A0A061IM09_CRIGR Loading...

Pre-mRNA-splicing factor SPF27

AlphaFold DB , UniProt , Accession A0A061IM09, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Bcas2, Length 225 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.3Very low43.3Very low242 Ų242117.1 Ų117.1100%1.19278%0.78SS**  01100-70.5-150.1-79.700106.8G3M1-G3 PolarHBondContact O-N 3.15Å
2A35.1Very low44.9Very low105 Ų105118.4 Ų118.487%0.86878%0.782SS**  trans-62.7118.7-176.900000108.5T4A2-T4 PolarHBondContact O-N 3.05Å
3G38.3Very low47Very low69 Ų69118.5 Ų118.571%0.71178%0.778SS**  trans-56.3130.117100000108.6M1 G5M1-G3 PolarHBondContact O-N 3.15Å; G3-G5 PolarHBondContact O-N 3.23Å
4T43.7Very low49.3Very low139 Ų139118.8 Ų118.885%0.85377%0.769SS**  trans-50109.9162.443.70000107A2 L6A2-T4 PolarHBondContact O-N 3.05Å; T4-L6 PolarHBondContact O-N 3.29Å
5G40.3Very low51.6Low59 Ų59115.1 Ų115.161%0.60875%0.752SS**  trans-56.9128.3-177.300000109.4G3 V7G3-G5 PolarHBondContact O-N 3.23Å; G5-V7 PolarHBondContact O-N 3.04Å
6L43.8Very low54Low147 Ų147108.6 Ų108.677%0.7771%0.709SS**  trans-52.8111.7166.5-83.1106.4000107.7T4 E10T4-L6 PolarHBondContact O-N 3.29Å; L6-E10 VanDerWaalsContact CD2-OE2 3.24Å; L6-E10 WeakPolarHBondContact CD2-OE2 3.24Å; L6-E10 WeakPolarHBondContact CG-OE2 3.24Å
7V43.1Very low56.2Low110 Ų110106 Ų10667%0.66769%0.692SS**  trans-74.6128.5174-172.30000106.7G5 G9 E10G5-V7 PolarHBondContact O-N 3.04Å; V7-G9 PolarHBondContact O-N 3.14Å; V7-E10 PolarHBondContact O-N 3.07Å
8A38.1Very low58.1Low107 Ų107104.4 Ų104.488%0.88467%0.67SS**THydrogen-bonded Turntrans-53.3110.8178.100000110.3
9G49Very low59.8Low73 Ų73101.3 Ų101.375%0.75365%0.646SS**THydrogen-bonded Turntrans126.62.2-174.300000115.8V7 V11V7-G9 PolarHBondContact O-N 3.14Å; G9-V11 PolarHBondContact O-N 3.15Å
10E51.3Low61.3Low117 Ų117100.4 Ų100.455%0.54764%0.635SS.*  trans-63.293172.6-79.8-176.2-177.800111.4L6 V7 V12L6-E10 VanDerWaalsContact CD2-OE2 3.24Å; L6-E10 WeakPolarHBondContact CD2-OE2 3.24Å; L6-E10 WeakPolarHBondContact CG-OE2 3.24Å; V7-E10 PolarHBondContact O-N 3.07Å; E10-V12 PolarHBondContact O-N 3.35Å
11V56.8Low62.4Low120 Ų120103 Ų10373%0.72764%0.64SS**  trans-61.4115155.6178.20000105.7G9 V13G9-V11 PolarHBondContact O-N 3.15Å; V11-V13 VanDerWaalsContact C-N 3.28Å; V11-V13 HydrophobicContact CB-CG2 4.42Å; V11-V13 HydrophobicContact CG1-CG2 4Å; V11-V13 PolarHBondContact O-N 3.47Å
12V62.1Low64.7Low133 Ų13393.9 Ų93.981%0.80661%0.608SS**  trans-68.194.6170.7-179.80000106.6E10 D14E10-V12 PolarHBondContact O-N 3.35Å; V12-D14 PolarHBondContact O-N 2.9Å
13V71.9Confident66.9Low120 Ų12093.3 Ų93.373%0.72758%0.584SS**  trans-80.5105.8174.61800000107.1V11V11-V13 VanDerWaalsContact C-N 3.28Å; V11-V13 HydrophobicContact CB-CG2 4.42Å; V11-V13 HydrophobicContact CG1-CG2 4Å; V11-V13 PolarHBondContact O-N 3.47Å
14D79.1Confident69Low122 Ų12296.4 Ų96.465%0.65258%0.58SS**  trans-88.7124.2173.7-166.912.6000110.1V12 L16V12-D14 PolarHBondContact O-N 2.9Å; D14-L16 WeakPolarHBondContact OD1-CD2 3.43Å
15A83.6Confident71.2Confident63 Ų6391.9 Ų91.952%0.52156%0.557SS.*  trans-145.2132.8171.900000107.5P17A15-P17 WeakPolarHBondContact O-CD 3.31Å
16L90.6Very high73.6Confident12 Ų1295.5 Ų95.56%0.06357%0.569CS.*  trans-113.167.4-172.7-53.6177.9000112.5D14 Y18 F19 D20 Q171 A174 L178D14-L16 WeakPolarHBondContact OD1-CD2 3.43Å; L16-Y18 PolarHBondContact O-N 3.37Å; L16-F19 HydrophobicContact CB-CB 3.99Å; L16-F19 PolarHBondContact O-N 3Å; L16-D20 PolarHBondContact O-N 3.2Å; L16-Q171 HydrophobicContact CB-CB 4.36Å; L16-Q171 HydrophobicContact CB-CG 4.38Å; L16-Q171 HydrophobicContact CD2-CB 4.1Å; L16-Q171 HydrophobicContact CD2-CG 3.69Å; L16-A174 HydrophobicContact CD1-CB 4.45Å; L16-L178 HydrophobicContact CD1-CD1 3.75Å
17P90.6Very high75.8Confident64 Ų6490.3 Ų90.342%0.41655%0.551SS.*THydrogen-bonded Turntrans-52.9-28.3-176.8-28.331000116.8A15 Y23A15-P17 WeakPolarHBondContact O-CD 3.31Å; P17-Y23 HydrophobicContact CB-CE1 4.26Å
18Y91.4Very high78.1Confident77 Ų7788.2 Ų88.230%0.30254%0.539SS..THydrogen-bonded Turntrans-78.5-19176.7-73.9-66.9000113.5L16 N164 R167 K168 Q171L16-Y18 PolarHBondContact O-N 3.37Å; Y18-N164 WeakPolarHBondContact OH-CB 3.33Å; Y18-R167 HydrophobicContact CD2-CG 4.3Å; Y18-R167 HydrophobicContact CE2-CB 4.29Å; Y18-R167 HydrophobicContact CE2-CG 4.17Å; Y18-K168 HydrophobicContact CD1-CB 4.17Å; Y18-K168 HydrophobicContact CD1-CD 4.14Å; Y18-K168 HydrophobicContact CD1-CG 4.01Å; Y18-K168 HydrophobicContact CD2-CB 3.84Å; Y18-K168 HydrophobicContact CD2-CG 4.39Å; Y18-K168 HydrophobicContact CE1-CB 4.37Å; Y18-K168 HydrophobicContact CE1-CD 4.4Å; Y18-K168 HydrophobicContact CE2-CB 4.04Å; Y18-K168 HydrophobicContact CG-CB 3.92Å; Y18-K168 HydrophobicContact CG-CG 3.95Å; Y18-Q171 VanDerWaalsContact CB-OE1 3.3Å; Y18-Q171 VanDerWaalsContact CD2-OE1 3.32Å
19F90.6Very high80.6Confident46 Ų4690.2 Ų90.220%0.20252%0.524CS..THydrogen-bonded Turntrans-100.7-47.7177.9-175.5-98.5000111.6L16 Q21 L172 G175L16-F19 HydrophobicContact CB-CB 3.99Å; L16-F19 PolarHBondContact O-N 3Å; F19-Q21 PolarHBondContact O-N 3.49Å; F19-L172 HydrophobicContact CD2-CD2 4.3Å; F19-G175 VanDerWaalsContact CE2-CA 3.47Å; F19-G175 WeakPolarHBondContact CZ-O 3.17Å
20D89.1Confident82.7Confident82 Ų8292.8 Ų92.844%0.43952%0.516SS..  trans-7983.9-179.1-65.8-36.7000110.6L16 G22 Y23L16-D20 PolarHBondContact O-N 3.2Å; D20-G22 VanDerWaalsContact C-N 3.25Å; D20-G22 PolarHBondContact O-N 3.22Å; D20-Y23 WeakPolarHBondContact O-CD1 3.49Å; D20-Y23 WeakPolarHBondContact O-CE1 3.45Å
21Q85.6Confident84.8Confident156 Ų15689.9 Ų89.973%0.72951%0.512SS*.G310 helixtrans-79.1-8.3-178.6-63.6179.47.900113.7F19 Y23F19-Q21 PolarHBondContact O-N 3.49Å; Q21-Y23 VanDerWaalsContact C-N 3.3Å; Q21-Y23 PolarHBondContact O-N 2.89Å
22G83.7Confident86.5Confident51 Ų5186.6 Ų86.653%0.52650%0.497SS..G310 helixtrans-70.6-17.1-174.700000115.3D20 E24 A25D20-G22 VanDerWaalsContact C-N 3.25Å; D20-G22 PolarHBondContact O-N 3.22Å; G22-E24 PolarHBondContact O-N 3.3Å; G22-A25 VanDerWaalsContact O-CB 3.22Å; G22-A25 WeakPolarHBondContact O-CB 3.32Å; G22-A25 PolarHBondContact O-N 2.98Å; G22-A25 VanDerWaalsContact O-N 3.11Å
23Y81.6Confident88Confident92 Ų9283 Ų8336%0.36148%0.481SS..G310 helixtrans-72-13.9-179.971.2-96000113.8P17 D20 Q21 A25P17-Y23 HydrophobicContact CB-CE1 4.26Å; D20-Y23 WeakPolarHBondContact O-CD1 3.49Å; D20-Y23 WeakPolarHBondContact O-CE1 3.45Å; Q21-Y23 VanDerWaalsContact C-N 3.3Å; Q21-Y23 PolarHBondContact O-N 2.89Å; Y23-A25 VanDerWaalsContact C-N 3.31Å
24E82.8Confident89.1Confident134 Ų13479.8 Ų79.863%0.62647%0.468SS*.G310 helixtrans-86.5-3.8172.5-60.4-155.7144.800112.8G22 R29G22-E24 PolarHBondContact O-N 3.3Å; E24-R29 IonicContact OE1-NH2 3.49Å
25A89.1Confident89.8Confident45 Ų4580 Ų8037%0.37247%0.468SS..SBendtrans-62.1138.5175.300000110.5G22 Y23 G27 V28G22-A25 VanDerWaalsContact O-CB 3.22Å; G22-A25 WeakPolarHBondContact O-CB 3.32Å; G22-A25 PolarHBondContact O-N 2.98Å; G22-A25 VanDerWaalsContact O-N 3.11Å; Y23-A25 VanDerWaalsContact C-N 3.31Å; A25-G27 PolarHBondContact O-N 2.9Å; A25-V28 HydrophobicContact CB-CG2 3.91Å; A25-V28 PolarHBondContact O-N 2.97Å
26P90.8Very high90.3Very high134 Ų13481.4 Ų81.487%0.8747%0.47SS*.THydrogen-bonded Turntrans-54.4133.4179.2-25.233.5000111.7
27G90.8Very high90.4Very high38 Ų3887.6 Ų87.639%0.39250%0.499SS..THydrogen-bonded Turntrans91.4-17.7177.800000115.1A25 E30 A31A25-G27 PolarHBondContact O-N 2.9Å; G27-E30 WeakPolarHBondContact CA-OE2 3.33Å; G27-E30 PolarHBondContact N-OE2 3.05Å; G27-E30 VanDerWaalsContact N-OE2 3.08Å; G27-A31 VanDerWaalsContact O-CB 3.26Å; G27-A31 WeakPolarHBondContact O-CB 3.44Å; G27-A31 PolarHBondContact O-N 3.24Å
28V91.6Very high90.5Very high66 Ų6687.5 Ų87.540%0.449%0.493SS..Hα-helixtrans-70.8-42-178177.20000111.5A25 A31 A32A25-V28 HydrophobicContact CB-CG2 3.91Å; A25-V28 PolarHBondContact O-N 2.97Å; V28-A31 PolarHBondContact O-N 3.4Å; V28-A32 WeakPolarHBondContact O-CB 3.41Å; V28-A32 PolarHBondContact O-N 2.94Å
29R90.4Very high90.5Very high150 Ų15087.6 Ų87.657%0.56650%0.496SS*.Hα-helixtrans-67.5-40.1178.1-68.8-173.2-176.1176.93.5111.4E24 A32 A33E24-R29 IonicContact OE1-NH2 3.49Å; R29-A32 PolarHBondContact O-N 3.44Å; R29-A33 VanDerWaalsContact O-CB 3.3Å; R29-A33 WeakPolarHBondContact O-CB 3.41Å; R29-A33 PolarHBondContact O-N 2.89Å
30E94Very high90.4Very high126 Ų12689.3 Ų89.359%0.58951%0.51SS*.Hα-helixtrans-64.8-44.6177.3-63.778.8-175.700110.9G27 A33 A34G27-E30 WeakPolarHBondContact CA-OE2 3.33Å; G27-E30 PolarHBondContact N-OE2 3.05Å; G27-E30 VanDerWaalsContact N-OE2 3.08Å; E30-A33 PolarHBondContact O-N 3.43Å; E30-A34 WeakPolarHBondContact O-CB 3.44Å; E30-A34 PolarHBondContact O-N 3.33Å
31A93.8Very high90.4Very high56 Ų5694.2 Ų94.246%0.46352%0.523SS..Hα-helixtrans-62.6-45.2175.500000111.8G27 V28 A33 A34 L35G27-A31 VanDerWaalsContact O-CB 3.26Å; G27-A31 WeakPolarHBondContact O-CB 3.44Å; G27-A31 PolarHBondContact O-N 3.24Å; V28-A31 PolarHBondContact O-N 3.4Å; A31-A33 PolarHBondContact O-N 2.93Å; A31-A34 PolarHBondContact O-N 3.17Å; A31-L35 WeakPolarHBondContact O-CG 3.43Å; A31-L35 PolarHBondContact O-N 3.36Å; A31-L35 VanDerWaalsContact O-N 3.09Å
32A93.2Very high90.5Very high51 Ų5194.2 Ų94.242%0.42152%0.516SS..Hα-helixtrans-61.9-43.5176.300000111.7V28 R29 L35 V36V28-A32 WeakPolarHBondContact O-CB 3.41Å; V28-A32 PolarHBondContact O-N 2.94Å; R29-A32 PolarHBondContact O-N 3.44Å; A32-L35 PolarHBondContact O-N 3.46Å; A32-V36 WeakPolarHBondContact O-CG2 3.46Å; A32-V36 PolarHBondContact O-N 2.9Å
33A93.8Very high90.3Very high57 Ų5799.9 Ų99.947%0.47152%0.523SS..Hα-helixtrans-62.4-42.3176.900000112.1R29 E30 A31 L35 V36 E37R29-A33 VanDerWaalsContact O-CB 3.3Å; R29-A33 WeakPolarHBondContact O-CB 3.41Å; R29-A33 PolarHBondContact O-N 2.89Å; E30-A33 PolarHBondContact O-N 3.43Å; A31-A33 PolarHBondContact O-N 2.93Å; A33-L35 VanDerWaalsContact C-N 3.32Å; A33-L35 PolarHBondContact O-N 2.97Å; A33-V36 PolarHBondContact O-N 3.48Å; A33-E37 WeakPolarHBondContact O-CB 3.42Å; A33-E37 PolarHBondContact O-N 2.95Å
34A95.1Very high90Very high54 Ų54105.9 Ų105.945%0.44655%0.545SS..Hα-helixtrans-62.4-38.5176.900000112.4E30 A31 E37 E38E30-A34 WeakPolarHBondContact O-CB 3.44Å; E30-A34 PolarHBondContact O-N 3.33Å; A31-A34 PolarHBondContact O-N 3.17Å; A34-E37 PolarHBondContact O-N 3.22Å; A34-E38 PolarHBondContact O-N 2.83Å
35L94.3Very high89.8Confident125 Ų125105 Ų10565%0.65455%0.551SS**Hα-helixtrans-66.4-42.4174.3-67.8173.9000111.9A31 A32 A33 E37 E38 E39A31-L35 WeakPolarHBondContact O-CG 3.43Å; A31-L35 PolarHBondContact O-N 3.36Å; A31-L35 VanDerWaalsContact O-N 3.09Å; A32-L35 PolarHBondContact O-N 3.46Å; A33-L35 VanDerWaalsContact C-N 3.32Å; A33-L35 PolarHBondContact O-N 2.97Å; L35-E37 VanDerWaalsContact C-N 3.32Å; L35-E37 PolarHBondContact O-N 3.34Å; L35-E38 PolarHBondContact O-N 3.48Å; L35-E39 PolarHBondContact O-N 3.48Å; L35-E39 VanDerWaalsContact O-N 3.11Å
36V92.6Very high89.1Confident93 Ų93109.6 Ų109.656%0.56457%0.574SS**Hα-helixtrans-62.2-40.9175.1171.90000111A32 A33 E39 T40A32-V36 WeakPolarHBondContact O-CG2 3.46Å; A32-V36 PolarHBondContact O-N 2.9Å; A33-V36 PolarHBondContact O-N 3.48Å; V36-E39 PolarHBondContact O-N 3.48Å; V36-T40 WeakPolarHBondContact O-CB 3.22Å; V36-T40 PolarHBondContact O-N 3.33Å; V36-T40 PolarHBondContact O-OG1 3Å
37E92.6Very high88.6Confident142 Ų142111.6 Ų111.666%0.66457%0.569SS**Hα-helixtrans-65.4-44.9178.3-174175.6-167.500112.1A33 A34 L35 E39 T40 R41A33-E37 WeakPolarHBondContact O-CB 3.42Å; A33-E37 PolarHBondContact O-N 2.95Å; A34-E37 PolarHBondContact O-N 3.22Å; L35-E37 VanDerWaalsContact C-N 3.32Å; L35-E37 PolarHBondContact O-N 3.34Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.18Å; E37-T40 PolarHBondContact O-N 2.94Å; E37-R41 PolarHBondContact O-N 2.91Å
38E93.7Very high88.1Confident62 Ų62114.6 Ų114.629%0.2958%0.576SS.*Hα-helixtrans-61.8-40.4177.1178.859.2-160.400111.6A34 L35 R41 R42A34-E38 PolarHBondContact O-N 2.83Å; L35-E38 PolarHBondContact O-N 3.48Å; E38-R41 WeakPolarHBondContact O-CB 3.42Å; E38-R41 PolarHBondContact O-N 3.09Å; E38-R41 IonicContact OE1-NH2 3.3Å; E38-R41 PolarHBondContact OE1-NH2 3.39Å; E38-R41 IonicContact OE2-CZ 3.77Å; E38-R41 IonicContact OE2-NE 2.97Å; E38-R41 PolarHBondContact OE2-NE 3.48Å; E38-R41 IonicContact OE2-NH2 3.18Å; E38-R41 PolarHBondContact OE2-NH2 3.31Å; E38-R42 WeakPolarHBondContact O-CG 3.48Å; E38-R42 PolarHBondContact O-N 3.04Å; E38-R42 IonicContact OE1-CZ 2.69Å; E38-R42 IonicContact OE1-NE 3.15Å; E38-R42 PolarHBondContact OE1-NE 3.23Å; E38-R42 IonicContact OE1-NH2 2.96Å; E38-R42 PolarHBondContact OE1-NH2 2.91Å
39E90.7Very high87.6Confident80 Ų80120.1 Ų120.137%0.37459%0.591SS.*Hα-helixtrans-68.1-39174.3-72.7-57.8129.200112.2L35 V36 E37 R41 R42 Y43L35-E39 PolarHBondContact O-N 3.48Å; L35-E39 VanDerWaalsContact O-N 3.11Å; V36-E39 PolarHBondContact O-N 3.48Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.18Å; E39-R41 PolarHBondContact O-N 2.86Å; E39-R42 PolarHBondContact O-N 3.41Å; E39-R42 VanDerWaalsContact O-N 3.14Å; E39-R42 IonicContact OE1-CZ 3.37Å; E39-R42 IonicContact OE1-NH1 2.97Å; E39-R42 PolarHBondContact OE1-NH1 3.03Å; E39-Y43 PolarHBondContact O-N 3.47Å; E39-Y43 WeakPolarHBondContact OE2-CE2 3.38Å
40T88.1Confident87.3Confident82 Ų82116.5 Ų116.550%0.50358%0.583SS.*Hα-helixtrans-64.6-30.9174.9-55.30000111.6V36 E37 Y43V36-T40 WeakPolarHBondContact O-CB 3.22Å; V36-T40 PolarHBondContact O-N 3.33Å; V36-T40 PolarHBondContact O-OG1 3Å; E37-T40 PolarHBondContact O-N 2.94Å; T40-Y43 CarbonylContact O-C 3.54Å; T40-Y43 VanDerWaalsContact O-O 3.09Å
41R89Confident86.9Confident185 Ų185115 Ų11570%0.69859%0.586SS**Hα-helixtrans-68.8-34.9174.5-164.8177.672.1143.50.7112.2E37 E38 E39E37-R41 PolarHBondContact O-N 2.91Å; E38-R41 WeakPolarHBondContact O-CB 3.42Å; E38-R41 PolarHBondContact O-N 3.09Å; E38-R41 IonicContact OE1-NH2 3.3Å; E38-R41 PolarHBondContact OE1-NH2 3.39Å; E38-R41 IonicContact OE2-CZ 3.77Å; E38-R41 IonicContact OE2-NE 2.97Å; E38-R41 PolarHBondContact OE2-NE 3.48Å; E38-R41 IonicContact OE2-NH2 3.18Å; E38-R41 PolarHBondContact OE2-NH2 3.31Å; E39-R41 PolarHBondContact O-N 2.86Å
42R88.3Confident86.5Confident155 Ų155120.6 Ų120.659%0.58560%0.596SS**Hα-helixtrans-77.6-42.8179-67.7168.2-174.8-172.4-3.3111.9E38 E39E38-R42 WeakPolarHBondContact O-CG 3.48Å; E38-R42 PolarHBondContact O-N 3.04Å; E38-R42 IonicContact OE1-CZ 2.69Å; E38-R42 IonicContact OE1-NE 3.15Å; E38-R42 PolarHBondContact OE1-NE 3.23Å; E38-R42 IonicContact OE1-NH2 2.96Å; E38-R42 PolarHBondContact OE1-NH2 2.91Å; E39-R42 PolarHBondContact O-N 3.41Å; E39-R42 VanDerWaalsContact O-N 3.14Å; E39-R42 IonicContact OE1-CZ 3.37Å; E39-R42 IonicContact OE1-NH1 2.97Å; E39-R42 PolarHBondContact OE1-NH1 3.03Å
43Y80.3Confident86.2Confident170 Ų170122.5 Ų122.567%0.66760%0.599SS**SBendtrans-102.997.5-179.8-67.5-75.7000111E39 T40 P45E39-Y43 PolarHBondContact O-N 3.47Å; E39-Y43 WeakPolarHBondContact OE2-CE2 3.38Å; T40-Y43 CarbonylContact O-C 3.54Å; T40-Y43 VanDerWaalsContact O-O 3.09Å; Y43-P45 WeakPolarHBondContact O-CD 3.35Å
44R75.5Confident85.8Confident218 Ų218126.2 Ų126.282%0.82362%0.616SS**  trans-67.6125.7167.6-67.3-167.5-178.2-157.81.1109.3T46R44-T46 PolarHBondContact O-N 2.94Å; R44-T46 VanDerWaalsContact O-N 3.12Å
45P78Confident85.3Confident116 Ų116127.6 Ų127.675%0.75363%0.627SS**  trans-56.8119.3179-24.733.5000111.2Y43Y43-P45 WeakPolarHBondContact O-CD 3.35Å
46T74.1Confident85Confident141 Ų141125.4 Ų125.487%0.86562%0.621SS**  trans-91.9-19.7178.744.10000113R44R44-T46 PolarHBondContact O-N 2.94Å; R44-T46 VanDerWaalsContact O-N 3.12Å
47K80.2Confident84.9Confident177 Ų177125.6 Ų125.677%0.7762%0.618SS**SBendtrans-121.7131.2176.6-67.8-176.1179.9-179.70110Y49K47-Y49 PolarHBondContact O-N 3.24Å
48N81.3Confident84.4Confident100 Ų100128.4 Ų128.454%0.53563%0.625SS.*  trans-70.6110.1167.8-176.7-4.9000108.2L50 S51N48-L50 PolarHBondContact O-N 3.36Å; N48-L50 VanDerWaalsContact O-N 3.15Å; N48-L50 WeakPolarHBondContact OD1-CA 3.32Å; N48-L50 WeakPolarHBondContact OD1-CB 3.26Å; N48-L50 PolarHBondContact OD1-N 3.49Å; N48-S51 VanDerWaalsContact O-CB 3.24Å; N48-S51 WeakPolarHBondContact O-CB 3.48Å; N48-S51 PolarHBondContact O-N 2.9Å; N48-S51 PolarHBondContact O-OG 3.26Å
49Y80.3Confident84.1Confident183 Ų183127.7 Ų127.772%0.71863%0.626SS**THydrogen-bonded Turntrans-64.1-15.7178.467.9-86.3000112.4K47 Y52K47-Y49 PolarHBondContact O-N 3.24Å; Y49-Y52 WeakPolarHBondContact O-CD1 3.46Å; Y49-Y52 WeakPolarHBondContact O-CE1 3.39Å
50L84.4Confident83.9Confident74 Ų74126.6 Ų126.639%0.38763%0.631SS.*THydrogen-bonded Turntrans-91.42.6174.4-55.4173.5000113.3N48 Y52 L53N48-L50 PolarHBondContact O-N 3.36Å; N48-L50 VanDerWaalsContact O-N 3.15Å; N48-L50 WeakPolarHBondContact OD1-CA 3.32Å; N48-L50 WeakPolarHBondContact OD1-CB 3.26Å; N48-L50 PolarHBondContact OD1-N 3.49Å; L50-Y52 PolarHBondContact O-N 2.9Å; L50-Y52 VanDerWaalsContact O-N 3.15Å; L50-L53 HydrophobicContact CB-CD1 4.43Å; L50-L53 HydrophobicContact CD2-CD1 3.82Å; L50-L53 WeakPolarHBondContact O-CB 3.29Å; L50-L53 PolarHBondContact O-N 2.91Å
51S85.5Confident84Confident93 Ų93131.8 Ų131.865%0.6565%0.647SS**THydrogen-bonded Turntrans-63.2-20.2-176.954.20000114.6N48 L53N48-S51 VanDerWaalsContact O-CB 3.24Å; N48-S51 WeakPolarHBondContact O-CB 3.48Å; N48-S51 PolarHBondContact O-N 2.9Å; N48-S51 PolarHBondContact O-OG 3.26Å; S51-L53 VanDerWaalsContact C-N 3.27Å
52Y85.9Confident84.1Confident174 Ų174125.5 Ų125.568%0.68263%0.625SS**THydrogen-bonded Turntrans-76.7-15.3173.572.6-91.6000112.9Y49 L50Y49-Y52 WeakPolarHBondContact O-CD1 3.46Å; Y49-Y52 WeakPolarHBondContact O-CE1 3.39Å; L50-Y52 PolarHBondContact O-N 2.9Å; L50-Y52 VanDerWaalsContact O-N 3.15Å
53L85.6Confident84.3Confident91 Ų91121.8 Ų121.848%0.47662%0.62SS.*SBendtrans-88.8133.7176.5-62.6173.2000109.1L50 S51 A55L50-L53 HydrophobicContact CB-CD1 4.43Å; L50-L53 HydrophobicContact CD2-CD1 3.82Å; L50-L53 WeakPolarHBondContact O-CB 3.29Å; L50-L53 PolarHBondContact O-N 2.91Å; S51-L53 VanDerWaalsContact C-N 3.27Å; L53-A55 PolarHBondContact O-N 2.83Å
54T86.3Confident84.8Confident135 Ų135119.6 Ų119.683%0.82862%0.62SS**PPolyproline II helixtrans-59136.8168-49.20000109.1
55A85.5Confident85.7Confident83 Ų83115.3 Ų115.369%0.68661%0.612SS**PPolyproline II helixtrans-55.8128.9172.600000109L53 D57L53-A55 PolarHBondContact O-N 2.83Å; A55-D57 PolarHBondContact O-N 3.41Å
56P87.3Confident86.4Confident80 Ų80113.7 Ų113.752%0.51960%0.596SS.*PPolyproline II helixtrans-61.7126.8179.923.4-32.1000109.6Y58P56-Y58 HydrophobicContact CB-CE1 4.4Å; P56-Y58 HydrophobicContact CB-CE2 4.27Å; P56-Y58 HydrophobicContact CG-CD2 4.49Å; P56-Y58 HydrophobicContact CG-CE1 4.22Å; P56-Y58 HydrophobicContact CG-CE2 3.66Å; P56-Y58 VanDerWaalsContact CG-CZ 3.48Å; P56-Y58 WeakPolarHBondContact CG-OH 3.43Å; P56-Y58 VanDerWaalsContact O-CD2 3.31Å; P56-Y58 WeakPolarHBondContact O-CD2 3.36Å; P56-Y58 PolarHBondContact O-N 3.48Å
57D89.3Confident87.2Confident96 Ų96111.2 Ų111.251%0.51357%0.57SS.*  trans-78.998.5169.1179.18.1000108.6A55 S59 A60A55-D57 PolarHBondContact O-N 3.41Å; D57-S59 PolarHBondContact O-N 3.24Å; D57-S59 WeakPolarHBondContact OD1-CA 3.48Å; D57-S59 WeakPolarHBondContact OD1-CB 3.38Å; D57-S59 PolarHBondContact OD1-N 2.97Å; D57-S59 PolarHBondContact OD1-OG 2.93Å; D57-A60 HydrophobicContact CB-CB 4.05Å; D57-A60 WeakPolarHBondContact O-CB 3.46Å; D57-A60 PolarHBondContact O-N 3.49Å; D57-A60 PolarHBondContact OD1-N 2.86Å
58Y83.6Confident87.7Confident202 Ų202107.4 Ų107.479%0.79256%0.558SS**THydrogen-bonded Turntrans-67.7-15.3177.6-64.4-77000113P56P56-Y58 HydrophobicContact CB-CE1 4.4Å; P56-Y58 HydrophobicContact CB-CE2 4.27Å; P56-Y58 HydrophobicContact CG-CD2 4.49Å; P56-Y58 HydrophobicContact CG-CE1 4.22Å; P56-Y58 HydrophobicContact CG-CE2 3.66Å; P56-Y58 VanDerWaalsContact CG-CZ 3.48Å; P56-Y58 WeakPolarHBondContact CG-OH 3.43Å; P56-Y58 VanDerWaalsContact O-CD2 3.31Å; P56-Y58 WeakPolarHBondContact O-CD2 3.36Å; P56-Y58 PolarHBondContact O-N 3.48Å
59S86.3Confident88.2Confident46 Ų46106.1 Ų106.132%0.32255%0.549SS..THydrogen-bonded Turntrans-96.9-0.717868.70000113.9D57 F61 E62D57-S59 PolarHBondContact O-N 3.24Å; D57-S59 WeakPolarHBondContact OD1-CA 3.48Å; D57-S59 WeakPolarHBondContact OD1-CB 3.38Å; D57-S59 PolarHBondContact OD1-N 2.97Å; D57-S59 PolarHBondContact OD1-OG 2.93Å; S59-F61 PolarHBondContact O-N 3.34Å; S59-E62 VanDerWaalsContact CB-OE2 3.28Å; S59-E62 WeakPolarHBondContact CB-OE2 3.35Å; S59-E62 WeakPolarHBondContact O-CB 3.49Å; S59-E62 PolarHBondContact O-N 3.43Å
60A87.7Confident88.8Confident58 Ų58102.2 Ų102.248%0.47954%0.536SS..THydrogen-bonded Turntrans-57.6-28.3-173.800000114D57D57-A60 HydrophobicContact CB-CB 4.05Å; D57-A60 WeakPolarHBondContact O-CB 3.46Å; D57-A60 PolarHBondContact O-N 3.49Å; D57-A60 PolarHBondContact OD1-N 2.86Å
61F88.8Confident89.2Confident190 Ų190104.3 Ų104.383%0.83354%0.544SS*.THydrogen-bonded Turntrans-109.48.2179.5-55.3-74.8000113S59 T63S59-F61 PolarHBondContact O-N 3.34Å; F61-T63 PolarHBondContact O-N 2.9Å
62E91.5Very high89.6Confident53 Ų53102.1 Ų102.125%0.24852%0.521CS..  trans-73.5114.3175.1-70.9177.5177.300109.9S59 R67 F70S59-E62 VanDerWaalsContact CB-OE2 3.28Å; S59-E62 WeakPolarHBondContact CB-OE2 3.35Å; S59-E62 WeakPolarHBondContact O-CB 3.49Å; S59-E62 PolarHBondContact O-N 3.43Å; E62-R67 IonicContact OE2-CZ 2.7Å; E62-R67 IonicContact OE2-NH1 3.63Å; E62-R67 PolarHBondContact OE2-NH1 3.45Å; E62-R67 IonicContact OE2-NH2 2.79Å; E62-F70 HydrophobicContact CG-CE2 4.08Å
63T92.2Very high89.9Confident78 Ų7898.7 Ų98.748%0.47951%0.514SS..  trans-73.7159.2164.962.50000110.1F61 I65 M66 R67F61-T63 PolarHBondContact O-N 2.9Å; T63-I65 PolarHBondContact O-N 2.95Å; T63-I65 VanDerWaalsContact O-N 3.15Å; T63-M66 WeakPolarHBondContact O-CB 3.48Å; T63-M66 PolarHBondContact O-N 3.33Å; T63-M66 WeakPolarHBondContact OG1-CG 3.45Å; T63-M66 PolarHBondContact OG1-N 2.87Å; T63-R67 PolarHBondContact O-N 3.27Å
64D92.1Very high90.3Very high123 Ų12398.5 Ų98.566%0.65853%0.526SS*.Hα-helixtrans-56-34.2177.9-61.9-36000112.5R67 N68D64-R67 PolarHBondContact O-N 2.84Å; D64-N68 VanDerWaalsContact O-CG 3.24Å; D64-N68 PolarHBondContact O-N 2.96Å; D64-N68 PolarHBondContact O-ND2 3.18Å
65I92.9Very high90.7Very high128 Ų12895 Ų9566%0.65651%0.511SS*.Hα-helixtrans-64.4-45175.4-59.8174.8000110.7T63 R67 N68 E69T63-I65 PolarHBondContact O-N 2.95Å; T63-I65 VanDerWaalsContact O-N 3.15Å; I65-R67 VanDerWaalsContact C-N 3.33Å; I65-R67 PolarHBondContact O-N 2.97Å; I65-N68 PolarHBondContact O-N 3.3Å; I65-E69 WeakPolarHBondContact O-CG 3.33Å; I65-E69 PolarHBondContact O-N 2.97Å
66M93.1Very high91.1Very high83 Ų83101.7 Ų101.741%0.40952%0.518SS..Hα-helixtrans-64.4-40.7178.1-68.8171.770.200111.4T63 E69 F70T63-M66 WeakPolarHBondContact O-CB 3.48Å; T63-M66 PolarHBondContact O-N 3.33Å; T63-M66 WeakPolarHBondContact OG1-CG 3.45Å; T63-M66 PolarHBondContact OG1-N 2.87Å; M66-E69 PolarHBondContact O-N 2.89Å; M66-F70 HydrophobicContact CB-CD2 4.49Å; M66-F70 HydrophobicContact CB-CE2 4.14Å; M66-F70 HydrophobicContact CE-CE2 4.28Å; M66-F70 HydrophobicContact CE-CZ 4.26Å; M66-F70 WeakPolarHBondContact O-CD2 3.49Å; M66-F70 VanDerWaalsContact O-CG 3.27Å; M66-F70 WeakPolarHBondContact O-CG 3.31Å; M66-F70 PolarHBondContact O-N 3.24Å
67R91.3Very high91.4Very high88 Ų88103.4 Ų103.433%0.33252%0.519SS..Hα-helixtrans-59.6-48.7177.1-166.6-179.6-52-63.9-8.2111.3E62 T63 D64 I65 E69 F70 E71E62-R67 IonicContact OE2-CZ 2.7Å; E62-R67 IonicContact OE2-NH1 3.63Å; E62-R67 PolarHBondContact OE2-NH1 3.45Å; E62-R67 IonicContact OE2-NH2 2.79Å; T63-R67 PolarHBondContact O-N 3.27Å; D64-R67 PolarHBondContact O-N 2.84Å; I65-R67 VanDerWaalsContact C-N 3.33Å; I65-R67 PolarHBondContact O-N 2.97Å; R67-E69 VanDerWaalsContact C-N 3.33Å; R67-E69 PolarHBondContact O-N 3.14Å; R67-F70 PolarHBondContact O-N 3.35Å; R67-E71 WeakPolarHBondContact O-CG 3.23Å; R67-E71 PolarHBondContact O-N 3.33Å
68N91.5Very high91.5Very high97 Ų97104.6 Ų104.652%0.51953%0.532SS..Hα-helixtrans-60.5-40.9176.7-69.1-12.8000112.2D64 I65 E71 R72D64-N68 VanDerWaalsContact O-CG 3.24Å; D64-N68 PolarHBondContact O-N 2.96Å; D64-N68 PolarHBondContact O-ND2 3.18Å; I65-N68 PolarHBondContact O-N 3.3Å; N68-E71 PolarHBondContact O-N 2.97Å; N68-R72 WeakPolarHBondContact O-CB 3.43Å; N68-R72 PolarHBondContact O-N 3.12Å
69E91.4Very high91.8Very high74 Ų74100 Ų10035%0.34652%0.52SS..Hα-helixtrans-67-38.5176.3-76.5-60.5138.300112.6I65 M66 R67 R72 L73I65-E69 WeakPolarHBondContact O-CG 3.33Å; I65-E69 PolarHBondContact O-N 2.97Å; M66-E69 PolarHBondContact O-N 2.89Å; R67-E69 VanDerWaalsContact C-N 3.33Å; R67-E69 PolarHBondContact O-N 3.14Å; E69-R72 PolarHBondContact O-N 3Å; E69-R72 IonicContact OE1-NE 2.75Å; E69-R72 IonicContact OE2-CZ 3.28Å; E69-R72 IonicContact OE2-NE 3.63Å; E69-R72 PolarHBondContact OE2-NE 3.15Å; E69-R72 IonicContact OE2-NH2 3.46Å; E69-R72 PolarHBondContact OE2-NH2 3.19Å; E69-L73 WeakPolarHBondContact O-CB 3.38Å; E69-L73 WeakPolarHBondContact O-CG 3.5Å; E69-L73 PolarHBondContact O-N 3.15Å
70F91.8Very high91.7Very high100 Ų100106.6 Ų106.644%0.43955%0.546SS..Hα-helixtrans-65.6-40.5174.2-68.1-39.7000112E62 M66 R67 L73 A74E62-F70 HydrophobicContact CG-CE2 4.08Å; M66-F70 HydrophobicContact CB-CD2 4.49Å; M66-F70 HydrophobicContact CB-CE2 4.14Å; M66-F70 HydrophobicContact CE-CE2 4.28Å; M66-F70 HydrophobicContact CE-CZ 4.26Å; M66-F70 WeakPolarHBondContact O-CD2 3.49Å; M66-F70 VanDerWaalsContact O-CG 3.27Å; M66-F70 WeakPolarHBondContact O-CG 3.31Å; M66-F70 PolarHBondContact O-N 3.24Å; R67-F70 PolarHBondContact O-N 3.35Å; F70-L73 PolarHBondContact O-N 2.7Å; F70-A74 VanDerWaalsContact O-CB 3.32Å; F70-A74 WeakPolarHBondContact O-CB 3.42Å; F70-A74 PolarHBondContact O-N 3.38Å
71E92.9Very high91.6Very high119 Ų119110.8 Ų110.856%0.55656%0.56SS**Hα-helixtrans-62.2-44.5173.2-73.5178.3-171.700111.7R67 N68 L73 A74 A75R67-E71 WeakPolarHBondContact O-CG 3.23Å; R67-E71 PolarHBondContact O-N 3.33Å; N68-E71 PolarHBondContact O-N 2.97Å; E71-L73 PolarHBondContact O-N 2.87Å; E71-A74 PolarHBondContact O-N 2.88Å; E71-A75 WeakPolarHBondContact O-CB 3.28Å; E71-A75 PolarHBondContact O-N 3.32Å
72R94.4Very high91.2Very high47 Ų47107.7 Ų107.718%0.17755%0.551CS.*Hα-helixtrans-57.8-47.1174.8-174.1-172.565.889.7-6.2111.6N68 E69 A75 R76 Q77 P78N68-R72 WeakPolarHBondContact O-CB 3.43Å; N68-R72 PolarHBondContact O-N 3.12Å; E69-R72 PolarHBondContact O-N 3Å; E69-R72 IonicContact OE1-NE 2.75Å; E69-R72 IonicContact OE2-CZ 3.28Å; E69-R72 IonicContact OE2-NE 3.63Å; E69-R72 PolarHBondContact OE2-NE 3.15Å; E69-R72 IonicContact OE2-NH2 3.46Å; E69-R72 PolarHBondContact OE2-NH2 3.19Å; R72-A75 CarbonylContact O-C 3.51Å; R72-A75 PolarHBondContact O-N 3.2Å; R72-R76 PolarHBondContact O-N 3.46Å; R72-R76 VanDerWaalsContact O-N 3.11Å; R72-Q77 HydrophobicContact CG-CB 3.65Å; R72-Q77 PolarHBondContact NH1-O 3.35Å; R72-Q77 PolarHBondContact O-N 2.71Å; R72-P78 VanDerWaalsContact NH1-C 3.31Å
73L93.1Very high90.5Very high102 Ų102108.8 Ų108.853%0.53456%0.564SS.*Hα-helixtrans-64.4-42.6177.5-74.5173.4000112E69 F70 E71 A75 R76E69-L73 WeakPolarHBondContact O-CB 3.38Å; E69-L73 WeakPolarHBondContact O-CG 3.5Å; E69-L73 PolarHBondContact O-N 3.15Å; F70-L73 PolarHBondContact O-N 2.7Å; E71-L73 PolarHBondContact O-N 2.87Å; L73-A75 VanDerWaalsContact C-N 3.3Å; L73-A75 PolarHBondContact O-N 2.87Å; L73-R76 WeakPolarHBondContact O-CA 3.24Å; L73-R76 PolarHBondContact O-N 2.87Å
74A93.3Very high90Very high87 Ų87110.4 Ų110.472%0.71957%0.568SS**Hα-helixtrans-62.1-3917600000111.7F70 E71 R76F70-A74 VanDerWaalsContact O-CB 3.32Å; F70-A74 WeakPolarHBondContact O-CB 3.42Å; F70-A74 PolarHBondContact O-N 3.38Å; E71-A74 PolarHBondContact O-N 2.88Å; A74-R76 PolarHBondContact O-N 3.24Å
75A95.4Very high89.1Confident62 Ų62111.7 Ų111.751%0.51257%0.568SS.*THydrogen-bonded Turntrans-74.9-1.2172.800000113.6E71 R72 L73 Q77E71-A75 WeakPolarHBondContact O-CB 3.28Å; E71-A75 PolarHBondContact O-N 3.32Å; R72-A75 CarbonylContact O-C 3.51Å; R72-A75 PolarHBondContact O-N 3.2Å; L73-A75 VanDerWaalsContact C-N 3.3Å; L73-A75 PolarHBondContact O-N 2.87Å; A75-Q77 HydrophobicContact CB-CG 3.98Å; A75-Q77 PolarHBondContact O-N 3.41Å
76R94.3Very high88.1Confident223 Ų223113.8 Ų113.884%0.84257%0.567SS**THydrogen-bonded Turntrans53.231.3-176.2-58.6-178.6176.3-178.3-1.3113.2R72 L73 A74 P78R72-R76 PolarHBondContact O-N 3.46Å; R72-R76 VanDerWaalsContact O-N 3.11Å; L73-R76 WeakPolarHBondContact O-CA 3.24Å; L73-R76 PolarHBondContact O-N 2.87Å; A74-R76 PolarHBondContact O-N 3.24Å; R76-P78 WeakPolarHBondContact O-CD 3.38Å
77Q93.7Very high87.4Confident116 Ų116116.9 Ų116.954%0.54258%0.576SS.*PPolyproline II helixtrans-78.2124.3178.1-72.9-176.5-9.500109.6R72 A75R72-Q77 HydrophobicContact CG-CB 3.65Å; R72-Q77 PolarHBondContact NH1-O 3.35Å; R72-Q77 PolarHBondContact O-N 2.71Å; A75-Q77 HydrophobicContact CB-CG 3.98Å; A75-Q77 PolarHBondContact O-N 3.41Å
78P89.9Confident87Confident120 Ų120117.9 Ų117.978%0.77958%0.584SS**PPolyproline II helixtrans-56.4151.4174.1-23.634.1000111.5R72 R76R72-P78 VanDerWaalsContact NH1-C 3.31Å; R76-P78 WeakPolarHBondContact O-CD 3.38Å
79I90.1Very high86.6Confident106 Ų106118.4 Ų118.454%0.54459%0.586SS.*PPolyproline II helixtrans-70.6137.1175.6-165.1166.5000108.4L81I79-L81 HydrophobicContact CG2-CD2 4.39Å; I79-L81 PolarHBondContact O-N 3.19Å
80E85.4Confident86.1Confident184 Ų184117.8 Ų117.886%0.8659%0.588SS**PPolyproline II helixtrans-65.6119.7170.3-170.4173.1-176.900108.2
81L83.9Confident85.8Confident147 Ų147116.7 Ų116.777%0.7760%0.598SS**PPolyproline II helixtrans-72134.7178.4-65.1174.3000109.1I79 S83I79-L81 HydrophobicContact CG2-CD2 4.39Å; I79-L81 PolarHBondContact O-N 3.19Å; L81-S83 PolarHBondContact O-N 2.9Å
82L81.1Confident85.5Confident125 Ų125111.6 Ų111.665%0.65458%0.575SS**PPolyproline II helixtrans-59.8122.4173.4-165.289.2000109.4M84 Y87L82-M84 HydrophobicContact CD2-CE 4.28Å; L82-M84 HydrophobicContact CD2-SD 4.22Å; L82-M84 PolarHBondContact O-N 3.39Å; L82-Y87 HydrophobicContact CD2-CE2 4.27Å
83S77.9Confident85.2Confident75 Ų75112.3 Ų112.352%0.52459%0.587SS.*  trans-70.5114.1174.9-179.20000110.5L81 K85L81-S83 PolarHBondContact O-N 2.9Å; S83-K85 VanDerWaalsContact C-N 3.27Å; S83-K85 PolarHBondContact O-N 3.42Å
84M80.3Confident84.7Confident113 Ų113112.4 Ų112.456%0.55760%0.597SS**G310 helixtrans-77.4-11.9175.1-66.9-60.3-170.500113.4L82 R86 Y87L82-M84 HydrophobicContact CD2-CE 4.28Å; L82-M84 HydrophobicContact CD2-SD 4.22Å; L82-M84 PolarHBondContact O-N 3.39Å; M84-R86 PolarHBondContact O-N 2.89Å; M84-Y87 PolarHBondContact O-N 2.96Å; M84-Y87 HydrophobicContact SD-CD2 3.99Å; M84-Y87 HydrophobicContact SD-CE2 4.33Å
85K73.1Confident84.4Confident149 Ų149112 Ų11265%0.64860%0.601SS**G310 helixtrans-56.6-27.8-180-67.9-174.9176.4-178.60113.1S83 Y87 E88S83-K85 VanDerWaalsContact C-N 3.27Å; S83-K85 PolarHBondContact O-N 3.42Å; K85-Y87 PolarHBondContact O-N 3Å; K85-E88 PolarHBondContact O-N 3.39Å
86R72.9Confident84Confident173 Ų173113.2 Ų113.265%0.65360%0.596SS**G310 helixtrans-64.7-25.3176.4-176.3-180-70-165.50.1113M84 N109 Q113M84-R86 PolarHBondContact O-N 2.89Å; R86-N109 PolarHBondContact O-OD1 3.35Å; R86-Q113 PolarHBondContact O-NE2 3.01Å
87Y78.8Confident83.6Confident148 Ų148108.2 Ų108.258%0.5858%0.58SS**G310 helixtrans-99.21.4-179.3-55.4-68.6000113.1L82 M84 K85L82-Y87 HydrophobicContact CD2-CE2 4.27Å; M84-Y87 PolarHBondContact O-N 2.96Å; M84-Y87 HydrophobicContact SD-CD2 3.99Å; M84-Y87 HydrophobicContact SD-CE2 4.33Å; K85-Y87 PolarHBondContact O-N 3Å
88E81.7Confident83.3Confident108 Ų108110.5 Ų110.551%0.50560%0.596SS.*SBendtrans-107158.8176.3-64.3173.8-177.600109.4K85 P90 N109 Q113K85-E88 PolarHBondContact O-N 3.39Å; E88-P90 WeakPolarHBondContact O-CD 3.43Å; E88-N109 PolarHBondContact O-ND2 3.35Å; E88-Q113 PolarHBondContact O-NE2 3.29Å
89L82.8Confident83.4Confident108 Ų108107.8 Ų107.857%0.56558%0.575SS**  trans-110.162.2173-67.2164.6000110.1S110 Q113L89-S110 WeakPolarHBondContact CD2-OG 3.33Å; L89-Q113 HydrophobicContact CD2-CB 4.47Å; L89-Q113 VanDerWaalsContact CD2-OE1 3.3Å
90P82.6Confident83.5Confident61 Ų61109.1 Ų109.140%0.39658%0.582SS.*PPolyproline II helixtrans-69.9137.2179.831.1-34.3000109.7E88 C106E88-P90 WeakPolarHBondContact O-CD 3.43Å; P90-C106 PolarHBondContact O-SG 3.38Å
91A84.3Confident83.8Confident78 Ų78104.2 Ų104.265%0.64557%0.565SS**PPolyproline II helixtrans-69.1158.9164.300000110.1S93A91-S93 PolarHBondContact O-N 2.96Å
92P86.7Confident84Confident11 Ų1197.5 Ų97.57%0.07153%0.531CS..PPolyproline II helixtrans-54.6143171.8-24.434.6000110.8Q96 A102 W103 C106P92-Q96 HydrophobicContact CB-CB 4.22Å; P92-A102 HydrophobicContact CB-CB 4.18Å; P92-W103 HydrophobicContact CG-CD2 3.6Å; P92-W103 HydrophobicContact CG-CE3 3.8Å; P92-W103 HydrophobicContact CG-CG 4.01Å; P92-W103 HydrophobicContact CG-CH2 4.33Å; P92-W103 HydrophobicContact CG-CZ2 4.15Å; P92-W103 HydrophobicContact CG-CZ3 4.16Å; P92-C106 VanDerWaalsContact CD-SG 3.54Å
93S87.5Confident84.4Confident62 Ų6297.2 Ų97.243%0.43452%0.521SS..PPolyproline II helixtrans-59.2156.3178.470.60000111.1A91 G95 Q96 K97A91-S93 PolarHBondContact O-N 2.96Å; S93-G95 PolarHBondContact O-N 3.28Å; S93-Q96 PolarHBondContact O-N 2.85Å; S93-Q96 VanDerWaalsContact OG-CD 3.3Å; S93-Q96 WeakPolarHBondContact OG-CG 3.24Å; S93-Q96 PolarHBondContact OG-OE1 3.2Å; S93-K97 PolarHBondContact O-N 2.89Å
94S83.9Confident85.1Confident105 Ų10599.1 Ų99.173%0.73452%0.522SS*.THydrogen-bonded Turntrans-53.5-29.4-175.9-62.10000114.2
95G85.6Confident85.5Confident78 Ų78100.2 Ų100.280%0.80453%0.525SS*.THydrogen-bonded Turntrans-82.3-13.317600000115.2S93S93-G95 PolarHBondContact O-N 3.28Å
96Q87.8Confident86.2Confident88 Ų8894.4 Ų94.441%0.41150%0.503SS..THydrogen-bonded Turntrans-106.25.5-176.7-68.5173.5-53.200113P92 S93 N98 D99 A102P92-Q96 HydrophobicContact CB-CB 4.22Å; S93-Q96 PolarHBondContact O-N 2.85Å; S93-Q96 VanDerWaalsContact OG-CD 3.3Å; S93-Q96 WeakPolarHBondContact OG-CG 3.24Å; S93-Q96 PolarHBondContact OG-OE1 3.2Å; Q96-N98 PolarHBondContact O-N 3.11Å; Q96-D99 HydrophobicContact CB-CB 4.48Å; Q96-D99 WeakPolarHBondContact O-CB 3.28Å; Q96-D99 PolarHBondContact O-N 3.46Å; Q96-A102 HydrophobicContact CB-CB 3.9Å
97K85.1Confident87Confident117 Ų11789.4 Ų89.451%0.50949%0.492SS..THydrogen-bonded Turntrans-64-22.6-177.4-70.9-174.7175.3-178.90114.5S93 W103S93-K97 PolarHBondContact O-N 2.89Å; K97-W103 PolarHBondContact O-NE1 3.42Å
98N88.6Confident87.6Confident164 Ų16486.5 Ų86.588%0.87749%0.486SS*.THydrogen-bonded Turntrans-94.4-2.4175.6-62.3-20.1000112.4Q96Q96-N98 PolarHBondContact O-N 3.11Å
99D91.6Very high88Confident63 Ų6383.1 Ų83.134%0.33747%0.471SS..  trans-90.3111.3179.5-178.52.4000110Q96 T101 A102 W103Q96-D99 HydrophobicContact CB-CB 4.48Å; Q96-D99 WeakPolarHBondContact O-CB 3.28Å; Q96-D99 PolarHBondContact O-N 3.46Å; D99-T101 PolarHBondContact O-N 2.86Å; D99-T101 WeakPolarHBondContact OD1-CB 3.45Å; D99-T101 PolarHBondContact OD1-N 3.48Å; D99-T101 PolarHBondContact OD1-OG1 2.71Å; D99-T101 PolarHBondContact OD2-OG1 3Å; D99-T101 VanDerWaalsContact OD2-OG1 3.1Å; D99-A102 HydrophobicContact CB-CB 4.14Å; D99-A102 PolarHBondContact O-N 3.23Å; D99-W103 VanDerWaalsContact O-CD1 3.26Å; D99-W103 PolarHBondContact O-N 3.47Å
100I91.8Very high88.3Confident134 Ų13480.5 Ų80.569%0.68746%0.462SS*.Hα-helixtrans-61.5-33.6-179.5-61.4170.6000110.8W103 Q104I100-W103 PolarHBondContact O-N 3.45Å; I100-Q104 WeakPolarHBondContact O-CB 3.33Å; I100-Q104 PolarHBondContact O-N 3.43Å
101T91.6Very high88.8Confident82 Ų8282.9 Ų82.950%0.50347%0.47SS..Hα-helixtrans-68.6-42.5-177.865.70000111.4D99 W103 Q104 E105D99-T101 PolarHBondContact O-N 2.86Å; D99-T101 WeakPolarHBondContact OD1-CB 3.45Å; D99-T101 PolarHBondContact OD1-N 3.48Å; D99-T101 PolarHBondContact OD1-OG1 2.71Å; D99-T101 PolarHBondContact OD2-OG1 3Å; D99-T101 VanDerWaalsContact OD2-OG1 3.1Å; T101-W103 VanDerWaalsContact C-N 3.32Å; T101-W103 PolarHBondContact O-N 3.43Å; T101-Q104 PolarHBondContact O-N 3.31Å; T101-Q104 VanDerWaalsContact O-N 3.11Å; T101-E105 WeakPolarHBondContact O-CG 3.34Å; T101-E105 PolarHBondContact O-N 3.09Å
102A88.4Confident89.1Confident6 Ų681.3 Ų81.35%0.0546%0.457CS..Hα-helixtrans-61.3-38.2175.100000112.5P92 Q96 D99 C106P92-A102 HydrophobicContact CB-CB 4.18Å; Q96-A102 HydrophobicContact CB-CB 3.9Å; D99-A102 HydrophobicContact CB-CB 4.14Å; D99-A102 PolarHBondContact O-N 3.23Å; A102-C106 PolarHBondContact O-N 3.01Å; A102-C106 VanDerWaalsContact O-N 3.15Å; A102-C106 PolarHBondContact O-SG 2.89Å; A102-C106 VanDerWaalsContact O-SG 3.39Å
103W89.5Confident89.2Confident118 Ų11882 Ų8245%0.44746%0.459SS..Hα-helixtrans-66.7-40.9172.7-78105.3000112.6P92 K97 D99 I100 T101 E105 C106 V107P92-W103 HydrophobicContact CG-CD2 3.6Å; P92-W103 HydrophobicContact CG-CE3 3.8Å; P92-W103 HydrophobicContact CG-CG 4.01Å; P92-W103 HydrophobicContact CG-CH2 4.33Å; P92-W103 HydrophobicContact CG-CZ2 4.15Å; P92-W103 HydrophobicContact CG-CZ3 4.16Å; K97-W103 PolarHBondContact O-NE1 3.42Å; D99-W103 VanDerWaalsContact O-CD1 3.26Å; D99-W103 PolarHBondContact O-N 3.47Å; I100-W103 PolarHBondContact O-N 3.45Å; T101-W103 VanDerWaalsContact C-N 3.32Å; T101-W103 PolarHBondContact O-N 3.43Å; W103-E105 VanDerWaalsContact C-N 3.33Å; W103-E105 PolarHBondContact O-N 2.96Å; W103-C106 PolarHBondContact O-N 2.92Å; W103-V107 WeakPolarHBondContact O-CB 3.24Å; W103-V107 VanDerWaalsContact O-CG2 3.3Å; W103-V107 WeakPolarHBondContact O-CG2 3.45Å; W103-V107 PolarHBondContact O-N 2.93Å
104Q91.7Very high89.4Confident116 Ų11684.7 Ų84.754%0.54247%0.468SS..Hα-helixtrans-64.9-37.7178.3-169.6159.84.200111.7I100 T101 V107 N108I100-Q104 WeakPolarHBondContact O-CB 3.33Å; I100-Q104 PolarHBondContact O-N 3.43Å; T101-Q104 PolarHBondContact O-N 3.31Å; T101-Q104 VanDerWaalsContact O-N 3.11Å; Q104-V107 PolarHBondContact O-N 3.48Å; Q104-N108 WeakPolarHBondContact O-CB 3.44Å; Q104-N108 PolarHBondContact O-N 2.84Å; Q104-N108 PolarHBondContact O-ND2 3.47Å
105E88.6Confident89.9Confident136 Ų13685.7 Ų85.764%0.63646%0.461SS*.Hα-helixtrans-61.9-47172-72.4180174.900112.4T101 W103 V107 N108 N109T101-E105 WeakPolarHBondContact O-CG 3.34Å; T101-E105 PolarHBondContact O-N 3.09Å; W103-E105 VanDerWaalsContact C-N 3.33Å; W103-E105 PolarHBondContact O-N 2.96Å; E105-V107 VanDerWaalsContact C-N 3.32Å; E105-V107 PolarHBondContact O-N 3.22Å; E105-N108 PolarHBondContact O-N 3.43Å; E105-N109 WeakPolarHBondContact O-CB 3.28Å; E105-N109 PolarHBondContact O-N 3.32Å
106C88.7Confident90.2Very high26 Ų2688 Ų8818%0.17645%0.45CS..Hα-helixtrans-60.2-41.6176.1-72.80000112.1P90 P92 A102 W103 S110P90-C106 PolarHBondContact O-SG 3.38Å; P92-C106 VanDerWaalsContact CD-SG 3.54Å; A102-C106 PolarHBondContact O-N 3.01Å; A102-C106 VanDerWaalsContact O-N 3.15Å; A102-C106 PolarHBondContact O-SG 2.89Å; A102-C106 VanDerWaalsContact O-SG 3.39Å; W103-C106 PolarHBondContact O-N 2.92Å; C106-S110 WeakPolarHBondContact O-CB 3.49Å; C106-S110 PolarHBondContact O-N 3.26Å; C106-S110 PolarHBondContact O-OG 3.05Å
107V90.6Very high90.5Very high69 Ų6988.4 Ų88.442%0.41845%0.452SS..Hα-helixtrans-67.3-45.2178.2168.40000111.1W103 Q104 E105 N109 S110 M111W103-V107 WeakPolarHBondContact O-CB 3.24Å; W103-V107 VanDerWaalsContact O-CG2 3.3Å; W103-V107 WeakPolarHBondContact O-CG2 3.45Å; W103-V107 PolarHBondContact O-N 2.93Å; Q104-V107 PolarHBondContact O-N 3.48Å; E105-V107 VanDerWaalsContact C-N 3.32Å; E105-V107 PolarHBondContact O-N 3.22Å; V107-N109 PolarHBondContact O-N 3.08Å; V107-S110 WeakPolarHBondContact O-CB 3.39Å; V107-S110 PolarHBondContact O-N 3.26Å; V107-S110 VanDerWaalsContact O-N 3.17Å; V107-M111 HydrophobicContact CG1-CE 3.3Å; V107-M111 WeakPolarHBondContact O-CG 3.41Å; V107-M111 PolarHBondContact O-N 2.88Å
108N90.7Very high91Very high87 Ų8785.2 Ų85.247%0.46545%0.448SS..Hα-helixtrans-60.6-43.5175.5-71.1-16.2000111.9Q104 E105 S110 M111 A112Q104-N108 WeakPolarHBondContact O-CB 3.44Å; Q104-N108 PolarHBondContact O-N 2.84Å; Q104-N108 PolarHBondContact O-ND2 3.47Å; E105-N108 PolarHBondContact O-N 3.43Å; N108-S110 VanDerWaalsContact C-N 3.32Å; N108-S110 PolarHBondContact O-N 3.42Å; N108-M111 PolarHBondContact O-N 2.93Å; N108-A112 WeakPolarHBondContact O-CB 3.36Å; N108-A112 PolarHBondContact O-N 3.36Å
109N89.6Confident91.4Very high36 Ų3680.6 Ų80.619%0.19343%0.425CS..Hα-helixtrans-62.6-39.6175.3-176.758.2000111.6R86 E88 E105 V107 A112 Q113R86-N109 PolarHBondContact O-OD1 3.35Å; E88-N109 PolarHBondContact O-ND2 3.35Å; E105-N109 WeakPolarHBondContact O-CB 3.28Å; E105-N109 PolarHBondContact O-N 3.32Å; V107-N109 PolarHBondContact O-N 3.08Å; N109-A112 PolarHBondContact O-N 3.43Å; N109-Q113 PolarHBondContact ND2-NE2 3.22Å; N109-Q113 WeakPolarHBondContact O-CG 3.36Å; N109-Q113 PolarHBondContact O-N 2.96Å
110S90.1Very high91.6Very high54 Ų5484.8 Ų84.838%0.37844%0.437SS..Hα-helixtrans-64.6-43.1176.5-55.40000112.2L89 C106 V107 N108 Q113 L114L89-S110 WeakPolarHBondContact CD2-OG 3.33Å; C106-S110 WeakPolarHBondContact O-CB 3.49Å; C106-S110 PolarHBondContact O-N 3.26Å; C106-S110 PolarHBondContact O-OG 3.05Å; V107-S110 WeakPolarHBondContact O-CB 3.39Å; V107-S110 PolarHBondContact O-N 3.26Å; V107-S110 VanDerWaalsContact O-N 3.17Å; N108-S110 VanDerWaalsContact C-N 3.32Å; N108-S110 PolarHBondContact O-N 3.42Å; S110-Q113 PolarHBondContact O-N 2.92Å; S110-L114 PolarHBondContact O-N 3.37Å
111M91.5Very high91.9Very high111 Ų11183 Ų8355%0.54743%0.427SS..Hα-helixtrans-62.6-46.4174.6-67.5-167.8-140.800111.3V107 N108 Q113 L114 E115V107-M111 HydrophobicContact CG1-CE 3.3Å; V107-M111 WeakPolarHBondContact O-CG 3.41Å; V107-M111 PolarHBondContact O-N 2.88Å; N108-M111 PolarHBondContact O-N 2.93Å; M111-Q113 VanDerWaalsContact C-N 3.29Å; M111-Q113 PolarHBondContact O-N 2.86Å; M111-L114 WeakPolarHBondContact O-CB 3.5Å; M111-L114 PolarHBondContact O-N 3.5Å; M111-E115 PolarHBondContact O-N 3.44Å; M111-E115 VanDerWaalsContact O-N 3.12Å
112A90.6Very high92.2Very high45 Ų4584.7 Ų84.737%0.37243%0.429SS..Hα-helixtrans-59-41.2177.400000111.9N108 N109 E115 H116N108-A112 WeakPolarHBondContact O-CB 3.36Å; N108-A112 PolarHBondContact O-N 3.36Å; N109-A112 PolarHBondContact O-N 3.43Å; A112-E115 PolarHBondContact O-N 2.95Å; A112-H116 PolarHBondContact O-CD2 2.86Å; A112-H116 PolarHBondContact O-N 3.25Å
113Q90.3Very high92.6Very high25 Ų2588.6 Ų88.612%0.11745%0.45CS..Hα-helixtrans-67.5-38176.7-76.6-171.721.300113.3R86 E88 L89 N109 S110 M111 E115 H116 Q117R86-Q113 PolarHBondContact O-NE2 3.01Å; E88-Q113 PolarHBondContact O-NE2 3.29Å; L89-Q113 HydrophobicContact CD2-CB 4.47Å; L89-Q113 VanDerWaalsContact CD2-OE1 3.3Å; N109-Q113 PolarHBondContact ND2-NE2 3.22Å; N109-Q113 WeakPolarHBondContact O-CG 3.36Å; N109-Q113 PolarHBondContact O-N 2.96Å; S110-Q113 PolarHBondContact O-N 2.92Å; M111-Q113 VanDerWaalsContact C-N 3.29Å; M111-Q113 PolarHBondContact O-N 2.86Å; Q113-E115 VanDerWaalsContact C-N 3.33Å; Q113-E115 PolarHBondContact O-N 3.38Å; Q113-H116 PolarHBondContact O-N 2.95Å; Q113-Q117 WeakPolarHBondContact O-CG 3.43Å; Q113-Q117 PolarHBondContact O-N 2.95Å
114L92.1Very high93Very high119 Ų11986.9 Ų86.962%0.62345%0.449SS*.Hα-helixtrans-58.4-48.1175.4-179.464.4000110.8S110 M111 H116 Q117 A118S110-L114 PolarHBondContact O-N 3.37Å; M111-L114 WeakPolarHBondContact O-CB 3.5Å; M111-L114 PolarHBondContact O-N 3.5Å; L114-H116 PolarHBondContact O-N 3.39Å; L114-Q117 PolarHBondContact O-N 3.5Å; L114-A118 PolarHBondContact O-N 2.82Å
115E93.6Very high93.3Very high125 Ų12586.6 Ų86.658%0.58445%0.447SS*.Hα-helixtrans-63.1-42176.8-64.3-56.4149.400111.7M111 A112 Q113 Q117 A118 V119M111-E115 PolarHBondContact O-N 3.44Å; M111-E115 VanDerWaalsContact O-N 3.12Å; A112-E115 PolarHBondContact O-N 2.95Å; Q113-E115 VanDerWaalsContact C-N 3.33Å; Q113-E115 PolarHBondContact O-N 3.38Å; E115-Q117 VanDerWaalsContact C-N 3.3Å; E115-Q117 PolarHBondContact O-N 3.38Å; E115-A118 WeakPolarHBondContact O-CB 3.37Å; E115-A118 PolarHBondContact O-N 2.93Å; E115-V119 WeakPolarHBondContact O-CG2 3.34Å; E115-V119 PolarHBondContact O-N 3.48Å
116H92.4Very high93.7Very high127 Ų12784.1 Ų84.159%0.58844%0.438SS*.Hα-helixtrans-60.7-36.4174.3-80.3-57.1000113A112 Q113 L114 R120A112-H116 PolarHBondContact O-CD2 2.86Å; A112-H116 PolarHBondContact O-N 3.25Å; Q113-H116 PolarHBondContact O-N 2.95Å; L114-H116 PolarHBondContact O-N 3.39Å; H116-R120 VanDerWaalsContact O-CB 3.25Å; H116-R120 WeakPolarHBondContact O-CB 2.96Å; H116-R120 PolarHBondContact O-N 3.23Å
117Q92.8Very high94.2Very high96 Ų9688.5 Ų88.545%0.44946%0.457SS..Hα-helixtrans-69.7-39.4175-67.4-62-18.800111.7Q113 L114 E115 R120 I121Q113-Q117 WeakPolarHBondContact O-CG 3.43Å; Q113-Q117 PolarHBondContact O-N 2.95Å; L114-Q117 PolarHBondContact O-N 3.5Å; E115-Q117 VanDerWaalsContact C-N 3.3Å; E115-Q117 PolarHBondContact O-N 3.38Å; Q117-R120 WeakPolarHBondContact O-CB 3.07Å; Q117-R120 PolarHBondContact O-N 3.36Å; Q117-I121 WeakPolarHBondContact O-CG1 3.41Å; Q117-I121 PolarHBondContact O-N 3.34Å
118A96Very high94.5Very high50 Ų5090 Ų9041%0.41347%0.471SS..Hα-helixtrans-59.6-49.9174.700000111.3L114 E115 R120 I121 E122L114-A118 PolarHBondContact O-N 2.82Å; E115-A118 WeakPolarHBondContact O-CB 3.37Å; E115-A118 PolarHBondContact O-N 2.93Å; A118-R120 VanDerWaalsContact C-N 3.3Å; A118-R120 PolarHBondContact O-N 3.29Å; A118-I121 PolarHBondContact O-N 3.02Å; A118-I121 VanDerWaalsContact O-N 3.17Å; A118-E122 PolarHBondContact O-N 3.03Å; A118-E122 VanDerWaalsContact O-N 3.09Å
119V96.9Very high94.8Very high68 Ų6891.7 Ų91.741%0.41248%0.476SS..Hα-helixtrans-62.1-37.3175.6172.80000111.7E115 I121 E122 N123E115-V119 WeakPolarHBondContact O-CG2 3.34Å; E115-V119 PolarHBondContact O-N 3.48Å; V119-I121 VanDerWaalsContact C-N 3.35Å; V119-E122 PolarHBondContact O-N 2.95Å; V119-N123 WeakPolarHBondContact O-CB 3.45Å; V119-N123 VanDerWaalsContact O-CG 3.32Å; V119-N123 PolarHBondContact O-N 3.08Å; V119-N123 PolarHBondContact O-ND2 3.27Å
120R96.4Very high95.1Very high151 Ų15195.3 Ų95.357%0.5749%0.491SS*.Hα-helixtrans-62.6-42.1175.9179.8178.7-180160.60.2111.6H116 Q117 A118 N123 L124H116-R120 VanDerWaalsContact O-CB 3.25Å; H116-R120 WeakPolarHBondContact O-CB 2.96Å; H116-R120 PolarHBondContact O-N 3.23Å; Q117-R120 WeakPolarHBondContact O-CB 3.07Å; Q117-R120 PolarHBondContact O-N 3.36Å; A118-R120 VanDerWaalsContact C-N 3.3Å; A118-R120 PolarHBondContact O-N 3.29Å; R120-N123 PolarHBondContact O-N 3.32Å; R120-L124 HydrophobicContact CG-CD1 4.09Å; R120-L124 HydrophobicContact CG-CG 4.4Å; R120-L124 WeakPolarHBondContact O-CB 3.42Å; R120-L124 VanDerWaalsContact O-CG 3.24Å; R120-L124 WeakPolarHBondContact O-CG 3.48Å; R120-L124 PolarHBondContact O-N 3.11Å
121I97.8Very high95.5Very high96 Ų9693.9 Ų93.949%0.49249%0.486SS..Hα-helixtrans-62.1-48.8176.9-68.6164.6000109.6Q117 A118 V119 N123 L124 E125Q117-I121 WeakPolarHBondContact O-CG1 3.41Å; Q117-I121 PolarHBondContact O-N 3.34Å; A118-I121 PolarHBondContact O-N 3.02Å; A118-I121 VanDerWaalsContact O-N 3.17Å; V119-I121 VanDerWaalsContact C-N 3.35Å; I121-N123 VanDerWaalsContact C-N 3.34Å; I121-N123 PolarHBondContact O-N 2.63Å; I121-L124 PolarHBondContact O-N 3.19Å; I121-L124 VanDerWaalsContact O-N 3.09Å; I121-E125 HydrophobicContact CG2-CG 4.45Å; I121-E125 WeakPolarHBondContact O-CG 3.44Å; I121-E125 PolarHBondContact O-N 3.05Å
122E97.7Very high95.7Very high117 Ų11793.1 Ų93.155%0.54749%0.49SS..Hα-helixtrans-56.7-45.9176.8-174.1-179.9-175.300112A118 V119 L124 E125 L126A118-E122 PolarHBondContact O-N 3.03Å; A118-E122 VanDerWaalsContact O-N 3.09Å; V119-E122 PolarHBondContact O-N 2.95Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.38Å; E122-E125 PolarHBondContact O-N 3.28Å; E122-L126 WeakPolarHBondContact O-CG 3.4Å; E122-L126 PolarHBondContact O-N 3.26Å
123N97.8Very high96Very high89 Ų8995.7 Ų95.748%0.47650%0.498SS..Hα-helixtrans-63.2-38.4176.2-75.7-32000112.8V119 R120 I121 L126 M127V119-N123 WeakPolarHBondContact O-CB 3.45Å; V119-N123 VanDerWaalsContact O-CG 3.32Å; V119-N123 PolarHBondContact O-N 3.08Å; V119-N123 PolarHBondContact O-ND2 3.27Å; R120-N123 PolarHBondContact O-N 3.32Å; I121-N123 VanDerWaalsContact C-N 3.34Å; I121-N123 PolarHBondContact O-N 2.63Å; N123-L126 PolarHBondContact O-N 2.87Å; N123-M127 VanDerWaalsContact O-CB 3.32Å; N123-M127 WeakPolarHBondContact O-CB 3.3Å; N123-M127 PolarHBondContact O-N 3.45Å
124L97.9Very high96.4Very high81 Ų8197.5 Ų97.542%0.42452%0.517SS..Hα-helixtrans-68.7-36.1176.4-74.3174.3000111.6R120 I121 E122 M127 S128R120-L124 HydrophobicContact CG-CD1 4.09Å; R120-L124 HydrophobicContact CG-CG 4.4Å; R120-L124 WeakPolarHBondContact O-CB 3.42Å; R120-L124 VanDerWaalsContact O-CG 3.24Å; R120-L124 WeakPolarHBondContact O-CG 3.48Å; R120-L124 PolarHBondContact O-N 3.11Å; I121-L124 PolarHBondContact O-N 3.19Å; I121-L124 VanDerWaalsContact O-N 3.09Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.38Å; L124-M127 HydrophobicContact CD2-CE 3.61Å; L124-M127 PolarHBondContact O-N 2.89Å; L124-S128 VanDerWaalsContact O-CB 3.27Å; L124-S128 WeakPolarHBondContact O-CB 3.44Å; L124-S128 PolarHBondContact O-N 3.34Å
125E97.6Very high96.7Very high111 Ų11199.4 Ų99.452%0.51952%0.516SS..Hα-helixtrans-63.9-47173.4-72.3177175.300110.8I121 E122 M127 S128 Q129I121-E125 HydrophobicContact CG2-CG 4.45Å; I121-E125 WeakPolarHBondContact O-CG 3.44Å; I121-E125 PolarHBondContact O-N 3.05Å; E122-E125 PolarHBondContact O-N 3.28Å; E125-M127 PolarHBondContact O-N 3.36Å; E125-S128 PolarHBondContact O-N 2.86Å; E125-Q129 VanDerWaalsContact O-CG 3.27Å; E125-Q129 WeakPolarHBondContact O-CG 3.37Å; E125-Q129 PolarHBondContact O-N 3.49Å
126L97.7Very high96.9Very high84 Ų8499.5 Ų99.544%0.4451%0.514SS..Hα-helixtrans-59.7-44.9174.3-72.5173.2000112E122 N123 S128 Q129 H130E122-L126 WeakPolarHBondContact O-CG 3.4Å; E122-L126 PolarHBondContact O-N 3.26Å; N123-L126 PolarHBondContact O-N 2.87Å; L126-S128 VanDerWaalsContact C-N 3.35Å; L126-S128 PolarHBondContact O-N 3.45Å; L126-Q129 PolarHBondContact O-N 3.41Å; L126-H130 PolarHBondContact O-N 2.92Å
127M97.3Very high97.1Very high117 Ų11797.2 Ų97.258%0.57651%0.509SS*.Hα-helixtrans-64.6-39.4177.3-173.4-17972.200111.6N123 L124 E125 Q129 G131N123-M127 VanDerWaalsContact O-CB 3.32Å; N123-M127 WeakPolarHBondContact O-CB 3.3Å; N123-M127 PolarHBondContact O-N 3.45Å; L124-M127 HydrophobicContact CD2-CE 3.61Å; L124-M127 PolarHBondContact O-N 2.89Å; E125-M127 PolarHBondContact O-N 3.36Å; M127-Q129 VanDerWaalsContact C-N 3.28Å; M127-Q129 PolarHBondContact O-N 3.45Å; M127-G131 VanDerWaalsContact O-CA 3.23Å; M127-G131 WeakPolarHBondContact O-CA 3.26Å; M127-G131 PolarHBondContact O-N 3.28Å
128S96.9Very high97.4Very high101 Ų10198 Ų9871%0.70651%0.509SS*.Hα-helixtrans-64.1-35.5176.1-1730000111.8L124 E125 L126L124-S128 VanDerWaalsContact O-CB 3.27Å; L124-S128 WeakPolarHBondContact O-CB 3.44Å; L124-S128 PolarHBondContact O-N 3.34Å; E125-S128 PolarHBondContact O-N 2.86Å; L126-S128 VanDerWaalsContact C-N 3.35Å; L126-S128 PolarHBondContact O-N 3.45Å
129Q97Very high97.5Very high123 Ų12398.6 Ų98.658%0.57551%0.505SS*.Hα-helixtrans-77.1-41.5-179.9-70174.636.700112.7E125 L126 M127E125-Q129 VanDerWaalsContact O-CG 3.27Å; E125-Q129 WeakPolarHBondContact O-CG 3.37Å; E125-Q129 PolarHBondContact O-N 3.49Å; L126-Q129 PolarHBondContact O-N 3.41Å; M127-Q129 VanDerWaalsContact C-N 3.28Å; M127-Q129 PolarHBondContact O-N 3.45Å
130H97.4Very high97.6Very high111 Ų111100.9 Ų100.951%0.51451%0.511SS..Hα-helixtrans-117.7-20.1-167.8-59.5-59.9000115.1L126 C132 N133 A134L126-H130 PolarHBondContact O-N 2.92Å; H130-C132 PolarHBondContact O-N 2.97Å; H130-N133 PolarHBondContact O-N 3.47Å; H130-N133 VanDerWaalsContact O-N 3.15Å; H130-A134 WeakPolarHBondContact O-CB 3.26Å; H130-A134 PolarHBondContact O-N 2.75Å
131G97.2Very high97.7Very high25 Ų2598 Ų9826%0.25851%0.507SS..Hα-helixtrans-58.3-45.3-170.300000113.4M127 N133 A134 W135M127-G131 VanDerWaalsContact O-CA 3.23Å; M127-G131 WeakPolarHBondContact O-CA 3.26Å; M127-G131 PolarHBondContact O-N 3.28Å; G131-N133 VanDerWaalsContact C-N 3.34Å; G131-N133 PolarHBondContact O-N 3.02Å; G131-A134 PolarHBondContact O-N 2.93Å; G131-W135 WeakPolarHBondContact O-CB 3.45Å; G131-W135 PolarHBondContact O-N 3.04Å
132C97Very high97.7Very high95 Ų9596.2 Ų96.264%0.64250%0.498SS*.Hα-helixtrans-60.9-41.5178.7-69.80000112.7H130 K136H130-C132 PolarHBondContact O-N 2.97Å; C132-K136 WeakPolarHBondContact O-CG 3.03Å; C132-K136 PolarHBondContact O-N 3.38Å; C132-K136 VanDerWaalsContact O-N 3.15Å
133N97.1Very high97.7Very high99 Ų9994.2 Ų94.253%0.52949%0.494SS..Hα-helixtrans-74.8-41.7-179-69.8-25.4000111.2H130 G131 W135 K136 V137H130-N133 PolarHBondContact O-N 3.47Å; H130-N133 VanDerWaalsContact O-N 3.15Å; G131-N133 VanDerWaalsContact C-N 3.34Å; G131-N133 PolarHBondContact O-N 3.02Å; N133-W135 VanDerWaalsContact C-N 3.28Å; N133-W135 PolarHBondContact O-N 3.44Å; N133-K136 PolarHBondContact O-N 2.9Å; N133-V137 WeakPolarHBondContact O-CG2 3.11Å; N133-V137 PolarHBondContact O-N 2.99Å; N133-V137 VanDerWaalsContact O-N 3.14Å
134A97.8Very high97.8Very high62 Ų6295.7 Ų95.751%0.51250%0.498SS..Hα-helixtrans-58.6-41.7173.400000111.6H130 G131 K136 V137 Y138H130-A134 WeakPolarHBondContact O-CB 3.26Å; H130-A134 PolarHBondContact O-N 2.75Å; G131-A134 PolarHBondContact O-N 2.93Å; A134-K136 PolarHBondContact O-N 3.42Å; A134-V137 PolarHBondContact O-N 3.36Å; A134-Y138 WeakPolarHBondContact O-CB 3.41Å; A134-Y138 PolarHBondContact O-N 2.93Å
135W97.8Very high97.8Very high159 Ų15998 Ų9860%0.60251%0.508SS*.Hα-helixtrans-66.5-37178.4-162.8-112.9000113G131 N133 Y138 N139G131-W135 WeakPolarHBondContact O-CB 3.45Å; G131-W135 PolarHBondContact O-N 3.04Å; N133-W135 VanDerWaalsContact C-N 3.28Å; N133-W135 PolarHBondContact O-N 3.44Å; W135-Y138 HydrophobicContact CD2-CD1 4.45Å; W135-Y138 AromaticContact CE3-CD1 3.98Å; W135-Y138 HydrophobicContact CE3-CD1 3.98Å; W135-Y138 AromaticContact CH2-CD1 3.96Å; W135-Y138 HydrophobicContact CH2-CD1 3.96Å; W135-Y138 AromaticContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CZ2-CD1 4.42Å; W135-Y138 AromaticContact CZ3-CD1 3.72Å; W135-Y138 HydrophobicContact CZ3-CD1 3.72Å; W135-Y138 HydrophobicContact CZ3-CE1 4Å; W135-Y138 PolarHBondContact O-N 3.48Å; W135-N139 PolarHBondContact NE1-ND2 2.96Å; W135-N139 VanDerWaalsContact O-CG 3.27Å; W135-N139 PolarHBondContact O-N 2.83Å; W135-N139 PolarHBondContact O-ND2 3.35Å
136K97.9Very high97.8Very high127 Ų12797.4 Ų97.455%0.55251%0.507SS*.Hα-helixtrans-61.9-48.7174.3-74172.7-176.6179.40111.6C132 N133 A134 Y138 N139 E140C132-K136 WeakPolarHBondContact O-CG 3.03Å; C132-K136 PolarHBondContact O-N 3.38Å; C132-K136 VanDerWaalsContact O-N 3.15Å; N133-K136 PolarHBondContact O-N 2.9Å; A134-K136 PolarHBondContact O-N 3.42Å; K136-Y138 VanDerWaalsContact C-N 3.31Å; K136-Y138 PolarHBondContact O-N 3.5Å; K136-N139 WeakPolarHBondContact O-CB 3.36Å; K136-N139 PolarHBondContact O-N 3.16Å; K136-N139 VanDerWaalsContact O-N 3.14Å; K136-E140 WeakPolarHBondContact O-CG 3.47Å; K136-E140 PolarHBondContact O-N 3.3Å
137V98.1Very high97.9Very high79 Ų7997.1 Ų97.148%0.47950%0.503SS..Hα-helixtrans-61.1-41.7176.7175.70000111.1N133 A134 N139 E140 N141N133-V137 WeakPolarHBondContact O-CG2 3.11Å; N133-V137 PolarHBondContact O-N 2.99Å; N133-V137 VanDerWaalsContact O-N 3.14Å; A134-V137 PolarHBondContact O-N 3.36Å; V137-N139 VanDerWaalsContact C-N 3.33Å; V137-N139 PolarHBondContact O-N 3.46Å; V137-E140 PolarHBondContact O-N 3.29Å; V137-N141 PolarHBondContact O-N 2.95Å
138Y98.1Very high97.9Very high114 Ų11497.2 Ų97.245%0.44750%0.502SS..Hα-helixtrans-60.6-42.8175.1-180-106.7000112.1A134 W135 K136 E140 N141 L142A134-Y138 WeakPolarHBondContact O-CB 3.41Å; A134-Y138 PolarHBondContact O-N 2.93Å; W135-Y138 HydrophobicContact CD2-CD1 4.45Å; W135-Y138 AromaticContact CE3-CD1 3.98Å; W135-Y138 HydrophobicContact CE3-CD1 3.98Å; W135-Y138 AromaticContact CH2-CD1 3.96Å; W135-Y138 HydrophobicContact CH2-CD1 3.96Å; W135-Y138 AromaticContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CZ2-CD1 4.42Å; W135-Y138 AromaticContact CZ3-CD1 3.72Å; W135-Y138 HydrophobicContact CZ3-CD1 3.72Å; W135-Y138 HydrophobicContact CZ3-CE1 4Å; W135-Y138 PolarHBondContact O-N 3.48Å; K136-Y138 VanDerWaalsContact C-N 3.31Å; K136-Y138 PolarHBondContact O-N 3.5Å; Y138-E140 PolarHBondContact O-N 2.87Å; Y138-N141 WeakPolarHBondContact O-CB 3.31Å; Y138-N141 PolarHBondContact O-N 3.17Å; Y138-L142 HydrophobicContact CD1-CD1 3.97Å; Y138-L142 HydrophobicContact CD1-CG 4.36Å; Y138-L142 HydrophobicContact CE1-CD1 3.42Å; Y138-L142 VanDerWaalsContact CE1-CD1 3.42Å; Y138-L142 HydrophobicContact CE1-CD2 4.43Å; Y138-L142 HydrophobicContact CE1-CG 3.95Å; Y138-L142 HydrophobicContact CE2-CG 4.5Å; Y138-L142 WeakPolarHBondContact O-CG 3.33Å; Y138-L142 PolarHBondContact O-N 2.86Å
139N98.3Very high98Very high62 Ų6295.2 Ų95.233%0.33249%0.492SS..Hα-helixtrans-64.1-39.2175.5-71.9-38.5000112.4W135 K136 V137 N141 L142 V143W135-N139 PolarHBondContact NE1-ND2 2.96Å; W135-N139 VanDerWaalsContact O-CG 3.27Å; W135-N139 PolarHBondContact O-N 2.83Å; W135-N139 PolarHBondContact O-ND2 3.35Å; K136-N139 WeakPolarHBondContact O-CB 3.36Å; K136-N139 PolarHBondContact O-N 3.16Å; K136-N139 VanDerWaalsContact O-N 3.14Å; V137-N139 VanDerWaalsContact C-N 3.33Å; V137-N139 PolarHBondContact O-N 3.46Å; N139-N141 VanDerWaalsContact C-N 3.32Å; N139-N141 PolarHBondContact O-N 3.35Å; N139-L142 PolarHBondContact O-N 2.95Å; N139-V143 WeakPolarHBondContact O-CG2 3Å; N139-V143 PolarHBondContact O-N 2.95Å
140E98.3Very high98.1Very high116 Ų11695.2 Ų95.254%0.54249%0.492SS..Hα-helixtrans-59.5-43.6174-71.3169.9-173.500111.3K136 V137 Y138 L142 V143 H144K136-E140 WeakPolarHBondContact O-CG 3.47Å; K136-E140 PolarHBondContact O-N 3.3Å; V137-E140 PolarHBondContact O-N 3.29Å; Y138-E140 PolarHBondContact O-N 2.87Å; E140-L142 PolarHBondContact O-N 3.46Å; E140-V143 PolarHBondContact O-N 3.39Å; E140-H144 PolarHBondContact O-CD2 3.11Å; E140-H144 VanDerWaalsContact O-CD2 3.26Å; E140-H144 PolarHBondContact O-N 2.93Å
141N98.3Very high98.1Very high89 Ų8995.7 Ų95.748%0.47649%0.492SS..Hα-helixtrans-61.1-43.5174.6-69.5-24.1000112V137 Y138 N139 V143 H144 M145V137-N141 PolarHBondContact O-N 2.95Å; Y138-N141 WeakPolarHBondContact O-CB 3.31Å; Y138-N141 PolarHBondContact O-N 3.17Å; N139-N141 VanDerWaalsContact C-N 3.32Å; N139-N141 PolarHBondContact O-N 3.35Å; N141-V143 PolarHBondContact O-N 2.87Å; N141-H144 PolarHBondContact O-N 3.45Å; N141-M145 WeakPolarHBondContact O-CG 3.22Å; N141-M145 PolarHBondContact O-N 3.29Å
142L98.3Very high98.2Very high59 Ų5998.4 Ų98.431%0.30950%0.498SS..Hα-helixtrans-62-42.5176.6-72-178.5000112.1Y138 N139 E140 H144 M145 I146Y138-L142 HydrophobicContact CD1-CD1 3.97Å; Y138-L142 HydrophobicContact CD1-CG 4.36Å; Y138-L142 HydrophobicContact CE1-CD1 3.42Å; Y138-L142 VanDerWaalsContact CE1-CD1 3.42Å; Y138-L142 HydrophobicContact CE1-CD2 4.43Å; Y138-L142 HydrophobicContact CE1-CG 3.95Å; Y138-L142 HydrophobicContact CE2-CG 4.5Å; Y138-L142 WeakPolarHBondContact O-CG 3.33Å; Y138-L142 PolarHBondContact O-N 2.86Å; N139-L142 PolarHBondContact O-N 2.95Å; E140-L142 PolarHBondContact O-N 3.46Å; L142-H144 VanDerWaalsContact C-N 3.35Å; L142-H144 PolarHBondContact O-N 3.37Å; L142-M145 PolarHBondContact O-N 2.92Å; L142-I146 WeakPolarHBondContact O-CG1 3.39Å; L142-I146 PolarHBondContact O-N 2.87Å
143V98.5Very high98.3Very high75 Ų7597.8 Ų97.846%0.45549%0.488SS..Hα-helixtrans-60.2-46.5176171.50000110.2N139 E140 N141 M145 I146 E147N139-V143 WeakPolarHBondContact O-CG2 3Å; N139-V143 PolarHBondContact O-N 2.95Å; E140-V143 PolarHBondContact O-N 3.39Å; N141-V143 PolarHBondContact O-N 2.87Å; V143-M145 PolarHBondContact O-N 3.46Å; V143-I146 PolarHBondContact O-N 3.4Å; V143-E147 HydrophobicContact CG1-CG 4.41Å; V143-E147 WeakPolarHBondContact O-CG 3.33Å; V143-E147 PolarHBondContact O-N 3.42Å
144H98.4Very high98.3Very high121 Ų12198.6 Ų98.656%0.5649%0.489SS*.Hα-helixtrans-60.2-41.4176.3-77.7-50.6000113.3E140 N141 L142 E147 H148E140-H144 PolarHBondContact O-CD2 3.11Å; E140-H144 VanDerWaalsContact O-CD2 3.26Å; E140-H144 PolarHBondContact O-N 2.93Å; N141-H144 PolarHBondContact O-N 3.45Å; L142-H144 VanDerWaalsContact C-N 3.35Å; L142-H144 PolarHBondContact O-N 3.37Å; H144-E147 PolarHBondContact O-N 3.41Å; H144-H148 WeakPolarHBondContact O-CB 2.98Å; H144-H148 PolarHBondContact O-N 2.92Å
145M98.4Very high98.4Very high130 Ų130101.9 Ų101.964%0.6449%0.491SS*.Hα-helixtrans-62.4-43.4176.3-71.7176.467.500111.9N141 L142 V143 H148 A149N141-M145 WeakPolarHBondContact O-CG 3.22Å; N141-M145 PolarHBondContact O-N 3.29Å; L142-M145 PolarHBondContact O-N 2.92Å; V143-M145 PolarHBondContact O-N 3.46Å; M145-H148 PolarHBondContact O-N 3.21Å; M145-A149 WeakPolarHBondContact O-CB 2.87Å; M145-A149 PolarHBondContact O-N 3.49Å
146I98.6Very high98.4Very high97 Ų9799 Ų9950%0.49749%0.487SS..Hα-helixtrans-63.6-48.4177.7-69.7167.7000110.4L142 V143 H148 A149 Q150L142-I146 WeakPolarHBondContact O-CG1 3.39Å; L142-I146 PolarHBondContact O-N 2.87Å; V143-I146 PolarHBondContact O-N 3.4Å; I146-H148 VanDerWaalsContact C-N 3.3Å; I146-H148 PolarHBondContact O-N 3.27Å; I146-A149 PolarHBondContact O-N 3.02Å; I146-Q150 HydrophobicContact CG2-CG 4.3Å; I146-Q150 WeakPolarHBondContact O-CB 3.47Å; I146-Q150 WeakPolarHBondContact O-CG 3.27Å; I146-Q150 PolarHBondContact O-N 3.44Å
147E98.6Very high98.5Very high78 Ų7899.5 Ų99.536%0.36449%0.486SS..Hα-helixtrans-59.4-41.8178.5-74.6-177.9-179.600112V143 H144 Q150 K151V143-E147 HydrophobicContact CG1-CG 4.41Å; V143-E147 WeakPolarHBondContact O-CG 3.33Å; V143-E147 PolarHBondContact O-N 3.42Å; H144-E147 PolarHBondContact O-N 3.41Å; E147-Q150 PolarHBondContact O-N 2.96Å; E147-K151 WeakPolarHBondContact O-CB 3.29Å; E147-K151 VanDerWaalsContact O-CG 3.24Å; E147-K151 WeakPolarHBondContact O-CG 3.41Å; E147-K151 PolarHBondContact O-N 3.27Å; E147-K151 IonicContact OE2-NZ 3.67Å
148H98.5Very high98.5Very high120 Ų120101.6 Ų101.656%0.55649%0.489SS*.Hα-helixtrans-61.7-50.1176.4-179.3-87.5000111.2H144 M145 I146 Q150 K151 E152H144-H148 WeakPolarHBondContact O-CB 2.98Å; H144-H148 PolarHBondContact O-N 2.92Å; M145-H148 PolarHBondContact O-N 3.21Å; I146-H148 VanDerWaalsContact C-N 3.3Å; I146-H148 PolarHBondContact O-N 3.27Å; H148-Q150 VanDerWaalsContact C-N 3.32Å; H148-Q150 PolarHBondContact O-N 3.15Å; H148-K151 PolarHBondContact O-N 3.04Å; H148-E152 PolarHBondContact O-N 3.38Å
149A98.6Very high98.5Very high59 Ų59101.3 Ų101.349%0.48849%0.491SS..Hα-helixtrans-60.3-40.8178.500000112.4M145 I146 E152 L153M145-A149 WeakPolarHBondContact O-CB 2.87Å; M145-A149 PolarHBondContact O-N 3.49Å; I146-A149 PolarHBondContact O-N 3.02Å; A149-E152 PolarHBondContact O-N 3.41Å; A149-L153 WeakPolarHBondContact O-CB 3.38Å; A149-L153 PolarHBondContact O-N 2.98Å
150Q98.6Very high98.5Very high122 Ų122102.3 Ų102.357%0.5750%0.495SS*.Hα-helixtrans-65.3-40.3176.2-73.4177.1-13.800112.5I146 E147 H148 L153 Q154I146-Q150 HydrophobicContact CG2-CG 4.3Å; I146-Q150 WeakPolarHBondContact O-CB 3.47Å; I146-Q150 WeakPolarHBondContact O-CG 3.27Å; I146-Q150 PolarHBondContact O-N 3.44Å; E147-Q150 PolarHBondContact O-N 2.96Å; H148-Q150 VanDerWaalsContact C-N 3.32Å; H148-Q150 PolarHBondContact O-N 3.15Å; Q150-L153 PolarHBondContact O-N 3.29Å; Q150-Q154 WeakPolarHBondContact O-CB 3.32Å; Q150-Q154 PolarHBondContact O-N 3.32Å
151K98.6Very high98.5Very high121 Ų121102.9 Ų102.953%0.52650%0.498SS..Hα-helixtrans-61.7-45.7175.3-75.7168.4-171.6167.10111.3E147 H148 Q154 K155E147-K151 WeakPolarHBondContact O-CB 3.29Å; E147-K151 VanDerWaalsContact O-CG 3.24Å; E147-K151 WeakPolarHBondContact O-CG 3.41Å; E147-K151 PolarHBondContact O-N 3.27Å; E147-K151 IonicContact OE2-NZ 3.67Å; H148-K151 PolarHBondContact O-N 3.04Å; K151-Q154 PolarHBondContact O-N 2.98Å; K151-K155 WeakPolarHBondContact O-CG 3.45Å; K151-K155 PolarHBondContact O-N 3.45Å
152E98.6Very high98.5Very high82 Ų82102.1 Ų102.138%0.38349%0.494SS..Hα-helixtrans-63.6-42.8177-68.8-53.8113.400111.9H148 A149 Q154 K155 L156H148-E152 PolarHBondContact O-N 3.38Å; A149-E152 PolarHBondContact O-N 3.41Å; E152-Q154 VanDerWaalsContact C-N 3.32Å; E152-Q154 PolarHBondContact O-N 2.95Å; E152-K155 PolarHBondContact O-N 2.9Å; E152-K155 WeakPolarHBondContact OE1-CD 3.39Å; E152-K155 WeakPolarHBondContact OE1-CE 3.34Å; E152-K155 IonicContact OE1-NZ 4Å; E152-K155 PolarHBondContact OE1-NZ 3.39Å; E152-L156 PolarHBondContact O-N 3.22Å
153L98.6Very high98.5Very high82 Ų82102.8 Ų102.843%0.42950%0.498SS..Hα-helixtrans-58.9-43.5174.4179.863.8000111.9A149 Q150 L156 R157A149-L153 WeakPolarHBondContact O-CB 3.38Å; A149-L153 PolarHBondContact O-N 2.98Å; Q150-L153 PolarHBondContact O-N 3.29Å; L153-L156 PolarHBondContact O-N 2.69Å; L153-R157 HydrophobicContact CD1-CG 4.42Å; L153-R157 WeakPolarHBondContact O-CB 3.12Å; L153-R157 WeakPolarHBondContact O-CG 3.38Å; L153-R157 PolarHBondContact O-N 3.44Å
154Q98.6Very high98.4Very high117 Ų117101.7 Ų101.755%0.54749%0.489SS..Hα-helixtrans-67.1-40.1179.7-173.161.416.900112Q150 K151 E152 R157 K158Q150-Q154 WeakPolarHBondContact O-CB 3.32Å; Q150-Q154 PolarHBondContact O-N 3.32Å; K151-Q154 PolarHBondContact O-N 2.98Å; E152-Q154 VanDerWaalsContact C-N 3.32Å; E152-Q154 PolarHBondContact O-N 2.95Å; Q154-R157 PolarHBondContact O-N 2.87Å; Q154-K158 WeakPolarHBondContact O-CB 3.36Å; Q154-K158 PolarHBondContact O-N 2.7Å
155K98.6Very high98.4Very high130 Ų130103.9 Ų103.957%0.56549%0.493SS*.Hα-helixtrans-59.5-47.6173.3-72.2173.6-172.91710111K151 E152 K158 H159K151-K155 WeakPolarHBondContact O-CG 3.45Å; K151-K155 PolarHBondContact O-N 3.45Å; E152-K155 PolarHBondContact O-N 2.9Å; E152-K155 WeakPolarHBondContact OE1-CD 3.39Å; E152-K155 WeakPolarHBondContact OE1-CE 3.34Å; E152-K155 IonicContact OE1-NZ 4Å; E152-K155 PolarHBondContact OE1-NZ 3.39Å; K155-K158 PolarHBondContact O-N 2.79Å; K155-H159 PolarHBondContact O-N 3.47Å
156L98.6Very high98.3Very high98 Ų98102.7 Ų102.751%0.51349%0.485SS..Hα-helixtrans-63.7-44179.7-176.462.5000111.7E152 L153 K158 H159 I160E152-L156 PolarHBondContact O-N 3.22Å; L153-L156 PolarHBondContact O-N 2.69Å; L156-K158 VanDerWaalsContact C-N 3.34Å; L156-K158 PolarHBondContact O-N 2.9Å; L156-H159 PolarHBondContact O-N 2.98Å; L156-I160 HydrophobicContact CD1-CD1 4.32Å; L156-I160 HydrophobicContact CD1-CG1 4.48Å; L156-I160 HydrophobicContact CG-CD1 3.96Å; L156-I160 VanDerWaalsContact O-CG1 3.31Å; L156-I160 WeakPolarHBondContact O-CG1 3.34Å; L156-I160 PolarHBondContact O-N 3.29Å
157R98.5Very high98.1Very high138 Ų138104.1 Ų104.152%0.52149%0.485SS..Hα-helixtrans-58.7-45.2175.5-78.1177.1173.2-179-1.8112L153 Q154 I160 Q161L153-R157 HydrophobicContact CD1-CG 4.42Å; L153-R157 WeakPolarHBondContact O-CB 3.12Å; L153-R157 WeakPolarHBondContact O-CG 3.38Å; L153-R157 PolarHBondContact O-N 3.44Å; Q154-R157 PolarHBondContact O-N 2.87Å; R157-I160 PolarHBondContact O-N 2.93Å; R157-Q161 VanDerWaalsContact O-CG 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.28Å; R157-Q161 PolarHBondContact O-N 3.03Å
158K98.6Very high98Very high124 Ų124105 Ų10554%0.53949%0.487SS..Hα-helixtrans-60.5-46.5175.9-175.5-179.5176.6-177.90110.9Q154 K155 L156 I160 Q161 D162Q154-K158 WeakPolarHBondContact O-CB 3.36Å; Q154-K158 PolarHBondContact O-N 2.7Å; K155-K158 PolarHBondContact O-N 2.79Å; L156-K158 VanDerWaalsContact C-N 3.34Å; L156-K158 PolarHBondContact O-N 2.9Å; K158-I160 PolarHBondContact O-N 3.4Å; K158-Q161 WeakPolarHBondContact O-CB 3.49Å; K158-Q161 PolarHBondContact O-N 3.02Å; K158-Q161 VanDerWaalsContact O-N 3.16Å; K158-D162 VanDerWaalsContact O-CG 3.28Å; K158-D162 PolarHBondContact O-N 2.95Å
159H98.4Very high97.9Very high107 Ų107102.6 Ų102.650%0.49548%0.478SS..Hα-helixtrans-60.6-43.7178.6-17458.6000112.7K155 L156 Q161 D162 L163K155-H159 PolarHBondContact O-N 3.47Å; L156-H159 PolarHBondContact O-N 2.98Å; H159-Q161 VanDerWaalsContact C-N 3.33Å; H159-Q161 PolarHBondContact O-N 3.38Å; H159-D162 PolarHBondContact O-N 3.43Å; H159-L163 WeakPolarHBondContact O-CG 3.35Å; H159-L163 PolarHBondContact O-N 2.96Å
160I98.3Very high97.7Very high83 Ų83106.5 Ų106.543%0.42649%0.488SS..Hα-helixtrans-60.7-43.3174.9-68.6166.5000110.8L156 R157 K158 L163 N164L156-I160 HydrophobicContact CD1-CD1 4.32Å; L156-I160 HydrophobicContact CD1-CG1 4.48Å; L156-I160 HydrophobicContact CG-CD1 3.96Å; L156-I160 VanDerWaalsContact O-CG1 3.31Å; L156-I160 WeakPolarHBondContact O-CG1 3.34Å; L156-I160 PolarHBondContact O-N 3.29Å; R157-I160 PolarHBondContact O-N 2.93Å; K158-I160 PolarHBondContact O-N 3.4Å; I160-L163 PolarHBondContact O-N 3.19Å; I160-N164 WeakPolarHBondContact O-CB 3.42Å; I160-N164 VanDerWaalsContact O-CG 3.3Å; I160-N164 PolarHBondContact O-N 3.3Å; I160-N164 PolarHBondContact O-ND2 2.96Å
161Q98.2Very high97.5Very high128 Ų128101.6 Ų101.660%0.59847%0.465SS*.Hα-helixtrans-63.7-45.1177.7-74.9175.8-7.800112R157 K158 H159 L163 N164 W165R157-Q161 VanDerWaalsContact O-CG 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.28Å; R157-Q161 PolarHBondContact O-N 3.03Å; K158-Q161 WeakPolarHBondContact O-CB 3.49Å; K158-Q161 PolarHBondContact O-N 3.02Å; K158-Q161 VanDerWaalsContact O-N 3.16Å; H159-Q161 VanDerWaalsContact C-N 3.33Å; H159-Q161 PolarHBondContact O-N 3.38Å; Q161-L163 PolarHBondContact O-N 2.99Å; Q161-N164 PolarHBondContact O-N 3.49Å; Q161-W165 WeakPolarHBondContact O-CB 3.31Å; Q161-W165 PolarHBondContact O-N 3.21Å
162D98.3Very high97.3Very high73 Ų7399.2 Ų99.239%0.3946%0.458SS..Hα-helixtrans-61.1-44.8178.4-68.3-21.4000110.9K158 H159 W165 Q166K158-D162 VanDerWaalsContact O-CG 3.28Å; K158-D162 PolarHBondContact O-N 2.95Å; H159-D162 PolarHBondContact O-N 3.43Å; D162-W165 PolarHBondContact O-N 3.43Å; D162-Q166 WeakPolarHBondContact O-CG 3.32Å; D162-Q166 PolarHBondContact O-N 2.96Å
163L97.8Very high97.2Very high74 Ų7499.3 Ų99.339%0.38747%0.468SS..Hα-helixtrans-62.2-45.7175.3-74.8176.5000112.3H159 I160 Q161 W165 Q166 R167H159-L163 WeakPolarHBondContact O-CG 3.35Å; H159-L163 PolarHBondContact O-N 2.96Å; I160-L163 PolarHBondContact O-N 3.19Å; Q161-L163 PolarHBondContact O-N 2.99Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.23Å; L163-Q166 PolarHBondContact O-N 3.38Å; L163-R167 WeakPolarHBondContact O-CB 3.46Å; L163-R167 PolarHBondContact O-N 3.26Å
164N96.8Very high96.9Very high52 Ų5297.4 Ų97.428%0.27846%0.464SS..Hα-helixtrans-64.7-36.8178.1-78.3-17.4000111.8Y18 I160 Q161 R167 K168Y18-N164 WeakPolarHBondContact OH-CB 3.33Å; I160-N164 WeakPolarHBondContact O-CB 3.42Å; I160-N164 VanDerWaalsContact O-CG 3.3Å; I160-N164 PolarHBondContact O-N 3.3Å; I160-N164 PolarHBondContact O-ND2 2.96Å; Q161-N164 PolarHBondContact O-N 3.49Å; N164-R167 PolarHBondContact O-N 2.92Å; N164-R167 PolarHBondContact OD1-NH1 3.28Å; N164-K168 VanDerWaalsContact O-CB 3.29Å; N164-K168 WeakPolarHBondContact O-CB 3.15Å; N164-K168 PolarHBondContact O-N 3.22Å
165W97.8Very high96.7Very high166 Ų16691.9 Ų91.963%0.62944%0.438SS*.Hα-helixtrans-64.2-47.3175.1-179.381.1000111.6Q161 D162 L163 R167 K168 N169Q161-W165 WeakPolarHBondContact O-CB 3.31Å; Q161-W165 PolarHBondContact O-N 3.21Å; D162-W165 PolarHBondContact O-N 3.43Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.23Å; W165-R167 PolarHBondContact O-N 3.19Å; W165-K168 PolarHBondContact O-N 2.99Å; W165-N169 WeakPolarHBondContact CH2-ND2 3.27Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.46Å; W165-N169 PolarHBondContact O-N 3.41Å
166Q96.9Very high96.5Very high105 Ų10589.3 Ų89.349%0.49144%0.436SS..Hα-helixtrans-58.8-48.1174.6-711759.200111.4D162 L163 K168 N169 M170D162-Q166 WeakPolarHBondContact O-CG 3.32Å; D162-Q166 PolarHBondContact O-N 2.96Å; L163-Q166 PolarHBondContact O-N 3.38Å; Q166-K168 PolarHBondContact O-N 3.46Å; Q166-N169 PolarHBondContact O-N 3.46Å; Q166-M170 WeakPolarHBondContact O-CG 3.33Å; Q166-M170 PolarHBondContact O-N 3.46Å
167R95.1Very high96.4Very high127 Ų12790.5 Ų90.548%0.47944%0.438SS..Hα-helixtrans-58.6-46.9177.6-172.4-177.9-64.2146.7-1.1111.5Y18 L163 N164 W165 N169 M170 Q171Y18-R167 HydrophobicContact CD2-CG 4.3Å; Y18-R167 HydrophobicContact CE2-CB 4.29Å; Y18-R167 HydrophobicContact CE2-CG 4.17Å; L163-R167 WeakPolarHBondContact O-CB 3.46Å; L163-R167 PolarHBondContact O-N 3.26Å; N164-R167 PolarHBondContact O-N 2.92Å; N164-R167 PolarHBondContact OD1-NH1 3.28Å; W165-R167 PolarHBondContact O-N 3.19Å; R167-N169 PolarHBondContact O-N 3.49Å; R167-M170 PolarHBondContact O-N 3.27Å; R167-Q171 HydrophobicContact CG-CG 4.31Å; R167-Q171 WeakPolarHBondContact O-CB 3.44Å; R167-Q171 VanDerWaalsContact O-CG 3.26Å; R167-Q171 WeakPolarHBondContact O-CG 3.33Å; R167-Q171 PolarHBondContact O-N 3.5Å
168K95.5Very high96.2Very high98 Ų9888.1 Ų88.143%0.42644%0.435SS..Hα-helixtrans-58.9-46.2178.2-178.4174.9180178.50111.6Y18 N164 W165 Q166 Q171 L172Y18-K168 HydrophobicContact CD1-CB 4.17Å; Y18-K168 HydrophobicContact CD1-CD 4.14Å; Y18-K168 HydrophobicContact CD1-CG 4.01Å; Y18-K168 HydrophobicContact CD2-CB 3.84Å; Y18-K168 HydrophobicContact CD2-CG 4.39Å; Y18-K168 HydrophobicContact CE1-CB 4.37Å; Y18-K168 HydrophobicContact CE1-CD 4.4Å; Y18-K168 HydrophobicContact CE2-CB 4.04Å; Y18-K168 HydrophobicContact CG-CB 3.92Å; Y18-K168 HydrophobicContact CG-CG 3.95Å; N164-K168 VanDerWaalsContact O-CB 3.29Å; N164-K168 WeakPolarHBondContact O-CB 3.15Å; N164-K168 PolarHBondContact O-N 3.22Å; W165-K168 PolarHBondContact O-N 2.99Å; Q166-K168 PolarHBondContact O-N 3.46Å; K168-Q171 PolarHBondContact O-N 3.26Å; K168-L172 HydrophobicContact CD-CD1 4.49Å; K168-L172 HydrophobicContact CG-CD1 3.84Å; K168-L172 HydrophobicContact CG-CG 4.27Å; K168-L172 WeakPolarHBondContact O-CB 3.44Å; K168-L172 VanDerWaalsContact O-CG 3.27Å; K168-L172 WeakPolarHBondContact O-CG 3.48Å; K168-L172 PolarHBondContact O-N 3.28Å
169N96.6Very high96Very high68 Ų6889.9 Ų89.936%0.36444%0.438SS..Hα-helixtrans-62.6-45.1179.2-71-15.9000112.1W165 Q166 R167 S173W165-N169 WeakPolarHBondContact CH2-ND2 3.27Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.46Å; W165-N169 PolarHBondContact O-N 3.41Å; Q166-N169 PolarHBondContact O-N 3.46Å; R167-N169 PolarHBondContact O-N 3.49Å; N169-S173 WeakPolarHBondContact O-CB 3.48Å; N169-S173 PolarHBondContact O-N 3.26Å
170M94.6Very high95.9Very high141 Ų14190.1 Ų90.170%0.69544%0.439SS*.Hα-helixtrans-60.1-47.7176.5-71.5178.46500111.6Q166 R167 S173 A174Q166-M170 WeakPolarHBondContact O-CG 3.33Å; Q166-M170 PolarHBondContact O-N 3.46Å; R167-M170 PolarHBondContact O-N 3.27Å; M170-S173 PolarHBondContact O-N 3.03Å; M170-A174 WeakPolarHBondContact O-CB 3.48Å; M170-A174 PolarHBondContact O-N 2.92Å
171Q94.5Very high95.9Very high19 Ų1991.2 Ų91.29%0.08944%0.444CS..Hα-helixtrans-66.9-40.8-178.1-68.5-174.21.700112.6L16 Y18 R167 K168 A174 G175L16-Q171 HydrophobicContact CB-CB 4.36Å; L16-Q171 HydrophobicContact CB-CG 4.38Å; L16-Q171 HydrophobicContact CD2-CB 4.1Å; L16-Q171 HydrophobicContact CD2-CG 3.69Å; Y18-Q171 VanDerWaalsContact CB-OE1 3.3Å; Y18-Q171 VanDerWaalsContact CD2-OE1 3.32Å; R167-Q171 HydrophobicContact CG-CG 4.31Å; R167-Q171 WeakPolarHBondContact O-CB 3.44Å; R167-Q171 VanDerWaalsContact O-CG 3.26Å; R167-Q171 WeakPolarHBondContact O-CG 3.33Å; R167-Q171 PolarHBondContact O-N 3.5Å; K168-Q171 PolarHBondContact O-N 3.26Å; Q171-A174 PolarHBondContact O-N 3.45Å; Q171-G175 PolarHBondContact O-N 2.99Å
172L94.8Very high95.8Very high72 Ų7291.2 Ų91.238%0.37744%0.444SS..Hα-helixtrans-67-37.6176.8-69.7177.9000112.1F19 K168 S176F19-L172 HydrophobicContact CD2-CD2 4.3Å; K168-L172 HydrophobicContact CD-CD1 4.49Å; K168-L172 HydrophobicContact CG-CD1 3.84Å; K168-L172 HydrophobicContact CG-CG 4.27Å; K168-L172 WeakPolarHBondContact O-CB 3.44Å; K168-L172 VanDerWaalsContact O-CG 3.27Å; K168-L172 WeakPolarHBondContact O-CG 3.48Å; K168-L172 PolarHBondContact O-N 3.28Å; L172-S176 WeakPolarHBondContact O-CB 3.32Å; L172-S176 PolarHBondContact O-N 3.48Å
173S95.3Very high95.8Very high84 Ų8491.4 Ų91.459%0.58745%0.451SS*.Hα-helixtrans-65.8-48175.3-178.60000111.7N169 M170 S176 K177N169-S173 WeakPolarHBondContact O-CB 3.48Å; N169-S173 PolarHBondContact O-N 3.26Å; M170-S173 PolarHBondContact O-N 3.03Å; S173-S176 PolarHBondContact O-N 3.34Å; S173-K177 PolarHBondContact O-N 3.05Å
174A93.9Very high95.8Very high42 Ų4291.8 Ų91.835%0.34745%0.453SS..Hα-helixtrans-61.3-45.9175.800000111.6L16 M170 Q171 S176 K177 L178L16-A174 HydrophobicContact CD1-CB 4.45Å; M170-A174 WeakPolarHBondContact O-CB 3.48Å; M170-A174 PolarHBondContact O-N 2.92Å; Q171-A174 PolarHBondContact O-N 3.45Å; A174-S176 PolarHBondContact O-N 3.22Å; A174-K177 WeakPolarHBondContact O-CA 3.48Å; A174-K177 WeakPolarHBondContact O-CB 3.36Å; A174-K177 PolarHBondContact O-N 2.93Å; A174-L178 PolarHBondContact O-N 3.4Å
175G93.2Very high95.8Very high0 Ų097.2 Ų97.20%047%0.47CS..Hα-helixtrans-62.7-37.4178.100000113.6F19 Q171 K177 L178 R179F19-G175 VanDerWaalsContact CE2-CA 3.47Å; F19-G175 WeakPolarHBondContact CZ-O 3.17Å; Q171-G175 PolarHBondContact O-N 2.99Å; G175-K177 VanDerWaalsContact C-N 3.26Å; G175-K177 PolarHBondContact O-N 3.41Å; G175-L178 PolarHBondContact O-N 3.4Å; G175-R179 PolarHBondContact O-N 3.24Å
176S94.8Very high95.9Very high76 Ų7692.6 Ų92.653%0.53146%0.46SS..Hα-helixtrans-59.9-39.9171.9-173.30000111.8L172 S173 A174 R179 E180L172-S176 WeakPolarHBondContact O-CB 3.32Å; L172-S176 PolarHBondContact O-N 3.48Å; S173-S176 PolarHBondContact O-N 3.34Å; A174-S176 PolarHBondContact O-N 3.22Å; S176-R179 PolarHBondContact O-N 3.15Å; S176-E180 PolarHBondContact O-N 2.89Å; S176-E180 VanDerWaalsContact O-N 3.08Å
177K95.5Very high95.9Very high124 Ų12491 Ų9154%0.53946%0.461SS..Hα-helixtrans-70.4-36.8177.8-170.8145.8-175.5166.60112.1S173 A174 G175 E180 M181S173-K177 PolarHBondContact O-N 3.05Å; A174-K177 WeakPolarHBondContact O-CA 3.48Å; A174-K177 WeakPolarHBondContact O-CB 3.36Å; A174-K177 PolarHBondContact O-N 2.93Å; G175-K177 VanDerWaalsContact C-N 3.26Å; G175-K177 PolarHBondContact O-N 3.41Å; K177-E180 PolarHBondContact O-N 3.43Å; K177-M181 HydrophobicContact CD-CE 4.36Å; K177-M181 HydrophobicContact CG-CE 3.88Å; K177-M181 HydrophobicContact CG-SD 4.45Å; K177-M181 WeakPolarHBondContact O-CB 3.42Å; K177-M181 VanDerWaalsContact O-CG 3.28Å; K177-M181 WeakPolarHBondContact O-CG 3.5Å; K177-M181 PolarHBondContact O-N 2.94Å
178L94.6Very high96Very high88 Ų8890 Ų9046%0.46146%0.464SS..Hα-helixtrans-60.3-45.5171.8-71174.7000111.5L16 A174 G175 E180 M181 E182L16-L178 HydrophobicContact CD1-CD1 3.75Å; A174-L178 PolarHBondContact O-N 3.4Å; G175-L178 PolarHBondContact O-N 3.4Å; L178-E180 VanDerWaalsContact C-N 3.34Å; L178-E180 PolarHBondContact O-N 3.14Å; L178-M181 PolarHBondContact O-N 3.5Å; L178-E182 WeakPolarHBondContact O-CB 3.39Å; L178-E182 PolarHBondContact O-N 2.91Å
179R94.8Very high96.1Very high161 Ų16188.6 Ų88.661%0.60846%0.463SS*.Hα-helixtrans-62.4-40177.1-170.7-177.2-63.9170.81.2112.5G175 S176 E182 S183G175-R179 PolarHBondContact O-N 3.24Å; S176-R179 PolarHBondContact O-N 3.15Å; R179-E182 PolarHBondContact O-N 3.1Å; R179-S183 WeakPolarHBondContact O-CB 3.47Å; R179-S183 PolarHBondContact O-N 3.39Å
180E97.2Very high96.2Very high112 Ų11287.9 Ų87.952%0.52346%0.464SS..Hα-helixtrans-62.6-46.5174.4-174.2-170.7168.600111.2S176 K177 L178 E182 S183 N184S176-E180 PolarHBondContact O-N 2.89Å; S176-E180 VanDerWaalsContact O-N 3.08Å; K177-E180 PolarHBondContact O-N 3.43Å; L178-E180 VanDerWaalsContact C-N 3.34Å; L178-E180 PolarHBondContact O-N 3.14Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.69Å; E180-S183 PolarHBondContact O-N 3.36Å; E180-N184 WeakPolarHBondContact O-CB 3.45Å; E180-N184 VanDerWaalsContact O-CG 3.23Å; E180-N184 PolarHBondContact O-N 3.38Å; E180-N184 PolarHBondContact O-ND2 3.31Å
181M97.3Very high96.3Very high106 Ų10687.1 Ų87.152%0.52246%0.456SS..Hα-helixtrans-61.9-41.3177.1-72.7177.3176.400112.1K177 L178 N184 W185K177-M181 HydrophobicContact CD-CE 4.36Å; K177-M181 HydrophobicContact CG-CE 3.88Å; K177-M181 HydrophobicContact CG-SD 4.45Å; K177-M181 WeakPolarHBondContact O-CB 3.42Å; K177-M181 VanDerWaalsContact O-CG 3.28Å; K177-M181 WeakPolarHBondContact O-CG 3.5Å; K177-M181 PolarHBondContact O-N 2.94Å; L178-M181 PolarHBondContact O-N 3.5Å; M181-N184 PolarHBondContact O-N 2.96Å; M181-W185 WeakPolarHBondContact O-CB 3.44Å; M181-W185 PolarHBondContact O-N 3.14Å
182E96.7Very high96.5Very high128 Ų12890.8 Ų90.860%0.59848%0.477SS*.Hα-helixtrans-62.7-47.1175.3-174.7179.9-168.200111.3L178 R179 E180 N184 W185 V186L178-E182 WeakPolarHBondContact O-CB 3.39Å; L178-E182 PolarHBondContact O-N 2.91Å; R179-E182 PolarHBondContact O-N 3.1Å; E180-E182 VanDerWaalsContact C-N 3.35Å; E180-E182 PolarHBondContact O-N 2.69Å; E182-N184 VanDerWaalsContact C-N 3.33Å; E182-N184 PolarHBondContact O-N 2.92Å; E182-W185 WeakPolarHBondContact O-CB 3.24Å; E182-W185 PolarHBondContact O-N 3.36Å; E182-V186 WeakPolarHBondContact O-CG2 3.32Å; E182-V186 PolarHBondContact O-N 3.15Å
183S97.4Very high96.6Very high76 Ų7694.7 Ų94.753%0.53149%0.487SS..Hα-helixtrans-61.1-42.2176.4-175.60000112.1R179 E180 W185 V186 S187R179-S183 WeakPolarHBondContact O-CB 3.47Å; R179-S183 PolarHBondContact O-N 3.39Å; E180-S183 PolarHBondContact O-N 3.36Å; S183-W185 VanDerWaalsContact C-N 3.33Å; S183-V186 PolarHBondContact O-N 3.48Å; S183-S187 WeakPolarHBondContact O-CB 3.44Å; S183-S187 PolarHBondContact O-N 2.65Å
184N97.9Very high96.7Very high82 Ų8296.6 Ų96.644%0.43949%0.487SS..Hα-helixtrans-64-41.3176.2-72.8-19.7000111.1E180 M181 E182 S187 L188E180-N184 WeakPolarHBondContact O-CB 3.45Å; E180-N184 VanDerWaalsContact O-CG 3.23Å; E180-N184 PolarHBondContact O-N 3.38Å; E180-N184 PolarHBondContact O-ND2 3.31Å; M181-N184 PolarHBondContact O-N 2.96Å; E182-N184 VanDerWaalsContact C-N 3.33Å; E182-N184 PolarHBondContact O-N 2.92Å; N184-S187 PolarHBondContact O-N 3.11Å; N184-L188 WeakPolarHBondContact O-CB 3.32Å; N184-L188 VanDerWaalsContact O-CG 3.24Å; N184-L188 WeakPolarHBondContact O-CG 3.46Å; N184-L188 PolarHBondContact O-N 2.94Å
185W98.2Very high96.9Very high167 Ų16798.3 Ų98.363%0.63349%0.49SS*.Hα-helixtrans-62.1-49.3175.5177.183.1000111.7M181 E182 S183 S187 L188 V189M181-W185 WeakPolarHBondContact O-CB 3.44Å; M181-W185 PolarHBondContact O-N 3.14Å; E182-W185 WeakPolarHBondContact O-CB 3.24Å; E182-W185 PolarHBondContact O-N 3.36Å; S183-W185 VanDerWaalsContact C-N 3.33Å; W185-S187 VanDerWaalsContact C-N 3.29Å; W185-S187 PolarHBondContact O-N 2.97Å; W185-L188 PolarHBondContact O-N 3.39Å; W185-V189 HydrophobicContact CD2-CG2 4.1Å; W185-V189 HydrophobicContact CG-CG2 4.46Å; W185-V189 HydrophobicContact CZ2-CG2 3.9Å; W185-V189 WeakPolarHBondContact O-CB 3.34Å; W185-V189 VanDerWaalsContact O-CG2 3.31Å; W185-V189 WeakPolarHBondContact O-CG2 3.4Å; W185-V189 PolarHBondContact O-N 3.33Å
186V98.1Very high97Very high68 Ų68104.2 Ų104.241%0.41252%0.517SS..Hα-helixtrans-57.8-44.1176.4173.30000110.8E182 S183 V189 S190E182-V186 WeakPolarHBondContact O-CG2 3.32Å; E182-V186 PolarHBondContact O-N 3.15Å; S183-V186 PolarHBondContact O-N 3.48Å; V186-V189 PolarHBondContact O-N 3.4Å; V186-S190 VanDerWaalsContact O-CB 3.28Å; V186-S190 WeakPolarHBondContact O-CB 3.48Å; V186-S190 PolarHBondContact O-N 2.88Å; V186-S190 PolarHBondContact O-OG 3.42Å
187S97.8Very high97.2Very high73 Ų73107.8 Ų107.851%0.5152%0.519SS..Hα-helixtrans-61.9-46.5178-179.90000112.2S183 N184 W185 S190 K191S183-S187 WeakPolarHBondContact O-CB 3.44Å; S183-S187 PolarHBondContact O-N 2.65Å; N184-S187 PolarHBondContact O-N 3.11Å; W185-S187 VanDerWaalsContact C-N 3.29Å; W185-S187 PolarHBondContact O-N 2.97Å; S187-S190 PolarHBondContact O-N 3.3Å; S187-K191 VanDerWaalsContact O-CB 3.28Å; S187-K191 WeakPolarHBondContact O-CB 3.42Å; S187-K191 PolarHBondContact O-N 2.91Å
188L97.9Very high97.2Very high106 Ų106105 Ų10556%0.55551%0.512SS*.Hα-helixtrans-64-43.6178-72.8171.1000112.1N184 W185 K191 N192N184-L188 WeakPolarHBondContact O-CB 3.32Å; N184-L188 VanDerWaalsContact O-CG 3.24Å; N184-L188 WeakPolarHBondContact O-CG 3.46Å; N184-L188 PolarHBondContact O-N 2.94Å; W185-L188 PolarHBondContact O-N 3.39Å; L188-K191 PolarHBondContact O-N 3.37Å; L188-N192 WeakPolarHBondContact O-CB 3.49Å; L188-N192 PolarHBondContact O-N 2.86Å
189V97.8Very high97.3Very high67 Ų67104.6 Ų104.641%0.40651%0.51SS..Hα-helixtrans-63.5-44.8176.6172.50000110.7W185 V186 K191 N192 Y193W185-V189 HydrophobicContact CD2-CG2 4.1Å; W185-V189 HydrophobicContact CG-CG2 4.46Å; W185-V189 HydrophobicContact CZ2-CG2 3.9Å; W185-V189 WeakPolarHBondContact O-CB 3.34Å; W185-V189 VanDerWaalsContact O-CG2 3.31Å; W185-V189 WeakPolarHBondContact O-CG2 3.4Å; W185-V189 PolarHBondContact O-N 3.33Å; V186-V189 PolarHBondContact O-N 3.4Å; V189-K191 PolarHBondContact O-N 3.18Å; V189-N192 PolarHBondContact O-N 3.49Å; V189-Y193 WeakPolarHBondContact O-CB 3.5Å; V189-Y193 PolarHBondContact O-N 2.9Å
190S97.5Very high97.5Very high54 Ų54100.5 Ų100.538%0.37850%0.503SS..Hα-helixtrans-62.7-43.7178.2-56.80000111.4V186 S187 Y193 E194V186-S190 VanDerWaalsContact O-CB 3.28Å; V186-S190 WeakPolarHBondContact O-CB 3.48Å; V186-S190 PolarHBondContact O-N 2.88Å; V186-S190 PolarHBondContact O-OG 3.42Å; S187-S190 PolarHBondContact O-N 3.3Å; S190-Y193 WeakPolarHBondContact O-CB 3.49Å; S190-Y193 PolarHBondContact O-N 3.05Å; S190-E194 WeakPolarHBondContact O-CG 3.35Å; S190-E194 PolarHBondContact O-N 3.47Å
191K97.8Very high97.4Very high124 Ų12499.2 Ų99.254%0.53950%0.497SS..Hα-helixtrans-64.4-42.1177.3-174.2171.4-177.3176.90112.2S187 L188 V189 Y193 E194 I195S187-K191 VanDerWaalsContact O-CB 3.28Å; S187-K191 WeakPolarHBondContact O-CB 3.42Å; S187-K191 PolarHBondContact O-N 2.91Å; L188-K191 PolarHBondContact O-N 3.37Å; V189-K191 PolarHBondContact O-N 3.18Å; K191-Y193 VanDerWaalsContact C-N 3.3Å; K191-Y193 PolarHBondContact O-N 3.45Å; K191-E194 PolarHBondContact O-N 2.95Å; K191-I195 HydrophobicContact CG-CD1 4.06Å; K191-I195 WeakPolarHBondContact O-CD1 3.34Å; K191-I195 VanDerWaalsContact O-CG1 3.23Å; K191-I195 WeakPolarHBondContact O-CG1 3.46Å; K191-I195 PolarHBondContact O-N 2.94Å
192N97.8Very high97.3Very high96 Ų9698.6 Ų98.651%0.51350%0.495SS..Hα-helixtrans-60.7-43.5174.2-77.1-12.3000111L188 V189 E194 I195 E196L188-N192 WeakPolarHBondContact O-CB 3.49Å; L188-N192 PolarHBondContact O-N 2.86Å; V189-N192 PolarHBondContact O-N 3.49Å; N192-E194 PolarHBondContact O-N 3.3Å; N192-I195 PolarHBondContact O-N 3.36Å; N192-E196 WeakPolarHBondContact O-CG 3.47Å; N192-E196 PolarHBondContact O-N 3.4Å
193Y97.4Very high97.3Very high154 Ų15498.1 Ų98.160%0.60449%0.493SS*.Hα-helixtrans-62.9-41.3176.4-178.2-101.1000112.9V189 S190 K191 I195 E196 R197V189-Y193 WeakPolarHBondContact O-CB 3.5Å; V189-Y193 PolarHBondContact O-N 2.9Å; S190-Y193 WeakPolarHBondContact O-CB 3.49Å; S190-Y193 PolarHBondContact O-N 3.05Å; K191-Y193 VanDerWaalsContact C-N 3.3Å; K191-Y193 PolarHBondContact O-N 3.45Å; Y193-I195 VanDerWaalsContact C-N 3.34Å; Y193-E196 PolarHBondContact O-N 3.36Å; Y193-R197 WeakPolarHBondContact O-CB 3.49Å; Y193-R197 PolarHBondContact O-N 3.35Å
194E97.3Very high97.1Very high125 Ų12598.9 Ų98.958%0.58449%0.491SS*.Hα-helixtrans-62.6-40.5174.4-74.1173.5-175.800112.1S190 K191 N192 R197 T198S190-E194 WeakPolarHBondContact O-CG 3.35Å; S190-E194 PolarHBondContact O-N 3.47Å; K191-E194 PolarHBondContact O-N 2.95Å; N192-E194 PolarHBondContact O-N 3.3Å; E194-R197 PolarHBondContact O-N 3.47Å; E194-T198 WeakPolarHBondContact O-CB 3.5Å; E194-T198 WeakPolarHBondContact O-CG2 3.47Å; E194-T198 PolarHBondContact O-N 2.97Å; E194-T198 PolarHBondContact O-OG1 3.49Å
195I97.3Very high96.9Very high77 Ų77100 Ų10040%0.39549%0.493SS..Hα-helixtrans-63.8-49.2175.6-68.9165000110.2K191 N192 Y193 R197 T198 I199K191-I195 HydrophobicContact CG-CD1 4.06Å; K191-I195 WeakPolarHBondContact O-CD1 3.34Å; K191-I195 VanDerWaalsContact O-CG1 3.23Å; K191-I195 WeakPolarHBondContact O-CG1 3.46Å; K191-I195 PolarHBondContact O-N 2.94Å; N192-I195 PolarHBondContact O-N 3.36Å; Y193-I195 VanDerWaalsContact C-N 3.34Å; I195-R197 VanDerWaalsContact C-N 3.32Å; I195-R197 PolarHBondContact O-N 3.07Å; I195-T198 WeakPolarHBondContact CA-OG1 3.37Å; I195-T198 PolarHBondContact O-N 3.12Å; I195-T198 PolarHBondContact O-OG1 2.92Å; I195-I199 HydrophobicContact CG2-CD1 3.72Å; I195-I199 HydrophobicContact CG2-CG1 4.38Å; I195-I199 VanDerWaalsContact O-CG1 3.26Å; I195-I199 WeakPolarHBondContact O-CG1 3.42Å; I195-I199 PolarHBondContact O-N 3.37Å
196E96.9Very high96.7Very high125 Ų12596.2 Ų96.258%0.58449%0.485SS*.Hα-helixtrans-59.4-43.6177.6-74.3-180-175.300111.7N192 Y193 T198 I199 V200N192-E196 WeakPolarHBondContact O-CG 3.47Å; N192-E196 PolarHBondContact O-N 3.4Å; Y193-E196 PolarHBondContact O-N 3.36Å; E196-T198 PolarHBondContact O-N 3.18Å; E196-I199 PolarHBondContact O-N 2.78Å; E196-V200 WeakPolarHBondContact O-CG2 3.47Å; E196-V200 PolarHBondContact O-N 3.25Å
197R97.4Very high96.4Very high150 Ų15096.6 Ų96.657%0.56649%0.49SS*.Hα-helixtrans-61.4-44.4176.7-179.6-178.6173-174.60.6112.2Y193 E194 I195 V200 Q201Y193-R197 WeakPolarHBondContact O-CB 3.49Å; Y193-R197 PolarHBondContact O-N 3.35Å; E194-R197 PolarHBondContact O-N 3.47Å; I195-R197 VanDerWaalsContact C-N 3.32Å; I195-R197 PolarHBondContact O-N 3.07Å; R197-V200 PolarHBondContact O-N 3.4Å; R197-Q201 WeakPolarHBondContact O-CG 3.46Å; R197-Q201 PolarHBondContact O-N 2.91Å
198T97.1Very high96Very high65 Ų6598.7 Ų98.740%0.39949%0.492SS..Hα-helixtrans-68.9-36.2179.3450000111.9E194 I195 E196 Q201 L202E194-T198 WeakPolarHBondContact O-CB 3.5Å; E194-T198 WeakPolarHBondContact O-CG2 3.47Å; E194-T198 PolarHBondContact O-N 2.97Å; E194-T198 PolarHBondContact O-OG1 3.49Å; I195-T198 WeakPolarHBondContact CA-OG1 3.37Å; I195-T198 PolarHBondContact O-N 3.12Å; I195-T198 PolarHBondContact O-OG1 2.92Å; E196-T198 PolarHBondContact O-N 3.18Å; T198-Q201 PolarHBondContact O-N 3.43Å; T198-L202 WeakPolarHBondContact O-CB 3.35Å; T198-L202 VanDerWaalsContact O-CG 3.29Å; T198-L202 WeakPolarHBondContact O-CG 3.37Å; T198-L202 PolarHBondContact O-N 3.28Å
199I96.8Very high95.7Very high80 Ų8098.2 Ų98.241%0.4149%0.488SS..Hα-helixtrans-58.9-49.7171.7-69.9166.4000110.4I195 E196 Q201 L202 E203I195-I199 HydrophobicContact CG2-CD1 3.72Å; I195-I199 HydrophobicContact CG2-CG1 4.38Å; I195-I199 VanDerWaalsContact O-CG1 3.26Å; I195-I199 WeakPolarHBondContact O-CG1 3.42Å; I195-I199 PolarHBondContact O-N 3.37Å; E196-I199 PolarHBondContact O-N 2.78Å; I199-Q201 VanDerWaalsContact C-N 3.3Å; I199-Q201 PolarHBondContact O-N 3.25Å; I199-L202 PolarHBondContact O-N 2.96Å; I199-E203 HydrophobicContact CG2-CG 4.27Å; I199-E203 WeakPolarHBondContact O-CB 3.25Å; I199-E203 WeakPolarHBondContact O-CG 3.5Å; I199-E203 PolarHBondContact O-N 3.2Å
200V97Very high95.2Very high76 Ų76102.2 Ų102.246%0.46150%0.5SS..Hα-helixtrans-61.2-38.6178.8171.80000111.8E196 R197 N204E196-V200 WeakPolarHBondContact O-CG2 3.47Å; E196-V200 PolarHBondContact O-N 3.25Å; R197-V200 PolarHBondContact O-N 3.4Å; V200-N204 PolarHBondContact O-N 2.89Å; V200-N204 VanDerWaalsContact O-N 3.09Å; V200-N204 PolarHBondContact O-ND2 3.48Å
201Q96Very high94.5Very high84 Ų84105.2 Ų105.239%0.39351%0.508SS..Hα-helixtrans-63.7-47.3175-73.9174.4-23.900111.6R197 T198 I199 E203 N204 E205R197-Q201 WeakPolarHBondContact O-CG 3.46Å; R197-Q201 PolarHBondContact O-N 2.91Å; T198-Q201 PolarHBondContact O-N 3.43Å; I199-Q201 VanDerWaalsContact C-N 3.3Å; I199-Q201 PolarHBondContact O-N 3.25Å; Q201-E203 PolarHBondContact O-N 3.25Å; Q201-N204 WeakPolarHBondContact O-CB 3.41Å; Q201-N204 PolarHBondContact O-N 3.44Å; Q201-E205 WeakPolarHBondContact O-CG 3.44Å; Q201-E205 PolarHBondContact O-N 3.25Å
202L95.9Very high93.6Very high94 Ų94105.3 Ų105.349%0.49251%0.511SS..Hα-helixtrans-63.7-39.4177.7-71.6169.7000112.2T198 I199 N204 E205 I206T198-L202 WeakPolarHBondContact O-CB 3.35Å; T198-L202 VanDerWaalsContact O-CG 3.29Å; T198-L202 WeakPolarHBondContact O-CG 3.37Å; T198-L202 PolarHBondContact O-N 3.28Å; I199-L202 PolarHBondContact O-N 2.96Å; L202-N204 VanDerWaalsContact C-N 3.33Å; L202-N204 PolarHBondContact O-N 3.46Å; L202-E205 PolarHBondContact O-N 3.09Å; L202-I206 WeakPolarHBondContact O-CB 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.32Å; L202-I206 PolarHBondContact O-N 3.37Å
203E95Very high92.6Very high118 Ų118107.5 Ų107.555%0.55152%0.518SS*.Hα-helixtrans-61.7-41.5174.9-75.2178.816500111.7I199 Q201 I206 C207I199-E203 HydrophobicContact CG2-CG 4.27Å; I199-E203 WeakPolarHBondContact O-CB 3.25Å; I199-E203 WeakPolarHBondContact O-CG 3.5Å; I199-E203 PolarHBondContact O-N 3.2Å; Q201-E203 PolarHBondContact O-N 3.25Å; E203-I206 PolarHBondContact O-N 2.96Å; E203-C207 WeakPolarHBondContact O-CB 3.23Å; E203-C207 PolarHBondContact O-N 2.94Å
204N94.2Very high91.4Very high91 Ų91101.7 Ų101.749%0.48751%0.505SS..Hα-helixtrans-65.2-44.1174.6-74.9-40.7000112V200 Q201 L202 C207 Q208V200-N204 PolarHBondContact O-N 2.89Å; V200-N204 VanDerWaalsContact O-N 3.09Å; V200-N204 PolarHBondContact O-ND2 3.48Å; Q201-N204 WeakPolarHBondContact O-CB 3.41Å; Q201-N204 PolarHBondContact O-N 3.44Å; L202-N204 VanDerWaalsContact C-N 3.33Å; L202-N204 PolarHBondContact O-N 3.46Å; N204-C207 WeakPolarHBondContact O-CB 3.33Å; N204-C207 PolarHBondContact O-N 3.33Å; N204-Q208 WeakPolarHBondContact O-CG 3.49Å; N204-Q208 PolarHBondContact O-N 3.39Å
205E94Very high89.9Confident105 Ų105100.7 Ų100.749%0.49150%0.5SS..Hα-helixtrans-61.1-44.8175.6-72.8174-166.500111.5Q201 L202 C207 Q208 I209Q201-E205 WeakPolarHBondContact O-CG 3.44Å; Q201-E205 PolarHBondContact O-N 3.25Å; L202-E205 PolarHBondContact O-N 3.09Å; E205-C207 VanDerWaalsContact C-N 3.3Å; E205-C207 PolarHBondContact O-N 2.78Å; E205-Q208 PolarHBondContact O-N 2.99Å; E205-I209 WeakPolarHBondContact O-CG1 3.47Å; E205-I209 PolarHBondContact O-N 3.17Å
206I93.1Very high88.4Confident88 Ų8899 Ų9945%0.45150%0.498SS..Hα-helixtrans-60.6-41.3175.2-70.4166.4000110.7L202 E203 I209 K210L202-I206 WeakPolarHBondContact O-CB 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.32Å; L202-I206 PolarHBondContact O-N 3.37Å; E203-I206 PolarHBondContact O-N 2.96Å; I206-I209 PolarHBondContact O-N 2.78Å; I206-K210 HydrophobicContact CG2-CD 4.16Å; I206-K210 HydrophobicContact CG2-CG 4.5Å; I206-K210 WeakPolarHBondContact O-CB 3.42Å; I206-K210 WeakPolarHBondContact O-CG 3.07Å; I206-K210 PolarHBondContact O-N 3.44Å
207C91.6Very high86.8Confident76 Ų7697.8 Ų97.851%0.51450%0.495SS..Hα-helixtrans-62.3-44.1176.7-1670000111.6E203 N204 E205 K210 Q211E203-C207 WeakPolarHBondContact O-CB 3.23Å; E203-C207 PolarHBondContact O-N 2.94Å; N204-C207 WeakPolarHBondContact O-CB 3.33Å; N204-C207 PolarHBondContact O-N 3.33Å; E205-C207 VanDerWaalsContact C-N 3.3Å; E205-C207 PolarHBondContact O-N 2.78Å; C207-K210 PolarHBondContact O-N 3.15Å; C207-Q211 PolarHBondContact O-N 3.44Å
208Q91.1Very high85Confident118 Ų11897.6 Ų97.655%0.55150%0.499SS*.Hα-helixtrans-63.4-45.8176.6-71.1175.116.800112.1N204 E205 K210 Q211 Q212N204-Q208 WeakPolarHBondContact O-CG 3.49Å; N204-Q208 PolarHBondContact O-N 3.39Å; E205-Q208 PolarHBondContact O-N 2.99Å; Q208-K210 PolarHBondContact O-N 2.96Å; Q208-Q211 PolarHBondContact O-N 2.82Å; Q208-Q212 WeakPolarHBondContact O-CG 3.3Å; Q208-Q212 PolarHBondContact O-N 3.34Å
209I90.3Very high83.3Confident95 Ų95100.8 Ų100.849%0.48751%0.509SS..Hα-helixtrans-61.4-44.6177.9-68.1167.3000110.5E205 I206 Q211 Q212 H213E205-I209 WeakPolarHBondContact O-CG1 3.47Å; E205-I209 PolarHBondContact O-N 3.17Å; I206-I209 PolarHBondContact O-N 2.78Å; I209-Q211 VanDerWaalsContact C-N 3.27Å; I209-Q211 PolarHBondContact O-N 3.49Å; I209-Q212 PolarHBondContact O-N 3.16Å; I209-H213 WeakPolarHBondContact O-CB 3.41Å; I209-H213 PolarHBondContact O-N 2.95Å
210K87.5Confident81.4Confident151 Ų151101.4 Ų101.466%0.65751%0.513SS*.Hα-helixtrans-60-38176.3-77.5178.4179.5177.50112.2I206 C207 Q208 G214I206-K210 HydrophobicContact CG2-CD 4.16Å; I206-K210 HydrophobicContact CG2-CG 4.5Å; I206-K210 WeakPolarHBondContact O-CB 3.42Å; I206-K210 WeakPolarHBondContact O-CG 3.07Å; I206-K210 PolarHBondContact O-N 3.44Å; C207-K210 PolarHBondContact O-N 3.15Å; Q208-K210 PolarHBondContact O-N 2.96Å; K210-G214 PolarHBondContact O-N 2.95Å
211Q82.5Confident79.6Confident117 Ų117102.3 Ų102.355%0.54752%0.515SS..Hα-helixtrans-68-47.7177.3-170.3167.5-6.500111.7C207 Q208 I209 H213 G214 E215C207-Q211 PolarHBondContact O-N 3.44Å; Q208-Q211 PolarHBondContact O-N 2.82Å; I209-Q211 VanDerWaalsContact C-N 3.27Å; I209-Q211 PolarHBondContact O-N 3.49Å; Q211-H213 PolarHBondContact O-N 2.71Å; Q211-G214 PolarHBondContact O-N 2.8Å; Q211-E215 WeakPolarHBondContact O-CG 3.44Å; Q211-E215 PolarHBondContact O-N 3.17Å
212Q80.4Confident77.7Confident127 Ų127108.1 Ų108.159%0.59353%0.533SS*.Hα-helixtrans-60.1-42.7175.8-71.4177.3-3.900112.4Q208 I209 G214 E215 A216Q208-Q212 WeakPolarHBondContact O-CG 3.3Å; Q208-Q212 PolarHBondContact O-N 3.34Å; I209-Q212 PolarHBondContact O-N 3.16Å; Q212-G214 VanDerWaalsContact C-N 3.34Å; Q212-G214 PolarHBondContact O-N 2.91Å; Q212-E215 PolarHBondContact O-N 2.99Å; Q212-A216 WeakPolarHBondContact O-CB 3.43Å; Q212-A216 PolarHBondContact O-N 3.19Å
213H75.1Confident75.6Confident141 Ų141111 Ų11165%0.65354%0.544SS*.Hα-helixtrans-66.4-37.8177.1-125.6-38.3000111.9I209 Q211 N217I209-H213 WeakPolarHBondContact O-CB 3.41Å; I209-H213 PolarHBondContact O-N 2.95Å; Q211-H213 PolarHBondContact O-N 2.71Å; H213-N217 WeakPolarHBondContact O-CB 3.35Å; H213-N217 PolarHBondContact O-N 2.9Å
214G72.3Confident73.4Confident33 Ų33112.2 Ų112.234%0.3455%0.554SS.*Hα-helixtrans-67-33.6174.400000113.4K210 Q211 Q212 K218K210-G214 PolarHBondContact O-N 2.95Å; Q211-G214 PolarHBondContact O-N 2.8Å; Q212-G214 VanDerWaalsContact C-N 3.34Å; Q212-G214 PolarHBondContact O-N 2.91Å; G214-K218 WeakPolarHBondContact O-CD 3.24Å; G214-K218 VanDerWaalsContact O-CG 3.24Å; G214-K218 WeakPolarHBondContact O-CG 3.42Å; G214-K218 PolarHBondContact O-N 3.09Å
215E67.2Low71Confident103 Ų103118.9 Ų118.948%0.48158%0.579SS.*Hα-helixtrans-72-46.8173.7-73.8172.4-174.100111.6Q211 Q212 N217 K218 E219Q211-E215 WeakPolarHBondContact O-CG 3.44Å; Q211-E215 PolarHBondContact O-N 3.17Å; Q212-E215 PolarHBondContact O-N 2.99Å; E215-N217 VanDerWaalsContact C-N 3.3Å; E215-N217 PolarHBondContact O-N 3.37Å; E215-K218 WeakPolarHBondContact O-CB 3.47Å; E215-K218 PolarHBondContact O-N 3.49Å; E215-K218 VanDerWaalsContact O-N 3.07Å; E215-E219 PolarHBondContact O-N 3Å
216A64.8Low69.9Low42 Ų42119.6 Ų119.635%0.34758%0.583SS.*Hα-helixtrans-60.3-38175.100000112.6Q212 K218 E219 N220Q212-A216 WeakPolarHBondContact O-CB 3.43Å; Q212-A216 PolarHBondContact O-N 3.19Å; A216-K218 VanDerWaalsContact C-N 3.34Å; A216-E219 PolarHBondContact O-N 3.17Å; A216-N220 PolarHBondContact O-N 2.92Å
217N62.7Low68.6Low100 Ų100121.2 Ų121.254%0.53559%0.59SS.*Hα-helixtrans-69.2-33.2176.4-146.222.1000111.8H213 E215 I221H213-N217 WeakPolarHBondContact O-CB 3.35Å; H213-N217 PolarHBondContact O-N 2.9Å; E215-N217 VanDerWaalsContact C-N 3.3Å; E215-N217 PolarHBondContact O-N 3.37Å; N217-I221 VanDerWaalsContact O-CD1 3.31Å; N217-I221 WeakPolarHBondContact O-CD1 3.41Å; N217-I221 WeakPolarHBondContact O-CG1 3.34Å; N217-I221 PolarHBondContact O-N 3.36Å; N217-I221 VanDerWaalsContact O-N 3.15Å
218K61.3Low67.4Low146 Ų146123.7 Ų123.764%0.63560%0.595SS**Hα-helixtrans-71.9-34.1173.3-74.2170.3-176.9176.80112.7G214 E215 A216 R222G214-K218 WeakPolarHBondContact O-CD 3.24Å; G214-K218 VanDerWaalsContact O-CG 3.24Å; G214-K218 WeakPolarHBondContact O-CG 3.42Å; G214-K218 PolarHBondContact O-N 3.09Å; E215-K218 WeakPolarHBondContact O-CB 3.47Å; E215-K218 PolarHBondContact O-N 3.49Å; E215-K218 VanDerWaalsContact O-N 3.07Å; A216-K218 VanDerWaalsContact C-N 3.34Å; K218-R222 WeakPolarHBondContact O-CG 3.27Å; K218-R222 PolarHBondContact O-N 3.43Å; K218-R222 VanDerWaalsContact O-N 3.15Å
219E60.5Low66Low131 Ų131124.1 Ų124.161%0.61260%0.597SS**Hα-helixtrans-69.8-43174.3-77.7-172.1155.300112.3E215 A216 I221 R222 Q223E215-E219 PolarHBondContact O-N 3Å; A216-E219 PolarHBondContact O-N 3.17Å; E219-I221 PolarHBondContact O-N 2.95Å; E219-R222 PolarHBondContact O-N 2.87Å; E219-Q223 PolarHBondContact O-N 3.24Å
220N57.9Low64.4Low93 Ų93125.9 Ų125.950%0.49760%0.604SS.*Hα-helixtrans-59.8-45.1173.4-83.8-17.8000111.7A216 R222 Q223 D224A216-N220 PolarHBondContact O-N 2.92Å; N220-R222 PolarHBondContact O-N 2.8Å; N220-Q223 PolarHBondContact O-N 3.5Å; N220-Q223 VanDerWaalsContact O-N 3.14Å; N220-D224 PolarHBondContact O-N 2.99Å
221I58.3Low62.9Low96 Ų96124.2 Ų124.249%0.49260%0.601SS.*Hα-helixtrans-62.2-28.3175.5-66.6165.3000111.6N217 E219 F225N217-I221 VanDerWaalsContact O-CD1 3.31Å; N217-I221 WeakPolarHBondContact O-CD1 3.41Å; N217-I221 WeakPolarHBondContact O-CG1 3.34Å; N217-I221 PolarHBondContact O-N 3.36Å; N217-I221 VanDerWaalsContact O-N 3.15Å; E219-I221 PolarHBondContact O-N 2.95Å; I221-F225 HydrophobicContact CG2-CE2 4.27Å; I221-F225 VanDerWaalsContact O-CD2 3.24Å; I221-F225 WeakPolarHBondContact O-CD2 3.27Å
222R55.3Low61.5Low206 Ų206124.7 Ų124.778%0.77760%0.604SS**Hα-helixtrans-81.8-19.4176.6-82.6-179.5173.9-179.1-1.5114.5K218 E219 N220K218-R222 WeakPolarHBondContact O-CG 3.27Å; K218-R222 PolarHBondContact O-N 3.43Å; K218-R222 VanDerWaalsContact O-N 3.15Å; E219-R222 PolarHBondContact O-N 2.87Å; N220-R222 PolarHBondContact O-N 2.8Å
223Q51.8Low60Low154 Ų154124.5 Ų124.572%0.7261%0.605SS**Hα-helixtrans-86.9-20.1176.1-74.1-174.4-8.300112.9E219 N220 F225E219-Q223 PolarHBondContact O-N 3.24Å; N220-Q223 PolarHBondContact O-N 3.5Å; N220-Q223 VanDerWaalsContact O-N 3.14Å; Q223-F225 VanDerWaalsContact C-N 3.34Å
224D49.6Very low58.8Low143 Ų143123.2 Ų123.277%0.76560%0.601SS**  trans-88.47.6178.8-75-26.4000114.3N220N220-D224 PolarHBondContact O-N 2.99Å
225F44Very low57.6Low231 Ų231131.4 Ų131.4100%1.01363%0.625SS**  trans-122.30170.1-73.5-77.2000110.9I221 Q223I221-F225 HydrophobicContact CG2-CE2 4.27Å; I221-F225 VanDerWaalsContact O-CD2 3.24Å; I221-F225 WeakPolarHBondContact O-CD2 3.27Å; Q223-F225 VanDerWaalsContact C-N 3.34Å

Retrieved 225 of 225 residues in 63.8 ms (Link to these results)