09Å; L469-S472 PolarHBondContact O-N 3.35Å; L469-S472 PolarHBondContact O-OG 2.95Å; S472-G476 WeakPolarHBondContact O-CA 3.24Å; S472-G476 PolarHBondContact O-N 3.39Å
473L64.8Low66Low130 Ų130108.7 Ų108.768%0.68162%0.617SS**Hα-helixtrans-77.5-18.5173.1-69.7166.1000113.9L469 I470 S471L469-L473 HydrophobicContact CD1-CD1 4.49Å; L469-L473 HydrophobicContact CG-CD1 4.2Å; L469-L473 WeakPolarHBondContact O-CB 3.32Å; L469-L473 VanDerWaalsContact O-CG 3.29Å; L469-L473 WeakPolarHBondContact O-CG 3.44Å; L469-L473 PolarHBondContact O-N 2.64Å; I470-L473 PolarHBondContact O-N 3.13Å; S471-L473 PolarHBondContact O-N 2.89Å; S471-L473 VanDerWaalsContact O-N 3.16Å
474K66.7Low64.4Low160 Ų160106.5 Ų106.570%0.69662%0.618SS**Hα-helixtrans-102.7-34.7-177.7-174.5-173177.2-166.40112.9I470 S471 S477I470-K474 VanDerWaalsContact O-CB 3.26Å; I470-K474 WeakPolarHBondContact O-CB 3.37Å; I470-K474 PolarHBondContact O-N 3.1Å; S471-K474 CarbonylContact O-C 3.6Å; S471-K474 WeakPolarHBondContact O-CA 3.46Å; S471-K474 PolarHBondContact O-N 2.75Å; K474-S477 CarbonylContact O-C 3.52Å; K474-S477 WeakPolarHBondContact O-CB 3.37Å; K474-S477 PolarHBondContact O-N 3.35Å
475E59.5Low63Low141 Ų141103.5 Ų103.566%0.65961%0.613SS**Hα-helixtrans-89.7-27.1179.8-164166.7-119.600110.4S471 S477 G478S471-E475 WeakPolarHBondContact O-CA 3.46Å; S471-E475 WeakPolarHBondContact O-CB 3.32Å; S471-E475 PolarHBondContact O-N 3.35Å; E475-S477 PolarHBondContact O-N 2.91Å; E475-G478 CarbonylContact O-C 3.45Å; E475-G478 PolarHBondContact O-N 2.97Å
476G51.8Low62Low75 Ų75102.4 Ų102.477%0.77361%0.613SS**THydrogen-bonded Turntrans-61-1.6154.800000114.3S472S472-G476 WeakPolarHBondContact O-CA 3.24Å; S472-G476 PolarHBondContact O-N 3.39Å
477S52.5Low61Low108 Ų108100.8 Ų100.876%0.75561%0.613SS**THydrogen-bonded Turntrans-120.513.9168.2-175.20000112.5K474 E475K474-S477 CarbonylContact O-C 3.52Å; K474-S477 WeakPolarHBondContact O-CB 3.37Å; K474-S477 PolarHBondContact O-N 3.35Å; E475-S477 PolarHBondContact O-N 2.91Å
478G49.6Very low60.2Low40 Ų40101.1 Ų101.141%0.41262%0.618SS.*  trans-152.694.3-172.100000114.3E475E475-G478 CarbonylContact O-C 3.45Å; E475-G478 PolarHBondContact O-N 2.97Å
479L43.2Very low59.8Low165 Ų16596.9 Ų96.986%0.86461%0.611SS**  trans-49.4145.9151.9-139.870.4000108.3
480D43.7Very low59.7Low139 Ų13997.1 Ų97.174%0.74361%0.613SS**  cis-160.9-17541-156.2-7.3000112.8
481V49.6Very low60Low141 Ų14197 Ų9786%0.85561%0.61SS**  trans-80.2131.2-171.2176.70000114.1
482G45.7Very low60.2Low70 Ų7098.9 Ų98.972%0.72261%0.614SS**  trans125.2117.4141.900000117.6
483D47.6Very low60.8Low148 Ų148101.7 Ų101.779%0.79162%0.62SS**  -168.9148.3108.6-17834.6000110.7G485D483-G485 VanDerWaalsContact CG-N 3.26Å; D483-G485 PolarHBondContact OD1-N 3.44Å; D483-G485 WeakPolarHBondContact OD2-CA 3.49Å; D483-G485 PolarHBondContact OD2-N 2.89Å
484G54.2Low61.7Low51 Ų51102.1 Ų102.153%0.52662%0.618SS.*SBendtrans-89.9-13.4173.500000114.4G486 T487G484-G486 PolarHBondContact O-N 3.47Å; G484-T487 PolarHBondContact O-N 2.93Å; G484-T487 PolarHBondContact O-OG1 3.49Å
485G56.9Low62.7Low34 Ų3499.3 Ų99.335%0.35161%0.61SS.*Hα-helixtrans-62.5-25.7-176.800000114.5D483 T487 A489D483-G485 VanDerWaalsContact CG-N 3.26Å; D483-G485 PolarHBondContact OD1-N 3.44Å; D483-G485 WeakPolarHBondContact OD2-CA 3.49Å; D483-G485 PolarHBondContact OD2-N 2.89Å; G485-T487 PolarHBondContact O-N 2.99Å; G485-A489 WeakPolarHBondContact O-CB 3.34Å; G485-A489 PolarHBondContact O-N 3.27Å
486G62Low64.2Low45 Ų45100.3 Ų100.346%0.46461%0.608SS.*Hα-helixtrans-63.3-34.7-17900000114.8G484 L490G484-G486 PolarHBondContact O-N 3.47Å; G486-L490 WeakPolarHBondContact O-CG 3.24Å; G486-L490 PolarHBondContact O-N 3.46Å
487T64.3Low66Low91 Ų91103.3 Ų103.356%0.55860%0.601SS**Hα-helixtrans-74.6-46.2179.558.80000111.2G484 G485 A489 L490 E491G484-T487 PolarHBondContact O-N 2.93Å; G484-T487 PolarHBondContact O-OG1 3.49Å; G485-T487 PolarHBondContact O-N 2.99Å; T487-A489 VanDerWaalsContact C-N 3.26Å; T487-A489 PolarHBondContact O-N 2.96Å; T487-L490 PolarHBondContact O-N 3.38Å; T487-L490 VanDerWaalsContact O-N 3.14Å; T487-E491 WeakPolarHBondContact O-CG 3.5Å; T487-E491 PolarHBondContact O-N 3.19Å
488L69Low67.9Low107 Ų107102.9 Ų102.956%0.5659%0.588SS**Hα-helixtrans-62.8-33.1178.5-174.765.2000112.2M492L488-M492 VanDerWaalsContact O-CB 3.3Å; L488-M492 WeakPolarHBondContact O-CB 3.24Å; L488-M492 VanDerWaalsContact O-CG 3.24Å; L488-M492 WeakPolarHBondContact O-CG 3.49Å; L488-M492 PolarHBondContact O-N 2.96Å; L488-M492 VanDerWaalsContact O-N 3.08Å
489A74.8Confident69.9Low63 Ų63107.8 Ų107.852%0.52160%0.598SS.*Hα-helixtrans-65.9-42.1174.400000112.5G485 T487 M492 E493G485-A489 WeakPolarHBondContact O-CB 3.34Å; G485-A489 PolarHBondContact O-N 3.27Å; T487-A489 VanDerWaalsContact C-N 3.26Å; T487-A489 PolarHBondContact O-N 2.96Å; A489-M492 PolarHBondContact O-N 2.89Å; A489-E493 PolarHBondContact O-N 3.28Å; A489-E493 VanDerWaalsContact O-N 3.16Å
490L77Confident72.4Confident107 Ų107103.9 Ų103.956%0.5658%0.575SS**Hα-helixtrans-67.1-47.3176.8-72.9166.9000111.6G486 T487 M492 E493 E494G486-L490 WeakPolarHBondContact O-CG 3.24Å; G486-L490 PolarHBondContact O-N 3.46Å; T487-L490 PolarHBondContact O-N 3.38Å; T487-L490 VanDerWaalsContact O-N 3.14Å; L490-M492 VanDerWaalsContact C-N 3.26Å; L490-M492 PolarHBondContact O-N 2.87Å; L490-E493 PolarHBondContact O-N 3.37Å; L490-E494 PolarHBondContact O-N 2.88Å
491E80.8Confident74.7Confident104 Ų104102 Ų10249%0.48656%0.564SS.*Hα-helixtrans-55.5-41.8175.1-70.3168.3-171.300111.6T487 E493 L495T487-E491 WeakPolarHBondContact O-CG 3.5Å; T487-E491 PolarHBondContact O-N 3.19Å; E491-E493 VanDerWaalsContact C-N 3.29Å; E491-E493 PolarHBondContact O-N 2.89Å; E491-L495 WeakPolarHBondContact O-CB 3.47Å; E491-L495 VanDerWaalsContact O-CG 3.27Å; E491-L495 WeakPolarHBondContact O-CG 3.47Å; E491-L495 PolarHBondContact O-N 3.12Å
492M80.5Confident76.8Confident93 Ų9399.7 Ų99.746%0.45854%0.544SS..Hα-helixtrans-71-17.5176.4-77.3-64.6-55.300114.6L488 A489 L490 R496L488-M492 VanDerWaalsContact O-CB 3.3Å; L488-M492 WeakPolarHBondContact O-CB 3.24Å; L488-M492 VanDerWaalsContact O-CG 3.24Å; L488-M492 WeakPolarHBondContact O-CG 3.49Å; L488-M492 PolarHBondContact O-N 2.96Å; L488-M492 VanDerWaalsContact O-N 3.08Å; A489-M492 PolarHBondContact O-N 2.89Å; L490-M492 VanDerWaalsContact C-N 3.26Å; L490-M492 PolarHBondContact O-N 2.87Å; M492-R496 VanDerWaalsContact O-CD 3.28Å; M492-R496 WeakPolarHBondContact O-CD 3.28Å; M492-R496 VanDerWaalsContact O-CG 3.23Å; M492-R496 WeakPolarHBondContact O-CG 3.31Å; M492-R496 PolarHBondContact O-NE 3.12Å
493E83.2Confident79.2Confident124 Ų124103.4 Ų103.458%0.57954%0.537SS*.Hα-helixtrans-91.5-38.8174.1-171.6150.5-129.100111.5A489 L490 E491 R496 H497A489-E493 PolarHBondContact O-N 3.28Å; A489-E493 VanDerWaalsContact O-N 3.16Å; L490-E493 PolarHBondContact O-N 3.37Å; E491-E493 VanDerWaalsContact C-N 3.29Å; E491-E493 PolarHBondContact O-N 2.89Å; E493-R496 WeakPolarHBondContact O-CB 3.38Å; E493-R496 PolarHBondContact O-N 3.04Å; E493-R496 VanDerWaalsContact O-N 3.13Å; E493-H497 PolarHBondContact O-N 3.07Å
494E83.4Confident81.5Confident138 Ų138102.4 Ų102.465%0.64553%0.527SS*.Hα-helixtrans-58.6-47.8170.2-70.6-177.5169.900111.2L490 R496 H497 E498L490-E494 PolarHBondContact O-N 2.88Å; E494-R496 PolarHBondContact O-N 3.42Å; E494-H497 PolarHBondContact O-N 3.2Å; E494-H497 VanDerWaalsContact O-N 3.09Å; E494-E498 PolarHBondContact O-N 3.08Å
495L87.3Confident83.4Confident101 Ų101105.3 Ų105.353%0.52953%0.527SS..Hα-helixtrans-62.2-26.1175.3-73.2170.4000113.7E491 K499E491-L495 WeakPolarHBondContact O-CB 3.47Å; E491-L495 VanDerWaalsContact O-CG 3.27Å; E491-L495 WeakPolarHBondContact O-CG 3.47Å; E491-L495 PolarHBondContact O-N 3.12Å; L495-K499 VanDerWaalsContact O-CB 3.29Å; L495-K499 WeakPolarHBondContact O-CB 3.23Å; L495-K499 PolarHBondContact O-N 3.45Å
496R90.6Very high85.2Confident162 Ų162108 Ų10861%0.61153%0.532SS*.Hα-helixtrans-75.7-40.6172.8-74.5167.6-176.9178.42.3111.4M492 E493 E494 K499 E500M492-R496 VanDerWaalsContact O-CD 3.28Å; M492-R496 WeakPolarHBondContact O-CD 3.28Å; M492-R496 VanDerWaalsContact O-CG 3.23Å; M492-R496 WeakPolarHBondContact O-CG 3.31Å; M492-R496 PolarHBondContact O-NE 3.12Å; E493-R496 WeakPolarHBondContact O-CB 3.38Å; E493-R496 PolarHBondContact O-N 3.04Å; E493-R496 VanDerWaalsContact O-N 3.13Å; E494-R496 PolarHBondContact O-N 3.42Å; R496-K499 PolarHBondContact O-N 3.17Å; R496-E500 PolarHBondContact O-N 3.37Å; R496-E500 VanDerWaalsContact O-N 3.1Å
497H90.3Very high86.8Confident138 Ų138112.1 Ų112.164%0.63954%0.54SS*.Hα-helixtrans-68.1-42.4177.4-172.843.4000111.5E493 E494 K499 E500 L501E493-H497 PolarHBondContact O-N 3.07Å; E494-H497 PolarHBondContact O-N 3.2Å; E494-H497 VanDerWaalsContact O-N 3.09Å; H497-K499 VanDerWaalsContact C-N 3.35Å; H497-K499 PolarHBondContact O-N 3.38Å; H497-E500 PolarHBondContact O-N 2.72Å; H497-L501 WeakPolarHBondContact O-CB 3.48Å; H497-L501 PolarHBondContact O-N 3.45Å
498E91.9Very high88.3Confident100 Ų100114.2 Ų114.247%0.46754%0.541SS..Hα-helixtrans-58.8-46.1173.8-165.1-165163.700111.1E494 E500 L501 Q502E494-E498 PolarHBondContact O-N 3.08Å; E498-E500 VanDerWaalsContact C-N 3.33Å; E498-E500 PolarHBondContact O-N 2.95Å; E498-L501 PolarHBondContact O-N 2.87Å; E498-Q502 WeakPolarHBondContact O-CB 3.33Å; E498-Q502 VanDerWaalsContact O-CG 3.28Å; E498-Q502 WeakPolarHBondContact O-CG 3.47Å; E498-Q502 PolarHBondContact O-N 3.49Å; E498-Q502 PolarHBondContact OE1-NE2 3.44Å
499K92.4Very high89.6Confident143 Ų143113.3 Ų113.362%0.62254%0.536SS*.Hα-helixtrans-58.5-41.2176.4179.3-174173.2-172.20112.9L495 R496 H497 R503L495-K499 VanDerWaalsContact O-CB 3.29Å; L495-K499 WeakPolarHBondContact O-CB 3.23Å; L495-K499 PolarHBondContact O-N 3.45Å; R496-K499 PolarHBondContact O-N 3.17Å; H497-K499 VanDerWaalsContact C-N 3.35Å; H497-K499 PolarHBondContact O-N 3.38Å; K499-R503 WeakPolarHBondContact O-CB 3.4Å; K499-R503 PolarHBondContact O-N 3.05Å
500E94.3Very high90.6Very high82 Ų82116.5 Ų116.538%0.38354%0.54SS..Hα-helixtrans-75.8-33.9179.6-154.565.4-165.400111.5R496 H497 E498 R503 E504R496-E500 PolarHBondContact O-N 3.37Å; R496-E500 VanDerWaalsContact O-N 3.1Å; H497-E500 PolarHBondContact O-N 2.72Å; E498-E500 VanDerWaalsContact C-N 3.33Å; E498-E500 PolarHBondContact O-N 2.95Å; E500-R503 WeakPolarHBondContact O-CA 3.24Å; E500-R503 VanDerWaalsContact O-CB 3.31Å; E500-R503 WeakPolarHBondContact O-CB 3.44Å; E500-R503 PolarHBondContact O-N 3.36Å; E500-R503 VanDerWaalsContact O-N 3.12Å; E500-R503 WeakPolarHBondContact OE1-CD 3.47Å; E500-R503 IonicContact OE1-CZ 3.66Å; E500-R503 IonicContact OE1-NE 3.97Å; E500-R503 IonicContact OE1-NH1 2.67Å; E500-R503 PolarHBondContact OE1-NH1 3.33Å; E500-R503 IonicContact OE2-NH1 2.62Å; E500-E504 PolarHBondContact O-N 3.1Å
501L93.9Very high91.5Very high99 Ų99113.3 Ų113.352%0.51853%0.533SS..Hα-helixtrans-62.1-45.5170.5-178.565.6000111.7H497 E498 R503 E504 E505H497-L501 WeakPolarHBondContact O-CB 3.48Å; H497-L501 PolarHBondContact O-N 3.45Å; E498-L501 PolarHBondContact O-N 2.87Å; L501-R503 PolarHBondContact O-N 2.75Å; L501-E504 PolarHBondContact O-N 3.29Å; L501-E505 WeakPolarHBondContact O-CB 3.48Å; L501-E505 PolarHBondContact O-N 2.81Å
502Q93.1Very high92.3Very high94 Ų94112.8 Ų112.844%0.43953%0.531SS..Hα-helixtrans-59.2-36.1172-71.6174.510.900111.3E498 I506E498-Q502 WeakPolarHBondContact O-CB 3.33Å; E498-Q502 VanDerWaalsContact O-CG 3.28Å; E498-Q502 WeakPolarHBondContact O-CG 3.47Å; E498-Q502 PolarHBondContact O-N 3.49Å; E498-Q502 PolarHBondContact OE1-NE2 3.44Å; Q502-I506 WeakPolarHBondContact O-CB 3.34Å; Q502-I506 WeakPolarHBondContact O-CD1 3.44Å; Q502-I506 WeakPolarHBondContact O-CG1 3.43Å; Q502-I506 PolarHBondContact O-N 2.96Å
503R96.2Very high93Very high148 Ų148111.5 Ų111.556%0.55853%0.528SS*.Hα-helixtrans-68.5-45.2176.3-169.1-164.4-170.7156.32.4112.5K499 E500 L501 E505 I506 Q507K499-R503 WeakPolarHBondContact O-CB 3.4Å; K499-R503 PolarHBondContact O-N 3.05Å; E500-R503 WeakPolarHBondContact O-CA 3.24Å; E500-R503 VanDerWaalsContact O-CB 3.31Å; E500-R503 WeakPolarHBondContact O-CB 3.44Å; E500-R503 PolarHBondContact O-N 3.36Å; E500-R503 VanDerWaalsContact O-N 3.12Å; E500-R503 WeakPolarHBondContact OE1-CD 3.47Å; E500-R503 IonicContact OE1-CZ 3.66Å; E500-R503 IonicContact OE1-NE 3.97Å; E500-R503 IonicContact OE1-NH1 2.67Å; E500-R503 PolarHBondContact OE1-NH1 3.33Å; E500-R503 IonicContact OE2-NH1 2.62Å; L501-R503 PolarHBondContact O-N 2.75Å; R503-E505 VanDerWaalsContact C-N 3.32Å; R503-I506 PolarHBondContact O-N 3.24Å; R503-Q507 WeakPolarHBondContact O-CB 3.34Å; R503-Q507 PolarHBondContact O-N 2.82Å
504E95.3Very high93.7Very high126 Ų126107.5 Ų107.559%0.58952%0.52SS*.Hα-helixtrans-61-42.1174.8-72.8-174.7175.900111.1E500 L501 Q507 K508E500-E504 PolarHBondContact O-N 3.1Å; L501-E504 PolarHBondContact O-N 3.29Å; E504-Q507 PolarHBondContact O-N 3.15Å; E504-K508 VanDerWaalsContact O-CB 3.29Å; E504-K508 WeakPolarHBondContact O-CB 3.36Å; E504-K508 PolarHBondContact O-N 3.28Å
505E95.1Very high94.4Very high112 Ų112104.4 Ų104.452%0.52351%0.511SS..Hα-helixtrans-64.6-45.2175.1-177.9161.4-128.500112L501 R503 Q507 K508 L509L501-E505 WeakPolarHBondContact O-CB 3.48Å; L501-E505 PolarHBondContact O-N 2.81Å; R503-E505 VanDerWaalsContact C-N 3.32Å; E505-Q507 VanDerWaalsContact C-N 3.33Å; E505-Q507 PolarHBondContact O-N 3.03Å; E505-K508 PolarHBondContact O-N 3.29Å; E505-L509 HydrophobicContact CG-CD1 3.88Å; E505-L509 HydrophobicContact CG-CG 4.29Å; E505-L509 WeakPolarHBondContact O-CB 3.4Å; E505-L509 VanDerWaalsContact O-CG 3.29Å; E505-L509 WeakPolarHBondContact O-CG 3.42Å; E505-L509 PolarHBondContact O-N 3Å
506I94.3Very high94.8Very high90 Ų90104 Ų10446%0.46251%0.509SS..Hα-helixtrans-58.8-44173.9-74.1164.6000110.9Q502 R503 L509 Q510Q502-I506 WeakPolarHBondContact O-CB 3.34Å; Q502-I506 WeakPolarHBondContact O-CD1 3.44Å; Q502-I506 WeakPolarHBondContact O-CG1 3.43Å; Q502-I506 PolarHBondContact O-N 2.96Å; R503-I506 PolarHBondContact O-N 3.24Å; I506-L509 PolarHBondContact O-N 3.33Å; I506-Q510 HydrophobicContact CG2-CG 4.43Å; I506-Q510 WeakPolarHBondContact O-CB 3.34Å; I506-Q510 WeakPolarHBondContact O-CG 3.41Å; I506-Q510 PolarHBondContact O-N 2.92Å
507Q95.8Very high95.1Very high133 Ų133104.7 Ų104.762%0.62151%0.511SS*.Hα-helixtrans-65.6-39.6178.2-176.6173.6-11.800111.9R503 E504 E505 Q510 G511R503-Q507 WeakPolarHBondContact O-CB 3.34Å; R503-Q507 PolarHBondContact O-N 2.82Å; E504-Q507 PolarHBondContact O-N 3.15Å; E505-Q507 VanDerWaalsContact C-N 3.33Å; E505-Q507 PolarHBondContact O-N 3.03Å; Q507-Q510 PolarHBondContact O-N 3.25Å; Q507-G511 PolarHBondContact O-N 3.49Å
508K95.8Very high95.4Very high135 Ų135100.3 Ų100.359%0.58750%0.499SS*.Hα-helixtrans-65.1-45175.1179.2-174172.9-166.70111.9E504 E505 G511 Q512E504-K508 VanDerWaalsContact O-CB 3.29Å; E504-K508 WeakPolarHBondContact O-CB 3.36Å; E504-K508 PolarHBondContact O-N 3.28Å; E505-K508 PolarHBondContact O-N 3.29Å; K508-G511 PolarHBondContact O-N 2.86Å; K508-Q512 WeakPolarHBondContact O-CG 3.48Å; K508-Q512 PolarHBondContact O-N 2.93Å
509L95.5Very high95.7Very high87 Ų87100.3 Ų100.346%0.45550%0.499SS..Hα-helixtrans-64.6-39.8175.7-71.7170.2000111.4E505 I506 G511 Q512 V513E505-L509 HydrophobicContact CG-CD1 3.88Å; E505-L509 HydrophobicContact CG-CG 4.29Å; E505-L509 WeakPolarHBondContact O-CB 3.4Å; E505-L509 VanDerWaalsContact O-CG 3.29Å; E505-L509 WeakPolarHBondContact O-CG 3.42Å; E505-L509 PolarHBondContact O-N 3Å; I506-L509 PolarHBondContact O-N 3.33Å; L509-G511 VanDerWaalsContact C-N 3.33Å; L509-G511 PolarHBondContact O-N 2.84Å; L509-Q512 PolarHBondContact O-N 2.98Å; L509-V513 WeakPolarHBondContact O-CB 2.96Å; L509-V513 WeakPolarHBondContact O-CG2 3.35Å; L509-V513 PolarHBondContact O-N 3.08Å
510Q96Very high95.8Very high130 Ų13097.9 Ų97.961%0.60749%0.492SS*.Hα-helixtrans-61.2-40.9171.8-75.8172.15.400111.8I506 Q507 V513 G514I506-Q510 HydrophobicContact CG2-CG 4.43Å; I506-Q510 WeakPolarHBondContact O-CB 3.34Å; I506-Q510 WeakPolarHBondContact O-CG 3.41Å; I506-Q510 PolarHBondContact O-N 2.92Å; Q507-Q510 PolarHBondContact O-N 3.25Å; Q510-V513 PolarHBondContact O-N 3.01Å; Q510-G514 PolarHBondContact O-N 3.4Å
511G95.6Very high96Very high41 Ų4199.6 Ų99.642%0.42350%0.5SS..Hα-helixtrans-60.4-46.8172.700000112.8Q507 K508 L509 G514 T515Q507-G511 PolarHBondContact O-N 3.49Å; K508-G511 PolarHBondContact O-N 2.86Å; L509-G511 VanDerWaalsContact C-N 3.33Å; L509-G511 PolarHBondContact O-N 2.84Å; G511-G514 CarbonylContact O-C 3.54Å; G511-G514 WeakPolarHBondContact O-CA 3.49Å; G511-G514 PolarHBondContact O-N 2.82Å; G511-T515 PolarHBondContact O-N 3.01Å
512Q96.9Very high96.2Very high92 Ų9299.9 Ų99.943%0.4350%0.502SS..Hα-helixtrans-65.5-38.4177.3-71.2177.7-34.500112.8K508 L509 G514 T515 L516K508-Q512 WeakPolarHBondContact O-CG 3.48Å; K508-Q512 PolarHBondContact O-N 2.93Å; L509-Q512 PolarHBondContact O-N 2.98Å; Q512-G514 PolarHBondContact O-N 3.31Å; Q512-T515 PolarHBondContact O-N 2.82Å; Q512-T515 PolarHBondContact O-OG1 2.97Å; Q512-L516 WeakPolarHBondContact O-CB 3.48Å; Q512-L516 VanDerWaalsContact O-CG 3.27Å; Q512-L516 WeakPolarHBondContact O-CG 3.41Å; Q512-L516 PolarHBondContact O-N 3.49Å
513V96.7Very high96.3Very high67 Ų67100.8 Ų100.841%0.40651%0.509SS..Hα-helixtrans-65.4-31171169.60000111L509 Q510 R517L509-V513 WeakPolarHBondContact O-CB 2.96Å; L509-V513 WeakPolarHBondContact O-CG2 3.35Å; L509-V513 PolarHBondContact O-N 3.08Å; Q510-V513 PolarHBondContact O-N 3.01Å; V513-R517 WeakPolarHBondContact O-CB 3.2Å; V513-R517 WeakPolarHBondContact O-CD 3.45Å; V513-R517 WeakPolarHBondContact O-CG 3.31Å; V513-R517 PolarHBondContact O-N 3.5Å
514G97.4Very high96.3Very high39 Ų3999.4 Ų99.440%0.40251%0.509SS..Hα-helixtrans-64.3-51.2171.400000113Q510 G511 Q512 R517 A518Q510-G514 PolarHBondContact O-N 3.4Å; G511-G514 CarbonylContact O-C 3.54Å; G511-G514 WeakPolarHBondContact O-CA 3.49Å; G511-G514 PolarHBondContact O-N 2.82Å; Q512-G514 PolarHBondContact O-N 3.31Å; G514-R517 PolarHBondContact O-N 3.32Å; G514-A518 PolarHBondContact O-N 2.91Å
515T97.3Very high96.4Very high73 Ų7397.3 Ų97.345%0.44850%0.502SS..Hα-helixtrans-66.3-45.7179.665.20000111.6G511 Q512 R517 A518 E519G511-T515 PolarHBondContact O-N 3.01Å; Q512-T515 PolarHBondContact O-N 2.82Å; Q512-T515 PolarHBondContact O-OG1 2.97Å; T515-R517 PolarHBondContact O-N 3.43Å; T515-A518 WeakPolarHBondContact O-CB 3.49Å; T515-A518 PolarHBondContact O-N 2.93Å; T515-E519 WeakPolarHBondContact CB-OE1 3.31Å; T515-E519 WeakPolarHBondContact O-CG 3.3Å; T515-E519 PolarHBondContact O-N 3.38Å; T515-E519 PolarHBondContact OG1-OE1 3.47Å
516L95.9Very high96.5Very high93 Ų9397 Ų9749%0.48750%0.5SS..Hα-helixtrans-59.7-32.8177.5-71.5170000112.8Q512 I520Q512-L516 WeakPolarHBondContact O-CB 3.48Å; Q512-L516 VanDerWaalsContact O-CG 3.27Å; Q512-L516 WeakPolarHBondContact O-CG 3.41Å; Q512-L516 PolarHBondContact O-N 3.49Å; L516-I520 WeakPolarHBondContact O-CB 3.31Å; L516-I520 WeakPolarHBondContact O-CD1 3.28Å; L516-I520 WeakPolarHBondContact O-CG1 3.45Å; L516-I520 PolarHBondContact O-N 2.88Å
517R97.6Very high96.5Very high177 Ų17795.5 Ų95.567%0.66850%0.502SS*.Hα-helixtrans-70.1-39.1173.5-78.4171.1-179.7175.41.3112.8V513 G514 T515 Q521V513-R517 WeakPolarHBondContact O-CB 3.2Å; V513-R517 WeakPolarHBondContact O-CD 3.45Å; V513-R517 WeakPolarHBondContact O-CG 3.31Å; V513-R517 PolarHBondContact O-N 3.5Å; G514-R517 PolarHBondContact O-N 3.32Å; T515-R517 PolarHBondContact O-N 3.43Å; R517-Q521 WeakPolarHBondContact O-CB 3.42Å; R517-Q521 PolarHBondContact O-N 2.99Å
518A97.3Very high96.5Very high46 Ų4694.6 Ų94.638%0.3850%0.5SS..Hα-helixtrans-66.7-45.3174.300000111G514 T515 I520 Q521 D522G514-A518 PolarHBondContact O-N 2.91Å; T515-A518 WeakPolarHBondContact O-CB 3.49Å; T515-A518 PolarHBondContact O-N 2.93Å; A518-I520 VanDerWaalsContact C-N 3.34Å; A518-I520 PolarHBondContact O-N 3.46Å; A518-Q521 PolarHBondContact O-N 3.33Å; A518-Q521 VanDerWaalsContact O-N 3.12Å; A518-D522 PolarHBondContact O-N 3.43Å
519E96.9Very high96.6Very high99 Ų9990.6 Ų90.646%0.46349%0.492SS..Hα-helixtrans-58.6-42.4175.7-69.3162.3-13800111.9T515 L523T515-E519 WeakPolarHBondContact CB-OE1 3.31Å; T515-E519 WeakPolarHBondContact O-CG 3.3Å; T515-E519 PolarHBondContact O-N 3.38Å; T515-E519 PolarHBondContact OG1-OE1 3.47Å; E519-L523 WeakPolarHBondContact O-CB 3.33Å; E519-L523 WeakPolarHBondContact O-CD1 3.44Å; E519-L523 VanDerWaalsContact O-CG 3.23Å; E519-L523 WeakPolarHBondContact O-CG 3.29Å; E519-L523 PolarHBondContact O-N 2.87Å
520I95.9Very high96.6Very high93 Ų9390.8 Ų90.848%0.47749%0.491SS..Hα-helixtrans-63.2-46.9172.9-72.2164.2000111L516 A518 D522 L523 E524L516-I520 WeakPolarHBondContact O-CB 3.31Å; L516-I520 WeakPolarHBondContact O-CD1 3.28Å; L516-I520 WeakPolarHBondContact O-CG1 3.45Å; L516-I520 PolarHBondContact O-N 2.88Å; A518-I520 VanDerWaalsContact C-N 3.34Å; A518-I520 PolarHBondContact O-N 3.46Å; I520-D522 PolarHBondContact O-N 2.97Å; I520-L523 PolarHBondContact O-N 3.47Å; I520-E524 HydrophobicContact CG2-CG 4.34Å; I520-E524 WeakPolarHBondContact O-CB 3.25Å; I520-E524 WeakPolarHBondContact O-CG 3.21Å; I520-E524 PolarHBondContact O-N 3.25Å
521Q97.8Very high96.5Very high118 Ų11887.2 Ų87.255%0.55148%0.484SS*.Hα-helixtrans-63.8-39.2-179.4-174.6175.9-0.200112.3R517 A518 E524 N525R517-Q521 WeakPolarHBondContact O-CB 3.42Å; R517-Q521 PolarHBondContact O-N 2.99Å; A518-Q521 PolarHBondContact O-N 3.33Å; A518-Q521 VanDerWaalsContact O-N 3.12Å; Q521-E524 PolarHBondContact O-N 2.67Å; Q521-N525 WeakPolarHBondContact O-CB 3.49Å; Q521-N525 PolarHBondContact O-N 2.94Å; Q521-N525 PolarHBondContact O-ND2 3.41Å; Q521-N525 VanDerWaalsContact O-ND2 3.08Å
522D97.3Very high96.6Very high104 Ų10490.9 Ų90.956%0.55649%0.49SS*.Hα-helixtrans-68.6-37.3176.5-73.6-23.9000111.7A518 I520 N525 Q526A518-D522 PolarHBondContact O-N 3.43Å; I520-D522 PolarHBondContact O-N 2.97Å; D522-N525 PolarHBondContact O-N 2.97Å; D522-Q526 WeakPolarHBondContact O-CB 3.32Å; D522-Q526 PolarHBondContact O-N 3.43Å
523L96.2Very high96.6Very high113 Ų11389.7 Ų89.759%0.59249%0.489SS*.Hα-helixtrans-68-38172.4-72.4169.9000112.7E519 I520 Q526 A527E519-L523 WeakPolarHBondContact O-CB 3.33Å; E519-L523 WeakPolarHBondContact O-CD1 3.44Å; E519-L523 VanDerWaalsContact O-CG 3.23Å; E519-L523 WeakPolarHBondContact O-CG 3.29Å; E519-L523 PolarHBondContact O-N 2.87Å; I520-L523 PolarHBondContact O-N 3.47Å; L523-Q526 PolarHBondContact O-N 2.91Å; L523-A527 WeakPolarHBondContact O-CB 3.45Å; L523-A527 PolarHBondContact O-N 2.9Å
524E96.2Very high96.5Very high119 Ų11994.1 Ų94.156%0.55650%0.499SS*.Hα-helixtrans-63.6-45.3172.8-75.4175.4170.300111.1I520 Q521 A527 L528I520-E524 HydrophobicContact CG2-CG 4.34Å; I520-E524 WeakPolarHBondContact O-CB 3.25Å; I520-E524 WeakPolarHBondContact O-CG 3.21Å; I520-E524 PolarHBondContact O-N 3.25Å; Q521-E524 PolarHBondContact O-N 2.67Å; E524-A527 PolarHBondContact O-N 3.15Å; E524-L528 WeakPolarHBondContact O-CG 3.41Å; E524-L528 PolarHBondContact O-N 2.87Å
525N96.8Very high96.5Very high83 Ų8397.7 Ų97.744%0.44450%0.5SS..Hα-helixtrans-60.7-43.8174.3-72-34.4000111.9Q521 D522 L528 A529Q521-N525 WeakPolarHBondContact O-CB 3.49Å; Q521-N525 PolarHBondContact O-N 2.94Å; Q521-N525 PolarHBondContact O-ND2 3.41Å; Q521-N525 VanDerWaalsContact O-ND2 3.08Å; D522-N525 PolarHBondContact O-N 2.97Å; N525-L528 PolarHBondContact O-N 3.3Å; N525-A529 WeakPolarHBondContact O-CB 3.19Å; N525-A529 PolarHBondContact O-N 3.39Å
526Q96.7Very high96.5Very high105 Ų10599.5 Ų99.549%0.49150%0.503SS..Hα-helixtrans-63.6-45.9176.9-179176.9-17.200111.3D522 L523 L528 A529 E530D522-Q526 WeakPolarHBondContact O-CB 3.32Å; D522-Q526 PolarHBondContact O-N 3.43Å; L523-Q526 PolarHBondContact O-N 2.91Å; Q526-L528 VanDerWaalsContact C-N 3.3Å; Q526-L528 PolarHBondContact O-N 2.88Å; Q526-A529 PolarHBondContact O-N 3.36Å; Q526-E530 HydrophobicContact CG-CG 4.39Å; Q526-E530 WeakPolarHBondContact CG-OE1 3.45Å; Q526-E530 PolarHBondContact NE2-OE1 2.92Å; Q526-E530 WeakPolarHBondContact O-CB 3.27Å; Q526-E530 WeakPolarHBondContact O-CG 3.35Å; Q526-E530 PolarHBondContact O-N 3.4Å
527A94.2Very high96.5Very high59 Ų5999.5 Ų99.549%0.48850%0.501SS..Hα-helixtrans-62.3-36.6178.700000112.5L523 E524 A531L523-A527 WeakPolarHBondContact O-CB 3.45Å; L523-A527 PolarHBondContact O-N 2.9Å; E524-A527 PolarHBondContact O-N 3.15Å; A527-A531 VanDerWaalsContact O-CB 3.28Å; A527-A531 WeakPolarHBondContact O-CB 3.27Å; A527-A531 PolarHBondContact O-N 3.2Å
528L97.4Very high96.3Very high113 Ų11397.3 Ų97.359%0.59250%0.498SS*.Hα-helixtrans-66.1-47.5172.9-72.5170.6000111.8E524 N525 Q526 E530 A531 E532E524-L528 WeakPolarHBondContact O-CG 3.41Å; E524-L528 PolarHBondContact O-N 2.87Å; N525-L528 PolarHBondContact O-N 3.3Å; Q526-L528 VanDerWaalsContact C-N 3.3Å; Q526-L528 PolarHBondContact O-N 2.88Å; L528-E530 PolarHBondContact O-N 2.74Å; L528-A531 PolarHBondContact O-N 3.16Å; L528-E532 WeakPolarHBondContact O-CG 3.26Å; L528-E532 PolarHBondContact O-N 2.86Å
529A96.8Very high96.3Very high51 Ų5198.7 Ų98.742%0.42150%0.502SS..Hα-helixtrans-62.3-42.617800000112.2N525 Q526 E532 T533N525-A529 WeakPolarHBondContact O-CB 3.19Å; N525-A529 PolarHBondContact O-N 3.39Å; Q526-A529 PolarHBondContact O-N 3.36Å; A529-E532 PolarHBondContact O-N 3.15Å; A529-T533 WeakPolarHBondContact O-CG2 3.32Å; A529-T533 PolarHBondContact O-N 3.16Å
530E95.3Very high96.3Very high91 Ų9199.5 Ų99.543%0.42551%0.505SS..Hα-helixtrans-60.5-47.7173.5-74.3-179-160.800110.9Q526 L528 E532 T533 W534Q526-E530 HydrophobicContact CG-CG 4.39Å; Q526-E530 WeakPolarHBondContact CG-OE1 3.45Å; Q526-E530 PolarHBondContact NE2-OE1 2.92Å; Q526-E530 WeakPolarHBondContact O-CB 3.27Å; Q526-E530 WeakPolarHBondContact O-CG 3.35Å; Q526-E530 PolarHBondContact O-N 3.4Å; L528-E530 PolarHBondContact O-N 2.74Å; E530-E532 VanDerWaalsContact C-N 3.31Å; E530-E532 PolarHBondContact O-N 3.4Å; E530-T533 PolarHBondContact O-N 3.33Å; E530-T533 VanDerWaalsContact O-N 3.16Å; E530-T533 PolarHBondContact O-OG1 2.85Å; E530-W534 PolarHBondContact O-N 3.41Å
531A95.3Very high96.2Very high56 Ų56100 Ų10046%0.46351%0.508SS..Hα-helixtrans-60-37.1176.600000113.2A527 L528 R535A527-A531 VanDerWaalsContact O-CB 3.28Å; A527-A531 WeakPolarHBondContact O-CB 3.27Å; A527-A531 PolarHBondContact O-N 3.2Å; L528-A531 PolarHBondContact O-N 3.16Å; A531-R535 WeakPolarHBondContact O-CB 3.4Å; A531-R535 PolarHBondContact O-N 2.86Å
532E97.5Very high96.2Very high117 Ų117100.2 Ų100.255%0.54751%0.509SS..Hα-helixtrans-65.5-44.6173.1-73.9-171.7156.700112L528 A529 E530 W534 R535 E536L528-E532 WeakPolarHBondContact O-CG 3.26Å; L528-E532 PolarHBondContact O-N 2.86Å; A529-E532 PolarHBondContact O-N 3.15Å; E530-E532 VanDerWaalsContact C-N 3.31Å; E530-E532 PolarHBondContact O-N 3.4Å; E532-W534 VanDerWaalsContact C-N 3.34Å; E532-W534 PolarHBondContact O-N 3.26Å; E532-R535 WeakPolarHBondContact O-CB 3.31Å; E532-R535 PolarHBondContact O-N 2.78Å; E532-E536 WeakPolarHBondContact O-CG 3.38Å; E532-E536 PolarHBondContact O-N 2.84Å
533T96.6Very high96.2Very high67 Ų67100.6 Ų100.641%0.41151%0.508SS..Hα-helixtrans-64.8-35.8176.364.70000112.9A529 E530 E536 Q537A529-T533 WeakPolarHBondContact O-CG2 3.32Å; A529-T533 PolarHBondContact O-N 3.16Å; E530-T533 PolarHBondContact O-N 3.33Å; E530-T533 VanDerWaalsContact O-N 3.16Å; E530-T533 PolarHBondContact O-OG1 2.85Å; T533-E536 PolarHBondContact O-N 2.87Å; T533-Q537 VanDerWaalsContact O-CG 3.29Å; T533-Q537 WeakPolarHBondContact O-CG 3.2Å; T533-Q537 PolarHBondContact O-N 2.85Å; T533-Q537 PolarHBondContact O-NE2 2.75Å
534W94.8Very high96.1Very high161 Ų16199.6 Ų99.661%0.6150%0.5SS*.Hα-helixtrans-66.1-41.7173.2-74.1119000112E530 E532 E536 Q537 Q538E530-W534 PolarHBondContact O-N 3.41Å; E532-W534 VanDerWaalsContact C-N 3.34Å; E532-W534 PolarHBondContact O-N 3.26Å; W534-E536 VanDerWaalsContact C-N 3.32Å; W534-E536 PolarHBondContact O-N 3.35Å; W534-Q537 PolarHBondContact O-N 2.84Å; W534-Q538 WeakPolarHBondContact O-CB 3.41Å; W534-Q538 PolarHBondContact O-N 3.43Å
535R97.6Very high95.9Very high114 Ų11499.5 Ų99.543%0.4350%0.5SS..Hα-helixtrans-59.6-41.9173.6-178.9-166.959.364.15111.3A531 E532 Q538 V539A531-R535 WeakPolarHBondContact O-CB 3.4Å; A531-R535 PolarHBondContact O-N 2.86Å; E532-R535 WeakPolarHBondContact O-CB 3.31Å; E532-R535 PolarHBondContact O-N 2.78Å; R535-Q538 PolarHBondContact O-N 3.45Å; R535-V539 WeakPolarHBondContact O-CG2 3.36Å; R535-V539 PolarHBondContact O-N 2.9Å
536E97.2Very high95.9Very high111 Ų11198.3 Ų98.352%0.51950%0.501SS..Hα-helixtrans-70.6-40.9179.3-71.4-177.4174.800112.7E532 T533 W534 Q538 V539 H540E532-E536 WeakPolarHBondContact O-CG 3.38Å; E532-E536 PolarHBondContact O-N 2.84Å; T533-E536 PolarHBondContact O-N 2.87Å; W534-E536 VanDerWaalsContact C-N 3.32Å; W534-E536 PolarHBondContact O-N 3.35Å; E536-Q538 VanDerWaalsContact C-N 3.33Å; E536-Q538 PolarHBondContact O-N 2.91Å; E536-V539 PolarHBondContact O-N 2.86Å; E536-H540 WeakPolarHBondContact O-CB 3.5Å; E536-H540 PolarHBondContact O-N 3.14Å
537Q95.7Very high95.9Very high92 Ų9298.6 Ų98.643%0.4351%0.505SS..Hα-helixtrans-59.9-43.1171-72.3173.153.500111.7T533 W534 H540 L541T533-Q537 VanDerWaalsContact O-CG 3.29Å; T533-Q537 WeakPolarHBondContact O-CG 3.2Å; T533-Q537 PolarHBondContact O-N 2.85Å; T533-Q537 PolarHBondContact O-NE2 2.75Å; W534-Q537 PolarHBondContact O-N 2.84Å; Q537-H540 PolarHBondContact O-N 3.38Å; Q537-L541 WeakPolarHBondContact O-CB 3.37Å; Q537-L541 VanDerWaalsContact O-CG 3.31Å; Q537-L541 WeakPolarHBondContact O-CG 3.29Å; Q537-L541 PolarHBondContact O-N 2.88Å
538Q92.8Very high95.7Very high131 Ų131101.5 Ų101.561%0.61251%0.509SS*.Hα-helixtrans-61.1-46.6176.2-178.1-179.2-10.300111.7W534 R535 E536 L541 Q542W534-Q538 WeakPolarHBondContact O-CB 3.41Å; W534-Q538 PolarHBondContact O-N 3.43Å; R535-Q538 PolarHBondContact O-N 3.45Å; E536-Q538 VanDerWaalsContact C-N 3.33Å; E536-Q538 PolarHBondContact O-N 2.91Å; Q538-L541 PolarHBondContact O-N 3.45Å; Q538-Q542 VanDerWaalsContact O-CB 3.31Å; Q538-Q542 WeakPolarHBondContact O-CB 3.42Å; Q538-Q542 PolarHBondContact O-N 2.95Å
539V97.8Very high95.6Very high76 Ų76100.1 Ų100.146%0.46150%0.502SS..Hα-helixtrans-63.3-43.1177.2169.80000111.2R535 E536 Q542 E543R535-V539 WeakPolarHBondContact O-CG2 3.36Å; R535-V539 PolarHBondContact O-N 2.9Å; E536-V539 PolarHBondContact O-N 2.86Å; V539-Q542 PolarHBondContact O-N 3.44Å; V539-E543 WeakPolarHBondContact O-CB 3.37Å; V539-E543 PolarHBondContact O-N 2.95Å
540H97Very high95.6Very high115 Ų115105.2 Ų105.253%0.53251%0.51SS..Hα-helixtrans-65.3-41.1179.3-175.355.9000112.6E536 Q537 E543 Q544E536-H540 WeakPolarHBondContact O-CB 3.5Å; E536-H540 PolarHBondContact O-N 3.14Å; Q537-H540 PolarHBondContact O-N 3.38Å; H540-E543 PolarHBondContact O-N 2.85Å; H540-Q544 WeakPolarHBondContact O-CB 3.04Å; H540-Q544 PolarHBondContact O-N 3.26Å
541L94.2Very high95.5Very high104 Ų104103.3 Ų103.355%0.54551%0.51SS..Hα-helixtrans-65.4-38.4173.7-71.3170.6000111.8Q537 Q538 Q544 Q545Q537-L541 WeakPolarHBondContact O-CB 3.37Å; Q537-L541 VanDerWaalsContact O-CG 3.31Å; Q537-L541 WeakPolarHBondContact O-CG 3.29Å; Q537-L541 PolarHBondContact O-N 2.88Å; Q538-L541 PolarHBondContact O-N 3.45Å; L541-Q544 PolarHBondContact O-N 2.81Å; L541-Q545 WeakPolarHBondContact O-CB 3.36Å; L541-Q545 PolarHBondContact O-N 3.47Å
542Q96.4Very high95.4Very high122 Ų122106 Ų10657%0.5751%0.511SS*.Hα-helixtrans-67.4-39.5176.1-173.9174.9-2.900112.1Q538 V539 Q545 A546Q538-Q542 VanDerWaalsContact O-CB 3.31Å; Q538-Q542 WeakPolarHBondContact O-CB 3.42Å; Q538-Q542 PolarHBondContact O-N 2.95Å; V539-Q542 PolarHBondContact O-N 3.44Å; Q542-Q545 PolarHBondContact O-N 3.45Å; Q542-A546 WeakPolarHBondContact O-CB 3.46Å; Q542-A546 PolarHBondContact O-N 2.9Å
543E97.4Very high95.3Very high112 Ų112106.4 Ų106.452%0.52351%0.513SS..Hα-helixtrans-65.1-45.9172.8-177.4178-14600111.3V539 H540 Q545 A546 L547V539-E543 WeakPolarHBondContact O-CB 3.37Å; V539-E543 PolarHBondContact O-N 2.95Å; H540-E543 PolarHBondContact O-N 2.85Å; E543-Q545 VanDerWaalsContact C-N 3.3Å; E543-Q545 PolarHBondContact O-N 3.42Å; E543-A546 PolarHBondContact O-N 3.36Å; E543-A546 VanDerWaalsContact O-N 3.14Å; E543-L547 HydrophobicContact CG-CD1 4.19Å; E543-L547 WeakPolarHBondContact O-CG 3.47Å; E543-L547 PolarHBondContact O-N 3.39Å
544Q94.3Very high95.2Very high93 Ų93107 Ų10744%0.43551%0.514SS..Hα-helixtrans-59-42.2175.3-174.1-178.960.900111.6H540 L541 L547 Q548H540-Q544 WeakPolarHBondContact O-CB 3.04Å; H540-Q544 PolarHBondContact O-N 3.26Å; L541-Q544 PolarHBondContact O-N 2.81Å; Q544-L547 PolarHBondContact O-N 3.27Å; Q544-Q548 WeakPolarHBondContact O-CB 3.29Å; Q544-Q548 WeakPolarHBondContact O-CG 3.47Å; Q544-Q548 PolarHBondContact O-N 3.34Å
545Q91.8Very high95.1Very high117 Ų117104.4 Ų104.455%0.54751%0.511SS..Hα-helixtrans-65.6-39.9175.2-169.7-178.411.700111.8L541 Q542 E543 Q548 N549L541-Q545 WeakPolarHBondContact O-CB 3.36Å; L541-Q545 PolarHBondContact O-N 3.47Å; Q542-Q545 PolarHBondContact O-N 3.45Å; E543-Q545 VanDerWaalsContact C-N 3.3Å; E543-Q545 PolarHBondContact O-N 3.42Å; Q545-Q548 PolarHBondContact O-N 2.89Å; Q545-N549 VanDerWaalsContact O-CB 3.32Å; Q545-N549 WeakPolarHBondContact O-CB 3.45Å; Q545-N549 PolarHBondContact O-N 3.46Å; Q545-N549 PolarHBondContact O-ND2 3.19Å
546A96.7Very high94.9Very high57 Ų57103.3 Ų103.347%0.47151%0.511SS..Hα-helixtrans-64.3-41.9175.800000112.1Q542 E543 N549 R550Q542-A546 WeakPolarHBondContact O-CB 3.46Å; Q542-A546 PolarHBondContact O-N 2.9Å; E543-A546 PolarHBondContact O-N 3.36Å; E543-A546 VanDerWaalsContact O-N 3.14Å; A546-N549 PolarHBondContact O-N 2.89Å; A546-R550 WeakPolarHBondContact O-CB 3.35Å; A546-R550 PolarHBondContact O-N 3.46Å
547L96.9Very high94.9Very high111 Ų111100.8 Ų100.858%0.58151%0.509SS*.Hα-helixtrans-64.7-42.8175-70.8171000112E543 Q544 R550 A551E543-L547 HydrophobicContact CG-CD1 4.19Å; E543-L547 WeakPolarHBondContact O-CG 3.47Å; E543-L547 PolarHBondContact O-N 3.39Å; Q544-L547 PolarHBondContact O-N 3.27Å; L547-R550 PolarHBondContact O-N 2.93Å; L547-A551 WeakPolarHBondContact O-CB 3.39Å; L547-A551 PolarHBondContact O-N 3.26Å
548Q91Very high94.9Very high121 Ų121101.3 Ų101.357%0.56551%0.512SS*.Hα-helixtrans-64.4-43.5174.6-74.5179.910.600112.1Q544 Q545 R550 A551 K552Q544-Q548 WeakPolarHBondContact O-CB 3.29Å; Q544-Q548 WeakPolarHBondContact O-CG 3.47Å; Q544-Q548 PolarHBondContact O-N 3.34Å; Q545-Q548 PolarHBondContact O-N 2.89Å; Q548-R550 VanDerWaalsContact C-N 3.32Å; Q548-R550 PolarHBondContact O-N 2.95Å; Q548-A551 PolarHBondContact O-N 2.86Å; Q548-K552 WeakPolarHBondContact O-CB 3.39Å; Q548-K552 PolarHBondContact O-N 2.93Å
549N94.2Very high94.9Very high83 Ų8398.6 Ų98.644%0.44450%0.504SS..Hα-helixtrans-61.8-40.3175.7-76.1-21.7000111.7Q545 A546 K552 Q553Q545-N549 VanDerWaalsContact O-CB 3.32Å; Q545-N549 WeakPolarHBondContact O-CB 3.45Å; Q545-N549 PolarHBondContact O-N 3.46Å; Q545-N549 PolarHBondContact O-ND2 3.19Å; A546-N549 PolarHBondContact O-N 2.89Å; N549-K552 WeakPolarHBondContact O-CB 3.25Å; N549-K552 PolarHBondContact O-N 2.96Å; N549-Q553 WeakPolarHBondContact O-CG 3.4Å; N549-Q553 PolarHBondContact O-N 2.89Å
550R96.6Very high94.8Very high158 Ų158100.5 Ų100.560%0.59651%0.508SS*.Hα-helixtrans-65.1-51.5175.6-173.1-174.2176.4108.916.8111.7A546 L547 Q548 K552 Q553 D554A546-R550 WeakPolarHBondContact O-CB 3.35Å; A546-R550 PolarHBondContact O-N 3.46Å; L547-R550 PolarHBondContact O-N 2.93Å; Q548-R550 VanDerWaalsContact C-N 3.32Å; Q548-R550 PolarHBondContact O-N 2.95Å; R550-K552 PolarHBondContact O-N 3.48Å; R550-Q553 WeakPolarHBondContact O-CB 3.36Å; R550-Q553 PolarHBondContact O-N 2.98Å; R550-D554 IonicContact NE-OD2 3.17Å; R550-D554 PolarHBondContact NE-OD2 3.43Å; R550-D554 PolarHBondContact O-N 3.37Å
551A92.9Very high94.8Very high51 Ų51102.1 Ų102.142%0.42151%0.509SS..Hα-helixtrans-59.2-34.5178.300000111.9L547 Q548 L555L547-A551 WeakPolarHBondContact O-CB 3.39Å; L547-A551 PolarHBondContact O-N 3.26Å; Q548-A551 PolarHBondContact O-N 2.86Å; A551-L555 WeakPolarHBondContact O-CB 3.44Å; A551-L555 VanDerWaalsContact O-CG 3.29Å; A551-L555 WeakPolarHBondContact O-CG 3.24Å; A551-L555 PolarHBondContact O-N 3.4Å; A551-L555 VanDerWaalsContact O-N 3.1Å
552K93.3Very high94.8Very high112 Ų112103.9 Ų103.949%0.48751%0.51SS..Hα-helixtrans-63.2-48170.6-173.5-169.7174.8-99.50111.9Q548 N549 R550 L555 E556Q548-K552 WeakPolarHBondContact O-CB 3.39Å; Q548-K552 PolarHBondContact O-N 2.93Å; N549-K552 WeakPolarHBondContact O-CB 3.25Å; N549-K552 PolarHBondContact O-N 2.96Å; R550-K552 PolarHBondContact O-N 3.48Å; K552-L555 PolarHBondContact O-N 2.88Å; K552-E556 VanDerWaalsContact CE-OE1 3.24Å; K552-E556 WeakPolarHBondContact CE-OE1 3.33Å; K552-E556 HydrophobicContact CG-CG 4.39Å; K552-E556 IonicContact NZ-OE1 3.61Å; K552-E556 PolarHBondContact NZ-OE1 3.33Å; K552-E556 IonicContact NZ-OE2 3.86Å; K552-E556 PolarHBondContact NZ-OE2 3.48Å; K552-E556 WeakPolarHBondContact O-CB 3.37Å; K552-E556 WeakPolarHBondContact O-CG 3.31Å; K552-E556 PolarHBondContact O-N 3.3Å
553Q96.1Very high94.8Very high126 Ų126104.2 Ų104.259%0.58951%0.509SS*.Hα-helixtrans-62.7-42.7178.6-75.7172.8-17.800112.5N549 R550 L555 E556 A557N549-Q553 WeakPolarHBondContact O-CG 3.4Å; N549-Q553 PolarHBondContact O-N 2.89Å; R550-Q553 WeakPolarHBondContact O-CB 3.36Å; R550-Q553 PolarHBondContact O-N 2.98Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 3.48Å; Q553-E556 PolarHBondContact O-N 2.83Å; Q553-A557 WeakPolarHBondContact O-CB 3.31Å; Q553-A557 PolarHBondContact O-N 2.91Å
554D94.9Very high94.9Very high81 Ų81104.8 Ų104.843%0.43351%0.512SS..Hα-helixtrans-61.4-43.3176.9-67-33.1000110.2R550 A557 E558R550-D554 IonicContact NE-OD2 3.17Å; R550-D554 PolarHBondContact NE-OD2 3.43Å; R550-D554 PolarHBondContact O-N 3.37Å; D554-A557 PolarHBondContact O-N 3.47Å; D554-E558 PolarHBondContact O-N 2.88Å
555L91.4Very high94.9Very high105 Ų105104 Ų10455%0.5551%0.508SS..Hα-helixtrans-68.4-36.9173.9-73.2169.7000114A551 K552 Q553 A557 E558 V559A551-L555 WeakPolarHBondContact O-CB 3.44Å; A551-L555 VanDerWaalsContact O-CG 3.29Å; A551-L555 WeakPolarHBondContact O-CG 3.24Å; A551-L555 PolarHBondContact O-N 3.4Å; A551-L555 VanDerWaalsContact O-N 3.1Å; K552-L555 PolarHBondContact O-N 2.88Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 3.48Å; L555-A557 VanDerWaalsContact C-N 3.33Å; L555-E558 PolarHBondContact O-N 3.38Å; L555-V559 WeakPolarHBondContact O-CG2 3.45Å; L555-V559 PolarHBondContact O-N 2.88Å
556E94.3Very high95Very high91 Ų91103.3 Ų103.343%0.42551%0.508SS..Hα-helixtrans-64.4-39.6175.6-77.3177.7140.800110.6K552 Q553 V559 E560K552-E556 VanDerWaalsContact CE-OE1 3.24Å; K552-E556 WeakPolarHBondContact CE-OE1 3.33Å; K552-E556 HydrophobicContact CG-CG 4.39Å; K552-E556 IonicContact NZ-OE1 3.61Å; K552-E556 PolarHBondContact NZ-OE1 3.33Å; K552-E556 IonicContact NZ-OE2 3.86Å; K552-E556 PolarHBondContact NZ-OE2 3.48Å; K552-E556 WeakPolarHBondContact O-CB 3.37Å; K552-E556 WeakPolarHBondContact O-CG 3.31Å; K552-E556 PolarHBondContact O-N 3.3Å; Q553-E556 PolarHBondContact O-N 2.83Å; E556-V559 PolarHBondContact O-N 2.87Å; E556-E560 WeakPolarHBondContact O-CG 3.47Å; E556-E560 PolarHBondContact O-N 3.31Å
557A96.3Very high95Very high58 Ų58106.7 Ų106.748%0.47951%0.514SS..Hα-helixtrans-66.7-38.8173.600000113.1Q553 D554 L555 E560 R561Q553-A557 WeakPolarHBondContact O-CB 3.31Å; Q553-A557 PolarHBondContact O-N 2.91Å; D554-A557 PolarHBondContact O-N 3.47Å; L555-A557 VanDerWaalsContact C-N 3.33Å; A557-E560 PolarHBondContact O-N 2.94Å; A557-R561 WeakPolarHBondContact O-CB 3.35Å; A557-R561 PolarHBondContact O-N 3.38Å
558E95.9Very high95.1Very high104 Ų104108.2 Ų108.249%0.48651%0.513SS..Hα-helixtrans-62.2-43.5171.5-74.9-174.2177.700111.7D554 L555 E560 R561 Y562D554-E558 PolarHBondContact O-N 2.88Å; L555-E558 PolarHBondContact O-N 3.38Å; E558-E560 PolarHBondContact O-N 3.26Å; E558-R561 PolarHBondContact O-N 3.41Å; E558-Y562 HydrophobicContact CB-CE2 4.33Å; E558-Y562 WeakPolarHBondContact O-CD2 3.08Å; E558-Y562 PolarHBondContact O-N 2.84Å
559V93.4Very high95.4Very high74 Ų74107.5 Ų107.545%0.44851%0.513SS..Hα-helixtrans-64.6-38.2176.41670000112L555 E556 K563L555-V559 WeakPolarHBondContact O-CG2 3.45Å; L555-V559 PolarHBondContact O-N 2.88Å; E556-V559 PolarHBondContact O-N 2.87Å; V559-K563 HydrophobicContact CG1-CD 4.37Å; V559-K563 VanDerWaalsContact O-CG 3.28Å; V559-K563 WeakPolarHBondContact O-CG 3.43Å; V559-K563 PolarHBondContact O-N 2.87Å; V559-K563 VanDerWaalsContact O-N 3.07Å
560E96.6Very high95.5Very high115 Ų115108.5 Ų108.554%0.53751%0.514SS..Hα-helixtrans-65.4-41172.5-75.6-173.8176.500112.4E556 A557 E558 K563 Q564E556-E560 WeakPolarHBondContact O-CG 3.47Å; E556-E560 PolarHBondContact O-N 3.31Å; A557-E560 PolarHBondContact O-N 2.94Å; E558-E560 PolarHBondContact O-N 3.26Å; E560-K563 PolarHBondContact O-N 2.89Å; E560-Q564 WeakPolarHBondContact O-CG 3.43Å; E560-Q564 PolarHBondContact O-N 3.48Å
561R97Very high95.5Very high149 Ų149104.3 Ų104.356%0.56250%0.504SS*.Hα-helixtrans-61.2-47.6173.6-179.7-178.7163.4-152.8-16.1111.7A557 E558 K563 Q564 E565A557-R561 WeakPolarHBondContact O-CB 3.35Å; A557-R561 PolarHBondContact O-N 3.38Å; E558-R561 PolarHBondContact O-N 3.41Å; R561-K563 VanDerWaalsContact C-N 3.29Å; R561-K563 PolarHBondContact O-N 2.91Å; R561-Q564 PolarHBondContact O-N 3.48Å; R561-Q564 VanDerWaalsContact O-N 3.09Å; R561-E565 HydrophobicContact CG-CG 4.45Å; R561-E565 IonicContact CZ-OE1 2.75Å; R561-E565 IonicContact NE-OE1 3.98Å; R561-E565 PolarHBondContact NE-OE1 3.49Å; R561-E565 IonicContact NH2-OE1 2.64Å; R561-E565 PolarHBondContact NH2-OE1 3.38Å; R561-E565 IonicContact NH2-OE2 2.64Å; R561-E565 PolarHBondContact O-N 3.14Å
562Y93.6Very high95.7Very high142 Ų142106.7 Ų106.756%0.55751%0.506SS*.Hα-helixtrans-63.1-33.4178.2-72-55.6000112.7E558 L566E558-Y562 HydrophobicContact CB-CE2 4.33Å; E558-Y562 WeakPolarHBondContact O-CD2 3.08Å; E558-Y562 PolarHBondContact O-N 2.84Å; Y562-L566 VanDerWaalsContact O-CB 3.32Å; Y562-L566 WeakPolarHBondContact O-CB 3.38Å; Y562-L566 PolarHBondContact O-N 2.87Å
563K96.8Very high95.8Very high128 Ų128107.4 Ų107.456%0.55751%0.511SS*.Hα-helixtrans-63.9-42.2171.2-71.9164.4-174.9166.60112V559 E560 R561 L566 Q567V559-K563 HydrophobicContact CG1-CD 4.37Å; V559-K563 VanDerWaalsContact O-CG 3.28Å; V559-K563 WeakPolarHBondContact O-CG 3.43Å; V559-K563 PolarHBondContact O-N 2.87Å; V559-K563 VanDerWaalsContact O-N 3.07Å; E560-K563 PolarHBondContact O-N 2.89Å; R561-K563 VanDerWaalsContact C-N 3.29Å; R561-K563 PolarHBondContact O-N 2.91Å; K563-L566 PolarHBondContact O-N 3.11Å; K563-Q567 WeakPolarHBondContact O-CB 3.42Å; K563-Q567 PolarHBondContact O-N 3.32Å
564Q97.8Very high95.9Very high125 Ų125106.4 Ų106.458%0.58451%0.506SS*.Hα-helixtrans-67.1-40.7177.3-68.117126.600111.9E560 R561 Q567 Y568E560-Q564 WeakPolarHBondContact O-CG 3.43Å; E560-Q564 PolarHBondContact O-N 3.48Å; R561-Q564 PolarHBondContact O-N 3.48Å; R561-Q564 VanDerWaalsContact O-N 3.09Å; Q564-Q567 PolarHBondContact O-N 2.81Å; Q564-Y568 WeakPolarHBondContact O-CB 3.38Å; Q564-Y568 PolarHBondContact O-N 2.94Å
565E96.1Very high96Very high76 Ų76110.2 Ų110.236%0.35552%0.515SS..Hα-helixtrans-65.3-41.8175-71.4-180178.300111.8R561 Y568 L569R561-E565 HydrophobicContact CG-CG 4.45Å; R561-E565 IonicContact CZ-OE1 2.75Å; R561-E565 IonicContact NE-OE1 3.98Å; R561-E565 PolarHBondContact NE-OE1 3.49Å; R561-E565 IonicContact NH2-OE1 2.64Å; R561-E565 PolarHBondContact NH2-OE1 3.38Å; R561-E565 IonicContact NH2-OE2 2.64Å; R561-E565 PolarHBondContact O-N 3.14Å; E565-Y568 PolarHBondContact O-N 3.42Å; E565-L569 WeakPolarHBondContact O-CG 3.5Å; E565-L569 PolarHBondContact O-N 2.93Å; E565-L569 VanDerWaalsContact O-N 3.07Å
566L93Very high96.3Very high103 Ų103107.4 Ų107.454%0.53951%0.506SS..Hα-helixtrans-61.1-51.3173.3-172.877000111.2Y562 K563 Y568 L569 E570Y562-L566 VanDerWaalsContact O-CB 3.32Å; Y562-L566 WeakPolarHBondContact O-CB 3.38Å; Y562-L566 PolarHBondContact O-N 2.87Å; K563-L566 PolarHBondContact O-N 3.11Å; L566-Y568 VanDerWaalsContact C-N 3.29Å; L566-Y568 PolarHBondContact O-N 3.23Å; L566-L569 PolarHBondContact O-N 2.94Å; L566-L569 VanDerWaalsContact O-N 3.11Å; L566-E570 WeakPolarHBondContact O-CG 3.4Å; L566-E570 PolarHBondContact O-N 3.42Å
567Q97.7Very high96.5Very high128 Ų128108.9 Ų108.960%0.59851%0.511SS*.Hα-helixtrans-59.5-40.7179.9-174.8179.92.200111.4K563 Q564 E570 D571K563-Q567 WeakPolarHBondContact O-CB 3.42Å; K563-Q567 PolarHBondContact O-N 3.32Å; Q564-Q567 PolarHBondContact O-N 2.81Å; Q567-E570 PolarHBondContact O-N 3.48Å; Q567-D571 WeakPolarHBondContact O-CB 3.4Å; Q567-D571 PolarHBondContact O-N 3.44Å
568Y97.9Very high96.5Very high142 Ų142111.4 Ų111.456%0.55752%0.516SS*.Hα-helixtrans-61.8-43.2175.5176.4-86000112Q564 E565 L566 D571 E572Q564-Y568 WeakPolarHBondContact O-CB 3.38Å; Q564-Y568 PolarHBondContact O-N 2.94Å; E565-Y568 PolarHBondContact O-N 3.42Å; L566-Y568 VanDerWaalsContact C-N 3.29Å; L566-Y568 PolarHBondContact O-N 3.23Å; Y568-D571 PolarHBondContact O-N 2.96Å; Y568-E572 HydrophobicContact CE1-CB 4.44Å; Y568-E572 VanDerWaalsContact CE1-OE2 3.26Å; Y568-E572 WeakPolarHBondContact CE1-OE2 3.29Å; Y568-E572 WeakPolarHBondContact O-CB 3.28Å; Y568-E572 PolarHBondContact O-N 3.43Å
569L96.7Very high96.7Very high107 Ų107110.8 Ų110.856%0.5652%0.516SS*.Hα-helixtrans-68.6-36.7177.7-71170.5000112.5E565 L566 H573E565-L569 WeakPolarHBondContact O-CG 3.5Å; E565-L569 PolarHBondContact O-N 2.93Å; E565-L569 VanDerWaalsContact O-N 3.07Å; L566-L569 PolarHBondContact O-N 2.94Å; L566-L569 VanDerWaalsContact O-N 3.11Å; L569-H573 VanDerWaalsContact O-CB 3.24Å; L569-H573 WeakPolarHBondContact O-CB 3.41Å; L569-H573 PolarHBondContact O-N 3.4Å
570E96.1Very high96.8Very high103 Ų103111.8 Ų111.848%0.48152%0.518SS..Hα-helixtrans-62.3-46.8171.5-72.2178.5163.700110.8L566 Q567 H573 H574L566-E570 WeakPolarHBondContact O-CG 3.4Å; L566-E570 PolarHBondContact O-N 3.42Å; Q567-E570 PolarHBondContact O-N 3.48Å; E570-H573 PolarHBondContact O-N 3.45Å; E570-H574 WeakPolarHBondContact O-CB 3.41Å; E570-H574 PolarHBondContact O-CD2 3.33Å; E570-H574 PolarHBondContact O-N 2.85Å
571D97.3Very high96.9Very high71 Ų71112.3 Ų112.338%0.3852%0.52SS..Hα-helixtrans-62.2-42.9176.6-121.835.5000112.2Q567 Y568 H574 R575Q567-D571 WeakPolarHBondContact O-CB 3.4Å; Q567-D571 PolarHBondContact O-N 3.44Å; Y568-D571 PolarHBondContact O-N 2.96Å; D571-H574 PolarHBondContact O-N 2.97Å; D571-R575 WeakPolarHBondContact O-CB 3.47Å; D571-R575 WeakPolarHBondContact O-CD 3.45Å; D571-R575 WeakPolarHBondContact O-CG 3.37Å; D571-R575 PolarHBondContact O-N 2.83Å; D571-R575 IonicContact OD2-CZ 3.5Å; D571-R575 IonicContact OD2-NE 3.52Å; D571-R575 IonicContact OD2-NH2 2.75Å; D571-R575 PolarHBondContact OD2-NH2 3.46Å
572E97.5Very high96.9Very high100 Ų100108.1 Ų108.147%0.46751%0.514SS..Hα-helixtrans-64.8-43.5175.7-178.2163.1-15900111.3Y568 R575 A576Y568-E572 HydrophobicContact CE1-CB 4.44Å; Y568-E572 VanDerWaalsContact CE1-OE2 3.26Å; Y568-E572 WeakPolarHBondContact CE1-OE2 3.29Å; Y568-E572 WeakPolarHBondContact O-CB 3.28Å; Y568-E572 PolarHBondContact O-N 3.43Å; E572-R575 PolarHBondContact O-N 3.4Å; E572-A576 WeakPolarHBondContact O-CB 3.37Å; E572-A576 PolarHBondContact O-N 3.45Å
573H95.3Very high97.1Very high127 Ų127108.3 Ų108.359%0.58851%0.514SS*.Hα-helixtrans-64.1-39.8174.8178.4-114.4000112.2L569 E570 A576 K577L569-H573 VanDerWaalsContact O-CB 3.24Å; L569-H573 WeakPolarHBondContact O-CB 3.41Å; L569-H573 PolarHBondContact O-N 3.4Å; E570-H573 PolarHBondContact O-N 3.45Å; H573-A576 PolarHBondContact O-N 3.07Å; H573-K577 WeakPolarHBondContact O-CB 3.45Å; H573-K577 PolarHBondContact O-N 2.67Å
574H97.8Very high97.1Very high105 Ų105106.9 Ų106.949%0.48651%0.511SS..Hα-helixtrans-62.5-44.7173-83-64.9000111.9E570 D571 K577 I578E570-H574 WeakPolarHBondContact O-CB 3.41Å; E570-H574 PolarHBondContact O-CD2 3.33Å; E570-H574 PolarHBondContact O-N 2.85Å; D571-H574 PolarHBondContact O-N 2.97Å; H574-K577 PolarHBondContact O-N 2.67Å; H574-I578 WeakPolarHBondContact O-CD1 3.26Å; H574-I578 VanDerWaalsContact O-CG1 3.27Å; H574-I578 WeakPolarHBondContact O-CG1 3.31Å; H574-I578 PolarHBondContact O-N 2.82Å
575R97.9Very high97.1Very high162 Ų162106.8 Ų106.861%0.61151%0.509SS*.Hα-helixtrans-62.9-42.4175.2-68.7164.1-163-158.97.5111.7D571 E572 I578 N579D571-R575 WeakPolarHBondContact O-CB 3.47Å; D571-R575 WeakPolarHBondContact O-CD 3.45Å; D571-R575 WeakPolarHBondContact O-CG 3.37Å; D571-R575 PolarHBondContact O-N 2.83Å; D571-R575 IonicContact OD2-CZ 3.5Å; D571-R575 IonicContact OD2-NE 3.52Å; D571-R575 IonicContact OD2-NH2 2.75Å; D571-R575 PolarHBondContact OD2-NH2 3.46Å; E572-R575 PolarHBondContact O-N 3.4Å; R575-I578 PolarHBondContact O-N 3.23Å; R575-N579 WeakPolarHBondContact O-CB 3.35Å; R575-N579 PolarHBondContact O-N 3.41Å
576A97.1Very high97.2Very high45 Ų45107.4 Ų107.437%0.37252%0.515SS..Hα-helixtrans-63.2-44.5176.100000111.8E572 H573 I578 N579 L580E572-A576 WeakPolarHBondContact O-CB 3.37Å; E572-A576 PolarHBondContact O-N 3.45Å; H573-A576 PolarHBondContact O-N 3.07Å; A576-I578 PolarHBondContact O-N 3.46Å; A576-N579 PolarHBondContact O-N 3.34Å; A576-L580 WeakPolarHBondContact O-CG 3.49Å; A576-L580 PolarHBondContact O-N 3.35Å
577K98Very high97.4Very high122 Ų122110 Ų11053%0.5352%0.517SS..Hα-helixtrans-58.9-46.5174.4-178.1178.1178.6179.30111.7H573 H574 L580 Q581H573-K577 WeakPolarHBondContact O-CB 3.45Å; H573-K577 PolarHBondContact O-N 2.67Å; H574-K577 PolarHBondContact O-N 2.67Å; K577-L580 PolarHBondContact O-N 2.88Å; K577-Q581 VanDerWaalsContact O-CB 3.26Å; K577-Q581 WeakPolarHBondContact O-CB 3.48Å; K577-Q581 PolarHBondContact O-N 2.95Å
578I98.1Very high97.4Very high112 Ų112109.4 Ų109.457%0.57451%0.514SS*.Hα-helixtrans-63.1-42.3177.3-68.9164.2000111H574 R575 A576 Q581 S582H574-I578 WeakPolarHBondContact O-CD1 3.26Å; H574-I578 VanDerWaalsContact O-CG1 3.27Å; H574-I578 WeakPolarHBondContact O-CG1 3.31Å; H574-I578 PolarHBondContact O-N 2.82Å; R575-I578 PolarHBondContact O-N 3.23Å; A576-I578 PolarHBondContact O-N 3.46Å; I578-Q581 PolarHBondContact O-N 3.07Å; I578-S582 PolarHBondContact O-N 3.01Å
579N98.1Very high97.4Very high91 Ų91105.8 Ų105.849%0.48751%0.505SS..Hα-helixtrans-62.7-46.2177-173.9-90.6000112.3R575 A576 S582 R583R575-N579 WeakPolarHBondContact O-CB 3.35Å; R575-N579 PolarHBondContact O-N 3.41Å; A576-N579 PolarHBondContact O-N 3.34Å; N579-S582 PolarHBondContact O-N 2.86Å; N579-R583 WeakPolarHBondContact O-CG 3.23Å; N579-R583 PolarHBondContact O-N 2.9Å; N579-R583 WeakPolarHBondContact OD1-CD 3.37Å
580L97Very high97.5Very high95 Ų95105.3 Ų105.350%0.49750%0.5SS..Hα-helixtrans-64.9-40.9176.8-69.5174.2000111.6A576 K577 R583 I584A576-L580 WeakPolarHBondContact O-CG 3.49Å; A576-L580 PolarHBondContact O-N 3.35Å; K577-L580 PolarHBondContact O-N 2.88Å; L580-R583 PolarHBondContact O-N 3.23Å; L580-I584 VanDerWaalsContact O-CG1 3.29Å; L580-I584 WeakPolarHBondContact O-CG1 3.45Å; L580-I584 PolarHBondContact O-N 2.9Å
581Q97.8Very high97.5Very high125 Ų125104.2 Ų104.258%0.58450%0.496SS*.Hα-helixtrans-64.2-39.8176.6-172.9173.1-3.500112.1K577 I578 I584 K585K577-Q581 VanDerWaalsContact O-CB 3.26Å; K577-Q581 WeakPolarHBondContact O-CB 3.48Å; K577-Q581 PolarHBondContact O-N 2.95Å; I578-Q581 PolarHBondContact O-N 3.07Å; Q581-I584 PolarHBondContact O-N 3.07Å; Q581-K585 PolarHBondContact O-N 2.99Å
582S97.8Very high97.5Very high61 Ų61105.1 Ų105.143%0.42750%0.498SS..Hα-helixtrans-59.9-49.9171-168.60000110.9I578 N579 I584 K585 D586I578-S582 PolarHBondContact O-N 3.01Å; N579-S582 PolarHBondContact O-N 2.86Å; S582-I584 VanDerWaalsContact C-N 3.28Å; S582-I584 PolarHBondContact O-N 3.41Å; S582-K585 CarbonylContact O-C 3.5Å; S582-K585 WeakPolarHBondContact O-CA 3.46Å; S582-K585 WeakPolarHBondContact O-CB 3.44Å; S582-K585 PolarHBondContact O-N 2.83Å; S582-K585 VanDerWaalsContact O-N 3.07Å; S582-D586 PolarHBondContact O-N 2.94Å; S582-D586 VanDerWaalsContact O-OD2 3.06Å
583R97.8Very high97.4Very high146 Ų146106.5 Ų106.555%0.55150%0.503SS*.Hα-helixtrans-64.7-29.1-179.2-71.4173.861-162-4.5113.7N579 L580 R587N579-R583 WeakPolarHBondContact O-CG 3.23Å; N579-R583 PolarHBondContact O-N 2.9Å; N579-R583 WeakPolarHBondContact OD1-CD 3.37Å; L580-R583 PolarHBondContact O-N 3.23Å; R583-R587 VanDerWaalsContact O-CG 3.3Å; R583-R587 WeakPolarHBondContact O-CG 3.36Å; R583-R587 PolarHBondContact O-N 2.78Å
584I97.1Very high97.5Very high99 Ų99105 Ų10551%0.50850%0.498SS..Hα-helixtrans-67.2-52170.3-72.5163.6000108.9L580 Q581 S582 D586 R587 E588L580-I584 VanDerWaalsContact O-CG1 3.29Å; L580-I584 WeakPolarHBondContact O-CG1 3.45Å; L580-I584 PolarHBondContact O-N 2.9Å; Q581-I584 PolarHBondContact O-N 3.07Å; S582-I584 VanDerWaalsContact C-N 3.28Å; S582-I584 PolarHBondContact O-N 3.41Å; I584-D586 VanDerWaalsContact C-N 3.35Å; I584-D586 PolarHBondContact O-N 3.26Å; I584-R587 CarbonylContact O-C 3.51Å; I584-R587 WeakPolarHBondContact O-CA 3.24Å; I584-R587 WeakPolarHBondContact O-CB 3.37Å; I584-R587 PolarHBondContact O-N 3.19Å; I584-E588 HydrophobicContact CG2-CG 4.3Å; I584-E588 WeakPolarHBondContact O-CG 3.42Å; I584-E588 PolarHBondContact O-N 2.95Å
585K98.2Very high97.3Very high122 Ų122107 Ų10753%0.5350%0.502SS..Hα-helixtrans-57.7-43.8177.7-172.9-172.1172.1-171.50112.7Q581 S582 R587 E588 D589Q581-K585 PolarHBondContact O-N 2.99Å; S582-K585 CarbonylContact O-C 3.5Å; S582-K585 WeakPolarHBondContact O-CA 3.46Å; S582-K585 WeakPolarHBondContact O-CB 3.44Å; S582-K585 PolarHBondContact O-N 2.83Å; S582-K585 VanDerWaalsContact O-N 3.07Å; K585-R587 PolarHBondContact O-N 3.29Å; K585-E588 PolarHBondContact O-N 3.16Å; K585-E588 VanDerWaalsContact O-N 3.1Å; K585-D589 WeakPolarHBondContact O-CB 3.33Å; K585-D589 PolarHBondContact O-N 2.62Å
586D97.9Very high97Very high89 Ų89103.2 Ų103.248%0.47649%0.494SS..Hα-helixtrans-57-35.9177.4-64-40.5000111.5S582 I584 E590S582-D586 PolarHBondContact O-N 2.94Å; S582-D586 VanDerWaalsContact O-OD2 3.06Å; I584-D586 VanDerWaalsContact C-N 3.35Å; I584-D586 PolarHBondContact O-N 3.26Å; D586-E590 WeakPolarHBondContact O-CB 3.34Å; D586-E590 PolarHBondContact O-N 2.85Å
587R96.8Very high96.8Very high159 Ų159107 Ų10760%0.650%0.504SS*.Hα-helixtrans-80.3-32.9176.3-68.8-64.5-175.177.6-4.8113.4R583 I584 K585 E590 I591R583-R587 VanDerWaalsContact O-CG 3.3Å; R583-R587 WeakPolarHBondContact O-CG 3.36Å; R583-R587 PolarHBondContact O-N 2.78Å; I584-R587 CarbonylContact O-C 3.51Å; I584-R587 WeakPolarHBondContact O-CA 3.24Å; I584-R587 WeakPolarHBondContact O-CB 3.37Å; I584-R587 PolarHBondContact O-N 3.19Å; K585-R587 PolarHBondContact O-N 3.29Å; R587-E590 WeakPolarHBondContact CD-OE2 3.5Å; R587-E590 IonicContact NE-OE2 2.68Å; R587-E590 PolarHBondContact O-N 3.24Å; R587-I591 WeakPolarHBondContact O-CB 3.36Å; R587-I591 WeakPolarHBondContact O-CD1 3.45Å; R587-I591 WeakPolarHBondContact O-CG1 3.48Å; R587-I591 PolarHBondContact O-N 2.89Å
588E97.9Very high96.2Very high114 Ų114106.9 Ų106.953%0.53351%0.508SS..Hα-helixtrans-64.3-43.8170.4-69.4171157.200110.6I584 K585 I591 Q592I584-E588 HydrophobicContact CG2-CG 4.3Å; I584-E588 WeakPolarHBondContact O-CG 3.42Å; I584-E588 PolarHBondContact O-N 2.95Å; K585-E588 PolarHBondContact O-N 3.16Å; K585-E588 VanDerWaalsContact O-N 3.1Å; E588-I591 PolarHBondContact O-N 3.48Å; E588-Q592 VanDerWaalsContact O-CB 3.29Å; E588-Q592 WeakPolarHBondContact O-CB 3.47Å; E588-Q592 PolarHBondContact O-N 3Å
589D97.8Very high95.6Very high67 Ų67105.1 Ų105.136%0.35850%0.503SS..Hα-helixtrans-64.5-37173.6-79.4-25.2000111.9K585 K593K585-D589 WeakPolarHBondContact O-CB 3.33Å; K585-D589 PolarHBondContact O-N 2.62Å; D589-K593 WeakPolarHBondContact O-CB 3.4Å; D589-K593 VanDerWaalsContact O-CD 3.26Å; D589-K593 WeakPolarHBondContact O-CD 3.46Å; D589-K593 WeakPolarHBondContact O-CG 3.4Å; D589-K593 PolarHBondContact O-N 3.23Å
590E97.6Very high94.9Very high96 Ų96105.2 Ų105.245%0.44950%0.503SS..Hα-helixtrans-65.7-48.1172.3-176173.4-146.300111.9D586 R587 Q592 K593 L594D586-E590 WeakPolarHBondContact O-CB 3.34Å; D586-E590 PolarHBondContact O-N 2.85Å; R587-E590 WeakPolarHBondContact CD-OE2 3.5Å; R587-E590 IonicContact NE-OE2 2.68Å; R587-E590 PolarHBondContact O-N 3.24Å; E590-Q592 VanDerWaalsContact C-N 3.29Å; E590-Q592 PolarHBondContact O-N 3.37Å; E590-K593 WeakPolarHBondContact O-CB 3.43Å; E590-K593 PolarHBondContact O-N 2.99Å; E590-L594 HydrophobicContact CG-CD1 4.25Å; E590-L594 WeakPolarHBondContact O-CG 3.44Å; E590-L594 PolarHBondContact O-N 3.38Å
591I96.8Very high94.2Very high81 Ų81108.4 Ų108.442%0.41551%0.513SS..Hα-helixtrans-59.9-40.6175.5-72.3163.8000110.6R587 E588 L594 R595R587-I591 WeakPolarHBondContact O-CB 3.36Å; R587-I591 WeakPolarHBondContact O-CD1 3.45Å; R587-I591 WeakPolarHBondContact O-CG1 3.48Å; R587-I591 PolarHBondContact O-N 2.89Å; E588-I591 PolarHBondContact O-N 3.48Å; I591-L594 PolarHBondContact O-N 3.43Å; I591-R595 HydrophobicContact CG2-CG 4.49Å; I591-R595 WeakPolarHBondContact O-CB 3.33Å; I591-R595 VanDerWaalsContact O-CG 3.31Å; I591-R595 WeakPolarHBondContact O-CG 3.44Å; I591-R595 PolarHBondContact O-N 2.85Å
592Q96.9Very high93Very high89 Ų89107.4 Ų107.442%0.41652%0.516SS..Hα-helixtrans-71.2-35.6178.6-162.568.6-3.600111.9E588 E590 R595 N596E588-Q592 VanDerWaalsContact O-CB 3.29Å; E588-Q592 WeakPolarHBondContact O-CB 3.47Å; E588-Q592 PolarHBondContact O-N 3Å; E590-Q592 VanDerWaalsContact C-N 3.29Å; E590-Q592 PolarHBondContact O-N 3.37Å; Q592-R595 VanDerWaalsContact OE1-NH1 3.14Å; Q592-N596 VanDerWaalsContact O-CB 3.32Å; Q592-N596 WeakPolarHBondContact O-CB 3.43Å; Q592-N596 PolarHBondContact O-N 2.99Å; Q592-N596 PolarHBondContact O-OD1 3.36Å
593K96.8Very high91.4Very high129 Ų129110.8 Ų110.856%0.56153%0.528SS*.Hα-helixtrans-62.1-44168.9-73.4158.2-167.2157.40111.5D589 E590 N596 Q597D589-K593 WeakPolarHBondContact O-CB 3.4Å; D589-K593 VanDerWaalsContact O-CD 3.26Å; D589-K593 WeakPolarHBondContact O-CD 3.46Å; D589-K593 WeakPolarHBondContact O-CG 3.4Å; D589-K593 PolarHBondContact O-N 3.23Å; E590-K593 WeakPolarHBondContact O-CB 3.43Å; E590-K593 PolarHBondContact O-N 2.99Å; K593-N596 PolarHBondContact O-N 2.99Å; K593-Q597 WeakPolarHBondContact O-CB 3.38Å; K593-Q597 VanDerWaalsContact O-CG 3.31Å; K593-Q597 WeakPolarHBondContact O-CG 3.29Å; K593-Q597 PolarHBondContact O-N 3.32Å
594L95.7Very high89.6Confident96 Ų96107.5 Ų107.550%0.50353%0.528SS..Hα-helixtrans-66.6-39.9177.9-70.7170.5000112.3E590 I591 Q597 L598E590-L594 HydrophobicContact CG-CD1 4.25Å; E590-L594 WeakPolarHBondContact O-CG 3.44Å; E590-L594 PolarHBondContact O-N 3.38Å; I591-L594 PolarHBondContact O-N 3.43Å; L594-Q597 PolarHBondContact O-N 3.4Å; L594-L598 WeakPolarHBondContact O-CB 3.17Å; L594-L598 PolarHBondContact O-N 2.9Å
595R93.6Very high87.8Confident146 Ų146104.6 Ų104.655%0.55152%0.516SS*.Hα-helixtrans-60.4-48.4170.5-75.9169.3176.4162.8-0.5111.4I591 Q592 Q597 L598 T599I591-R595 HydrophobicContact CG2-CG 4.49Å; I591-R595 WeakPolarHBondContact O-CB 3.33Å; I591-R595 VanDerWaalsContact O-CG 3.31Å; I591-R595 WeakPolarHBondContact O-CG 3.44Å; I591-R595 PolarHBondContact O-N 2.85Å; Q592-R595 VanDerWaalsContact OE1-NH1 3.14Å; R595-Q597 VanDerWaalsContact C-N 3.31Å; R595-Q597 PolarHBondContact O-N 2.76Å; R595-L598 PolarHBondContact O-N 2.83Å; R595-T599 WeakPolarHBondContact O-CB 3.41Å; R595-T599 PolarHBondContact O-N 3.43Å; R595-T599 PolarHBondContact O-OG1 3.16Å; R595-T599 VanDerWaalsContact O-OG1 3.14Å
596N92.6Very high86Confident83 Ų83102 Ų10244%0.44451%0.513SS..Hα-helixtrans-63.8-36.8177.8-71.4-4.2000111.7Q592 K593 N600Q592-N596 VanDerWaalsContact O-CB 3.32Å; Q592-N596 WeakPolarHBondContact O-CB 3.43Å; Q592-N596 PolarHBondContact O-N 2.99Å; Q592-N596 PolarHBondContact O-OD1 3.36Å; K593-N596 PolarHBondContact O-N 2.99Å; N596-N600 WeakPolarHBondContact O-CB 3.37Å; N596-N600 PolarHBondContact O-N 2.94Å; N596-N600 PolarHBondContact O-ND2 3Å; N596-N600 PolarHBondContact O-OD1 3.31Å
597Q92.3Very high84.3Confident126 Ų126101.5 Ų101.559%0.58952%0.517SS*.Hα-helixtrans-65.4-41.2172.2-76.8176.16.500112.2K593 L594 R595 K601K593-Q597 WeakPolarHBondContact O-CB 3.38Å; K593-Q597 VanDerWaalsContact O-CG 3.31Å; K593-Q597 WeakPolarHBondContact O-CG 3.29Å; K593-Q597 PolarHBondContact O-N 3.32Å; L594-Q597 PolarHBondContact O-N 3.4Å; R595-Q597 VanDerWaalsContact C-N 3.31Å; R595-Q597 PolarHBondContact O-N 2.76Å; Q597-K601 WeakPolarHBondContact O-CB 3.18Å; Q597-K601 PolarHBondContact O-N 2.93Å
598L85Confident83.2Confident118 Ų11898.9 Ų98.962%0.61851%0.512SS*.Hα-helixtrans-64.7-50.8176.5-173.266.5000110.9L594 R595 N600 K601 T602L594-L598 WeakPolarHBondContact O-CB 3.17Å; L594-L598 PolarHBondContact O-N 2.9Å; R595-L598 PolarHBondContact O-N 2.83Å; L598-N600 PolarHBondContact O-N 2.87Å; L598-K601 PolarHBondContact O-N 3.42Å; L598-K601 VanDerWaalsContact O-N 3.15Å; L598-T602 PolarHBondContact O-N 3.13Å; L598-T602 PolarHBondContact O-OG1 3.19Å; L598-T602 VanDerWaalsContact O-OG1 3.11Å
599T87.2Confident82Confident76 Ų7696.4 Ų96.447%0.46650%0.504SS..Hα-helixtrans-59.6-45.7175.9-59.70000111.4R595 K601 T602 L603R595-T599 WeakPolarHBondContact O-CB 3.41Å; R595-T599 PolarHBondContact O-N 3.43Å; R595-T599 PolarHBondContact O-OG1 3.16Å; R595-T599 VanDerWaalsContact O-OG1 3.14Å; T599-K601 VanDerWaalsContact C-N 3.3Å; T599-K601 PolarHBondContact O-N 2.89Å; T599-T602 PolarHBondContact O-N 2.77Å; T599-L603 HydrophobicContact CG2-CD1 3.95Å; T599-L603 WeakPolarHBondContact O-CB 3.49Å; T599-L603 WeakPolarHBondContact O-CG 3.24Å; T599-L603 PolarHBondContact O-N 3.39Å
600N82.4Confident80.9Confident93 Ų9397.1 Ų97.150%0.49751%0.505SS..Hα-helixtrans-66.3-31.7176.5-71.7-4.3000112.1N596 L598 L603 S604N596-N600 WeakPolarHBondContact O-CB 3.37Å; N596-N600 PolarHBondContact O-N 2.94Å; N596-N600 PolarHBondContact O-ND2 3Å; N596-N600 PolarHBondContact O-OD1 3.31Å; L598-N600 PolarHBondContact O-N 2.87Å; N600-L603 PolarHBondContact O-N 2.94Å; N600-S604 VanDerWaalsContact O-CB 3.22Å; N600-S604 WeakPolarHBondContact O-CB 3.4Å; N600-S604 PolarHBondContact O-N 3.02Å; N600-S604 PolarHBondContact O-OG 3Å
601K82.1Confident80Confident162 Ų16298 Ų9870%0.70451%0.513SS*.Hα-helixtrans-71-38174.6-173.6175.9179.8-178.10111.7Q597 L598 T599 S604Q597-K601 WeakPolarHBondContact O-CB 3.18Å; Q597-K601 PolarHBondContact O-N 2.93Å; L598-K601 PolarHBondContact O-N 3.42Å; L598-K601 VanDerWaalsContact O-N 3.15Å; T599-K601 VanDerWaalsContact C-N 3.3Å; T599-K601 PolarHBondContact O-N 2.89Å; K601-S604 PolarHBondContact O-N 3.12Å
602T72.2Confident79.3Confident104 Ų10498.5 Ų98.564%0.63851%0.513SS*.Hα-helixtrans-66.8-37.5171.5-57.30000111.9L598 T599 S605L598-T602 PolarHBondContact O-N 3.13Å; L598-T602 PolarHBondContact O-OG1 3.19Å; L598-T602 VanDerWaalsContact O-OG1 3.11Å; T599-T602 PolarHBondContact O-N 2.77Å; T602-S605 WeakPolarHBondContact O-CB 3.39Å
603L63.8Low78.7Confident132 Ų13298.8 Ų98.869%0.69152%0.518SS*.Hα-helixtrans-73.8-28.7172.8-70.1168.3000112.6T599 N600 S605T599-L603 HydrophobicContact CG2-CD1 3.95Å; T599-L603 WeakPolarHBondContact O-CB 3.49Å; T599-L603 WeakPolarHBondContact O-CG 3.24Å; T599-L603 PolarHBondContact O-N 3.39Å; N600-L603 PolarHBondContact O-N 2.94Å; L603-S605 PolarHBondContact O-N 3.21Å
604S61.8Low78.2Confident77 Ų7799.6 Ų99.654%0.53852%0.517SS..THydrogen-bonded Turntrans-74.331.6172-56.20000112.7N600 K601 S606N600-S604 VanDerWaalsContact O-CB 3.22Å; N600-S604 WeakPolarHBondContact O-CB 3.4Å; N600-S604 PolarHBondContact O-N 3.02Å; N600-S604 PolarHBondContact O-OG 3Å; K601-S604 PolarHBondContact O-N 3.12Å; S604-S606 PolarHBondContact O-N 3.27Å
605S57.9Low77.8Confident37 Ų37100.1 Ų100.126%0.25952%0.52SS..THydrogen-bonded Turntrans-67.119.7172.6-161.50000112.8T602 L603 S607 Q608 T609T602-S605 WeakPolarHBondContact O-CB 3.39Å; L603-S605 PolarHBondContact O-N 3.21Å; S605-S607 VanDerWaalsContact C-N 3.29Å; S605-S607 PolarHBondContact O-N 2.91Å; S605-Q608 PolarHBondContact O-N 3.45Å; S605-Q608 WeakPolarHBondContact OG-CB 3.23Å; S605-T609 WeakPolarHBondContact O-CB 3.41Å; S605-T609 WeakPolarHBondContact O-CG2 3.5Å; S605-T609 PolarHBondContact O-N 2.85Å; S605-T609 PolarHBondContact O-OG1 2.89Å
606S60.4Low77.5Confident68 Ų6899.6 Ų99.648%0.47652%0.523SS..Hα-helixtrans-60.3-43.9171.498.10000109.5S604 Q608 T609 E610S604-S606 PolarHBondContact O-N 3.27Å; S606-Q608 VanDerWaalsContact C-N 3.3Å; S606-Q608 PolarHBondContact O-N 3.47Å; S606-T609 WeakPolarHBondContact CA-OG1 3.46Å; S606-T609 PolarHBondContact O-N 3.05Å; S606-T609 PolarHBondContact O-OG1 2.89Å; S606-E610 VanDerWaalsContact C-OE1 3.32Å; S606-E610 WeakPolarHBondContact CB-OE1 3.38Å; S606-E610 WeakPolarHBondContact O-CA 3.39Å; S606-E610 WeakPolarHBondContact O-CB 3.45Å; S606-E610 WeakPolarHBondContact O-CG 3.45Å; S606-E610 PolarHBondContact O-N 3.16Å; S606-E610 PolarHBondContact OG-OE1 2.96Å
607S63.6Low77.5Confident79 Ų79101.3 Ų101.355%0.55253%0.529SS*.Hα-helixtrans-64.7-31.1179.760.60000113.8S605 L611S605-S607 VanDerWaalsContact C-N 3.29Å; S605-S607 PolarHBondContact O-N 2.91Å; S607-L611 WeakPolarHBondContact O-CB 3.5Å; S607-L611 PolarHBondContact O-N 3.41Å; S607-L611 VanDerWaalsContact O-N 3.15Å
608Q72.3Confident77.4Confident104 Ų104101.1 Ų101.149%0.48653%0.531SS..Hα-helixtrans-78.9-45.4173.7171172.9-16.300111.5S605 S606 E610 L611 E612S605-Q608 PolarHBondContact O-N 3.45Å; S605-Q608 WeakPolarHBondContact OG-CB 3.23Å; S606-Q608 VanDerWaalsContact C-N 3.3Å; S606-Q608 PolarHBondContact O-N 3.47Å; Q608-E610 VanDerWaalsContact C-N 3.31Å; Q608-E610 PolarHBondContact O-N 3.05Å; Q608-L611 CarbonylContact O-C 3.6Å; Q608-L611 WeakPolarHBondContact O-CA 3.41Å; Q608-L611 VanDerWaalsContact O-CB 3.27Å; Q608-L611 WeakPolarHBondContact O-CB 3.37Å; Q608-L611 PolarHBondContact O-N 2.87Å; Q608-E612 HydrophobicContact CG-CG 4.42Å; Q608-E612 VanDerWaalsContact CG-OE1 3.27Å; Q608-E612 WeakPolarHBondContact CG-OE1 3.43Å; Q608-E612 PolarHBondContact NE2-OE1 2.97Å; Q608-E612 WeakPolarHBondContact O-CG 3.49Å; Q608-E612 PolarHBondContact O-N 3.43Å
609T74.1Confident77.6Confident61 Ų6198.3 Ų98.337%0.37452%0.519SS..Hα-helixtrans-68.1-29176.752.80000112.6S605 S606 N613S605-T609 WeakPolarHBondContact O-CB 3.41Å; S605-T609 WeakPolarHBondContact O-CG2 3.5Å; S605-T609 PolarHBondContact O-N 2.85Å; S605-T609 PolarHBondContact O-OG1 2.89Å; S606-T609 WeakPolarHBondContact CA-OG1 3.46Å; S606-T609 PolarHBondContact O-N 3.05Å; S606-T609 PolarHBondContact O-OG1 2.89Å; T609-N613 WeakPolarHBondContact O-CB 3.48Å; T609-N613 PolarHBondContact O-N 3.31Å; T609-N613 PolarHBondContact O-ND2 3.48Å
610E73.7Confident77.9Confident83 Ų83101.1 Ų101.139%0.38853%0.527SS..Hα-helixtrans-69-34.9167.1-73.9166.9-124.900111.9S606 Q608 R614S606-E610 VanDerWaalsContact C-OE1 3.32Å; S606-E610 WeakPolarHBondContact CB-OE1 3.38Å; S606-E610 WeakPolarHBondContact O-CA 3.39Å; S606-E610 WeakPolarHBondContact O-CB 3.45Å; S606-E610 WeakPolarHBondContact O-CG 3.45Å; S606-E610 PolarHBondContact O-N 3.16Å; S606-E610 PolarHBondContact OG-OE1 2.96Å; Q608-E610 VanDerWaalsContact C-N 3.31Å; Q608-E610 PolarHBondContact O-N 3.05Å; E610-R614 VanDerWaalsContact O-CB 3.29Å; E610-R614 WeakPolarHBondContact O-CB 3.38Å; E610-R614 VanDerWaalsContact O-CG 3.23Å; E610-R614 WeakPolarHBondContact O-CG 3.48Å; E610-R614 PolarHBondContact O-N 3.25Å; E610-R614 IonicContact OE2-NH1 3.41Å
611L79.1Confident78.3Confident114 Ų11499.7 Ų99.760%0.59752%0.521SS*.Hα-helixtrans-67.7-46.4172.2-103.7162.2000111S607 Q608 R614 L615S607-L611 WeakPolarHBondContact O-CB 3.5Å; S607-L611 PolarHBondContact O-N 3.41Å; S607-L611 VanDerWaalsContact O-N 3.15Å; Q608-L611 CarbonylContact O-C 3.6Å; Q608-L611 WeakPolarHBondContact O-CA 3.41Å; Q608-L611 VanDerWaalsContact O-CB 3.27Å; Q608-L611 WeakPolarHBondContact O-CB 3.37Å; Q608-L611 PolarHBondContact O-N 2.87Å; L611-R614 PolarHBondContact O-N 3.47Å; L611-L615 VanDerWaalsContact O-CB 3.24Å; L611-L615 WeakPolarHBondContact O-CB 3.4Å; L611-L615 PolarHBondContact O-N 3.16Å
612E82.4Confident78.8Confident92 Ų9297.3 Ų97.343%0.4352%0.516SS..Hα-helixtrans-63-43176.2-71.2164.3-17700111Q608 L615 H616Q608-E612 HydrophobicContact CG-CG 4.42Å; Q608-E612 VanDerWaalsContact CG-OE1 3.27Å; Q608-E612 WeakPolarHBondContact CG-OE1 3.43Å; Q608-E612 PolarHBondContact NE2-OE1 2.97Å; Q608-E612 WeakPolarHBondContact O-CG 3.49Å; Q608-E612 PolarHBondContact O-N 3.43Å; E612-L615 PolarHBondContact O-N 3.47Å; E612-H616 WeakPolarHBondContact O-CB 3.34Å; E612-H616 PolarHBondContact O-N 3.01Å
613N84.3Confident79.7Confident95 Ų9597.1 Ų97.151%0.50851%0.51SS..Hα-helixtrans-65-41.5173.2-79.1-42.3000112.6T609 L615 H616 Q617T609-N613 WeakPolarHBondContact O-CB 3.48Å; T609-N613 PolarHBondContact O-N 3.31Å; T609-N613 PolarHBondContact O-ND2 3.48Å; N613-L615 VanDerWaalsContact C-N 3.31Å; N613-L615 PolarHBondContact O-N 3.47Å; N613-H616 PolarHBondContact O-N 3.25Å; N613-Q617 WeakPolarHBondContact O-CB 3.18Å; N613-Q617 VanDerWaalsContact O-CG 3.32Å; N613-Q617 WeakPolarHBondContact O-CG 3.4Å; N613-Q617 PolarHBondContact O-N 2.88Å
614R84.9Confident81.1Confident145 Ų14597.1 Ų97.155%0.54751%0.506SS..Hα-helixtrans-64.8-35.8172.9-79.5177.5-178.8119.14.2112E610 L611 L618E610-R614 VanDerWaalsContact O-CB 3.29Å; E610-R614 WeakPolarHBondContact O-CB 3.38Å; E610-R614 VanDerWaalsContact O-CG 3.23Å; E610-R614 WeakPolarHBondContact O-CG 3.48Å; E610-R614 PolarHBondContact O-N 3.25Å; E610-R614 IonicContact OE2-NH1 3.41Å; L611-R614 PolarHBondContact O-N 3.47Å; R614-L618 WeakPolarHBondContact O-CB 3.18Å; R614-L618 PolarHBondContact O-N 3.28Å
615L87.6Confident82.6Confident107 Ų107100.2 Ų100.256%0.5651%0.51SS*.Hα-helixtrans-68.6-46.6177-161.6164.1000109.8L611 E612 N613 L618 T619L611-L615 VanDerWaalsContact O-CB 3.24Å; L611-L615 WeakPolarHBondContact O-CB 3.4Å; L611-L615 PolarHBondContact O-N 3.16Å; E612-L615 PolarHBondContact O-N 3.47Å; N613-L615 VanDerWaalsContact C-N 3.31Å; N613-L615 PolarHBondContact O-N 3.47Å; L615-L618 CarbonylContact O-C 3.52Å; L615-L618 PolarHBondContact O-N 2.9Å; L615-T619 WeakPolarHBondContact O-CB 3.33Å; L615-T619 PolarHBondContact O-N 3.47Å; L615-T619 PolarHBondContact O-OG1 3.26Å; L615-T619 VanDerWaalsContact O-OG1 3.07Å
616H88.5Confident84Confident135 Ų135103 Ų10363%0.62552%0.519SS*.Hα-helixtrans-58.1-46.6170.7-89.46.1000112.5E612 N613 L618 T619 E620E612-H616 WeakPolarHBondContact O-CB 3.34Å; E612-H616 PolarHBondContact O-N 3.01Å; N613-H616 PolarHBondContact O-N 3.25Å; H616-L618 VanDerWaalsContact C-N 3.31Å; H616-L618 PolarHBondContact O-N 3.24Å; H616-T619 CarbonylContact O-C 3.54Å; H616-T619 PolarHBondContact O-N 3.41Å; H616-T619 VanDerWaalsContact O-N 3.16Å; H616-E620 VanDerWaalsContact O-CB 3.28Å; H616-E620 WeakPolarHBondContact O-CB 3.25Å; H616-E620 PolarHBondContact O-N 3.08Å
617Q91.1Very high85.5Confident120 Ų120103.5 Ų103.556%0.56152%0.519SS*.Hα-helixtrans-62.2-36.4175.3-75175.8-5.300112.5N613 T621N613-Q617 WeakPolarHBondContact O-CB 3.18Å; N613-Q617 VanDerWaalsContact O-CG 3.32Å; N613-Q617 WeakPolarHBondContact O-CG 3.4Å; N613-Q617 PolarHBondContact O-N 2.88Å; Q617-T621 WeakPolarHBondContact O-CB 3.27Å; Q617-T621 WeakPolarHBondContact O-CG2 3.35Å; Q617-T621 PolarHBondContact O-N 2.86Å; Q617-T621 PolarHBondContact O-OG1 2.98Å
618L90.1Very high86.7Confident122 Ų122105.2 Ų105.264%0.63952%0.52SS*.Hα-helixtrans-69.4-38.4173-87.4164.6000112.2R614 L615 H616 T621 L622R614-L618 WeakPolarHBondContact O-CB 3.18Å; R614-L618 PolarHBondContact O-N 3.28Å; L615-L618 CarbonylContact O-C 3.52Å; L615-L618 PolarHBondContact O-N 2.9Å; H616-L618 VanDerWaalsContact C-N 3.31Å; H616-L618 PolarHBondContact O-N 3.24Å; L618-T621 PolarHBondContact O-OG1 3.37Å; L618-L622 WeakPolarHBondContact O-CB 3.49Å; L618-L622 PolarHBondContact O-N 3.22Å
619T91Very high87.6Confident59 Ų59104.9 Ų104.936%0.36252%0.521SS..Hα-helixtrans-67.8-42.7174.4-61.80000111.4L615 H616 L622 I623L615-T619 WeakPolarHBondContact O-CB 3.33Å; L615-T619 PolarHBondContact O-N 3.47Å; L615-T619 PolarHBondContact O-OG1 3.26Å; L615-T619 VanDerWaalsContact O-OG1 3.07Å; H616-T619 CarbonylContact O-C 3.54Å; H616-T619 PolarHBondContact O-N 3.41Å; H616-T619 VanDerWaalsContact O-N 3.16Å; T619-L622 PolarHBondContact O-N 2.98Å; T619-I623 HydrophobicContact CG2-CD1 3.9Å; T619-I623 WeakPolarHBondContact O-CB 3.47Å; T619-I623 VanDerWaalsContact O-CG1 3.23Å; T619-I623 WeakPolarHBondContact O-CG1 3.24Å; T619-I623 PolarHBondContact O-N 2.84Å
620E91.9Very high88.4Confident134 Ų134106.8 Ų106.863%0.62653%0.526SS*.Hα-helixtrans-66.6-46.6177.8-176176.3-158.500111.4H616 L622 I623 Q624H616-E620 VanDerWaalsContact O-CB 3.28Å; H616-E620 WeakPolarHBondContact O-CB 3.25Å; H616-E620 PolarHBondContact O-N 3.08Å; E620-L622 VanDerWaalsContact C-N 3.31Å; E620-L622 PolarHBondContact O-N 3.4Å; E620-I623 PolarHBondContact O-N 2.84Å; E620-Q624 WeakPolarHBondContact O-CB 3.39Å; E620-Q624 PolarHBondContact O-N 3.02Å
621T91.1Very high89.1Confident63 Ų63104.9 Ų104.939%0.38752%0.524SS..Hα-helixtrans-69.7-26.8174.654.90000113Q617 L618 K625Q617-T621 WeakPolarHBondContact O-CB 3.27Å; Q617-T621 WeakPolarHBondContact O-CG2 3.35Å; Q617-T621 PolarHBondContact O-N 2.86Å; Q617-T621 PolarHBondContact O-OG1 2.98Å; L618-T621 PolarHBondContact O-OG1 3.37Å; T621-K625 VanDerWaalsContact O-CB 3.31Å; T621-K625 WeakPolarHBondContact O-CB 3.37Å; T621-K625 WeakPolarHBondContact O-CG 3.38Å; T621-K625 PolarHBondContact O-N 3.18Å
622L92.9Very high89.4Confident113 Ų113103.7 Ų103.759%0.59252%0.518SS*.Hα-helixtrans-67.9-46.5168.8178.864.4000111L618 T619 E620 K625 Q626L618-L622 WeakPolarHBondContact O-CB 3.49Å; L618-L622 PolarHBondContact O-N 3.22Å; T619-L622 PolarHBondContact O-N 2.98Å; E620-L622 VanDerWaalsContact C-N 3.31Å; E620-L622 PolarHBondContact O-N 3.4Å; L622-K625 PolarHBondContact O-N 2.96Å; L622-Q626 VanDerWaalsContact O-CB 3.25Å; L622-Q626 WeakPolarHBondContact O-CB 3.4Å; L622-Q626 PolarHBondContact O-N 2.84Å
623I91.9Very high89.6Confident100 Ų100100.6 Ų100.651%0.51351%0.511SS..Hα-helixtrans-60.5-48.3174.7-71163000110T619 E620 K625 Q626 T627T619-I623 HydrophobicContact CG2-CD1 3.9Å; T619-I623 WeakPolarHBondContact O-CB 3.47Å; T619-I623 VanDerWaalsContact O-CG1 3.23Å; T619-I623 WeakPolarHBondContact O-CG1 3.24Å; T619-I623 PolarHBondContact O-N 2.84Å; E620-I623 PolarHBondContact O-N 2.84Å; I623-K625 VanDerWaalsContact C-N 3.3Å; I623-K625 PolarHBondContact O-N 3.16Å; I623-Q626 CarbonylContact O-C 3.57Å; I623-Q626 WeakPolarHBondContact O-CA 3.21Å; I623-Q626 WeakPolarHBondContact O-CB 3.36Å; I623-Q626 PolarHBondContact O-N 3.33Å; I623-T627 PolarHBondContact O-N 3.27Å; I623-T627 PolarHBondContact O-OG1 3.47Å
624Q92.3Very high89.7Confident132 Ų132100.7 Ų100.762%0.61752%0.515SS*.Hα-helixtrans-60.4-39.3178.6-167.5-176.840.800111.8E620 M628E620-Q624 WeakPolarHBondContact O-CB 3.39Å; E620-Q624 PolarHBondContact O-N 3.02Å; Q624-M628 VanDerWaalsContact O-CB 3.22Å; Q624-M628 WeakPolarHBondContact O-CB 3.29Å; Q624-M628 PolarHBondContact O-N 3.18Å
625K93.3Very high89.8Confident141 Ų14198.9 Ų98.961%0.61351%0.513SS*.Hα-helixtrans-72.3-31.3172.9-77.7-174.9176.3-176.30113.4T621 L622 I623 L629T621-K625 VanDerWaalsContact O-CB 3.31Å; T621-K625 WeakPolarHBondContact O-CB 3.37Å; T621-K625 WeakPolarHBondContact O-CG 3.38Å; T621-K625 PolarHBondContact O-N 3.18Å; L622-K625 PolarHBondContact O-N 2.96Å; I623-K625 VanDerWaalsContact C-N 3.3Å; I623-K625 PolarHBondContact O-N 3.16Å; K625-L629 VanDerWaalsContact O-CB 3.29Å; K625-L629 WeakPolarHBondContact O-CB 3.46Å; K625-L629 VanDerWaalsContact O-CG 3.22Å; K625-L629 WeakPolarHBondContact O-CG 3.17Å; K625-L629 PolarHBondContact O-N 2.93Å
626Q88.3Confident89.8Confident96 Ų96100.6 Ų100.645%0.44952%0.516SS..Hα-helixtrans-67.1-50.3174.5-177.263.430.800109.9L622 I623 M628 L629 E630L622-Q626 VanDerWaalsContact O-CB 3.25Å; L622-Q626 WeakPolarHBondContact O-CB 3.4Å; L622-Q626 PolarHBondContact O-N 2.84Å; I623-Q626 CarbonylContact O-C 3.57Å; I623-Q626 WeakPolarHBondContact O-CA 3.21Å; I623-Q626 WeakPolarHBondContact O-CB 3.36Å; I623-Q626 PolarHBondContact O-N 3.33Å; Q626-M628 VanDerWaalsContact C-N 3.33Å; Q626-M628 PolarHBondContact O-N 3.21Å; Q626-L629 CarbonylContact O-C 3.57Å; Q626-L629 PolarHBondContact O-N 2.99Å; Q626-L629 VanDerWaalsContact O-N 3.1Å; Q626-E630 WeakPolarHBondContact CG-OE1 3.35Å; Q626-E630 PolarHBondContact NE2-OE1 3.4Å; Q626-E630 WeakPolarHBondContact O-CB 3.42Å; Q626-E630 WeakPolarHBondContact O-CG 3.42Å; Q626-E630 PolarHBondContact O-N 2.93Å
627T91.1Very high89.6Confident78 Ų7897.9 Ų97.948%0.47951%0.512SS..Hα-helixtrans-61.7-37.7173.4-54.90000112.3I623 E630 A631I623-T627 PolarHBondContact O-N 3.27Å; I623-T627 PolarHBondContact O-OG1 3.47Å; T627-E630 PolarHBondContact O-N 2.89Å; T627-A631 WeakPolarHBondContact O-CB 3.23Å; T627-A631 PolarHBondContact O-N 2.89Å
628M88.6Confident89.4Confident116 Ų11694.8 Ų94.857%0.57150%0.503SS*.Hα-helixtrans-67.8-36.5172.7-178.7177.1-82.300112.3Q624 Q626 E630 L632Q624-M628 VanDerWaalsContact O-CB 3.22Å; Q624-M628 WeakPolarHBondContact O-CB 3.29Å; Q624-M628 PolarHBondContact O-N 3.18Å; Q626-M628 VanDerWaalsContact C-N 3.33Å; Q626-M628 PolarHBondContact O-N 3.21Å; M628-E630 VanDerWaalsContact C-N 3.34Å; M628-L632 HydrophobicContact CG-CD1 3.91Å; M628-L632 HydrophobicContact CG-CG 4.37Å; M628-L632 VanDerWaalsContact O-CB 3.26Å; M628-L632 WeakPolarHBondContact O-CB 3.39Å; M628-L632 WeakPolarHBondContact O-CG 3.48Å; M628-L632 PolarHBondContact O-N 2.68Å
629L90.6Very high89Confident97 Ų9793.6 Ų93.651%0.50850%0.497SS..Hα-helixtrans-71.1-28.9173.4-78.6169.6000112.6K625 Q626 G633K625-L629 VanDerWaalsContact O-CB 3.29Å; K625-L629 WeakPolarHBondContact O-CB 3.46Å; K625-L629 VanDerWaalsContact O-CG 3.22Å; K625-L629 WeakPolarHBondContact O-CG 3.17Å; K625-L629 PolarHBondContact O-N 2.93Å; Q626-L629 CarbonylContact O-C 3.57Å; Q626-L629 PolarHBondContact O-N 2.99Å; Q626-L629 VanDerWaalsContact O-N 3.1Å; L629-G633 WeakPolarHBondContact O-CA 3.44Å; L629-G633 PolarHBondContact O-N 2.86Å
630E91.4Very high88.8Confident100 Ų10094.2 Ų94.247%0.46750%0.501SS..Hα-helixtrans-73.3-42.4172.5-74.4158.7-173.100110.9Q626 T627 M628 G633 T634Q626-E630 WeakPolarHBondContact CG-OE1 3.35Å; Q626-E630 PolarHBondContact NE2-OE1 3.4Å; Q626-E630 WeakPolarHBondContact O-CB 3.42Å; Q626-E630 WeakPolarHBondContact O-CG 3.42Å; Q626-E630 PolarHBondContact O-N 2.93Å; T627-E630 PolarHBondContact O-N 2.89Å; M628-E630 VanDerWaalsContact C-N 3.34Å; E630-G633 CarbonylContact O-C 3.58Å; E630-G633 WeakPolarHBondContact O-CA 3.48Å; E630-G633 PolarHBondContact O-N 3.46Å; E630-G633 VanDerWaalsContact O-N 3.14Å; E630-T634 PolarHBondContact O-N 3.48Å; E630-T634 PolarHBondContact O-OG1 2.94Å
631A88.9Confident88.3Confident44 Ų4494.7 Ų94.736%0.36450%0.501SS..Hα-helixtrans-64.5-48.8172.400000112.3T627 G633 T634 E635T627-A631 WeakPolarHBondContact O-CB 3.23Å; T627-A631 PolarHBondContact O-N 2.89Å; A631-G633 PolarHBondContact O-N 3.46Å; A631-T634 PolarHBondContact O-N 3.24Å; A631-T634 PolarHBondContact O-OG1 3.22Å; A631-E635 WeakPolarHBondContact O-CB 3.4Å; A631-E635 WeakPolarHBondContact O-CG 3.35Å; A631-E635 PolarHBondContact O-N 2.92Å
632L85.9Confident88Confident89 Ų8996.8 Ų96.847%0.46651%0.506SS..Hα-helixtrans-63.3-23.5171.3-69.7169.4000111.9M628 K636M628-L632 HydrophobicContact CG-CD1 3.91Å; M628-L632 HydrophobicContact CG-CG 4.37Å; M628-L632 VanDerWaalsContact O-CB 3.26Å; M628-L632 WeakPolarHBondContact O-CB 3.39Å; M628-L632 WeakPolarHBondContact O-CG 3.48Å; M628-L632 PolarHBondContact O-N 2.68Å; L632-K636 WeakPolarHBondContact O-CB 3.36Å; L632-K636 PolarHBondContact O-N 3.06Å
633G85.9Confident87.3Confident27 Ų2796.9 Ų96.928%0.27851%0.507SS..Hα-helixtrans-74.2-42.8174.100000112.9L629 E630 A631 S637L629-G633 WeakPolarHBondContact O-CA 3.44Å; L629-G633 PolarHBondContact O-N 2.86Å; E630-G633 CarbonylContact O-C 3.58Å; E630-G633 WeakPolarHBondContact O-CA 3.48Å; E630-G633 PolarHBondContact O-N 3.46Å; E630-G633 VanDerWaalsContact O-N 3.14Å; A631-G633 PolarHBondContact O-N 3.46Å; G633-S637 VanDerWaalsContact O-CB 3.29Å; G633-S637 WeakPolarHBondContact O-CB 3.25Å; G633-S637 PolarHBondContact O-N 2.83Å; G633-S637 PolarHBondContact O-OG 2.86Å
634T86.1Confident86.8Confident96 Ų9696.6 Ų96.659%0.58950%0.503SS*.Hα-helixtrans-73.7-39.2173.854.80000111.5E630 A631 S637 S638E630-T634 PolarHBondContact O-N 3.48Å; E630-T634 PolarHBondContact O-OG1 2.94Å; A631-T634 PolarHBondContact O-N 3.24Å; A631-T634 PolarHBondContact O-OG1 3.22Å; T634-S637 PolarHBondContact O-N 2.94Å; T634-S638 WeakPolarHBondContact O-CB 3.44Å; T634-S638 PolarHBondContact O-N 3.44Å; T634-S638 PolarHBondContact O-OG 2.91Å
635E87.8Confident86.1Confident107 Ų10798.1 Ų98.150%0.550%0.504SS..Hα-helixtrans-56.8-54.3168.3-76.5179.3-170.400110.6A631 S637 S638 L639A631-E635 WeakPolarHBondContact O-CB 3.4Å; A631-E635 WeakPolarHBondContact O-CG 3.35Å; A631-E635 PolarHBondContact O-N 2.92Å; E635-S637 VanDerWaalsContact C-N 3.29Å; E635-S637 PolarHBondContact O-N 3.3Å; E635-S638 PolarHBondContact O-N 2.95Å; E635-S638 VanDerWaalsContact O-N 3.13Å; E635-S638 PolarHBondContact O-OG 3.4Å; E635-L639 WeakPolarHBondContact O-CB 3.29Å; E635-L639 WeakPolarHBondContact O-CG 2.81Å; E635-L639 PolarHBondContact O-N 3.38Å
636K87.4Confident85.1Confident144 Ų14496.4 Ų96.463%0.62650%0.5SS*.Hα-helixtrans-55.7-43.4174.9-178.3-173.3175.3-169.10111.5L632 S638 L639 V640L632-K636 WeakPolarHBondContact O-CB 3.36Å; L632-K636 PolarHBondContact O-N 3.06Å; K636-S638 VanDerWaalsContact C-N 3.34Å; K636-L639 PolarHBondContact O-N 3.32Å; K636-V640 HydrophobicContact CG-CG2 4.21Å; K636-V640 VanDerWaalsContact O-CB 3.31Å; K636-V640 WeakPolarHBondContact O-CB 3.42Å; K636-V640 VanDerWaalsContact O-CG2 3.23Å; K636-V640 WeakPolarHBondContact O-CG2 3.48Å; K636-V640 PolarHBondContact O-N 3.44Å
637S84.2Confident84.3Confident77 Ų7796.2 Ų96.254%0.53850%0.499SS..Hα-helixtrans-66.3-37.8-179.7-59.10000111.6G633 T634 E635 V640 F641G633-S637 VanDerWaalsContact O-CB 3.29Å; G633-S637 WeakPolarHBondContact O-CB 3.25Å; G633-S637 PolarHBondContact O-N 2.83Å; G633-S637 PolarHBondContact O-OG 2.86Å; T634-S637 PolarHBondContact O-N 2.94Å; E635-S637 VanDerWaalsContact C-N 3.29Å; E635-S637 PolarHBondContact O-N 3.3Å; S637-V640 PolarHBondContact O-N 2.98Å; S637-F641 WeakPolarHBondContact O-CB 3.28Å; S637-F641 PolarHBondContact O-N 3.2Å
638S85.9Confident83Confident55 Ų5598 Ų9839%0.38550%0.502SS..Hα-helixtrans-70-37.1174.277.80000112.7T634 E635 K636 F641 Q642T634-S638 WeakPolarHBondContact O-CB 3.44Å; T634-S638 PolarHBondContact O-N 3.44Å; T634-S638 PolarHBondContact O-OG 2.91Å; E635-S638 PolarHBondContact O-N 2.95Å; E635-S638 VanDerWaalsContact O-N 3.13Å; E635-S638 PolarHBondContact O-OG 3.4Å; K636-S638 VanDerWaalsContact C-N 3.34Å; S638-F641 PolarHBondContact O-N 2.98Å; S638-Q642 WeakPolarHBondContact O-CB 3.48Å; S638-Q642 VanDerWaalsContact O-CG 3.26Å; S638-Q642 WeakPolarHBondContact O-CG 3.49Å; S638-Q642 PolarHBondContact O-N 3.37Å
639L82.6Confident81.9Confident97 Ų9797.7 Ų97.751%0.50850%0.499SS..Hα-helixtrans-71.2-33.6173.9-72.9173000111.7E635 K636 L643E635-L639 WeakPolarHBondContact O-CB 3.29Å; E635-L639 WeakPolarHBondContact O-CG 2.81Å; E635-L639 PolarHBondContact O-N 3.38Å; K636-L639 PolarHBondContact O-N 3.32Å; L639-L643 VanDerWaalsContact O-CB 3.29Å; L639-L643 WeakPolarHBondContact O-CB 3.48Å; L639-L643 PolarHBondContact O-N 3.43Å
640V86.1Confident80.2Confident73 Ų7397.3 Ų97.344%0.44250%0.497SS..Hα-helixtrans-68-40.3170165.90000110.3K636 S637 L643 E644K636-V640 HydrophobicContact CG-CG2 4.21Å; K636-V640 VanDerWaalsContact O-CB 3.31Å; K636-V640 WeakPolarHBondContact O-CB 3.42Å; K636-V640 VanDerWaalsContact O-CG2 3.23Å; K636-V640 WeakPolarHBondContact O-CG2 3.48Å; K636-V640 PolarHBondContact O-N 3.44Å; S637-V640 PolarHBondContact O-N 2.98Å; V640-L643 CarbonylContact O-C 3.59Å; V640-L643 PolarHBondContact O-N 2.98Å; V640-E644 WeakPolarHBondContact O-CB 3.47Å; V640-E644 PolarHBondContact O-N 2.91Å
641F81.9Confident78.5Confident143 Ų14399.3 Ų99.363%0.62751%0.505SS*.Hα-helixtrans-69.6-33.7175.3-160-94.9000112.3S637 S638 R645S637-F641 WeakPolarHBondContact O-CB 3.28Å; S637-F641 PolarHBondContact O-N 3.2Å; S638-F641 PolarHBondContact O-N 2.98Å; F641-R645 WeakPolarHBondContact O-CB 3.49Å; F641-R645 PolarHBondContact O-N 3.48Å
642Q85.4Confident76.8Confident107 Ų107102.1 Ų102.150%0.552%0.522SS..Hα-helixtrans-67.6-41168.9-73.817334.800111.5S638 L646S638-Q642 WeakPolarHBondContact O-CB 3.48Å; S638-Q642 VanDerWaalsContact O-CG 3.26Å; S638-Q642 WeakPolarHBondContact O-CG 3.49Å; S638-Q642 PolarHBondContact O-N 3.37Å; Q642-L646 VanDerWaalsContact O-CB 3.26Å; Q642-L646 WeakPolarHBondContact O-CB 3.39Å; Q642-L646 VanDerWaalsContact O-CG 3.28Å; Q642-L646 WeakPolarHBondContact O-CG 3.31Å; Q642-L646 PolarHBondContact O-N 2.94Å
643L78.1Confident75.4Confident115 Ų115102.1 Ų102.160%0.60254%0.535SS*.Hα-helixtrans-65.7-41.8174.1-98.2168.6000111.8L639 V640 L646 E647L639-L643 VanDerWaalsContact O-CB 3.29Å; L639-L643 WeakPolarHBondContact O-CB 3.48Å; L639-L643 PolarHBondContact O-N 3.43Å; V640-L643 CarbonylContact O-C 3.59Å; V640-L643 PolarHBondContact O-N 2.98Å; L643-L646 CarbonylContact O-C 3.58Å; L643-L646 PolarHBondContact O-N 3.45Å; L643-E647 WeakPolarHBondContact O-CA 3.4Å; L643-E647 WeakPolarHBondContact O-CB 3.29Å; L643-E647 PolarHBondContact O-N 3.07Å
644E81.2Confident73.5Confident94 Ų94106 Ų10644%0.43955%0.546SS..Hα-helixtrans-67-41.4177.1-178.1175.9-170.900110.7V640 E647 Q648V640-E644 WeakPolarHBondContact O-CB 3.47Å; V640-E644 PolarHBondContact O-N 2.91Å; E644-E647 CarbonylContact O-C 3.56Å; E644-E647 PolarHBondContact O-N 3.33Å; E644-Q648 WeakPolarHBondContact O-CB 3.45Å; E644-Q648 VanDerWaalsContact O-CG 3.3Å; E644-Q648 WeakPolarHBondContact O-CG 3.13Å; E644-Q648 PolarHBondContact O-N 2.87Å
645R78.8Confident71.6Confident165 Ų165105.5 Ų105.562%0.62356%0.559SS**Hα-helixtrans-62.3-43.8171.7178.4174.7173.9160-0.5111.8F641 Q648 Q649F641-R645 WeakPolarHBondContact O-CB 3.49Å; F641-R645 PolarHBondContact O-N 3.48Å; R645-Q648 PolarHBondContact O-N 3.27Å; R645-Q649 WeakPolarHBondContact O-CG 3.42Å; R645-Q649 PolarHBondContact O-N 3.36Å
646L71.6Confident69.6Low104 Ų104102.6 Ų102.655%0.54556%0.558SS.*Hα-helixtrans-68.9-32.9174.9-77.2170.7000111.9Q642 L643 Q649 L650Q642-L646 VanDerWaalsContact O-CB 3.26Å; Q642-L646 WeakPolarHBondContact O-CB 3.39Å; Q642-L646 VanDerWaalsContact O-CG 3.28Å; Q642-L646 WeakPolarHBondContact O-CG 3.31Å; Q642-L646 PolarHBondContact O-N 2.94Å; L643-L646 CarbonylContact O-C 3.58Å; L643-L646 PolarHBondContact O-N 3.45Å; L646-Q649 CarbonylContact O-C 3.58Å; L646-Q649 PolarHBondContact O-N 2.88Å; L646-L650 WeakPolarHBondContact O-CB 3.47Å; L646-L650 PolarHBondContact O-N 3.35Å
647E71.4Confident67.3Low92 Ų92104.9 Ų104.943%0.4357%0.571SS.*Hα-helixtrans-77.5-26177.3-163-159.5134.600111.3L643 E644 L650 K651L643-E647 WeakPolarHBondContact O-CA 3.4Å; L643-E647 WeakPolarHBondContact O-CB 3.29Å; L643-E647 PolarHBondContact O-N 3.07Å; E644-E647 CarbonylContact O-C 3.56Å; E644-E647 PolarHBondContact O-N 3.33Å; E647-L650 CarbonylContact O-C 3.53Å; E647-L650 PolarHBondContact O-N 3Å; E647-K651 HydrophobicContact CG-CD 4.44Å; E647-K651 WeakPolarHBondContact O-CB 3.44Å; E647-K651 VanDerWaalsContact O-CG 3.31Å; E647-K651 WeakPolarHBondContact O-CG 3.27Å; E647-K651 PolarHBondContact O-N 3.42Å; E647-K651 WeakPolarHBondContact OE1-CE 3.4Å; E647-K651 IonicContact OE1-NZ 2.61Å; E647-K651 PolarHBondContact OE1-NZ 3.36Å
648Q64.1Low65Low116 Ų116106.6 Ų106.654%0.54258%0.583SS.*Hα-helixtrans-77.7-36168.7-74175.22.900111.1E644 R645 L650 S652E644-Q648 WeakPolarHBondContact O-CB 3.45Å; E644-Q648 VanDerWaalsContact O-CG 3.3Å; E644-Q648 WeakPolarHBondContact O-CG 3.13Å; E644-Q648 PolarHBondContact O-N 2.87Å; R645-Q648 PolarHBondContact O-N 3.27Å; Q648-L650 VanDerWaalsContact C-N 3.31Å; Q648-S652 WeakPolarHBondContact O-CB 3.43Å; Q648-S652 PolarHBondContact O-N 3.43Å; Q648-S652 PolarHBondContact O-OG 2.84Å
649Q65.1Low62.8Low109 Ų109107.6 Ų107.651%0.50960%0.602SS.*Hα-helixtrans-64.6-35.4165.3-72.1-176.4-50.700111.7R645 L646 S652 A653R645-Q649 WeakPolarHBondContact O-CG 3.42Å; R645-Q649 PolarHBondContact O-N 3.36Å; L646-Q649 CarbonylContact O-C 3.58Å; L646-Q649 PolarHBondContact O-N 2.88Å; Q649-S652 WeakPolarHBondContact CA-OG 3.46Å; Q649-S652 PolarHBondContact O-OG 2.88Å; Q649-A653 VanDerWaalsContact O-CB 3.25Å; Q649-A653 WeakPolarHBondContact O-CB 3.46Å; Q649-A653 PolarHBondContact O-N 3.12Å; Q649-A653 VanDerWaalsContact O-N 3.12Å
650L55Low60.6Low89 Ų89107 Ų10747%0.46662%0.618SS.*Hα-helixtrans-73.8-43175.8-155.981.3000111.2L646 E647 Q648 S652 A653 Q654L646-L650 WeakPolarHBondContact O-CB 3.47Å; L646-L650 PolarHBondContact O-N 3.35Å; E647-L650 CarbonylContact O-C 3.53Å; E647-L650 PolarHBondContact O-N 3Å; Q648-L650 VanDerWaalsContact C-N 3.31Å; L650-S652 VanDerWaalsContact C-N 3.26Å; L650-S652 PolarHBondContact O-N 2.85Å; L650-A653 CarbonylContact O-C 3.58Å; L650-A653 PolarHBondContact O-N 2.92Å; L650-Q654 HydrophobicContact CG-CB 4.2Å; L650-Q654 CarbonylContact O-C 3.59Å; L650-Q654 VanDerWaalsContact O-CA 3.29Å; L650-Q654 WeakPolarHBondContact O-CA 3.48Å; L650-Q654 WeakPolarHBondContact O-CB 3.48Å; L650-Q654 PolarHBondContact O-N 3.3Å
651K56.3Low58Low142 Ų142109.4 Ų109.462%0.61764%0.639SS**Hα-helixtrans-67-25.3176.1-84168.3165.2162.10112.9E647E647-K651 HydrophobicContact CG-CD 4.44Å; E647-K651 WeakPolarHBondContact O-CB 3.44Å; E647-K651 VanDerWaalsContact O-CG 3.31Å; E647-K651 WeakPolarHBondContact O-CG 3.27Å; E647-K651 PolarHBondContact O-N 3.42Å; E647-K651 WeakPolarHBondContact OE1-CE 3.4Å; E647-K651 IonicContact OE1-NZ 2.61Å; E647-K651 PolarHBondContact OE1-NZ 3.36Å
652S52.9Low55.6Low104 Ų104107.5 Ų107.573%0.72764%0.643SS**Hα-helixtrans-84.9-14170.651.30000114.1Q648 Q649 L650Q648-S652 WeakPolarHBondContact O-CB 3.43Å; Q648-S652 PolarHBondContact O-N 3.43Å; Q648-S652 PolarHBondContact O-OG 2.84Å; Q649-S652 WeakPolarHBondContact CA-OG 3.46Å; Q649-S652 PolarHBondContact O-OG 2.88Å; L650-S652 VanDerWaalsContact C-N 3.26Å; L650-S652 PolarHBondContact O-N 2.85Å
653A54.9Low53.3Low89 Ų89109.1 Ų109.174%0.73665%0.654SS**Hα-helixtrans-109.7-20177.100000115Q649 L650Q649-A653 VanDerWaalsContact O-CB 3.25Å; Q649-A653 WeakPolarHBondContact O-CB 3.46Å; Q649-A653 PolarHBondContact O-N 3.12Å; Q649-A653 VanDerWaalsContact O-N 3.12Å; L650-A653 CarbonylContact O-C 3.58Å; L650-A653 PolarHBondContact O-N 2.92Å
654Q46.1Very low51Low109 Ų109110.9 Ų110.951%0.50966%0.664SS.*  trans-148.784.1-167.9-175.1-174.7-15.100109.4L650 G656L650-Q654 HydrophobicContact CG-CB 4.2Å; L650-Q654 CarbonylContact O-C 3.59Å; L650-Q654 VanDerWaalsContact O-CA 3.29Å; L650-Q654 WeakPolarHBondContact O-CA 3.48Å; L650-Q654 WeakPolarHBondContact O-CB 3.48Å; L650-Q654 PolarHBondContact O-N 3.3Å; Q654-G656 PolarHBondContact O-N 3.25Å
655G47.6Very low48.7Very low85 Ų85114.6 Ų114.688%0.87668%0.683SS**  trans-72.6103.5164.100000110.9
656G45.8Very low46.6Very low45 Ų45111.7 Ų111.746%0.46469%0.688SS.*  trans136.4129.2155.800000118Q654Q654-G656 PolarHBondContact O-N 3.25Å
657Q39Very low44.6Very low193 Ų193111.6 Ų111.690%0.90269%0.692SS**  trans68.1155.7151-55.2-175.641.400118.3
658S35.8Very low42.8Very low113 Ų113113.9 Ų113.979%0.7971%0.707SS**  cis-171.1146.1-30.9-174.90000109.8
659G39.6Very low41.4Very low76 Ų76116.6 Ų116.678%0.78472%0.719SS**  trans59.8115.7149.700000120.8
660G35.3Very low39.9Very low83 Ų83114.6 Ų114.686%0.85673%0.728SS**  trans-89.8-167.7170.800000115.1
661S31.8Very low39.5Very low125 Ų125116.8 Ų116.887%0.87475%0.748SS**  trans-160.5-176.5165.6-158.50000112.1
662S31.8Very low38.5Very low102 Ų102113.4 Ų113.471%0.71375%0.753SS**  trans-148.1-169.5-161.457.80000114.6
663I36.2Very low37.6Very low141 Ų141114.7 Ų114.772%0.72376%0.756SS**  trans108.7119.8158-65166.4000119.8
664N31.4Very low36.6Very low153 Ų153121.1 Ų121.182%0.81876%0.762SS**  trans34.5144.2146.2-55.8-9.1000125
665M33Very low36Very low172 Ų172124 Ų12485%0.84778%0.775SS**  -147158.5115.7-159.8172178.600112.1
666S32.9Very low35.3Very low104 Ų104131.8 Ų131.873%0.72778%0.778SS**  trans-119.4-143.5175.556.30000110.9
667T30.2Very low34.7Very low102 Ų102135.3 Ų135.363%0.62679%0.786SS**  trans84.9142168.2-45.30000114.3
668L34.9Very low34.4Very low140 Ų140132.8 Ų132.873%0.73378%0.784SS**  cis-147.9-172.612.8-160.445.8000113.9
669E34.7Very low34.8Very low172 Ų172132.3 Ų132.380%0.80478%0.779SS**  trans-49.4178.9177.4-60.5163.5127.400117.9
670G32.8Very low34.6Very low68 Ų68134 Ų13470%0.70177%0.773SS**  cis-171.9-167.622.900000117.6
671P45.5Very low34.6Very low135 Ų135138 Ų13888%0.87777%0.774SS**  trans-132171-142.642.6-28.8000119
672G36.5Very low34.5Very low70 Ų70140.1 Ų140.172%0.72277%0.768SS**  trans115.1151.915800000116.4
673T34.5Very low34.6Very low131 Ų131139.2 Ų139.280%0.80476%0.762SS**  cis-160.7161.3-2.9-33.10000112
674R33.4Very low34.4Very low224 Ų224139.5 Ų139.585%0.84577%0.765SS**  trans74.7109.1168.2-57.3-176.3175-161.4-4.7116.2
675Q33.8Very low34.6Very low170 Ų170140 Ų14079%0.79476%0.763SS**  77.2114.350.4-66.6-175.4-23.600116.2
676R32.3Very low34.6Very low248 Ų248138.6 Ų138.694%0.93676%0.758SS**  -149.3107.5125-172.2169.5-178163.90.7109.7
677N34Very low34.9Very low119 Ų119139.2 Ų139.264%0.63676%0.762SS**  trans-81167.4174.6-59.79.6000108.7
678T31.8Very low36.3Very low140 Ų140140.5 Ų140.586%0.85977%0.772SS**  -147128.958.947.30000114.3
679P44.4Very low36.4Very low104 Ų104136.4 Ų136.468%0.67576%0.764SS**  trans-103.9-175.7165.838.7-31.1000112.9
680V34.9Very low37.3Very low111 Ų111133.5 Ų133.567%0.67376%0.758SS**  trans77.8110.3165.3-174.90000117.4F682V680-F682 HydrophobicContact CG1-CD2 3.96Å; V680-F682 HydrophobicContact CG1-CE2 3.91Å
681L35.3Very low38.1Very low166 Ų166139.7 Ų139.787%0.86976%0.761SS**  -151.7142.3112.6-108163.8000111.6
682F30.8Very low38.5Very low170 Ų170135.7 Ų135.775%0.74675%0.745SS**  trans-58.4172.9-177.3-73.8-115.7000114.3V680V680-F682 HydrophobicContact CG1-CD2 3.96Å; V680-F682 HydrophobicContact CG1-CE2 3.91Å
683S32.3Very low39.4Very low84 Ų84140.6 Ų140.659%0.58775%0.747SS**  cis178.1162.2-25.6-85.50000107
684D33.1Very low40.3Very low147 Ų147138.4 Ų138.479%0.78673%0.733SS**  trans61.3164.6160.9-71.7-32000117
685Q34.8Very low41.3Very low164 Ų164137.8 Ų137.877%0.76673%0.73SS**  cis-140.9-178.1-13.3-134.5176.2-12.600111.1
686D33.5Very low42.5Very low142 Ų142137.1 Ų137.176%0.75973%0.725SS**  trans-60.1-178.8-173.2-60.6-77.5000118.5
687S38.5Very low43.6Very low116 Ų116127.9 Ų127.981%0.81170%0.701SS**  trans99.3147.1159.6-72.80000118.9
688P59.8Low44.6Very low129 Ų129124.7 Ų124.784%0.83869%0.692SS**  trans-124.2117-134.433-15.3000115.1
689G38.4Very low46Very low54 Ų54120.8 Ų120.856%0.55767%0.67SS**  trans-100.7132.8177.600000115Y691 G692G689-Y691 PolarHBondContact O-N 2.89Å; G689-Y691 VanDerWaalsContact O-N 3.07Å; G689-G692 PolarHBondContact O-N 3.26Å
690V53.2Low46.8Very low111 Ų111119.5 Ų119.567%0.67366%0.66SS**THydrogen-bonded Turntrans-55.3-26.7174.3179.80000112.6G692 K693 V694V690-G692 PolarHBondContact O-N 3.46Å; V690-G692 VanDerWaalsContact O-N 3.07Å; V690-K693 PolarHBondContact O-N 3.26Å; V690-V694 HydrophobicContact CG1-CG2 4.16Å; V690-V694 PolarHBondContact O-N 2.88Å
691Y48.3Very low48.1Very low198 Ų198120 Ų12078%0.77666%0.658SS**Hα-helixtrans-45.4-35.2173.5-74.3-85.6000115G689 K693 V694 R695G689-Y691 PolarHBondContact O-N 2.89Å; G689-Y691 VanDerWaalsContact O-N 3.07Å; Y691-K693 VanDerWaalsContact C-N 3.28Å; Y691-K693 PolarHBondContact O-N 2.95Å; Y691-V694 PolarHBondContact O-N 2.97Å; Y691-R695 WeakPolarHBondContact O-CB 3.23Å; Y691-R695 PolarHBondContact O-N 3.43Å
692G54.8Low49.6Very low52 Ų52116.3 Ų116.354%0.53664%0.639SS.*Hα-helixtrans-63.2-31.7177.800000113.8G689 V690G689-G692 PolarHBondContact O-N 3.26Å; V690-G692 PolarHBondContact O-N 3.46Å; V690-G692 VanDerWaalsContact O-N 3.07Å
693K54.8Low51.2Low173 Ų173117.3 Ų117.375%0.75264%0.638SS**Hα-helixtrans-82.2-42.3175.8-66.9178.2179.71760111.1V690 Y691 R695 K696 A697V690-K693 PolarHBondContact O-N 3.26Å; Y691-K693 VanDerWaalsContact C-N 3.28Å; Y691-K693 PolarHBondContact O-N 2.95Å; K693-R695 PolarHBondContact O-N 2.73Å; K693-K696 PolarHBondContact O-N 2.85Å; K693-A697 PolarHBondContact O-N 3.38Å
694V54.5Low52.7Low84 Ų84120.5 Ų120.551%0.50964%0.641SS.*Hα-helixtrans-61.3-43.1178.1-179.20000111.4V690 Y691 K696 A697 A698V690-V694 HydrophobicContact CG1-CG2 4.16Å; V690-V694 PolarHBondContact O-N 2.88Å; Y691-V694 PolarHBondContact O-N 2.97Å; V694-K696 VanDerWaalsContact C-N 3.3Å; V694-K696 PolarHBondContact O-N 3.2Å; V694-A697 PolarHBondContact O-N 3.17Å; V694-A698 WeakPolarHBondContact O-CB 3.16Å; V694-A698 PolarHBondContact O-N 2.92Å
695R54Low54.2Low211 Ų211116.3 Ų116.380%0.79662%0.624SS**Hα-helixtrans-62.7-34.4177.9-166.4171.6-177.7172.40.9112.7Y691 K693 S699Y691-R695 WeakPolarHBondContact O-CB 3.23Å; Y691-R695 PolarHBondContact O-N 3.43Å; K693-R695 PolarHBondContact O-N 2.73Å; R695-S699 WeakPolarHBondContact O-CB 3.05Å; R695-S699 PolarHBondContact O-N 2.97Å; R695-S699 PolarHBondContact O-OG 3.19Å
696K58.3Low55.8Low157 Ų157112.9 Ų112.968%0.68361%0.61SS**Hα-helixtrans-71.1-44.7171.8-92.1-179.4173.7175.90112.2K693 V694 S699 T700K693-K696 PolarHBondContact O-N 2.85Å; V694-K696 VanDerWaalsContact C-N 3.3Å; V694-K696 PolarHBondContact O-N 3.2Å; K696-S699 PolarHBondContact O-N 3.48Å; K696-S699 PolarHBondContact O-OG 3.1Å; K696-T700 PolarHBondContact O-N 3.37Å; K696-T700 VanDerWaalsContact O-N 3.13Å; K696-T700 PolarHBondContact O-OG1 2.97Å
697A55.9Low57.5Low53 Ų53115 Ų11544%0.43861%0.607SS.*Hα-helixtrans-60.4-47.9177.100000111.9K693 V694 S699 T700 I701K693-A697 PolarHBondContact O-N 3.38Å; V694-A697 PolarHBondContact O-N 3.17Å; A697-S699 PolarHBondContact O-N 3.28Å; A697-T700 WeakPolarHBondContact O-CA 3.48Å; A697-T700 WeakPolarHBondContact O-CB 3.31Å; A697-T700 PolarHBondContact O-N 3.24Å; A697-I701 PolarHBondContact O-N 3.4Å
698A54.8Low59Low53 Ų53114.6 Ų114.644%0.43860%0.595SS.*Hα-helixtrans-57-47.617500000111.9V694 T700 I701 D702V694-A698 WeakPolarHBondContact O-CB 3.16Å; V694-A698 PolarHBondContact O-N 2.92Å; A698-T700 PolarHBondContact O-N 3.47Å; A698-T700 VanDerWaalsContact O-N 3.09Å; A698-I701 PolarHBondContact O-N 3Å; A698-D702 WeakPolarHBondContact O-CB 3.3Å; A698-D702 PolarHBondContact O-N 3.24Å
699S61.7Low59.3Low58 Ų58110.5 Ų110.541%0.40658%0.577SS.*Hα-helixtrans-64.4-13.8175.974.70000114.7R695 K696 A697 R703R695-S699 WeakPolarHBondContact O-CB 3.05Å; R695-S699 PolarHBondContact O-N 2.97Å; R695-S699 PolarHBondContact O-OG 3.19Å; K696-S699 PolarHBondContact O-N 3.48Å; K696-S699 PolarHBondContact O-OG 3.1Å; A697-S699 PolarHBondContact O-N 3.28Å; S699-R703 WeakPolarHBondContact O-CD 3.23Å; S699-R703 VanDerWaalsContact O-CG 3.28Å; S699-R703 WeakPolarHBondContact O-CG 3.43Å
700T61.3Low60.7Low76 Ų76113 Ų11347%0.46658%0.576SS.*Hα-helixtrans-94.2-42.9175.5-51.10000110.8K696 A697 A698 D702 R703 F704K696-T700 PolarHBondContact O-N 3.37Å; K696-T700 VanDerWaalsContact O-N 3.13Å; K696-T700 PolarHBondContact O-OG1 2.97Å; A697-T700 WeakPolarHBondContact O-CA 3.48Å; A697-T700 WeakPolarHBondContact O-CB 3.31Å; A697-T700 PolarHBondContact O-N 3.24Å; A698-T700 PolarHBondContact O-N 3.47Å; A698-T700 VanDerWaalsContact O-N 3.09Å; T700-D702 VanDerWaalsContact C-N 3.33Å; T700-D702 PolarHBondContact O-N 3.13Å; T700-R703 PolarHBondContact O-N 2.91Å; T700-F704 HydrophobicContact CG2-CD2 4.35Å; T700-F704 WeakPolarHBondContact O-CD2 3.24Å; T700-F704 PolarHBondContact O-N 2.86Å
701I62.5Low61.4Low123 Ų123112.9 Ų112.963%0.63157%0.567SS**Hα-helixtrans-57.3-45.5171-81.3175000110.8A697 A698 R703 F704 S705A697-I701 PolarHBondContact O-N 3.4Å; A698-I701 PolarHBondContact O-N 3Å; I701-R703 VanDerWaalsContact C-N 3.34Å; I701-R703 PolarHBondContact O-N 3.46Å; I701-F704 CarbonylContact O-C 3.6Å; I701-F704 WeakPolarHBondContact O-CA 3.18Å; I701-F704 WeakPolarHBondContact O-CB 3.28Å; I701-F704 PolarHBondContact O-N 3.05Å; I701-S705 PolarHBondContact O-N 3.28Å; I701-S705 PolarHBondContact O-OG 3.06Å
702D66.9Low62.2Low87 Ų87106.2 Ų106.247%0.46554%0.544SS..Hα-helixtrans-64.5-38.1179.6-170.350.4000112.3A698 T700 F704 S705 I706A698-D702 WeakPolarHBondContact O-CB 3.3Å; A698-D702 PolarHBondContact O-N 3.24Å; T700-D702 VanDerWaalsContact C-N 3.33Å; T700-D702 PolarHBondContact O-N 3.13Å; D702-F704 VanDerWaalsContact C-N 3.26Å; D702-F704 PolarHBondContact O-N 2.82Å; D702-S705 WeakPolarHBondContact CA-OG 3.23Å; D702-S705 PolarHBondContact O-N 3.09Å; D702-S705 PolarHBondContact O-OG 2.86Å; D702-I706 WeakPolarHBondContact O-CB 3.31Å; D702-I706 VanDerWaalsContact O-CG1 3.25Å; D702-I706 WeakPolarHBondContact O-CG1 3.46Å; D702-I706 PolarHBondContact O-N 3.27Å
703R64.4Low62.9Low191 Ų191115 Ų11572%0.72156%0.561SS**Hα-helixtrans-65.7-27.4171.1-75.9176.6174.9-162.8-2.3113.3S699 T700 I701 R707S699-R703 WeakPolarHBondContact O-CD 3.23Å; S699-R703 VanDerWaalsContact O-CG 3.28Å; S699-R703 WeakPolarHBondContact O-CG 3.43Å; T700-R703 PolarHBondContact O-N 2.91Å; I701-R703 VanDerWaalsContact C-N 3.34Å; I701-R703 PolarHBondContact O-N 3.46Å; R703-R707 WeakPolarHBondContact O-CB 3.43Å; R703-R707 PolarHBondContact O-N 3.42Å
704F63Low63.9Low151 Ų151115.7 Ų115.766%0.66256%0.559SS**Hα-helixtrans-81.2-42.7173.4-95.8-85.3000112.3T700 I701 D702 R707 L708T700-F704 HydrophobicContact CG2-CD2 4.35Å; T700-F704 WeakPolarHBondContact O-CD2 3.24Å; T700-F704 PolarHBondContact O-N 2.86Å; I701-F704 CarbonylContact O-C 3.6Å; I701-F704 WeakPolarHBondContact O-CA 3.18Å; I701-F704 WeakPolarHBondContact O-CB 3.28Å; I701-F704 PolarHBondContact O-N 3.05Å; D702-F704 VanDerWaalsContact C-N 3.26Å; D702-F704 PolarHBondContact O-N 2.82Å; F704-R707 PolarHBondContact O-N 2.78Å; F704-L708 WeakPolarHBondContact O-CB 3.5Å; F704-L708 PolarHBondContact O-N 2.91Å
705S63.9Low64.9Low59 Ų59117 Ų11741%0.41356%0.556SS.*Hα-helixtrans-65.1-47.5179.463.10000111.7I701 D702 R707 L708 G709I701-S705 PolarHBondContact O-N 3.28Å; I701-S705 PolarHBondContact O-OG 3.06Å; D702-S705 WeakPolarHBondContact CA-OG 3.23Å; D702-S705 PolarHBondContact O-N 3.09Å; D702-S705 PolarHBondContact O-OG 2.86Å; S705-R707 VanDerWaalsContact C-N 3.31Å; S705-R707 PolarHBondContact O-N 3.04Å; S705-L708 PolarHBondContact O-N 3.34Å; S705-G709 PolarHBondContact O-N 3Å
706I69.2Low65.8Low93 Ų93111.7 Ų111.748%0.47755%0.548SS..Hα-helixtrans-60.5-43.2176-66.5169000110.1D702 I710D702-I706 WeakPolarHBondContact O-CB 3.31Å; D702-I706 VanDerWaalsContact O-CG1 3.25Å; D702-I706 WeakPolarHBondContact O-CG1 3.46Å; D702-I706 PolarHBondContact O-N 3.27Å; I706-I710 HydrophobicContact CG2-CD1 3.93Å; I706-I710 WeakPolarHBondContact O-CD1 3.33Å; I706-I710 VanDerWaalsContact O-CG1 3.26Å; I706-I710 WeakPolarHBondContact O-CG1 3.27Å; I706-I710 PolarHBondContact O-N 3.2Å
707R69Low66.5Low186 Ų186110.2 Ų110.270%0.70255%0.546SS*.Hα-helixtrans-68.8-40.3179.2-172.1162.7-68.1-169.4-2.3112.3R703 F704 S705 I710 F711R703-R707 WeakPolarHBondContact O-CB 3.43Å; R703-R707 PolarHBondContact O-N 3.42Å; F704-R707 PolarHBondContact O-N 2.78Å; S705-R707 VanDerWaalsContact C-N 3.31Å; S705-R707 PolarHBondContact O-N 3.04Å; R707-I710 PolarHBondContact O-N 2.84Å; R707-F711 WeakPolarHBondContact O-CB 3.24Å; R707-F711 PolarHBondContact O-N 3.47Å
708L69.4Low67.5Low107 Ų107109 Ų10956%0.5654%0.535SS*.Hα-helixtrans-66.3-42.7176.8-173.966.4000111.5F704 S705 F711 L712F704-L708 WeakPolarHBondContact O-CB 3.5Å; F704-L708 PolarHBondContact O-N 2.91Å; S705-L708 PolarHBondContact O-N 3.34Å; L708-F711 WeakPolarHBondContact O-CB 3.4Å; L708-F711 PolarHBondContact O-N 2.84Å; L708-F711 VanDerWaalsContact O-N 3.13Å; L708-L712 HydrophobicContact CD1-CD1 3.88Å; L708-L712 HydrophobicContact CG-CD1 4.2Å; L708-L712 PolarHBondContact O-N 3.09Å
709G66.3Low68.7Low44 Ų44114.2 Ų114.245%0.45454%0.544SS..Hα-helixtrans-61.8-42.4174.900000112.7S705 F711 R713S705-G709 PolarHBondContact O-N 3Å; G709-F711 VanDerWaalsContact C-N 3.33Å; G709-R713 WeakPolarHBondContact O-CB 3.44Å; G709-R713 PolarHBondContact O-N 3.34Å
710I69.2Low69.5Low107 Ų107116.5 Ų116.555%0.54955%0.551SS.*Hα-helixtrans-65.1-37.1172.6-67.2166.4000111.1I706 R707 R713 R714I706-I710 HydrophobicContact CG2-CD1 3.93Å; I706-I710 WeakPolarHBondContact O-CD1 3.33Å; I706-I710 VanDerWaalsContact O-CG1 3.26Å; I706-I710 WeakPolarHBondContact O-CG1 3.27Å; I706-I710 PolarHBondContact O-N 3.2Å; R707-I710 PolarHBondContact O-N 2.84Å; I710-R713 PolarHBondContact O-N 3.49Å; I710-R714 WeakPolarHBondContact O-CB 3.23Å; I710-R714 PolarHBondContact O-N 3.32Å
711F66.4Low70.6Confident108 Ų108119.8 Ų119.847%0.47456%0.559SS.*Hα-helixtrans-66.4-47.8177.9-141-98.9000112R707 L708 G709 R713 R714 Y715R707-F711 WeakPolarHBondContact O-CB 3.24Å; R707-F711 PolarHBondContact O-N 3.47Å; L708-F711 WeakPolarHBondContact O-CB 3.4Å; L708-F711 PolarHBondContact O-N 2.84Å; L708-F711 VanDerWaalsContact O-N 3.13Å; G709-F711 VanDerWaalsContact C-N 3.33Å; F711-R713 VanDerWaalsContact C-N 3.28Å; F711-R713 PolarHBondContact O-N 3.24Å; F711-R714 PolarHBondContact O-N 3.07Å; F711-R714 VanDerWaalsContact O-N 3.1Å; F711-Y715 AromaticContact CD1-CD2 3.62Å; F711-Y715 HydrophobicContact CD1-CD2 3.62Å; F711-Y715 HydrophobicContact CD1-CE2 4.15Å; F711-Y715 HydrophobicContact CD2-CD2 4.14Å; F711-Y715 AromaticContact CD2-CE2 3.93Å; F711-Y715 HydrophobicContact CD2-CE2 3.93Å; F711-Y715 AromaticContact CE1-CD2 3.57Å; F711-Y715 HydrophobicContact CE1-CD2 3.57Å; F711-Y715 AromaticContact CE1-CE2 3.85Å; F711-Y715 HydrophobicContact CE1-CE2 3.85Å; F711-Y715 HydrophobicContact CE1-CG 4.43Å; F711-Y715 HydrophobicContact CE2-CD2 4.11Å; F711-Y715 AromaticContact CE2-CE2 3.61Å; F711-Y715 HydrophobicContact CE2-CE2 3.61Å; F711-Y715 AromaticContact CG-CD2 3.91Å; F711-Y715 HydrophobicContact CG-CD2 3.91Å; F711-Y715 HydrophobicContact CG-CE2 4.19Å; F711-Y715 AromaticContact CZ-CD2 3.83Å; F711-Y715 HydrophobicContact CZ-CD2 3.83Å; F711-Y715 AromaticContact CZ-CE2 3.56Å; F711-Y715 HydrophobicContact CZ-CE2 3.56Å; F711-Y715 WeakPolarHBondContact O-CD2 3.24Å; F711-Y715 PolarHBondContact O-N 3.08Å
712L65.3Low71.5Confident58 Ų58117 Ų11730%0.30455%0.547SS..Hα-helixtrans-64-30.9175.9-96.164000112.6L708 V722L708-L712 HydrophobicContact CD1-CD1 3.88Å; L708-L712 HydrophobicContact CG-CD1 4.2Å; L708-L712 PolarHBondContact O-N 3.09Å; L712-V722 HydrophobicContact CD2-CG2 4.47Å
713R69.9Low72.2Confident235 Ų235117.6 Ų117.689%0.88755%0.549SS*.Hα-helixtrans-75.4-23.7173.8-168.6172.2-177.7176.81.8113.1G709 I710 F711G709-R713 WeakPolarHBondContact O-CB 3.44Å; G709-R713 PolarHBondContact O-N 3.34Å; I710-R713 PolarHBondContact O-N 3.49Å; F711-R713 VanDerWaalsContact C-N 3.28Å; F711-R713 PolarHBondContact O-N 3.24Å
714R75.7Confident73.3Confident189 Ų189113.2 Ų113.271%0.71354%0.54SS*.Hα-helixtrans-99.2-21.7-176.1-162169.7-171.2170.22.6114.4I710 F711I710-R714 WeakPolarHBondContact O-CB 3.23Å; I710-R714 PolarHBondContact O-N 3.32Å; F711-R714 PolarHBondContact O-N 3.07Å; F711-R714 VanDerWaalsContact O-N 3.1Å
715Y75.8Confident74.6Confident112 Ų112113.5 Ų113.544%0.43954%0.538SS..  trans-124.2100.5-177.3-64.3-71.1000112.3F711 M717 A718 R719F711-Y715 AromaticContact CD1-CD2 3.62Å; F711-Y715 HydrophobicContact CD1-CD2 3.62Å; F711-Y715 HydrophobicContact CD1-CE2 4.15Å; F711-Y715 HydrophobicContact CD2-CD2 4.14Å; F711-Y715 AromaticContact CD2-CE2 3.93Å; F711-Y715 HydrophobicContact CD2-CE2 3.93Å; F711-Y715 AromaticContact CE1-CD2 3.57Å; F711-Y715 HydrophobicContact CE1-CD2 3.57Å; F711-Y715 AromaticContact CE1-CE2 3.85Å; F711-Y715 HydrophobicContact CE1-CE2 3.85Å; F711-Y715 HydrophobicContact CE1-CG 4.43Å; F711-Y715 HydrophobicContact CE2-CD2 4.11Å; F711-Y715 AromaticContact CE2-CE2 3.61Å; F711-Y715 HydrophobicContact CE2-CE2 3.61Å; F711-Y715 AromaticContact CG-CD2 3.91Å; F711-Y715 HydrophobicContact CG-CD2 3.91Å; F711-Y715 HydrophobicContact CG-CE2 4.19Å; F711-Y715 AromaticContact CZ-CD2 3.83Å; F711-Y715 HydrophobicContact CZ-CD2 3.83Å; F711-Y715 AromaticContact CZ-CE2 3.56Å; F711-Y715 HydrophobicContact CZ-CE2 3.56Å; F711-Y715 WeakPolarHBondContact O-CD2 3.24Å; F711-Y715 PolarHBondContact O-N 3.08Å; Y715-M717 VanDerWaalsContact C-N 3.27Å; Y715-M717 PolarHBondContact O-N 2.99Å; Y715-A718 WeakPolarHBondContact O-CB 3.37Å; Y715-A718 PolarHBondContact O-N 3.14Å; Y715-A718 VanDerWaalsContact O-N 3.12Å; Y715-R719 PolarHBondContact O-N 2.96Å
716P73.5Confident75.5Confident98 Ų98115.2 Ų115.264%0.63654%0.54SS*.Hα-helixtrans-62.5-32.1-179.124-33000112.9A718 R719 L720P716-A718 VanDerWaalsContact C-N 3.35Å; P716-A718 PolarHBondContact O-N 2.87Å; P716-R719 WeakPolarHBondContact O-CB 3.49Å; P716-R719 PolarHBondContact O-N 3.16Å; P716-R719 VanDerWaalsContact O-N 3.17Å; P716-L720 PolarHBondContact O-N 3.37Å; P716-L720 VanDerWaalsContact O-N 3.08Å
717M72.8Confident76.4Confident127 Ų127113.5 Ų113.563%0.62654%0.54SS*.Hα-helixtrans-63.8-37.5175.6-57.1-58.4-83.800112.3Y715 R719 L720 F721Y715-M717 VanDerWaalsContact C-N 3.27Å; Y715-M717 PolarHBondContact O-N 2.99Å; M717-R719 VanDerWaalsContact C-N 3.28Å; M717-R719 PolarHBondContact O-N 3.29Å; M717-L720 WeakPolarHBondContact O-CB 3.33Å; M717-L720 PolarHBondContact O-N 3Å; M717-L720 HydrophobicContact SD-CD1 4.08Å; M717-F721 VanDerWaalsContact O-CD2 3.24Å; M717-F721 WeakPolarHBondContact O-CD2 3.4Å; M717-F721 PolarHBondContact O-N 3.48Å
718A75.9Confident77.4Confident26 Ų26108.7 Ų108.722%0.21553%0.531CS..Hα-helixtrans-65.3-34.8175.300000111.6Y715 P716 F721 V722Y715-A718 WeakPolarHBondContact O-CB 3.37Å; Y715-A718 PolarHBondContact O-N 3.14Å; Y715-A718 VanDerWaalsContact O-N 3.12Å; P716-A718 VanDerWaalsContact C-N 3.35Å; P716-A718 PolarHBondContact O-N 2.87Å; A718-F721 PolarHBondContact O-N 2.84Å; A718-V722 WeakPolarHBondContact O-CG2 3.5Å; A718-V722 PolarHBondContact O-N 3.43Å; A718-V722 VanDerWaalsContact O-N 3.07Å
719R79.8Confident78.4Confident164 Ų164106.6 Ų106.662%0.61952%0.52SS*.Hα-helixtrans-64.5-40.3173.3-162.5-179.6-171.4179.83111.7Y715 P716 M717 V722 I723Y715-R719 PolarHBondContact O-N 2.96Å; P716-R719 WeakPolarHBondContact O-CB 3.49Å; P716-R719 PolarHBondContact O-N 3.16Å; P716-R719 VanDerWaalsContact O-N 3.17Å; M717-R719 VanDerWaalsContact C-N 3.28Å; M717-R719 PolarHBondContact O-N 3.29Å; R719-V722 PolarHBondContact O-N 2.79Å; R719-I723 HydrophobicContact CG-CD1 4.14Å; R719-I723 VanDerWaalsContact O-CG1 3.31Å; R719-I723 WeakPolarHBondContact O-CG1 3.37Å; R719-I723 PolarHBondContact O-N 2.99Å
720L80.1Confident79.3Confident106 Ų106110.3 Ų110.356%0.55553%0.525SS*.Hα-helixtrans-62.4-43.7173.6-67.9174.3000111.9P716 M717 V722 I723 L724P716-L720 PolarHBondContact O-N 3.37Å; P716-L720 VanDerWaalsContact O-N 3.08Å; M717-L720 WeakPolarHBondContact O-CB 3.33Å; M717-L720 PolarHBondContact O-N 3Å; M717-L720 HydrophobicContact SD-CD1 4.08Å; L720-V722 PolarHBondContact O-N 3.4Å; L720-I723 PolarHBondContact O-N 3.44Å; L720-L724 VanDerWaalsContact O-CB 3.25Å; L720-L724 WeakPolarHBondContact O-CB 3.34Å; L720-L724 PolarHBondContact O-N 3.44Å
721F83Confident80.1Confident144 Ų144110.4 Ų110.463%0.63253%0.527SS*.Hα-helixtrans-62.7-37.7175.7-79.3-68.3000113.4M717 A718 L724 Y725M717-F721 VanDerWaalsContact O-CD2 3.24Å; M717-F721 WeakPolarHBondContact O-CD2 3.4Å; M717-F721 PolarHBondContact O-N 3.48Å; A718-F721 PolarHBondContact O-N 2.84Å; F721-L724 HydrophobicContact CD1-CD2 4.46Å; F721-Y725 VanDerWaalsContact O-CB 3.28Å; F721-Y725 WeakPolarHBondContact O-CB 3.48Å; F721-Y725 PolarHBondContact O-N 2.96Å
722V81.1Confident81.2Confident65 Ų65113 Ų11339%0.39453%0.533SS..Hα-helixtrans-68.6-40.1175.6172.70000111.8L712 A718 R719 L720 Y725 M726L712-V722 HydrophobicContact CD2-CG2 4.47Å; A718-V722 WeakPolarHBondContact O-CG2 3.5Å; A718-V722 PolarHBondContact O-N 3.43Å; A718-V722 VanDerWaalsContact O-N 3.07Å; R719-V722 PolarHBondContact O-N 2.79Å; L720-V722 PolarHBondContact O-N 3.4Å; V722-Y725 PolarHBondContact O-N 2.98Å; V722-M726 WeakPolarHBondContact O-CG 3.47Å; V722-M726 PolarHBondContact O-N 2.85Å
723I82.2Confident82.1Confident99 Ų99113 Ų11351%0.50854%0.536SS..Hα-helixtrans-67-42.8175.6-68.1165.9000110.7R719 L720 M726 A727R719-I723 HydrophobicContact CG-CD1 4.14Å; R719-I723 VanDerWaalsContact O-CG1 3.31Å; R719-I723 WeakPolarHBondContact O-CG1 3.37Å; R719-I723 PolarHBondContact O-N 2.99Å; L720-I723 PolarHBondContact O-N 3.44Å; I723-M726 PolarHBondContact O-N 3.42Å; I723-A727 WeakPolarHBondContact O-CB 3.49Å; I723-A727 PolarHBondContact O-N 3.3Å
724L87.4Confident82.6Confident100 Ų100106.9 Ų106.952%0.52452%0.518SS..Hα-helixtrans-60.5-45.9174.8-176.472000111.2L720 F721 M726 A727 V728L720-L724 VanDerWaalsContact O-CB 3.25Å; L720-L724 WeakPolarHBondContact O-CB 3.34Å; L720-L724 PolarHBondContact O-N 3.44Å; F721-L724 HydrophobicContact CD1-CD2 4.46Å; L724-M726 PolarHBondContact O-N 2.95Å; L724-A727 PolarHBondContact O-N 3.21Å; L724-V728 WeakPolarHBondContact O-CB 3.44Å; L724-V728 VanDerWaalsContact O-CG2 3.32Å; L724-V728 WeakPolarHBondContact O-CG2 3.07Å; L724-V728 PolarHBondContact O-N 2.9Å
725Y91Very high82.9Confident156 Ų156101.8 Ų101.861%0.61250%0.504SS*.Hα-helixtrans-60.4-45176.1178.5-97.5000111.7F721 V722 V728 L729F721-Y725 VanDerWaalsContact O-CB 3.28Å; F721-Y725 WeakPolarHBondContact O-CB 3.48Å; F721-Y725 PolarHBondContact O-N 2.96Å; V722-Y725 PolarHBondContact O-N 2.98Å; Y725-V728 PolarHBondContact O-N 2.82Å; Y725-L729 HydrophobicContact CE1-CD1 3.89Å; Y725-L729 VanDerWaalsContact O-CB 3.27Å; Y725-L729 WeakPolarHBondContact O-CB 3.4Å; Y725-L729 PolarHBondContact O-N 3.46Å
726M83.3Confident83.3Confident96 Ų9699 Ų9947%0.47350%0.499SS..Hα-helixtrans-62.8-41.8174.8-77.2-66.1-177.800112.3V722 I723 L724 L729 H730V722-M726 WeakPolarHBondContact O-CG 3.47Å; V722-M726 PolarHBondContact O-N 2.85Å; I723-M726 PolarHBondContact O-N 3.42Å; L724-M726 PolarHBondContact O-N 2.95Å; M726-L729 PolarHBondContact O-N 3.22Å; M726-H730 PolarHBondContact O-N 2.95Å; M726-H730 PolarHBondContact O-ND1 3.14Å
727A86.8Confident83.4Confident56 Ų56100.5 Ų100.546%0.46350%0.501SS..Hα-helixtrans-64.7-42.9176.900000112I723 L724 H730 L731I723-A727 WeakPolarHBondContact O-CB 3.49Å; I723-A727 PolarHBondContact O-N 3.3Å; L724-A727 PolarHBondContact O-N 3.21Å; A727-H730 PolarHBondContact O-N 2.92Å; A727-L731 WeakPolarHBondContact O-CB 3.31Å; A727-L731 PolarHBondContact O-N 3.43Å
728V90.8Very high83.4Confident86 Ų86100 Ų10052%0.52150%0.5SS..Hα-helixtrans-65.5-37.9174.8170.60000111.4L724 Y725 L731 W732L724-V728 WeakPolarHBondContact O-CB 3.44Å; L724-V728 VanDerWaalsContact O-CG2 3.32Å; L724-V728 WeakPolarHBondContact O-CG2 3.07Å; L724-V728 PolarHBondContact O-N 2.9Å; Y725-V728 PolarHBondContact O-N 2.82Å; V728-L731 PolarHBondContact O-N 2.77Å; V728-W732 VanDerWaalsContact O-CB 3.29Å; V728-W732 WeakPolarHBondContact O-CB 3.42Å; V728-W732 PolarHBondContact O-N 3.25Å
729L90.6Very high83.2Confident62 Ų62103.3 Ų103.333%0.32552%0.518SS..Hα-helixtrans-65.8-46.4175.5-170161.6000111.2Y725 M726 W732 V733Y725-L729 HydrophobicContact CE1-CD1 3.89Å; Y725-L729 VanDerWaalsContact O-CB 3.27Å; Y725-L729 WeakPolarHBondContact O-CB 3.4Å; Y725-L729 PolarHBondContact O-N 3.46Å; M726-L729 PolarHBondContact O-N 3.22Å; L729-W732 PolarHBondContact O-N 3.23Å; L729-V733 HydrophobicContact CD2-CG2 4.07Å; L729-V733 WeakPolarHBondContact O-CG2 3.3Å; L729-V733 PolarHBondContact O-N 3.4Å
730H84Confident82.3Confident122 Ų122104.7 Ų104.757%0.56552%0.524SS*.Hα-helixtrans-64.6-39.8175.8-75.273.6000111.7M726 A727 W732 V733 M734M726-H730 PolarHBondContact O-N 2.95Å; M726-H730 PolarHBondContact O-ND1 3.14Å; A727-H730 PolarHBondContact O-N 2.92Å; H730-W732 VanDerWaalsContact C-N 3.34Å; H730-V733 PolarHBondContact O-N 2.83Å; H730-M734 VanDerWaalsContact O-CB 3.24Å; H730-M734 WeakPolarHBondContact O-CB 3.48Å; H730-M734 PolarHBondContact O-N 3.25Å
731L87.6Confident81Confident110 Ų110105 Ų10558%0.57653%0.531SS*.Hα-helixtrans-66.6-35175.1-175.3142.6000111.8A727 V728 M734 I735A727-L731 WeakPolarHBondContact O-CB 3.31Å; A727-L731 PolarHBondContact O-N 3.43Å; V728-L731 PolarHBondContact O-N 2.77Å; L731-M734 PolarHBondContact O-N 2.88Å; L731-I735 HydrophobicContact CD2-CD1 3.6Å; L731-I735 HydrophobicContact CD2-CG1 4.44Å; L731-I735 HydrophobicContact CG-CD1 4.44Å; L731-I735 WeakPolarHBondContact O-CB 3.49Å; L731-I735 VanDerWaalsContact O-CG1 3.25Å; L731-I735 WeakPolarHBondContact O-CG1 3.29Å; L731-I735 PolarHBondContact O-N 3.16Å
732W88.3Confident79.6Confident162 Ų162103.4 Ų103.461%0.61454%0.535SS*.Hα-helixtrans-66.6-46.3171.4178.383000112V728 L729 H730 M734 I735 V736V728-W732 VanDerWaalsContact O-CB 3.29Å; V728-W732 WeakPolarHBondContact O-CB 3.42Å; V728-W732 PolarHBondContact O-N 3.25Å; L729-W732 PolarHBondContact O-N 3.23Å; H730-W732 VanDerWaalsContact C-N 3.34Å; W732-M734 VanDerWaalsContact C-N 3.29Å; W732-M734 PolarHBondContact O-N 3.27Å; W732-I735 PolarHBondContact O-N 2.7Å; W732-V736 HydrophobicContact CD2-CG2 4.23Å; W732-V736 HydrophobicContact CH2-CG2 4.26Å; W732-V736 HydrophobicContact CZ2-CG2 3.94Å; W732-V736 WeakPolarHBondContact O-CG2 3.41Å; W732-V736 PolarHBondContact O-N 2.94Å
733V84.3Confident77.8Confident58 Ų58108.7 Ų108.735%0.35256%0.555SS.*Hα-helixtrans-60.7-39.3174.21710000111.2L729 H730 V736 L737L729-V733 HydrophobicContact CD2-CG2 4.07Å; L729-V733 WeakPolarHBondContact O-CG2 3.3Å; L729-V733 PolarHBondContact O-N 3.4Å; H730-V733 PolarHBondContact O-N 2.83Å; V733-V736 PolarHBondContact O-N 3.3Å; V733-L737 HydrophobicContact CG1-CD1 4Å; V733-L737 WeakPolarHBondContact O-CG 3.19Å; V733-L737 PolarHBondContact O-N 2.76Å
734M79.8Confident76Confident107 Ų107112.3 Ų112.353%0.52757%0.572SS.*Hα-helixtrans-72.6-35.8179.5-159.4-94175.300112H730 L731 W732 L737 L738H730-M734 VanDerWaalsContact O-CB 3.24Å; H730-M734 WeakPolarHBondContact O-CB 3.48Å; H730-M734 PolarHBondContact O-N 3.25Å; L731-M734 PolarHBondContact O-N 2.88Å; W732-M734 VanDerWaalsContact C-N 3.29Å; W732-M734 PolarHBondContact O-N 3.27Å; M734-L737 PolarHBondContact O-N 3.24Å; M734-L738 HydrophobicContact CE-CD1 3.65Å; M734-L738 HydrophobicContact CE-CD2 4.27Å; M734-L738 HydrophobicContact CE-CG 3.95Å; M734-L738 WeakPolarHBondContact O-CB 3.41Å; M734-L738 WeakPolarHBondContact O-CG 3.47Å; M734-L738 PolarHBondContact O-N 2.81Å; M734-L738 HydrophobicContact SD-CD1 3.5Å; M734-L738 WeakPolarHBondContact SD-CD1 3.35Å; M734-L738 HydrophobicContact SD-CG 3.97Å
735I83Confident74.1Confident82 Ų82115.7 Ų115.742%0.42159%0.585SS.*Hα-helixtrans-60.7-46.9166.6-76.1169.9000110.7L731 W732 L737 L738 T739L731-I735 HydrophobicContact CD2-CD1 3.6Å; L731-I735 HydrophobicContact CD2-CG1 4.44Å; L731-I735 HydrophobicContact CG-CD1 4.44Å; L731-I735 WeakPolarHBondContact O-CB 3.49Å; L731-I735 VanDerWaalsContact O-CG1 3.25Å; L731-I735 WeakPolarHBondContact O-CG1 3.29Å; L731-I735 PolarHBondContact O-N 3.16Å; W732-I735 PolarHBondContact O-N 2.7Å; I735-L737 VanDerWaalsContact C-N 3.35Å; I735-L737 PolarHBondContact O-N 3.48Å; I735-L738 PolarHBondContact O-N 2.72Å; I735-T739 HydrophobicContact CG2-CG2 4.2Å; I735-T739 WeakPolarHBondContact O-CB 3.46Å; I735-T739 WeakPolarHBondContact O-CG2 3.44Å; I735-T739 PolarHBondContact O-N 2.8Å; I735-T739 PolarHBondContact O-OG1 3.29Å
736V83.4Confident72Confident53 Ų53112 Ų11232%0.32159%0.594SS.*Hα-helixtrans-59.1-46.1177169.40000110.5W732 V733 L738 T739 Y740W732-V736 HydrophobicContact CD2-CG2 4.23Å; W732-V736 HydrophobicContact CH2-CG2 4.26Å; W732-V736 HydrophobicContact CZ2-CG2 3.94Å; W732-V736 WeakPolarHBondContact O-CG2 3.41Å; W732-V736 PolarHBondContact O-N 2.94Å; V733-V736 PolarHBondContact O-N 3.3Å; V736-L738 VanDerWaalsContact C-N 3.33Å; V736-L738 PolarHBondContact O-N 3.3Å; V736-T739 PolarHBondContact O-N 3.44Å; V736-Y740 WeakPolarHBondContact O-CB 3.37Å; V736-Y740 PolarHBondContact O-N 2.73Å
737L77.1Confident69.9Low130 Ų130112.8 Ų112.868%0.68161%0.609SS**Hα-helixtrans-66.1-28.9177.5-73.5167.7000114.2V733 M734 I735V733-L737 HydrophobicContact CG1-CD1 4Å; V733-L737 WeakPolarHBondContact O-CG 3.19Å; V733-L737 PolarHBondContact O-N 2.76Å; M734-L737 PolarHBondContact O-N 3.24Å; I735-L737 VanDerWaalsContact C-N 3.35Å; I735-L737 PolarHBondContact O-N 3.48Å
738L71.9Confident68.7Low116 Ų116115.9 Ų115.961%0.60762%0.624SS**Hα-helixtrans-83.9-27.3174.6-75.3-178.6000113.8M734 I735 V736M734-L738 HydrophobicContact CE-CD1 3.65Å; M734-L738 HydrophobicContact CE-CD2 4.27Å; M734-L738 HydrophobicContact CE-CG 3.95Å; M734-L738 WeakPolarHBondContact O-CB 3.41Å; M734-L738 WeakPolarHBondContact O-CG 3.47Å; M734-L738 PolarHBondContact O-N 2.81Å; M734-L738 HydrophobicContact SD-CD1 3.5Å; M734-L738 WeakPolarHBondContact SD-CD1 3.35Å; M734-L738 HydrophobicContact SD-CG 3.97Å; I735-L738 PolarHBondContact O-N 2.72Å; V736-L738 VanDerWaalsContact C-N 3.33Å; V736-L738 PolarHBondContact O-N 3.3Å
739T71.6Confident66.7Low96 Ų96120 Ų12059%0.58964%0.644SS**Hα-helixtrans-96.2-24.5-177.1530000113I735 V736 T741I735-T739 HydrophobicContact CG2-CG2 4.2Å; I735-T739 WeakPolarHBondContact O-CB 3.46Å; I735-T739 WeakPolarHBondContact O-CG2 3.44Å; I735-T739 PolarHBondContact O-N 2.8Å; I735-T739 PolarHBondContact O-OG1 3.29Å; V736-T739 PolarHBondContact O-N 3.44Å; T739-T741 PolarHBondContact O-N 2.96Å
740Y61.7Low64.5Low193 Ų193120 Ų12076%0.75766%0.659SS**  trans-91.477.1163.7-95.7-92.8000110.6V736 P742V736-Y740 WeakPolarHBondContact O-CB 3.37Å; V736-Y740 PolarHBondContact O-N 2.73Å; Y740-P742 WeakPolarHBondContact O-CD 3.26Å
741T51.3Low62.3Low113 Ų113129.6 Ų129.669%0.69369%0.69SS**  trans-62.5122.2156.5480000108.4T739T739-T741 PolarHBondContact O-N 2.96Å
742P53.4Low61.1Low110 Ų110130.6 Ų130.671%0.71470%0.696SS**  trans-68.3136.7-178.227.2-34.1000111.1Y740 M744Y740-P742 WeakPolarHBondContact O-CD 3.26Å; P742-M744 PolarHBondContact O-N 2.87Å
743E43.7Very low59.6Low175 Ų175128.9 Ų128.982%0.81870%0.7SS**  trans-6893.3174.1-70.3-17014400110.7H745E743-H745 PolarHBondContact O-N 3.02Å; E743-H745 PolarHBondContact O-ND1 3.26Å
744M46Very low58.3Low176 Ų176132.9 Ų132.987%0.86772%0.72SS**  trans-52105.6170.5-77.2-76.5-72.300110P742 G746P742-M744 PolarHBondContact O-N 2.87Å; M744-G746 PolarHBondContact O-N 3Å; M744-G746 VanDerWaalsContact O-N 3.16Å
745H47.2Very low57Low170 Ų170134.4 Ų134.479%0.78773%0.731SS**  trans-63116.7174.1-76.434.3000109.2E743 S747E743-H745 PolarHBondContact O-N 3.02Å; E743-H745 PolarHBondContact O-ND1 3.26Å; H745-S747 PolarHBondContact O-N 3.01Å; H745-S747 VanDerWaalsContact O-N 3.16Å
746G45.7Very low55.4Low78 Ų78137.7 Ų137.780%0.80475%0.751SS**  trans-67.9109.2175.900000111M744M744-G746 PolarHBondContact O-N 3Å; M744-G746 VanDerWaalsContact O-N 3.16Å
747S39.3Very low53.5Low114 Ų114143.3 Ų143.380%0.79778%0.779SS**  trans-67.2135.3172.1-63.40000111H745H745-S747 PolarHBondContact O-N 3.01Å; H745-S747 VanDerWaalsContact O-N 3.16Å
748P62.8Low51.8Low120 Ų120144.3 Ų144.378%0.77979%0.786SS**  trans-83.6124.1174.132.5-31.9000111.2
749D47.4Very low50.3Low173 Ų173146.5 Ų146.593%0.92580%0.8SS**  trans-161.7155.1152.3-108.4-23.3000108.3
750G45.7Very low48.5Very low63 Ų63150.7 Ų150.765%0.64982%0.818SS**  cis148.84.60.300000115.5
751R37.7Very low47.3Very low323 Ų323146.8 Ų146.8100%1.21982%0.823SS**  trans-157.60175.5-117171.2-175.5179.51.1113.3

Retrieved 751 of 751 residues in 740.5 ms (Link to these results)