G4V9D4_SCHMA Loading...

Mago-bind domain-containing protein

AlphaFold DB , UniProt , Accession G4V9D4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 209 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
1M44.1Very low77.9Confident221 Ų221110.9 Ų110.9100%1.08960%0.598SS**  086.10-78-172.617100108.7G3M1-G3 VanDerWaalsContact C-N 3.26Å; M1-G3 PolarHBondContact O-N 3.07Å
2N55.6Low79.1Confident174 Ų174106.6 Ų106.693%0.9357%0.574SS**  trans-93.758.2-178.5-68.466.3000110.3
3G65.9Low80.2Confident56 Ų56113.3 Ų113.358%0.57760%0.6SS**  trans-72146.6168.900000110M1 V5M1-G3 VanDerWaalsContact C-N 3.26Å; M1-G3 PolarHBondContact O-N 3.07Å; G3-V5 PolarHBondContact O-N 3.17Å; G3-V5 VanDerWaalsContact O-N 3.08Å
4F72.5Confident81Confident124 Ų124113.9 Ų113.954%0.54460%0.603SS.*  trans-58113.6170.5-175.5-95.4000109R6 P46F4-R6 PolarHBondContact O-N 3.27Å; F4-P46 HydrophobicContact CD2-CG 4.12Å; F4-P46 HydrophobicContact CE2-CG 3.74Å; F4-P46 HydrophobicContact CZ-CG 4.14Å
5V80.1Confident81.6Confident125 Ų125108.4 Ų108.476%0.75859%0.585SS**PPolyproline II helixtrans-81.1117.3177.2-179.80000107.3G3G3-V5 PolarHBondContact O-N 3.17Å; G3-V5 VanDerWaalsContact O-N 3.08Å
6R85.1Confident82.3Confident34 Ų34104.1 Ų104.113%0.12856%0.561CS.*PPolyproline II helixtrans-71.1143.8172.1-65.4-158.8-179.3-42.5-42.1110.5F4 G8 V9 Y39 E44F4-R6 PolarHBondContact O-N 3.27Å; R6-G8 PolarHBondContact O-N 3.29Å; R6-V9 HydrophobicContact CB-CB 3.94Å; R6-V9 HydrophobicContact CB-CG2 3.77Å; R6-V9 HydrophobicContact CG-CG2 4.45Å; R6-Y39 PolarHBondContact NE-O 3.31Å; R6-Y39 VanDerWaalsContact NH2-C 3.26Å; R6-Y39 PolarHBondContact NH2-O 3.12Å; R6-E44 WeakPolarHBondContact CD-OE2 3.46Å; R6-E44 VanDerWaalsContact CG-OE2 3.24Å; R6-E44 WeakPolarHBondContact CG-OE2 3.3Å; R6-E44 IonicContact CZ-OE2 3.57Å; R6-E44 IonicContact NE-OE2 3.68Å; R6-E44 IonicContact NH1-OE2 2.7Å; R6-E44 PolarHBondContact NH1-OE2 3.3Å
7Q86.5Confident82.9Confident178 Ų178100.1 Ų100.183%0.83254%0.539SS*.THydrogen-bonded Turntrans-67.8130.3169.8-167170.25.300109.3V9Q7-V9 VanDerWaalsContact C-N 3.31Å; Q7-V9 PolarHBondContact O-N 2.93Å
8G89.7Confident83.5Confident48 Ų4896.1 Ų96.150%0.49552%0.518SS..THydrogen-bonded Turntrans782.4176.400000116.4R6 P20R6-G8 PolarHBondContact O-N 3.29Å; G8-P20 WeakPolarHBondContact O-CD 3.45Å
9V92.6Very high84.1Confident22 Ų2295.1 Ų95.113%0.13351%0.511CS..  trans-109.4127.7173.1-1730000109.8R6 Q7 L17 I18 I19 V35R6-V9 HydrophobicContact CB-CB 3.94Å; R6-V9 HydrophobicContact CB-CG2 3.77Å; R6-V9 HydrophobicContact CG-CG2 4.45Å; Q7-V9 VanDerWaalsContact C-N 3.31Å; Q7-V9 PolarHBondContact O-N 2.93Å; V9-L17 HydrophobicContact CG1-CB 3.84Å; V9-L17 HydrophobicContact CG1-CD2 4.02Å; V9-L17 HydrophobicContact CG1-CG 4.47Å; V9-I18 CarbonylContact C-O 3.55Å; V9-I18 WeakPolarHBondContact CA-O 3.39Å; V9-I18 WeakPolarHBondContact CG1-O 3.4Å; V9-I19 HydrophobicContact CG2-CG1 4.29Å; V9-V35 HydrophobicContact CG1-CB 4.26Å; V9-V35 HydrophobicContact CG1-CG2 4.05Å; V9-V35 HydrophobicContact CG2-CG2 4.2Å
10V92.4Very high84.7Confident83 Ų8392.9 Ų92.950%0.50350%0.502SS..EExtended strand (participates in β ladder)trans-118.8154.2-177.6-174.80000109.3I18V10-I18 PolarHBondContact N-O 2.98Å; V10-I18 WeakPolarHBondContact O-CG1 3.47Å; V10-I18 PolarHBondContact O-N 3.49Å
11R92Very high85.2Confident155 Ų15591.5 Ų91.559%0.58550%0.498SS*.EExtended strand (participates in β ladder)trans-87.8126.7170.6-73.1179.9178.9-108.72.6109.6N16 L17R11-N16 WeakPolarHBondContact CA-O 3.43Å; R11-L17 HydrophobicContact CG-CD2 3.64Å; R11-L17 HydrophobicContact CG-CG 4.5Å
12D92.2Very high87.8Confident59 Ų5984.1 Ų84.132%0.31647%0.466SS..  trans-74.2168.9173.8-172.131.5000111.9N14 G15 N16 I18D12-N14 PolarHBondContact O-N 2.95Å; D12-N14 PolarHBondContact OD2-ND2 2.88Å; D12-G15 WeakPolarHBondContact O-CA 3.47Å; D12-G15 PolarHBondContact O-N 3.32Å; D12-N16 PolarHBondContact N-O 3.32Å; D12-I18 HydrophobicContact CB-CD1 3.95Å; D12-I18 HydrophobicContact CB-CG1 4.2Å; D12-I18 HydrophobicContact CB-CG2 4.26Å
13E93.6Very high89.8Confident194 Ų19481.1 Ų81.191%0.90745%0.446SS*.THydrogen-bonded Turntrans-55.8-32.9175.4-62.2179.1176.200112.1G15E13-G15 PolarHBondContact O-N 3.2Å
14N91.9Very high91.3Very high121 Ų12183 Ų8365%0.64744%0.436SS*.THydrogen-bonded Turntrans-76.62.4176.1-59.8-59.3000113.8D12 N16D12-N14 PolarHBondContact O-N 2.95Å; D12-N14 PolarHBondContact OD2-ND2 2.88Å; N14-N16 VanDerWaalsContact C-N 3.26Å; N14-N16 WeakPolarHBondContact CB-ND2 3.36Å; N14-N16 PolarHBondContact O-N 3.17Å
15G90.6Very high92.5Very high32 Ų3283.7 Ų83.733%0.3345%0.452SS..SBendtrans80.9-3.9-178.300000115.4D12 E13D12-G15 WeakPolarHBondContact O-CA 3.47Å; D12-G15 PolarHBondContact O-N 3.32Å; E13-G15 PolarHBondContact O-N 3.2Å
16N91.7Very high93.3Very high39 Ų3983.2 Ų83.221%0.20945%0.445CS..  trans-77.4142.5-176.3-59.8-53.3000112R11 D12 N14 R34R11-N16 WeakPolarHBondContact CA-O 3.43Å; D12-N16 PolarHBondContact N-O 3.32Å; N14-N16 VanDerWaalsContact C-N 3.26Å; N14-N16 WeakPolarHBondContact CB-ND2 3.36Å; N14-N16 PolarHBondContact O-N 3.17Å; N16-R34 PolarHBondContact ND2-NH1 3.45Å; N16-R34 PolarHBondContact OD1-NH1 3.06Å; N16-R34 PolarHBondContact OD1-NH2 3.44Å
17L92.7Very high93.8Very high36 Ų3683.1 Ų83.119%0.18846%0.455CS..EExtended strand (participates in β ladder)trans-75.7124.6171.3-69.9168.8000110V9 R11 V35 E37V9-L17 HydrophobicContact CG1-CB 3.84Å; V9-L17 HydrophobicContact CG1-CD2 4.02Å; V9-L17 HydrophobicContact CG1-CG 4.47Å; R11-L17 HydrophobicContact CG-CD2 3.64Å; R11-L17 HydrophobicContact CG-CG 4.5Å; L17-V35 HydrophobicContact CB-CB 4.19Å; L17-V35 PolarHBondContact O-N 3.25Å; L17-E37 HydrophobicContact CD1-CG 4.25Å
18I94.5Very high94.4Very high29 Ų2977.6 Ų77.615%0.14943%0.433CS..EExtended strand (participates in β ladder)trans-132.9146.6-178.963.7164.4000111.7V9 V10 D12 A32 V33V9-I18 CarbonylContact C-O 3.55Å; V9-I18 WeakPolarHBondContact CA-O 3.39Å; V9-I18 WeakPolarHBondContact CG1-O 3.4Å; V10-I18 PolarHBondContact N-O 2.98Å; V10-I18 WeakPolarHBondContact O-CG1 3.47Å; V10-I18 PolarHBondContact O-N 3.49Å; D12-I18 HydrophobicContact CB-CD1 3.95Å; D12-I18 HydrophobicContact CB-CG1 4.2Å; D12-I18 HydrophobicContact CB-CG2 4.26Å; I18-A32 HydrophobicContact CD1-CB 4.21Å; I18-V33 CarbonylContact C-O 3.49Å; I18-V33 VanDerWaalsContact CA-O 3.28Å; I18-V33 WeakPolarHBondContact CA-O 3.47Å
19I94Very high94.7Very high77 Ų7782.9 Ų82.940%0.39544%0.439SS..EExtended strand (participates in β ladder)trans-81.9123.1159-60.1171.1000106.2V9 A32 V33 V35V9-I19 HydrophobicContact CG2-CG1 4.29Å; I19-A32 VanDerWaalsContact O-CA 3.31Å; I19-A32 WeakPolarHBondContact O-CA 3.41Å; I19-V33 HydrophobicContact CB-CB 4.3Å; I19-V33 PolarHBondContact N-O 3.49Å; I19-V33 PolarHBondContact O-N 3.41Å; I19-V35 HydrophobicContact CD1-CG2 4.17Å; I19-V35 HydrophobicContact CG1-CG2 3.76Å
20P95.8Very high95Very high51 Ų5187 Ų8733%0.33145%0.452SS..PPolyproline II helixtrans-64155.1-175.427.2-33.8000111.4G8G8-P20 WeakPolarHBondContact O-CD 3.45Å
21P96.3Very high95.2Very high64 Ų6491.8 Ų91.842%0.41647%0.466SS..PPolyproline II helixtrans-61.6142.2176.828.9-34.4000110.5W29 R30P21-W29 HydrophobicContact CB-CE3 4.21Å; P21-R30 WeakPolarHBondContact CA-O 3.47Å; P21-R30 WeakPolarHBondContact CB-O 3.49Å
22T97.2Very high95.4Very high66 Ų6686.5 Ų86.541%0.40546%0.455SS..EExtended strand (participates in β ladder)trans-121.5142.3-18058.80000110.8R30T22-R30 PolarHBondContact N-O 3.23Å; T22-R30 WeakPolarHBondContact O-CB 3.46Å; T22-R30 PolarHBondContact O-N 3.02Å; T22-R30 WeakPolarHBondContact OG1-CD 3.46Å; T22-R30 PolarHBondContact OG1-NH1 3.04Å
23Q97.7Very high95.5Very high111 Ų11187.4 Ų87.452%0.51946%0.463SS..EExtended strand (participates in β ladder)trans-76.9139.3177.2-157.217622.700110.8G27 W29 R30Q23-G27 PolarHBondContact NE2-O 3.43Å; Q23-G27 VanDerWaalsContact NE2-O 3.14Å; Q23-W29 HydrophobicContact CB-CD2 4.37Å; Q23-W29 HydrophobicContact CB-CE3 4.35Å; Q23-W29 HydrophobicContact CB-CH2 4.42Å; Q23-W29 HydrophobicContact CB-CZ2 4.41Å; Q23-W29 HydrophobicContact CB-CZ3 4.39Å; Q23-W29 HydrophobicContact CG-CD2 4.41Å; Q23-W29 HydrophobicContact CG-CZ2 4.41Å; Q23-R30 PolarHBondContact O-NH1 2.73Å
24R97.3Very high95.6Very high96 Ų9685.4 Ų85.436%0.36245%0.447SS..  trans-82.7160169.7-64.6-165.3-16774.91.9109.6D26 G27 T28 W29 R30R24-D26 WeakPolarHBondContact CB-OD1 3.02Å; R24-D26 PolarHBondContact O-N 2.83Å; R24-G27 PolarHBondContact O-N 3.11Å; R24-T28 VanDerWaalsContact CB-O 3.31Å; R24-T28 WeakPolarHBondContact CB-O 3.44Å; R24-T28 VanDerWaalsContact CD-OG1 3.28Å; R24-T28 WeakPolarHBondContact CD-OG1 3.02Å; R24-T28 WeakPolarHBondContact CG-O 3.49Å; R24-T28 PolarHBondContact N-O 2.88Å; R24-T28 PolarHBondContact NH1-OG1 2.98Å; R24-W29 VanDerWaalsContact NH1-C 3.32Å; R24-W29 PolarHBondContact NH1-O 3.33Å; R24-R30 HydrophobicContact CG-CG 3.87Å
25P98Very high95.6Very high137 Ų13780.5 Ų80.589%0.8942%0.422SS*.THydrogen-bonded Turntrans-60.5-23.7177.4-25.435.5000115G27P25-G27 PolarHBondContact O-N 3.25Å
26D96.7Very high95.7Very high115 Ų11586.9 Ų86.962%0.61544%0.44SS*.THydrogen-bonded Turntrans-79.90.2174.266.2-3.8000113.5R24 T28R24-D26 WeakPolarHBondContact CB-OD1 3.02Å; R24-D26 PolarHBondContact O-N 2.83Å; D26-T28 WeakPolarHBondContact OD1-CB 3.43Å; D26-T28 PolarHBondContact OD1-N 2.71Å; D26-T28 PolarHBondContact OD1-OG1 3.44Å; D26-T28 PolarHBondContact OD2-OG1 3.08Å
27G97.2Very high95.6Very high32 Ų3290.6 Ų90.633%0.3346%0.456SS..SBendtrans89.2-12.7-178.200000114.9Q23 R24 P25Q23-G27 PolarHBondContact NE2-O 3.43Å; Q23-G27 VanDerWaalsContact NE2-O 3.14Å; R24-G27 PolarHBondContact O-N 3.11Å; P25-G27 PolarHBondContact O-N 3.25Å
28T97.4Very high95.3Very high62 Ų6292.1 Ų92.138%0.3848%0.48SS..PPolyproline II helixtrans-71.6152.2178.367.10000111.3R24 D26R24-T28 VanDerWaalsContact CB-O 3.31Å; R24-T28 WeakPolarHBondContact CB-O 3.44Å; R24-T28 VanDerWaalsContact CD-OG1 3.28Å; R24-T28 WeakPolarHBondContact CD-OG1 3.02Å; R24-T28 WeakPolarHBondContact CG-O 3.49Å; R24-T28 PolarHBondContact N-O 2.88Å; R24-T28 PolarHBondContact NH1-OG1 2.98Å; D26-T28 WeakPolarHBondContact OD1-CB 3.43Å; D26-T28 PolarHBondContact OD1-N 2.71Å; D26-T28 PolarHBondContact OD1-OG1 3.44Å; D26-T28 PolarHBondContact OD2-OG1 3.08Å
29W97.2Very high95Very high159 Ų15997.3 Ų97.360%0.60250%0.499SS*.EExtended strand (participates in β ladder)trans-97139.3-177.6-70.981.7000112.5P21 Q23 R24P21-W29 HydrophobicContact CB-CE3 4.21Å; Q23-W29 HydrophobicContact CB-CD2 4.37Å; Q23-W29 HydrophobicContact CB-CE3 4.35Å; Q23-W29 HydrophobicContact CB-CH2 4.42Å; Q23-W29 HydrophobicContact CB-CZ2 4.41Å; Q23-W29 HydrophobicContact CB-CZ3 4.39Å; Q23-W29 HydrophobicContact CG-CD2 4.41Å; Q23-W29 HydrophobicContact CG-CZ2 4.41Å; R24-W29 VanDerWaalsContact NH1-C 3.32Å; R24-W29 PolarHBondContact NH1-O 3.33Å
30R97.5Very high94.7Very high108 Ų10897.1 Ų97.141%0.40850%0.498SS..EExtended strand (participates in β ladder)trans-82.1135.6163.7-60.3-170.8-175.278.8-0.9108.3P21 T22 Q23 R24P21-R30 WeakPolarHBondContact CA-O 3.47Å; P21-R30 WeakPolarHBondContact CB-O 3.49Å; T22-R30 PolarHBondContact N-O 3.23Å; T22-R30 WeakPolarHBondContact O-CB 3.46Å; T22-R30 PolarHBondContact O-N 3.02Å; T22-R30 WeakPolarHBondContact OG1-CD 3.46Å; T22-R30 PolarHBondContact OG1-NH1 3.04Å; Q23-R30 PolarHBondContact O-NH1 2.73Å; R24-R30 HydrophobicContact CG-CG 3.87Å
31K97.1Very high94.5Very high184 Ų18496.5 Ų96.580%0.849%0.494SS*.PPolyproline II helixtrans-62.5153.2176.164.1179.3-179-179.30111.7
32A95.9Very high94.1Very high44 Ų44100.8 Ų100.836%0.36451%0.508SS..PPolyproline II helixtrans-60.8148.3168.900000110.9I18 I19I18-A32 HydrophobicContact CD1-CB 4.21Å; I19-A32 VanDerWaalsContact O-CA 3.31Å; I19-A32 WeakPolarHBondContact O-CA 3.41Å
33V95.5Very high93.8Very high78 Ų78106.4 Ų106.447%0.47353%0.53SS..EExtended strand (participates in β ladder)trans-118.5123.1179.9-1790000109.4I18 I19I18-V33 CarbonylContact C-O 3.49Å; I18-V33 VanDerWaalsContact CA-O 3.28Å; I18-V33 WeakPolarHBondContact CA-O 3.47Å; I19-V33 HydrophobicContact CB-CB 4.3Å; I19-V33 PolarHBondContact N-O 3.49Å; I19-V33 PolarHBondContact O-N 3.41Å
34R94.5Very high93.2Very high152 Ų152103.9 Ų103.957%0.57452%0.518SS*.EExtended strand (participates in β ladder)trans-71.1134176.8-172.9-172.717310312.3110.8N16N16-R34 PolarHBondContact ND2-NH1 3.45Å; N16-R34 PolarHBondContact OD1-NH1 3.06Å; N16-R34 PolarHBondContact OD1-NH2 3.44Å
35V92.7Very high92.8Very high19 Ų19102.5 Ų102.512%0.11552%0.52CS..  trans-105.3139.4174.2-176.60000109.3V9 L17 I19V9-V35 HydrophobicContact CG1-CB 4.26Å; V9-V35 HydrophobicContact CG1-CG2 4.05Å; V9-V35 HydrophobicContact CG2-CG2 4.2Å; L17-V35 HydrophobicContact CB-CB 4.19Å; L17-V35 PolarHBondContact O-N 3.25Å; I19-V35 HydrophobicContact CD1-CG2 4.17Å; I19-V35 HydrophobicContact CG1-CG2 3.76Å
36K92.3Very high92.2Very high165 Ų16599.5 Ų99.572%0.71750%0.501SS*.  trans-68.5133.4175.9-175.4173.8-177.7174.80110.4G38 Y39K36-G38 PolarHBondContact O-N 2.97Å; K36-Y39 WeakPolarHBondContact O-CB 3.23Å; K36-Y39 PolarHBondContact O-N 3.48Å
37E89.4Confident91.9Very high118 Ų118101 Ų10155%0.55151%0.508SS*.THydrogen-bonded Turntrans-59.1134176.5-63.8-166.4166.300111.8L17 Y39L17-E37 HydrophobicContact CD1-CG 4.25Å; E37-Y39 PolarHBondContact O-N 3.13Å
38G87Confident91.6Very high67 Ų67108.8 Ų108.869%0.69153%0.529SS*.THydrogen-bonded Turntrans75.7-9.5-179.500000115.9K36 I40K36-G38 PolarHBondContact O-N 2.97Å; G38-I40 PolarHBondContact O-N 3.35Å
39Y89.2Confident91.4Very high139 Ų139111.9 Ų111.955%0.54553%0.534SS..  trans-69.3119.4177.4175.7-106.1000110.8R6 K36 E37 P41R6-Y39 PolarHBondContact NE-O 3.31Å; R6-Y39 VanDerWaalsContact NH2-C 3.26Å; R6-Y39 PolarHBondContact NH2-O 3.12Å; K36-Y39 WeakPolarHBondContact O-CB 3.23Å; K36-Y39 PolarHBondContact O-N 3.48Å; E37-Y39 PolarHBondContact O-N 3.13Å; Y39-P41 HydrophobicContact CD1-CG 4.45Å; Y39-P41 HydrophobicContact CE1-CG 3.95Å
40I87.7Confident91.3Very high72 Ų72106.8 Ų106.837%0.36952%0.522SS..  trans-107.3113.9174.7-59.4156.1000110G38 E44 V45G38-I40 PolarHBondContact O-N 3.35Å; I40-E44 HydrophobicContact CG2-CB 4.28Å; I40-V45 HydrophobicContact CB-CG2 4.48Å; I40-V45 HydrophobicContact CG2-CB 4.31Å; I40-V45 HydrophobicContact CG2-CG2 3.61Å
41P90.3Very high91.2Very high38 Ų38105.3 Ų105.325%0.24753%0.528CS..  trans-58.9146167.9-21.633000111Y39 E43 E44 V45Y39-P41 HydrophobicContact CD1-CG 4.45Å; Y39-P41 HydrophobicContact CE1-CG 3.95Å; P41-E43 PolarHBondContact O-N 3.4Å; P41-E44 PolarHBondContact O-N 3.26Å; P41-V45 PolarHBondContact O-N 3.45Å
42Q89.3Confident91.2Very high154 Ų15498.8 Ų98.872%0.7251%0.514SS*.G310 helixtrans-55.5-37.5-177-173.758.144.800112.8E44 V45Q42-E44 PolarHBondContact O-N 3.15Å; Q42-V45 WeakPolarHBondContact O-CB 3.4Å; Q42-V45 PolarHBondContact O-N 3.1Å
43E89.1Confident91.2Very high185 Ų18599.3 Ų99.386%0.86451%0.512SS*.G310 helixtrans-60.6-27.7177.5-57.4-57.9156.300113.1P41P41-E43 PolarHBondContact O-N 3.4Å
44E86.8Confident91.1Very high58 Ų5899.6 Ų99.627%0.27151%0.508SS..G310 helixtrans-1031.9-179.2-62.6-175-172.100113R6 I40 P41 Q42 P46R6-E44 WeakPolarHBondContact CD-OE2 3.46Å; R6-E44 VanDerWaalsContact CG-OE2 3.24Å; R6-E44 WeakPolarHBondContact CG-OE2 3.3Å; R6-E44 IonicContact CZ-OE2 3.57Å; R6-E44 IonicContact NE-OE2 3.68Å; R6-E44 IonicContact NH1-OE2 2.7Å; R6-E44 PolarHBondContact NH1-OE2 3.3Å; I40-E44 HydrophobicContact CG2-CB 4.28Å; P41-E44 PolarHBondContact O-N 3.26Å; Q42-E44 PolarHBondContact O-N 3.15Å; E44-P46 VanDerWaalsContact O-CD 3.23Å; E44-P46 WeakPolarHBondContact O-CD 3.41Å
45V88.1Confident91.1Very high66 Ų6696.5 Ų96.540%0.450%0.502SS..SBendtrans-64118.8178.2175.10000108.6I40 P41 Q42 L47I40-V45 HydrophobicContact CB-CG2 4.48Å; I40-V45 HydrophobicContact CG2-CB 4.31Å; I40-V45 HydrophobicContact CG2-CG2 3.61Å; P41-V45 PolarHBondContact O-N 3.45Å; Q42-V45 WeakPolarHBondContact O-CB 3.4Å; Q42-V45 PolarHBondContact O-N 3.1Å; V45-L47 PolarHBondContact O-N 2.99Å
46P86.2Confident91.2Very high74 Ų74101.3 Ų101.348%0.48153%0.527SS..PPolyproline II helixtrans-59.5129.3-178.2-25.235.2000111.4F4 E44 Y48F4-P46 HydrophobicContact CD2-CG 4.12Å; F4-P46 HydrophobicContact CE2-CG 3.74Å; F4-P46 HydrophobicContact CZ-CG 4.14Å; E44-P46 VanDerWaalsContact O-CD 3.23Å; E44-P46 WeakPolarHBondContact O-CD 3.41Å; P46-Y48 PolarHBondContact O-N 3.02Å
47L89.1Confident91.2Very high146 Ų14697.8 Ų97.876%0.76451%0.513SS*.PPolyproline II helixtrans-60.3129.8175.8-168.667.2000109.9V45 R49V45-L47 PolarHBondContact O-N 2.99Å; L47-R49 PolarHBondContact O-N 2.87Å
48Y92.3Very high91.3Very high197 Ų19798.7 Ų98.777%0.77352%0.515SS*.PPolyproline II helixtrans-59.1129-178.4178.7-99000111.5P46P46-Y48 PolarHBondContact O-N 3.02Å
49R92.3Very high91.5Very high126 Ų126102.5 Ų102.548%0.47551%0.512SS..  trans-118.6131.3172.2-64.1-72.2-178.6147.3-3.7108.4L47 Q54L47-R49 PolarHBondContact O-N 2.87Å; R49-Q54 HydrophobicContact CB-CG 3.9Å; R49-Q54 PolarHBondContact O-NE2 3.31Å
50S96.2Very high91.5Very high52 Ų5299.4 Ų99.436%0.36451%0.511SS..  trans-64152.517771.20000111.2G52 V53 Q54S50-G52 PolarHBondContact O-N 2.99Å; S50-V53 PolarHBondContact O-N 3.22Å; S50-V53 VanDerWaalsContact OG-CG2 3.3Å; S50-V53 WeakPolarHBondContact OG-CG2 3.5Å; S50-V53 PolarHBondContact OG-N 3.19Å; S50-Q54 PolarHBondContact O-N 2.97Å
51S95.3Very high91.5Very high77 Ų77102.1 Ų102.154%0.53852%0.522SS..Hα-helixtrans-54.1-41.1179.8178.80000112.3V53 Q54 I55S51-V53 VanDerWaalsContact C-N 3.35Å; S51-V53 PolarHBondContact O-N 3.43Å; S51-Q54 PolarHBondContact O-N 3.1Å; S51-I55 WeakPolarHBondContact O-CB 3.42Å; S51-I55 WeakPolarHBondContact O-CD1 3.44Å; S51-I55 WeakPolarHBondContact O-CG1 3.5Å; S51-I55 PolarHBondContact O-N 2.95Å
52G96.6Very high91.5Very high48 Ų48107.4 Ų107.450%0.49554%0.542SS..Hα-helixtrans-61.5-37.9176.400000113.9S50 L56S50-G52 PolarHBondContact O-N 2.99Å; G52-L56 WeakPolarHBondContact O-CB 3.27Å; G52-L56 PolarHBondContact O-N 3.39Å
53V95.1Very high91.5Very high54 Ų54101.7 Ų101.733%0.32752%0.517SS..Hα-helixtrans-68.5-44.7175.7172.30000110.5S50 S51 I55 L56 E57S50-V53 PolarHBondContact O-N 3.22Å; S50-V53 VanDerWaalsContact OG-CG2 3.3Å; S50-V53 WeakPolarHBondContact OG-CG2 3.5Å; S50-V53 PolarHBondContact OG-N 3.19Å; S51-V53 VanDerWaalsContact C-N 3.35Å; S51-V53 PolarHBondContact O-N 3.43Å; V53-I55 VanDerWaalsContact C-N 3.32Å; V53-I55 PolarHBondContact O-N 3.01Å; V53-L56 PolarHBondContact O-N 3.22Å; V53-E57 PolarHBondContact O-N 3.28Å
54Q94.1Very high91.5Very high84 Ų8498.7 Ų98.739%0.39351%0.506SS..Hα-helixtrans-61.4-40.3176.2-62.5178.536.200111.9R49 S50 S51 K58R49-Q54 HydrophobicContact CB-CG 3.9Å; R49-Q54 PolarHBondContact O-NE2 3.31Å; S50-Q54 PolarHBondContact O-N 2.97Å; S51-Q54 PolarHBondContact O-N 3.1Å; Q54-K58 WeakPolarHBondContact O-CB 3.41Å; Q54-K58 VanDerWaalsContact O-CG 3.29Å; Q54-K58 WeakPolarHBondContact O-CG 3.36Å; Q54-K58 PolarHBondContact O-N 3.38Å
55I95.1Very high91.6Very high88 Ų88101.3 Ų101.345%0.45153%0.528SS..Hα-helixtrans-64.4-43.9175.5-69.3163.3000110.4S51 V53 K58 K59S51-I55 WeakPolarHBondContact O-CB 3.42Å; S51-I55 WeakPolarHBondContact O-CD1 3.44Å; S51-I55 WeakPolarHBondContact O-CG1 3.5Å; S51-I55 PolarHBondContact O-N 2.95Å; V53-I55 VanDerWaalsContact C-N 3.32Å; V53-I55 PolarHBondContact O-N 3.01Å; I55-K58 PolarHBondContact O-N 3.17Å; I55-K59 HydrophobicContact CG2-CD 3.8Å; I55-K59 HydrophobicContact CG2-CG 4.38Å; I55-K59 WeakPolarHBondContact O-CB 3.48Å; I55-K59 WeakPolarHBondContact O-CG 3.37Å; I55-K59 PolarHBondContact O-N 3.02Å
56L94Very high91.8Very high119 Ų119102.6 Ų102.662%0.62356%0.555SS**Hα-helixtrans-64.5-43179.3-176.362.3000112.2G52 V53 K59 S60G52-L56 WeakPolarHBondContact O-CB 3.27Å; G52-L56 PolarHBondContact O-N 3.39Å; V53-L56 PolarHBondContact O-N 3.22Å; L56-K59 PolarHBondContact O-N 3.47Å; L56-S60 PolarHBondContact O-N 3.27Å
57E92.7Very high92Very high91 Ų91102 Ų10243%0.42555%0.547SS..Hα-helixtrans-61.7-47.3173.6-93.5176.3174.300112.2V53 K59 S60 Q61V53-E57 PolarHBondContact O-N 3.28Å; E57-K59 VanDerWaalsContact C-N 3.27Å; E57-K59 PolarHBondContact O-N 3.27Å; E57-S60 PolarHBondContact O-N 2.71Å; E57-S60 VanDerWaalsContact O-N 3.16Å; E57-S60 PolarHBondContact O-OG 3.09Å; E57-Q61 WeakPolarHBondContact O-CG 3.24Å; E57-Q61 PolarHBondContact O-N 3.05Å
58K92Very high92.1Very high138 Ų13898.5 Ų98.560%0.653%0.532SS*.Hα-helixtrans-59.7-39.7176.2-74.2175.9-178.3177.30111.7Q54 I55 Q61 F62Q54-K58 WeakPolarHBondContact O-CB 3.41Å; Q54-K58 VanDerWaalsContact O-CG 3.29Å; Q54-K58 WeakPolarHBondContact O-CG 3.36Å; Q54-K58 PolarHBondContact O-N 3.38Å; I55-K58 PolarHBondContact O-N 3.17Å; K58-Q61 PolarHBondContact O-N 3.45Å; K58-F62 PolarHBondContact O-N 3.05Å
59K90.9Very high91.9Very high146 Ų14695.7 Ų95.764%0.63552%0.524SS*.Hα-helixtrans-68.3-32.7176.7-74.5173.968.9174.70113.1I55 L56 E57I55-K59 HydrophobicContact CG2-CD 3.8Å; I55-K59 HydrophobicContact CG2-CG 4.38Å; I55-K59 WeakPolarHBondContact O-CB 3.48Å; I55-K59 WeakPolarHBondContact O-CG 3.37Å; I55-K59 PolarHBondContact O-N 3.02Å; L56-K59 PolarHBondContact O-N 3.47Å; E57-K59 VanDerWaalsContact C-N 3.27Å; E57-K59 PolarHBondContact O-N 3.27Å
60S87.9Confident91.9Very high74 Ų7496.4 Ų96.452%0.51753%0.532SS..Hα-helixtrans-75.8-28.417769.50000112.5L56 E57L56-S60 PolarHBondContact O-N 3.27Å; E57-S60 PolarHBondContact O-N 2.71Å; E57-S60 VanDerWaalsContact O-N 3.16Å; E57-S60 PolarHBondContact O-OG 3.09Å
61Q87.8Confident91.6Very high130 Ų13096.7 Ų96.761%0.60753%0.53SS*.Hα-helixtrans-73-29.6174.2-71.3176.6-16.700113.3E57 K58E57-Q61 WeakPolarHBondContact O-CG 3.24Å; E57-Q61 PolarHBondContact O-N 3.05Å; K58-Q61 PolarHBondContact O-N 3.45Å
62F89.8Confident91.4Very high149 Ų14993.6 Ų93.665%0.65451%0.509SS*.  trans-74.9128.8179.5-172.2-95.7000111.4K58K58-F62 PolarHBondContact O-N 3.05Å
63V89.4Confident91.1Very high33 Ų3395.8 Ų95.820%0.251%0.509CS..  trans-124.4147.2173.9-176.90000108L67 K69 A72V63-L67 HydrophobicContact CG1-CB 3.98Å; V63-L67 HydrophobicContact CG1-CD2 4.42Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact CG1-O 3.48Å; V63-K69 HydrophobicContact CG2-CB 4.37Å; V63-K69 HydrophobicContact CG2-CG 3.71Å; V63-A72 HydrophobicContact CG1-CB 3.74Å; V63-A72 HydrophobicContact CG2-CB 4.33Å
64I88.9Confident90.9Very high122 Ų12298.5 Ų98.563%0.62652%0.517SS*.  trans-57.1127.8175.8-59.6171.8000107.9G66 L67I64-G66 PolarHBondContact O-N 2.84Å; I64-L67 PolarHBondContact O-N 3.35Å
65P90.6Very high90.8Very high114 Ų11498.7 Ų98.774%0.7452%0.52SS*.THydrogen-bonded Turntrans-49.5134.6176-27.634.7000111.6
66G91.7Very high90.5Very high93 Ų9399.6 Ų99.696%0.95952%0.521SS*.THydrogen-bonded Turntrans91.3-13.5-176.500000115.3I64I64-G66 PolarHBondContact O-N 2.84Å
67L90.9Very high90.4Very high62 Ų6298.2 Ų98.233%0.32551%0.513SS..SBendtrans-104.5136173-168.766.9000110.3V63 I64 D71 A72 L75V63-L67 HydrophobicContact CG1-CB 3.98Å; V63-L67 HydrophobicContact CG1-CD2 4.42Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact CG1-O 3.48Å; I64-L67 PolarHBondContact O-N 3.35Å; L67-D71 HydrophobicContact CD1-CB 3.58Å; L67-D71 HydrophobicContact CG-CB 4.14Å; L67-A72 HydrophobicContact CD2-CB 3.77Å; L67-A72 HydrophobicContact CG-CB 4.29Å; L67-L75 HydrophobicContact CD1-CD1 4.27Å; L67-L75 HydrophobicContact CD2-CD1 3.92Å
68T89.9Confident90.4Very high72 Ų7299 Ų9944%0.44252%0.517SS..  trans-74.4157.6175.774.60000111E70 D71 A72T68-E70 PolarHBondContact O-N 3.15Å; T68-D71 PolarHBondContact O-N 3.35Å; T68-D71 WeakPolarHBondContact OG1-CB 3.41Å; T68-D71 PolarHBondContact OG1-N 3.17Å; T68-D71 VanDerWaalsContact OG1-N 3.09Å; T68-D71 PolarHBondContact OG1-OD2 3.36Å; T68-A72 WeakPolarHBondContact O-CB 3.38Å; T68-A72 PolarHBondContact O-N 3.34Å
69K89.1Confident90.3Very high138 Ų138101.6 Ų101.660%0.652%0.523SS*.Hα-helixtrans-57.8-36.9174.2-71.7177.8179.3179.20111.9V63 N73V63-K69 HydrophobicContact CG2-CB 4.37Å; V63-K69 HydrophobicContact CG2-CG 3.71Å; K69-N73 WeakPolarHBondContact O-CB 3.46Å; K69-N73 PolarHBondContact O-N 3.1Å; K69-N73 VanDerWaalsContact O-N 3.13Å; K69-N73 PolarHBondContact O-ND2 3.35Å; K69-N73 VanDerWaalsContact O-ND2 3.14Å
70E91.1Very high90.3Very high140 Ų140100.2 Ų100.265%0.65452%0.519SS*.Hα-helixtrans-67.8-46179.5-62.3-176.5-175.600111.3T68 N73 K74T68-E70 PolarHBondContact O-N 3.15Å; E70-N73 WeakPolarHBondContact O-CB 3.28Å; E70-N73 PolarHBondContact O-N 3.27Å; E70-N73 VanDerWaalsContact O-N 3.14Å; E70-K74 WeakPolarHBondContact O-CG 3.32Å; E70-K74 PolarHBondContact O-N 3.49Å
71D91.6Very high90.3Very high58 Ų58103.1 Ų103.131%0.3152%0.522SS..Hα-helixtrans-68.8-37.4-179.8-59.4-35.5000112L67 T68 N73 K74 L75L67-D71 HydrophobicContact CD1-CB 3.58Å; L67-D71 HydrophobicContact CG-CB 4.14Å; T68-D71 PolarHBondContact O-N 3.35Å; T68-D71 WeakPolarHBondContact OG1-CB 3.41Å; T68-D71 PolarHBondContact OG1-N 3.17Å; T68-D71 VanDerWaalsContact OG1-N 3.09Å; T68-D71 PolarHBondContact OG1-OD2 3.36Å; D71-N73 VanDerWaalsContact C-N 3.25Å; D71-N73 PolarHBondContact O-N 2.9Å; D71-K74 PolarHBondContact O-N 2.94Å; D71-K74 IonicContact OD1-NZ 3.19Å; D71-K74 PolarHBondContact OD1-NZ 2.96Å; D71-L75 WeakPolarHBondContact O-CG 3.36Å; D71-L75 PolarHBondContact O-N 3.08Å
72A89.3Confident90.1Very high12 Ų12102.8 Ų102.810%0.09952%0.521CS..Hα-helixtrans-60.6-36.4171.600000112.3V63 L67 T68 K76V63-A72 HydrophobicContact CG1-CB 3.74Å; V63-A72 HydrophobicContact CG2-CB 4.33Å; L67-A72 HydrophobicContact CD2-CB 3.77Å; L67-A72 HydrophobicContact CG-CB 4.29Å; T68-A72 WeakPolarHBondContact O-CB 3.38Å; T68-A72 PolarHBondContact O-N 3.34Å; A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.29Å; A72-K76 PolarHBondContact O-N 3.2Å; A72-K76 VanDerWaalsContact O-N 3.14Å
73N91.1Very high89.5Confident95 Ų9599.1 Ų99.151%0.50851%0.513SS..Hα-helixtrans-72.7-39.3175.5-71.4-24000111.9K69 E70 D71 K76 L77K69-N73 WeakPolarHBondContact O-CB 3.46Å; K69-N73 PolarHBondContact O-N 3.1Å; K69-N73 VanDerWaalsContact O-N 3.13Å; K69-N73 PolarHBondContact O-ND2 3.35Å; K69-N73 VanDerWaalsContact O-ND2 3.14Å; E70-N73 WeakPolarHBondContact O-CB 3.28Å; E70-N73 PolarHBondContact O-N 3.27Å; E70-N73 VanDerWaalsContact O-N 3.14Å; D71-N73 VanDerWaalsContact C-N 3.25Å; D71-N73 PolarHBondContact O-N 2.9Å; N73-K76 PolarHBondContact O-N 3.36Å; N73-L77 WeakPolarHBondContact O-CB 3.49Å; N73-L77 PolarHBondContact O-N 2.93Å
74K91.8Very high88.6Confident111 Ų111104.6 Ų104.648%0.48354%0.537SS..Hα-helixtrans-59.9-49.3173.7-70.4172.8-170.2164.10111.4E70 D71 K76 L77 E78E70-K74 WeakPolarHBondContact O-CG 3.32Å; E70-K74 PolarHBondContact O-N 3.49Å; D71-K74 PolarHBondContact O-N 2.94Å; D71-K74 IonicContact OD1-NZ 3.19Å; D71-K74 PolarHBondContact OD1-NZ 2.96Å; K74-K76 VanDerWaalsContact C-N 3.31Å; K74-K76 PolarHBondContact O-N 3.48Å; K74-L77 PolarHBondContact O-N 2.93Å; K74-E78 WeakPolarHBondContact O-CG 3.37Å; K74-E78 PolarHBondContact O-N 2.68Å
75L90.3Very high87.4Confident88 Ų88102.4 Ų102.446%0.46153%0.532SS..Hα-helixtrans-60.6-37.6176.9-73.3167.3000112.6L67 D71 R79L67-L75 HydrophobicContact CD1-CD1 4.27Å; L67-L75 HydrophobicContact CD2-CD1 3.92Å; D71-L75 WeakPolarHBondContact O-CG 3.36Å; D71-L75 PolarHBondContact O-N 3.08Å; L75-R79 WeakPolarHBondContact O-CB 3.2Å; L75-R79 WeakPolarHBondContact O-CG 3.31Å; L75-R79 PolarHBondContact O-N 3.19Å
76K89.5Confident86.1Confident107 Ų107102.8 Ų102.847%0.46553%0.528SS..Hα-helixtrans-64.3-43.1173-77.9173.6-174.1172.30111.7A72 N73 K74 R79 Q80A72-K76 VanDerWaalsContact O-CG 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.29Å; A72-K76 PolarHBondContact O-N 3.2Å; A72-K76 VanDerWaalsContact O-N 3.14Å; N73-K76 PolarHBondContact O-N 3.36Å; K74-K76 VanDerWaalsContact C-N 3.31Å; K74-K76 PolarHBondContact O-N 3.48Å; K76-R79 PolarHBondContact O-N 3.21Å; K76-Q80 WeakPolarHBondContact O-CG 3.29Å; K76-Q80 PolarHBondContact O-N 2.95Å
77L91.6Very high84.4Confident90 Ų90104.1 Ų104.147%0.47152%0.517SS..Hα-helixtrans-68.4-41.2180-170.566.7000111.6N73 K74 Q80 K81N73-L77 WeakPolarHBondContact O-CB 3.49Å; N73-L77 PolarHBondContact O-N 2.93Å; K74-L77 PolarHBondContact O-N 2.93Å; L77-Q80 PolarHBondContact O-N 2.65Å; L77-K81 WeakPolarHBondContact O-CG 3.32Å; L77-K81 PolarHBondContact O-N 3.22Å
78E92.6Very high82.6Confident107 Ų107106.5 Ų106.550%0.554%0.54SS..Hα-helixtrans-60.9-45.6174.1-73.5172.5-179.500111.6K74 Q80 K81 Q82K74-E78 WeakPolarHBondContact O-CG 3.37Å; K74-E78 PolarHBondContact O-N 2.68Å; E78-Q80 VanDerWaalsContact C-N 3.32Å; E78-Q80 PolarHBondContact O-N 2.82Å; E78-K81 PolarHBondContact O-N 3.48Å; E78-Q82 WeakPolarHBondContact O-CG 3.34Å; E78-Q82 PolarHBondContact O-N 3.13Å
79R91.1Very high80.9Confident193 Ų193106.6 Ų106.673%0.72855%0.548SS*.Hα-helixtrans-61.3-38.2173.8-81-177.460.9171.30.3113L75 K76 S83L75-R79 WeakPolarHBondContact O-CB 3.2Å; L75-R79 WeakPolarHBondContact O-CG 3.31Å; L75-R79 PolarHBondContact O-N 3.19Å; K76-R79 PolarHBondContact O-N 3.21Å; R79-S83 PolarHBondContact O-N 3.41Å; R79-S83 VanDerWaalsContact O-N 3.09Å; R79-S83 PolarHBondContact O-OG 3.42Å
80Q89.4Confident79.1Confident117 Ų117104.8 Ų104.855%0.54755%0.552SS.*Hα-helixtrans-66-41.6176-76.8177.15.500111.5K76 L77 E78 S83 Q84K76-Q80 WeakPolarHBondContact O-CG 3.29Å; K76-Q80 PolarHBondContact O-N 2.95Å; L77-Q80 PolarHBondContact O-N 2.65Å; E78-Q80 VanDerWaalsContact C-N 3.32Å; E78-Q80 PolarHBondContact O-N 2.82Å; Q80-S83 PolarHBondContact O-N 3.33Å; Q80-S83 PolarHBondContact O-OG 2.92Å; Q80-Q84 PolarHBondContact O-N 2.94Å
81K88.6Confident77.1Confident135 Ų135104.8 Ų104.859%0.58756%0.557SS**Hα-helixtrans-62.6-44.3175.6-71.7177.2179.5-177.20112.3L77 E78 S83 Q84 S85L77-K81 WeakPolarHBondContact O-CG 3.32Å; L77-K81 PolarHBondContact O-N 3.22Å; E78-K81 PolarHBondContact O-N 3.48Å; K81-S83 VanDerWaalsContact C-N 3.33Å; K81-S83 PolarHBondContact O-N 2.95Å; K81-Q84 PolarHBondContact O-N 3.3Å; K81-Q84 VanDerWaalsContact O-N 3.14Å; K81-S85 PolarHBondContact O-N 3.44Å
82Q84.1Confident74.8Confident123 Ų123108.1 Ų108.158%0.57558%0.582SS**Hα-helixtrans-61.7-39.7176-71.7173.4-10.800112E78 Q84 S85E78-Q82 WeakPolarHBondContact O-CG 3.34Å; E78-Q82 PolarHBondContact O-N 3.13Å; Q82-Q84 PolarHBondContact O-N 3.45Å; Q82-S85 PolarHBondContact O-N 3.24Å; Q82-S85 PolarHBondContact O-OG 3.45Å
83S77.6Confident72.9Confident71 Ų71112.9 Ų112.950%0.49761%0.609SS.*Hα-helixtrans-67.7-16.617768.10000114.6R79 Q80 K81 T87R79-S83 PolarHBondContact O-N 3.41Å; R79-S83 VanDerWaalsContact O-N 3.09Å; R79-S83 PolarHBondContact O-OG 3.42Å; Q80-S83 PolarHBondContact O-N 3.33Å; Q80-S83 PolarHBondContact O-OG 2.92Å; K81-S83 VanDerWaalsContact C-N 3.33Å; K81-S83 PolarHBondContact O-N 2.95Å; S83-T87 WeakPolarHBondContact O-CG2 3.5Å
84Q70.6Confident71Confident149 Ų149115.7 Ų115.770%0.69662%0.623SS**Hα-helixtrans-87.7-23176-71.3-177.7-4.200113.1Q80 K81 Q82 T87Q80-Q84 PolarHBondContact O-N 2.94Å; K81-Q84 PolarHBondContact O-N 3.3Å; K81-Q84 VanDerWaalsContact O-N 3.14Å; Q82-Q84 PolarHBondContact O-N 3.45Å; Q84-T87 PolarHBondContact O-OG1 2.89Å
85S63.1Low69Low75 Ų75119.7 Ų119.752%0.52464%0.641SS.*Hα-helixtrans-77.4-29.2175.353.10000112.7K81 Q82 T87K81-S85 PolarHBondContact O-N 3.44Å; Q82-S85 PolarHBondContact O-N 3.24Å; Q82-S85 PolarHBondContact O-OG 3.45Å; S85-T87 PolarHBondContact O-N 3.1Å
86D63.1Low66.7Low122 Ų122125.7 Ų125.765%0.65266%0.663SS**G310 helixtrans-87.1-2-172-61.9-15.2000114.1S88D86-S88 VanDerWaalsContact C-N 3.25Å; D86-S88 PolarHBondContact O-N 3.24Å
87T56.5Low64.8Low121 Ų121130.1 Ų130.174%0.74268%0.682SS**G310 helixtrans-84.914-177.350.10000114.8S83 Q84 S85S83-T87 WeakPolarHBondContact O-CG2 3.5Å; Q84-T87 PolarHBondContact O-OG1 2.89Å; S85-T87 PolarHBondContact O-N 3.1Å
88S53.3Low62.5Low113 Ų113135.2 Ų135.279%0.7970%0.701SS**G310 helixtrans-98.4-0.3175.957.30000115.1D86D86-S88 VanDerWaalsContact C-N 3.25Å; D86-S88 PolarHBondContact O-N 3.24Å
89A54.3Low60.5Low74 Ų74135.1 Ų135.161%0.61271%0.712SS**SBendtrans-134.9113.2-179.100000113.6
90S50.7Low58.2Low99 Ų99133.6 Ų133.669%0.69272%0.718SS**  trans46.9104.2149.860.60000119.8
91N48.3Very low56.2Low141 Ų141137 Ų13775%0.75473%0.732SS**  153.9114.5112.7-79.2-47.5000110.9V93N91-V93 PolarHBondContact O-N 3.2Å
92P44.4Very low54.4Low128 Ų128135.4 Ų135.483%0.83174%0.737SS**  trans-93.286.5177.335.2-28.2000109.8
93V48Very low52.5Low112 Ų112138.8 Ų138.868%0.67975%0.75SS**  trans-140.9113.9173.7-175.70000109.9N91N91-V93 PolarHBondContact O-N 3.2Å
94L52.2Low50.7Low154 Ų154141.3 Ų141.381%0.80677%0.766SS**  trans79.4117170.3-46.8152000113.2
95K49Very low49.4Very low194 Ų194142.3 Ų142.384%0.84377%0.768SS**  cis-158.2123.647-69.9176-176.9171.90109.9K97K95-K97 PolarHBondContact O-N 3.44Å
96K42.8Very low48.8Very low214 Ų214148 Ų14893%0.9379%0.786SS**  trans-62.4115.3158.2-74.2173177.2168.10108.4
97K48.5Very low47.8Very low200 Ų200148.5 Ų148.587%0.8779%0.794SS**  trans-139.795.7151.2-138.5175.4-174.2178.50109K95 S99K95-K97 PolarHBondContact O-N 3.44Å; K97-S99 PolarHBondContact O-N 3.44Å
98K43.3Very low47.1Very low197 Ų197150.1 Ų150.186%0.85780%0.798SS**  trans-56.8124165-76.3176.6171.4177.80108.3
99S51.1Low46.5Very low106 Ų106150.3 Ų150.374%0.74179%0.794SS**  trans-122.599.9153.659.70000108K97 K101K97-S99 PolarHBondContact O-N 3.44Å; S99-K101 PolarHBondContact O-N 3.14Å
100N44.2Very low45.9Very low161 Ų161155.8 Ų155.886%0.86181%0.807SS**  trans-62.6111.7157.4-71.6-21.2000106.9
101K46.6Very low45.3Very low189 Ų189156.9 Ų156.982%0.82282%0.815SS**  trans-132.8111.2162.1-165.284.7-180-178.90108.5S99S99-K101 PolarHBondContact O-N 3.14Å
102S51.6Low44.9Very low100 Ų100155.1 Ų155.170%0.69981%0.814SS**  trans-35.3130.1171.331.70000115.3C104S102-C104 PolarHBondContact O-N 3.32Å; S102-C104 VanDerWaalsContact O-N 3.11Å
103K42.4Very low44.5Very low195 Ų195152.6 Ų152.685%0.84881%0.81SS**  trans-22.799.7151.3-160.1168.5-169164.90113
104C41.1Very low43.9Very low123 Ų123153.8 Ų153.883%0.83182%0.818SS**  trans-96.1111.9161.4-173.90000106.8S102 Q106S102-C104 PolarHBondContact O-N 3.32Å; S102-C104 VanDerWaalsContact O-N 3.11Å; C104-Q106 PolarHBondContact O-N 3.36Å
105K43.2Very low43.2Very low170 Ų170151.9 Ų151.974%0.73982%0.818SS**  trans-69.1119.5174.2-74.7175.1174-179.30108.1T107K105-T107 PolarHBondContact O-N 2.93Å
106Q51.3Low42.9Very low194 Ų194152.4 Ų152.491%0.90782%0.82SS**  trans-63117.1155.7-78.9168.8-38.300107.5C104C104-Q106 PolarHBondContact O-N 3.36Å
107T40.1Very low43Very low134 Ų134151.1 Ų151.182%0.82282%0.818SS**  trans-97.7109.6155.946.60000106.3K105K105-T107 PolarHBondContact O-N 2.93Å
108D43.4Very low42.5Very low155 Ų155148.3 Ų148.383%0.82982%0.817SS**  trans-69.4155.3173.8-139.3-23.4000110.6
109V39.6Very low42.3Very low117 Ų117147.2 Ų147.271%0.70982%0.815SS**  trans-75.4126.8-169.6-1650000109.9
110Q43Very low42.1Very low189 Ų189149.9 Ų149.988%0.88382%0.82SS**  trans-132.793.2153.2-84.9-174.4-6.600109.2S112Q110-S112 PolarHBondContact O-N 3.32Å
111S36.6Very low42.2Very low121 Ų121149.7 Ų149.785%0.84682%0.819SS**  trans-66108.9155-79.20000108.3
112S39.9Very low41.9Very low105 Ų105145.5 Ų145.573%0.73481%0.814SS**  trans-131111.4158.259.10000107.4Q110Q110-S112 PolarHBondContact O-N 3.32Å
113G35.7Very low41.7Very low74 Ų74146.6 Ų146.676%0.76382%0.818SS**  trans-62.4148.5179.300000112.4
114T37.2Very low41.6Very low138 Ų138146.1 Ų146.185%0.84782%0.816SS**  trans-157.7115.5145.4-79.40000107.6
115S36.4Very low41.7Very low114 Ų114147.1 Ų147.180%0.79781%0.813SS**  trans-52.1135.7169.2-48.70000111.6
116K42.9Very low41.6Very low205 Ų205145.8 Ų145.889%0.89182%0.819SS**  trans-154123.2142.8-107.6169.3-171.9-173.60109.6
117Q45.4Very low41.2Very low187 Ų187146 Ų14687%0.87482%0.817SS**  trans-53.5145.6172.5-65.3154-49.100110.7
118T37.9Very low41.3Very low141 Ų141146 Ų14687%0.86582%0.819SS**  -159131.1117.4-54.70000108.2
119E38.7Very low40.9Very low174 Ų174143.2 Ų143.281%0.81381%0.812SS**  trans-61.6154.1170.7-63.3-176.1132.200111.7
120L47.9Very low40.6Very low161 Ų161143.4 Ų143.484%0.84381%0.814SS**  172.9109.6123.8-87.6165.6000109.7
121D44.7Very low40.3Very low157 Ų157140 Ų14084%0.8481%0.806SS**  trans56133.8139.1-129.82.4000122.6
122S41.5Very low40.3Very low102 Ų102139.1 Ų139.171%0.71380%0.799SS**  trans-104.6-167.5175.3-49.20000109.2
123P46.9Very low40.1Very low122 Ų122139.8 Ų139.879%0.79280%0.804SS**  cis-132.9179.7-20.322.61.5000112.2
124K40.7Very low40Very low185 Ų185142.7 Ų142.780%0.80480%0.802SS**  147.9118.8119-154.8172.7-170.4177.40113.7
125L42.9Very low40Very low144 Ų144145.6 Ų145.675%0.75480%0.799SS**  trans16.6134.2149.8-64.2101.2000120.4
126T41.7Very low39.9Very low142 Ų142144.9 Ų144.987%0.87179%0.794SS**  178.5141.7102330000111.8
127K41.9Very low39.6Very low199 Ų199141.8 Ų141.887%0.86579%0.787SS**  trans-79.5166.6173.4-60.8173.6171.7176.30109.9
128P42.3Very low39.2Very low134 Ų134141 Ų14187%0.8778%0.781SS**  -154.4-178.188.637.2-14.9000116.8
129S35.9Very low39.1Very low97 Ų97140.7 Ų140.768%0.67878%0.779SS**  trans-77.6148.1-174.9133.30000114.9
130T32.3Very low39.1Very low121 Ų121138.8 Ų138.874%0.74277%0.774SS**  trans40.6118.9135.9-25.70000119.3
131T36.1Very low39Very low118 Ų118138 Ų13872%0.72477%0.769SS**  159.5129.4109-53.60000109.3
132S36.8Very low39.1Very low101 Ų101138.3 Ų138.371%0.70677%0.765SS**  trans29.6118.8158.567.60000120
133S36.5Very low39.1Very low120 Ų120140.2 Ų140.284%0.83977%0.766SS**  170.2146.7105.660.80000110.8
134D34Very low39Very low135 Ų135140.2 Ų140.272%0.72277%0.766SS**  trans-14142.5166.6-94-26.8000122
135Y37.1Very low38.8Very low198 Ų198136.4 Ų136.478%0.77676%0.763SS**  trans59119.2148.8-72.2-80.4000121.5
136S33.3Very low38.7Very low99 Ų99134.1 Ų134.169%0.69275%0.752SS**  trans56.3105.4140.9530000118.1
137D37.4Very low38.9Very low140 Ų140131.4 Ų131.475%0.74974%0.744SS**  -169.3132.6119.5-110.3-18.6000114.9
138K36.2Very low39.2Very low172 Ų172127.4 Ų127.475%0.74874%0.736SS**  trans49.898.1144.5-38.4-151-176.9-163.50119.7
139V37Very low39.5Very low133 Ų133125.4 Ų125.481%0.80672%0.721SS**  trans-96.3106.1140.9-167.60000107.2I141V139-I141 HydrophobicContact CG1-CG1 4.47Å; V139-I141 PolarHBondContact O-N 3.32Å; V139-I141 VanDerWaalsContact O-N 3.08Å
140N38.3Very low40.3Very low134 Ų134124.3 Ų124.372%0.71771%0.71SS**  trans-56100165.3-177.142.6000108.6
141I45Very low42.2Very low144 Ų144122.3 Ų122.374%0.73870%0.698SS**  trans-98.5114.3165.1-63.6-179.6000105.7V139 I143V139-I141 HydrophobicContact CG1-CG1 4.47Å; V139-I141 PolarHBondContact O-N 3.32Å; V139-I141 VanDerWaalsContact O-N 3.08Å; I141-I143 PolarHBondContact O-N 3.13Å
142E46.8Very low44.4Very low164 Ų164121 Ų12177%0.76669%0.69SS**  trans-47.8129.6-179.2-66167.3174.900111.6P144E142-P144 WeakPolarHBondContact O-CD 3.46Å
143I41.2Very low46.8Very low142 Ų142120.9 Ų120.973%0.72868%0.678SS**  trans-73.9117.7179.3-62151.6000108I141 S145I141-I143 PolarHBondContact O-N 3.13Å; I143-S145 PolarHBondContact O-N 3.27Å
144P45.2Very low49.2Very low122 Ų122118.5 Ų118.579%0.79266%0.656SS**  trans-84.894.1152.919.4-2.5000106.7E142 D146E142-P144 WeakPolarHBondContact O-CD 3.46Å; P144-D146 PolarHBondContact O-N 3.07Å
145S36.2Very low52Low106 Ų106113 Ų11374%0.74163%0.626SS**  trans-73.883.1163.563.70000107.7I143I143-S145 PolarHBondContact O-N 3.27Å
146D40.9Very low54.7Low96 Ų96105.5 Ų105.551%0.51360%0.6SS.*  trans-131.176.2163.5-160.514000108.8P144 T148P144-D146 PolarHBondContact O-N 3.07Å; D146-T148 PolarHBondContact O-N 2.82Å; D146-T148 VanDerWaalsContact O-N 3.07Å
147A45.6Very low57.5Low85 Ų85105.4 Ų105.470%0.70258%0.584SS**THydrogen-bonded Turntrans-79.225.6-166.500000114.3
148T50.1Low60.2Low114 Ų114102.9 Ų102.970%0.69957%0.568SS**THydrogen-bonded Turntrans-135-21-177.557.30000114.8D146D146-T148 PolarHBondContact O-N 2.82Å; D146-T148 VanDerWaalsContact O-N 3.07Å
149V48.5Very low63Low92 Ų9295.4 Ų95.456%0.55854%0.536SS*.THydrogen-bonded Turntrans-92.1-12.7177.2-171.70000112.3
150T51.3Low65.8Low74 Ų7495.6 Ų95.645%0.45452%0.522SS..Hα-helixtrans-89.72.1-175.251.80000115.6N154T150-N154 VanDerWaalsContact O-CB 3.32Å; T150-N154 WeakPolarHBondContact O-CB 3.34Å; T150-N154 PolarHBondContact O-ND2 3.28Å
151T71.8Confident68.6Low79 Ų7997.2 Ų97.249%0.48552%0.519SS..Hα-helixtrans-86.9-47.9-172.6-43.60000111.9N154 I155T151-N154 PolarHBondContact O-N 2.93Å; T151-I155 HydrophobicContact CG2-CD1 4.1Å; T151-I155 WeakPolarHBondContact O-CD1 3.34Å; T151-I155 VanDerWaalsContact O-CG1 3.27Å; T151-I155 WeakPolarHBondContact O-CG1 3.45Å; T151-I155 PolarHBondContact O-N 2.9Å
152T82.3Confident71Confident90 Ų9091.8 Ų91.855%0.55249%0.49SS*.Hα-helixtrans-68-45.9-176.157.70000112.7N154 I155 D156T152-N154 VanDerWaalsContact C-N 3.26Å; T152-N154 PolarHBondContact O-N 3.41Å; T152-I155 PolarHBondContact O-N 3.48Å; T152-D156 PolarHBondContact O-N 3.08Å
153E87.1Confident73.4Confident100 Ų10088.3 Ų88.347%0.46747%0.473SS..Hα-helixtrans-63.9-33.6178.4-65-164.1164.900112.6D156 R157E153-D156 PolarHBondContact O-N 2.98Å; E153-R157 VanDerWaalsContact CB-NH2 3.26Å; E153-R157 WeakPolarHBondContact O-CB 3.38Å; E153-R157 VanDerWaalsContact O-CG 3.28Å; E153-R157 WeakPolarHBondContact O-CG 3.37Å; E153-R157 PolarHBondContact O-N 3.23Å; E153-R157 IonicContact OE2-CZ 3.91Å; E153-R157 IonicContact OE2-NH1 3.39Å; E153-R157 PolarHBondContact OE2-NH1 2.75Å; E153-R157 IonicContact OE2-NH2 3.43Å; E153-R157 PolarHBondContact OE2-NH2 3.09Å
154N88.6Confident76.1Confident69 Ų6988.9 Ų88.937%0.36947%0.471SS..Hα-helixtrans-71.7-39.7176.8-78.3-28000111.5T150 T151 T152 D156 R157 Q158T150-N154 VanDerWaalsContact O-CB 3.32Å; T150-N154 WeakPolarHBondContact O-CB 3.34Å; T150-N154 PolarHBondContact O-ND2 3.28Å; T151-N154 PolarHBondContact O-N 2.93Å; T152-N154 VanDerWaalsContact C-N 3.26Å; T152-N154 PolarHBondContact O-N 3.41Å; N154-D156 VanDerWaalsContact C-N 3.34Å; N154-R157 PolarHBondContact O-N 3.41Å; N154-R157 PolarHBondContact OD1-NE 3.25Å; N154-R157 PolarHBondContact OD1-NH2 2.88Å; N154-Q158 WeakPolarHBondContact O-CG 3.41Å; N154-Q158 PolarHBondContact O-N 3.33Å
155I92.3Very high78.6Confident19 Ų1987.5 Ų87.510%0.09745%0.45CS..Hα-helixtrans-59-46170.3-66.4162.5000110.1T151 T152 R157 Q158 L159 L203 L206 K207T151-I155 HydrophobicContact CG2-CD1 4.1Å; T151-I155 WeakPolarHBondContact O-CD1 3.34Å; T151-I155 VanDerWaalsContact O-CG1 3.27Å; T151-I155 WeakPolarHBondContact O-CG1 3.45Å; T151-I155 PolarHBondContact O-N 2.9Å; T152-I155 PolarHBondContact O-N 3.48Å; I155-R157 PolarHBondContact O-N 2.96Å; I155-Q158 PolarHBondContact O-N 3Å; I155-Q158 VanDerWaalsContact O-N 3.09Å; I155-L159 HydrophobicContact CG2-CD1 4.11Å; I155-L159 HydrophobicContact CG2-CG 4.43Å; I155-L159 PolarHBondContact O-N 3.45Å; I155-L203 HydrophobicContact CG2-CB 4.36Å; I155-L203 HydrophobicContact CG2-CD2 4.35Å; I155-L203 WeakPolarHBondContact CG2-O 3.47Å; I155-L206 HydrophobicContact CD1-CB 4.18Å; I155-K207 HydrophobicContact CG2-CB 4.01Å
156D92.6Very high81.5Confident42 Ų4283.6 Ų83.623%0.22542%0.42CS..Hα-helixtrans-63.5-38.3176.7-80.4-23.4000113.2T152 E153 N154 Q158 R160 K207T152-D156 PolarHBondContact O-N 3.08Å; E153-D156 PolarHBondContact O-N 2.98Å; N154-D156 VanDerWaalsContact C-N 3.34Å; D156-Q158 VanDerWaalsContact C-N 3.31Å; D156-R160 WeakPolarHBondContact O-CB 3.45Å; D156-R160 WeakPolarHBondContact O-CG 3.49Å; D156-R160 PolarHBondContact O-N 3.09Å; D156-R160 VanDerWaalsContact O-N 3.07Å; D156-R160 PolarHBondContact O-NE 3.4Å; D156-R160 VanDerWaalsContact O-NE 3.13Å; D156-K207 WeakPolarHBondContact OD1-CD 3.46Å; D156-K207 WeakPolarHBondContact OD1-CE 3.16Å; D156-K207 IonicContact OD1-NZ 3.66Å; D156-K207 PolarHBondContact OD1-NZ 2.95Å; D156-K207 IonicContact OD2-NZ 2.71Å
157R93.5Very high84.1Confident97 Ų9784.2 Ų84.237%0.36642%0.423SS..Hα-helixtrans-63.2-38.6172.8-78.9-176.1-94.3-93.65.3111.1E153 N154 I155 R161E153-R157 VanDerWaalsContact CB-NH2 3.26Å; E153-R157 WeakPolarHBondContact O-CB 3.38Å; E153-R157 VanDerWaalsContact O-CG 3.28Å; E153-R157 WeakPolarHBondContact O-CG 3.37Å; E153-R157 PolarHBondContact O-N 3.23Å; E153-R157 IonicContact OE2-CZ 3.91Å; E153-R157 IonicContact OE2-NH1 3.39Å; E153-R157 PolarHBondContact OE2-NH1 2.75Å; E153-R157 IonicContact OE2-NH2 3.43Å; E153-R157 PolarHBondContact OE2-NH2 3.09Å; N154-R157 PolarHBondContact O-N 3.41Å; N154-R157 PolarHBondContact OD1-NE 3.25Å; N154-R157 PolarHBondContact OD1-NH2 2.88Å; I155-R157 PolarHBondContact O-N 2.96Å; R157-R161 WeakPolarHBondContact O-CG 3.28Å; R157-R161 PolarHBondContact O-N 3.19Å
158Q93.9Very high86.6Confident86 Ų8684.4 Ų84.440%0.40241%0.409SS..Hα-helixtrans-71.1-46.7176.6-69.9-178.526.800112.1N154 I155 D156 R160 R161 E162 L203N154-Q158 WeakPolarHBondContact O-CG 3.41Å; N154-Q158 PolarHBondContact O-N 3.33Å; I155-Q158 PolarHBondContact O-N 3Å; I155-Q158 VanDerWaalsContact O-N 3.09Å; D156-Q158 VanDerWaalsContact C-N 3.31Å; Q158-R160 VanDerWaalsContact C-N 3.28Å; Q158-R160 PolarHBondContact O-N 3.28Å; Q158-R161 WeakPolarHBondContact O-CA 3.45Å; Q158-R161 WeakPolarHBondContact O-CB 3.41Å; Q158-R161 PolarHBondContact O-N 3.22Å; Q158-E162 PolarHBondContact O-N 3.22Å; Q158-L203 HydrophobicContact CB-CD1 3.63Å; Q158-L203 HydrophobicContact CB-CD2 4.24Å
159L95.4Very high88.8Confident15 Ų1579 Ų798%0.07938%0.377CS..Hα-helixtrans-53.4-45.5174.4-78.1171.6000111.7I155 R161 E162 H163 I200 L203 T204 K207I155-L159 HydrophobicContact CG2-CD1 4.11Å; I155-L159 HydrophobicContact CG2-CG 4.43Å; I155-L159 PolarHBondContact O-N 3.45Å; L159-R161 VanDerWaalsContact C-N 3.28Å; L159-R161 PolarHBondContact O-N 2.72Å; L159-E162 PolarHBondContact O-N 3.03Å; L159-H163 WeakPolarHBondContact O-CB 3.4Å; L159-H163 PolarHBondContact O-CD2 3.38Å; L159-H163 PolarHBondContact O-N 3.31Å; L159-I200 HydrophobicContact CD2-CG2 4.25Å; L159-L203 HydrophobicContact CD2-CB 3.52Å; L159-L203 HydrophobicContact CD2-CD1 4.36Å; L159-L203 HydrophobicContact CG-CB 3.84Å; L159-L203 HydrophobicContact CG-CD1 4.48Å; L159-T204 HydrophobicContact CD2-CG2 3.8Å; L159-K207 HydrophobicContact CD1-CD 3.92Å
160R95.8Very high91.1Very high137 Ų13778.8 Ų78.852%0.51737%0.369SS..Hα-helixtrans-62.2-31.6176.2-76.3-179.9-72.7-125.5-1.3113.7D156 Q158 K164D156-R160 WeakPolarHBondContact O-CB 3.45Å; D156-R160 WeakPolarHBondContact O-CG 3.49Å; D156-R160 PolarHBondContact O-N 3.09Å; D156-R160 VanDerWaalsContact O-N 3.07Å; D156-R160 PolarHBondContact O-NE 3.4Å; D156-R160 VanDerWaalsContact O-NE 3.13Å; Q158-R160 VanDerWaalsContact C-N 3.28Å; Q158-R160 PolarHBondContact O-N 3.28Å; R160-K164 VanDerWaalsContact O-CG 3.28Å; R160-K164 WeakPolarHBondContact O-CG 3.32Å; R160-K164 PolarHBondContact O-N 2.92Å
161R96.7Very high93.3Very high169 Ų16980.3 Ų80.364%0.63837%0.371SS*.Hα-helixtrans-75.2-46.2177.1-71.4170.7-174.1-177.13110.7R157 Q158 L159 K164 R165R157-R161 WeakPolarHBondContact O-CG 3.28Å; R157-R161 PolarHBondContact O-N 3.19Å; Q158-R161 WeakPolarHBondContact O-CA 3.45Å; Q158-R161 WeakPolarHBondContact O-CB 3.41Å; Q158-R161 PolarHBondContact O-N 3.22Å; L159-R161 VanDerWaalsContact C-N 3.28Å; L159-R161 PolarHBondContact O-N 2.72Å; R161-K164 WeakPolarHBondContact O-CB 3.37Å; R161-K164 PolarHBondContact O-N 3.04Å; R161-R165 PolarHBondContact O-N 2.84Å
162E96.4Very high94.4Very high30 Ų3076.9 Ų76.914%0.1435%0.35CS..Hα-helixtrans-70.3-38.5-178-61.9-49.3131.700112.2Q158 L159 K164 R165 L166 V196 L199 I200 L203Q158-E162 PolarHBondContact O-N 3.22Å; L159-E162 PolarHBondContact O-N 3.03Å; E162-K164 VanDerWaalsContact C-N 3.31Å; E162-K164 PolarHBondContact O-N 3.5Å; E162-R165 CarbonylContact O-C 3.58Å; E162-R165 WeakPolarHBondContact O-CA 3.27Å; E162-R165 WeakPolarHBondContact O-CB 3.42Å; E162-R165 PolarHBondContact O-N 3.06Å; E162-R165 IonicContact OE2-NH1 2.65Å; E162-L166 PolarHBondContact O-N 3.34Å; E162-V196 HydrophobicContact CB-CG1 4.3Å; E162-L199 HydrophobicContact CG-CD2 3.68Å; E162-L199 HydrophobicContact CG-CG 4.08Å; E162-I200 HydrophobicContact CB-CD1 4.15Å; E162-I200 HydrophobicContact CB-CG1 3.62Å; E162-L203 HydrophobicContact CG-CD1 4.37Å
163H96.5Very high95Very high90 Ų9075.1 Ų75.142%0.41734%0.335SS..Hα-helixtrans-58.8-40.3170.8-83.4-64.2000112.6L159 R165 L166 L167L159-H163 WeakPolarHBondContact O-CB 3.4Å; L159-H163 PolarHBondContact O-CD2 3.38Å; L159-H163 PolarHBondContact O-N 3.31Å; H163-R165 VanDerWaalsContact C-N 3.29Å; H163-R165 PolarHBondContact O-N 2.95Å; H163-L166 PolarHBondContact O-N 3.32Å; H163-L167 WeakPolarHBondContact O-CG 3.42Å; H163-L167 PolarHBondContact O-N 3.14Å
164K97.8Very high95.4Very high154 Ų15477.7 Ų77.767%0.6735%0.345SS*.Hα-helixtrans-64.4-36174.6-75175.9-176.9-175.30112.1R160 R161 E162 Q168R160-K164 VanDerWaalsContact O-CG 3.28Å; R160-K164 WeakPolarHBondContact O-CG 3.32Å; R160-K164 PolarHBondContact O-N 2.92Å; R161-K164 WeakPolarHBondContact O-CB 3.37Å; R161-K164 PolarHBondContact O-N 3.04Å; E162-K164 VanDerWaalsContact C-N 3.31Å; E162-K164 PolarHBondContact O-N 3.5Å; K164-Q168 PolarHBondContact O-N 3.11Å; K164-Q168 VanDerWaalsContact O-N 3.1Å
165R96.6Very high95.8Very high94 Ų9477.4 Ų77.436%0.35534%0.34SS..Hα-helixtrans-68.5-41.8176.3-169.5176.1-179.5177.86111.3R161 E162 H163 Q168 I169 H192 V196R161-R165 PolarHBondContact O-N 2.84Å; E162-R165 CarbonylContact O-C 3.58Å; E162-R165 WeakPolarHBondContact O-CA 3.27Å; E162-R165 WeakPolarHBondContact O-CB 3.42Å; E162-R165 PolarHBondContact O-N 3.06Å; E162-R165 IonicContact OE2-NH1 2.65Å; H163-R165 VanDerWaalsContact C-N 3.29Å; H163-R165 PolarHBondContact O-N 2.95Å; R165-Q168 PolarHBondContact O-N 3.37Å; R165-I169 HydrophobicContact CG-CD1 4.22Å; R165-I169 VanDerWaalsContact O-CG1 3.3Å; R165-I169 WeakPolarHBondContact O-CG1 3.46Å; R165-I169 PolarHBondContact O-N 3.49Å; R165-H192 PolarHBondContact NH2-ND1 3.26Å; R165-H192 VanDerWaalsContact NH2-ND1 3.17Å; R165-V196 HydrophobicContact CB-CG1 4.31Å; R165-V196 HydrophobicContact CG-CG2 3.96Å
166L97.1Very high95.9Very high24 Ų2482.8 Ų82.813%0.12636%0.363CS..Hα-helixtrans-60.2-48.5175-173.164.1000111E162 H163 Q168 I169 E170 K193 V196 E197 I200E162-L166 PolarHBondContact O-N 3.34Å; H163-L166 PolarHBondContact O-N 3.32Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 3.39Å; L166-I169 WeakPolarHBondContact O-CA 3.48Å; L166-I169 WeakPolarHBondContact O-CB 3.34Å; L166-I169 PolarHBondContact O-N 2.72Å; L166-E170 WeakPolarHBondContact O-CG 3.41Å; L166-E170 PolarHBondContact O-N 3.07Å; L166-K193 HydrophobicContact CD1-CG 4.44Å; L166-V196 HydrophobicContact CB-CG1 4.04Å; L166-E197 HydrophobicContact CD1-CG 3.84Å; L166-I200 HydrophobicContact CB-CD1 4.18Å; L166-I200 HydrophobicContact CD2-CD1 3.92Å
167L97Very high96Very high109 Ų10988.8 Ų88.857%0.57139%0.39SS*.Hα-helixtrans-56.6-41.4175.1-73.7171.7000112.7H163 I169 E170 E171H163-L167 WeakPolarHBondContact O-CG 3.42Å; H163-L167 PolarHBondContact O-N 3.14Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-E170 PolarHBondContact O-N 3.24Å; L167-E171 PolarHBondContact O-N 3.43Å
168Q97.1Very high96Very high88 Ų8888.2 Ų88.241%0.41141%0.406SS..Hα-helixtrans-65-39176.1-17817620.400111.9K164 R165 L166 E171 I172K164-Q168 PolarHBondContact O-N 3.11Å; K164-Q168 VanDerWaalsContact O-N 3.1Å; R165-Q168 PolarHBondContact O-N 3.37Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 3.39Å; Q168-E171 PolarHBondContact O-N 3.24Å; Q168-I172 HydrophobicContact CG-CD1 4.17Å; Q168-I172 WeakPolarHBondContact O-CD1 3.42Å; Q168-I172 VanDerWaalsContact O-CG1 3.23Å; Q168-I172 WeakPolarHBondContact O-CG1 3.41Å; Q168-I172 PolarHBondContact O-N 2.89Å; Q168-I172 VanDerWaalsContact O-N 3.11Å
169I97.1Very high95.9Very high2 Ų287.2 Ų87.21%0.0142%0.418CS..Hα-helixtrans-66.9-44.4177.5-69.1168.6000110.1R165 L166 L167 E171 I172 E173 K189 L190 K193 V196R165-I169 HydrophobicContact CG-CD1 4.22Å; R165-I169 VanDerWaalsContact O-CG1 3.3Å; R165-I169 WeakPolarHBondContact O-CG1 3.46Å; R165-I169 PolarHBondContact O-N 3.49Å; L166-I169 WeakPolarHBondContact O-CA 3.48Å; L166-I169 WeakPolarHBondContact O-CB 3.34Å; L166-I169 PolarHBondContact O-N 2.72Å; L167-I169 VanDerWaalsContact C-N 3.34Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 3.36Å; I169-I172 CarbonylContact O-C 3.59Å; I169-I172 WeakPolarHBondContact O-CA 3.46Å; I169-I172 WeakPolarHBondContact O-CB 3.48Å; I169-I172 PolarHBondContact O-N 3.14Å; I169-I172 VanDerWaalsContact O-N 3.08Å; I169-E173 WeakPolarHBondContact O-CG 3.29Å; I169-E173 PolarHBondContact O-N 3.13Å; I169-K189 WeakPolarHBondContact CD1-O 3.24Å; I169-K189 HydrophobicContact CG1-CB 4.38Å; I169-L190 HydrophobicContact CG2-CD2 4.16Å; I169-K193 HydrophobicContact CG2-CB 3.84Å; I169-K193 HydrophobicContact CG2-CD 4.06Å; I169-K193 HydrophobicContact CG2-CG 3.98Å; I169-V196 HydrophobicContact CD1-CB 4.5Å; I169-V196 HydrophobicContact CD1-CG2 3.96Å
170E96.4Very high95.6Very high87 Ų8791.9 Ų91.941%0.40744%0.44SS..Hα-helixtrans-60.3-40175.2-71.3174.7-179.400112.2L166 L167 I172 E173 K174L166-E170 WeakPolarHBondContact O-CG 3.41Å; L166-E170 PolarHBondContact O-N 3.07Å; L167-E170 PolarHBondContact O-N 3.24Å; E170-I172 VanDerWaalsContact C-N 3.3Å; E170-I172 PolarHBondContact O-N 3.14Å; E170-E173 PolarHBondContact O-N 3Å; E170-K174 WeakPolarHBondContact O-CB 3.46Å; E170-K174 PolarHBondContact O-N 2.66Å
171E96.4Very high95.3Very high105 Ų10592.9 Ų92.949%0.49146%0.455SS..Hα-helixtrans-61.9-40173.5-165.6-165.2152.700111.4L167 Q168 I169 K174 K175L167-E171 PolarHBondContact O-N 3.43Å; Q168-E171 PolarHBondContact O-N 3.24Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 3.36Å; E171-K174 PolarHBondContact O-N 3.31Å; E171-K175 WeakPolarHBondContact O-CG 3.37Å; E171-K175 PolarHBondContact O-N 3.09Å; E171-K175 WeakPolarHBondContact OE1-CE 3.37Å; E171-K175 IonicContact OE1-NZ 2.98Å; E171-K175 PolarHBondContact OE1-NZ 3.43Å
172I96.1Very high95.1Very high7 Ų786.6 Ų86.64%0.03643%0.434CS..Hα-helixtrans-67.9-38.9175.8-68.4167.2000111Q168 I169 E170 K175 K176 L182 Q186 K189 L190Q168-I172 HydrophobicContact CG-CD1 4.17Å; Q168-I172 WeakPolarHBondContact O-CD1 3.42Å; Q168-I172 VanDerWaalsContact O-CG1 3.23Å; Q168-I172 WeakPolarHBondContact O-CG1 3.41Å; Q168-I172 PolarHBondContact O-N 2.89Å; Q168-I172 VanDerWaalsContact O-N 3.11Å; I169-I172 CarbonylContact O-C 3.59Å; I169-I172 WeakPolarHBondContact O-CA 3.46Å; I169-I172 WeakPolarHBondContact O-CB 3.48Å; I169-I172 PolarHBondContact O-N 3.14Å; I169-I172 VanDerWaalsContact O-N 3.08Å; E170-I172 VanDerWaalsContact C-N 3.3Å; E170-I172 PolarHBondContact O-N 3.14Å; I172-K175 PolarHBondContact O-N 3.31Å; I172-K176 PolarHBondContact O-N 2.89Å; I172-L182 HydrophobicContact CG2-CD1 3.78Å; I172-L182 HydrophobicContact CG2-CD2 3.7Å; I172-L182 HydrophobicContact CG2-CG 4.25Å; I172-Q186 HydrophobicContact CD1-CB 4.26Å; I172-Q186 HydrophobicContact CD1-CG 4.01Å; I172-Q186 HydrophobicContact CG1-CG 4.24Å; I172-Q186 HydrophobicContact CG2-CB 3.91Å; I172-Q186 HydrophobicContact CG2-CG 4.4Å; I172-K189 HydrophobicContact CD1-CB 4.02Å; I172-K189 HydrophobicContact CD1-CD 3.75Å; I172-L190 HydrophobicContact CB-CD2 4.14Å; I172-L190 HydrophobicContact CG2-CD1 4.01Å; I172-L190 HydrophobicContact CG2-CD2 3.64Å; I172-L190 HydrophobicContact CG2-CG 3.63Å
173E95.3Very high94.9Very high53 Ų5390.3 Ų90.325%0.24846%0.455CS..Hα-helixtrans-62.8-42.5173.8-73.8-173.4151.800111.7I169 E170 K175 K176 Q177 L190 K193I169-E173 WeakPolarHBondContact O-CG 3.29Å; I169-E173 PolarHBondContact O-N 3.13Å; E170-E173 PolarHBondContact O-N 3Å; E173-K175 VanDerWaalsContact C-N 3.33Å; E173-K175 PolarHBondContact O-N 3.05Å; E173-K176 WeakPolarHBondContact O-CB 3.39Å; E173-K176 PolarHBondContact O-N 3.33Å; E173-Q177 WeakPolarHBondContact O-CG 3.3Å; E173-Q177 PolarHBondContact O-N 3.16Å; E173-L190 HydrophobicContact CB-CD2 4.28Å; E173-L190 HydrophobicContact CG-CD2 3.27Å; E173-K193 WeakPolarHBondContact OE1-CD 3.11Å; E173-K193 IonicContact OE1-NZ 2.71Å; E173-K193 PolarHBondContact OE1-NZ 3.14Å; E173-K193 IonicContact OE2-NZ 2.72Å; E173-K193 PolarHBondContact OE2-NZ 3.33Å
174K95.8Very high94.8Very high154 Ų15494.7 Ų94.767%0.6747%0.473SS*.Hα-helixtrans-61.5-40.6175.4-170.6176.3-179.4176.90111.7E170 E171 Q177 A178E170-K174 WeakPolarHBondContact O-CB 3.46Å; E170-K174 PolarHBondContact O-N 2.66Å; E171-K174 PolarHBondContact O-N 3.31Å; K174-Q177 PolarHBondContact O-N 2.95Å; K174-A178 WeakPolarHBondContact O-CB 3.37Å; K174-A178 PolarHBondContact O-N 3.34Å
175K95.8Very high94.7Very high63 Ų6391.6 Ų91.627%0.27446%0.464SS..Hα-helixtrans-64.4-39.4173.7-72.1175.5-175.7165.60112.4E171 I172 E173 A178 G179 E180E171-K175 WeakPolarHBondContact O-CG 3.37Å; E171-K175 PolarHBondContact O-N 3.09Å; E171-K175 WeakPolarHBondContact OE1-CE 3.37Å; E171-K175 IonicContact OE1-NZ 2.98Å; E171-K175 PolarHBondContact OE1-NZ 3.43Å; I172-K175 PolarHBondContact O-N 3.31Å; E173-K175 VanDerWaalsContact C-N 3.33Å; E173-K175 PolarHBondContact O-N 3.05Å; K175-A178 PolarHBondContact O-N 2.93Å; K175-G179 PolarHBondContact O-N 3.2Å; K175-E180 HydrophobicContact CB-CB 4.37Å; K175-E180 WeakPolarHBondContact CD-OE2 3.45Å; K175-E180 WeakPolarHBondContact CG-OE2 3.29Å; K175-E180 WeakPolarHBondContact O-CB 3.17Å; K175-E180 PolarHBondContact O-N 3.39Å; K175-E180 VanDerWaalsContact O-N 3.07Å
176K94.5Very high94.7Very high132 Ų13288.8 Ų88.857%0.57446%0.455SS*.Hα-helixtrans-62.7-42.6173.5-177.2-176.9175.1-172.40111.5I172 E173 A178 G179 L190I172-K176 PolarHBondContact O-N 2.89Å; E173-K176 WeakPolarHBondContact O-CB 3.39Å; E173-K176 PolarHBondContact O-N 3.33Å; K176-A178 VanDerWaalsContact C-N 3.33Å; K176-G179 PolarHBondContact O-N 2.97Å; K176-G179 VanDerWaalsContact O-N 3.17Å; K176-L190 HydrophobicContact CD-CD1 3.82Å
177Q94.1Very high94.5Very high168 Ų16892.1 Ų92.179%0.78547%0.472SS*.Hα-helixtrans-66.5-33.6175.6-71.7178-0.800112.5E173 K174 G179E173-Q177 WeakPolarHBondContact O-CG 3.3Å; E173-Q177 PolarHBondContact O-N 3.16Å; K174-Q177 PolarHBondContact O-N 2.95Å; Q177-G179 PolarHBondContact O-N 3.41Å
178A94.7Very high94.5Very high85 Ų8591.7 Ų91.770%0.70247%0.47SS*.THydrogen-bonded Turntrans-71.9-4.6173.600000113.8K174 K175 K176K174-A178 WeakPolarHBondContact O-CB 3.37Å; K174-A178 PolarHBondContact O-N 3.34Å; K175-A178 PolarHBondContact O-N 2.93Å; K176-A178 VanDerWaalsContact C-N 3.33Å
179G90.6Very high94.4Very high65 Ų6590 Ų9067%0.6746%0.461SS*.THydrogen-bonded Turntrans80.616.3179.300000114.8K175 K176 Q177K175-G179 PolarHBondContact O-N 3.2Å; K176-G179 PolarHBondContact O-N 2.97Å; K176-G179 VanDerWaalsContact O-N 3.17Å; Q177-G179 PolarHBondContact O-N 3.41Å
180E90.2Very high94.3Very high114 Ų11491.1 Ų91.153%0.53347%0.467SS..  trans-73.9138.7178-165.4179.5175.600111.4K175 L182K175-E180 HydrophobicContact CB-CB 4.37Å; K175-E180 WeakPolarHBondContact CD-OE2 3.45Å; K175-E180 WeakPolarHBondContact CG-OE2 3.29Å; K175-E180 WeakPolarHBondContact O-CB 3.17Å; K175-E180 PolarHBondContact O-N 3.39Å; K175-E180 VanDerWaalsContact O-N 3.07Å; E180-L182 PolarHBondContact O-N 3.01Å
181N89.8Confident94.2Very high157 Ų15789.9 Ų89.984%0.8448%0.477SS*.  trans-67.8115.1178.3-75.7-47.6000111.1
182L90.9Very high94.1Very high37 Ų3788.7 Ų88.719%0.19447%0.472CS..  trans-89.9137.5-171.6-148.574.1000113I172 E180 Q186 L187 L190I172-L182 HydrophobicContact CG2-CD1 3.78Å; I172-L182 HydrophobicContact CG2-CD2 3.7Å; I172-L182 HydrophobicContact CG2-CG 4.25Å; E180-L182 PolarHBondContact O-N 3.01Å; L182-Q186 HydrophobicContact CD1-CB 3.84Å; L182-Q186 HydrophobicContact CD1-CG 4.27Å; L182-Q186 HydrophobicContact CD2-CB 3.64Å; L182-Q186 HydrophobicContact CG-CB 3.41Å; L182-Q186 VanDerWaalsContact CG-CB 3.41Å; L182-Q186 HydrophobicContact CG-CG 4.29Å; L182-L187 HydrophobicContact CB-CD2 4.49Å; L182-L187 HydrophobicContact CD2-CD2 3.83Å; L182-L187 HydrophobicContact CD2-CG 4.07Å; L182-L190 HydrophobicContact CD2-CD1 3.49Å; L182-L190 VanDerWaalsContact CD2-CD1 3.49Å; L182-L190 HydrophobicContact CD2-CG 4.25Å
183N93.3Very high94.1Very high108 Ų10890.8 Ų90.858%0.57848%0.48SS*.  trans-72.1157.7176.5-71.7-64.3000112.2D185 Q186 L187N183-D185 VanDerWaalsContact C-N 3.27Å; N183-D185 PolarHBondContact O-N 3.48Å; N183-Q186 HydrophobicContact CB-CG 4.33Å; N183-Q186 PolarHBondContact ND2-OE1 3Å; N183-Q186 WeakPolarHBondContact O-CB 3.21Å; N183-Q186 PolarHBondContact O-N 3.03Å; N183-L187 PolarHBondContact O-N 3.05Å
184K95Very high94.2Very high182 Ų18295 Ų9579%0.79150%0.5SS*.Hα-helixtrans-54.3-41176.6-63.9-173.3179.6-173.50113.1L187 I188K184-L187 PolarHBondContact O-N 2.87Å; K184-I188 WeakPolarHBondContact O-CG1 3.47Å; K184-I188 PolarHBondContact O-N 3.03Å; K184-I188 VanDerWaalsContact O-N 3.17Å
185D95Very high94.2Very high90 Ų9090.4 Ų90.448%0.48149%0.491SS..Hα-helixtrans-64.5-38.1177.2179.168.1000112.7N183 I188 K189N183-D185 VanDerWaalsContact C-N 3.27Å; N183-D185 PolarHBondContact O-N 3.48Å; D185-I188 PolarHBondContact O-N 3.26Å; D185-K189 WeakPolarHBondContact O-CG 3.21Å; D185-K189 PolarHBondContact O-N 3.36Å; D185-K189 VanDerWaalsContact OD2-CE 3.24Å; D185-K189 WeakPolarHBondContact OD2-CE 3.47Å; D185-K189 IonicContact OD2-NZ 2.73Å; D185-K189 PolarHBondContact OD2-NZ 3.31Å
186Q95.9Very high94.3Very high34 Ų3487.5 Ų87.516%0.15948%0.478CS..Hα-helixtrans-70.7-37.4178.7-73.3172.2-46.900111.3I172 L182 N183 I188 K189 L190I172-Q186 HydrophobicContact CD1-CB 4.26Å; I172-Q186 HydrophobicContact CD1-CG 4.01Å; I172-Q186 HydrophobicContact CG1-CG 4.24Å; I172-Q186 HydrophobicContact CG2-CB 3.91Å; I172-Q186 HydrophobicContact CG2-CG 4.4Å; L182-Q186 HydrophobicContact CD1-CB 3.84Å; L182-Q186 HydrophobicContact CD1-CG 4.27Å; L182-Q186 HydrophobicContact CD2-CB 3.64Å; L182-Q186 HydrophobicContact CG-CB 3.41Å; L182-Q186 VanDerWaalsContact CG-CB 3.41Å; L182-Q186 HydrophobicContact CG-CG 4.29Å; N183-Q186 HydrophobicContact CB-CG 4.33Å; N183-Q186 PolarHBondContact ND2-OE1 3Å; N183-Q186 WeakPolarHBondContact O-CB 3.21Å; N183-Q186 PolarHBondContact O-N 3.03Å; Q186-I188 VanDerWaalsContact C-N 3.34Å; Q186-I188 PolarHBondContact O-N 3.23Å; Q186-K189 WeakPolarHBondContact O-CB 3.49Å; Q186-K189 PolarHBondContact O-N 2.94Å; Q186-L190 WeakPolarHBondContact O-CG 3.14Å; Q186-L190 PolarHBondContact O-N 3.45Å
187L94.4Very high94.4Very high95 Ų9585.1 Ų85.150%0.49747%0.469SS..Hα-helixtrans-61.5-41172.3-70.3169.9000112L182 N183 K184 L190 G191L182-L187 HydrophobicContact CB-CD2 4.49Å; L182-L187 HydrophobicContact CD2-CD2 3.83Å; L182-L187 HydrophobicContact CD2-CG 4.07Å; N183-L187 PolarHBondContact O-N 3.05Å; K184-L187 PolarHBondContact O-N 2.87Å; L187-L190 PolarHBondContact O-N 3.27Å; L187-G191 PolarHBondContact O-N 3.08Å; L187-G191 VanDerWaalsContact O-N 3.13Å
188I95.5Very high94.5Very high100 Ų10082.4 Ų82.451%0.51346%0.456SS..Hα-helixtrans-62.5-44.7175-65.7164.4000110.2K184 D185 Q186 L190 G191 H192K184-I188 WeakPolarHBondContact O-CG1 3.47Å; K184-I188 PolarHBondContact O-N 3.03Å; K184-I188 VanDerWaalsContact O-N 3.17Å; D185-I188 PolarHBondContact O-N 3.26Å; Q186-I188 VanDerWaalsContact C-N 3.34Å; Q186-I188 PolarHBondContact O-N 3.23Å; I188-L190 VanDerWaalsContact C-N 3.33Å; I188-L190 PolarHBondContact O-N 3.17Å; I188-G191 PolarHBondContact O-N 3.45Å; I188-G191 VanDerWaalsContact O-N 3.12Å; I188-H192 PolarHBondContact O-CD2 3.22Å; I188-H192 PolarHBondContact O-N 2.81Å
189K95.8Very high94.5Very high52 Ų5281 Ų8123%0.22644%0.437CS..Hα-helixtrans-59.6-40.7176.6-75.3169.7177162.60112.7I169 I172 D185 Q186 G191 H192I169-K189 WeakPolarHBondContact CD1-O 3.24Å; I169-K189 HydrophobicContact CG1-CB 4.38Å; I172-K189 HydrophobicContact CD1-CB 4.02Å; I172-K189 HydrophobicContact CD1-CD 3.75Å; D185-K189 WeakPolarHBondContact O-CG 3.21Å; D185-K189 PolarHBondContact O-N 3.36Å; D185-K189 VanDerWaalsContact OD2-CE 3.24Å; D185-K189 WeakPolarHBondContact OD2-CE 3.47Å; D185-K189 IonicContact OD2-NZ 2.73Å; D185-K189 PolarHBondContact OD2-NZ 3.31Å; Q186-K189 WeakPolarHBondContact O-CB 3.49Å; Q186-K189 PolarHBondContact O-N 2.94Å; K189-G191 VanDerWaalsContact C-N 3.33Å; K189-G191 PolarHBondContact O-N 3.36Å; K189-H192 PolarHBondContact O-N 3.33Å; K189-H192 VanDerWaalsContact O-N 3.15Å
190L94.4Very high94.8Very high25 Ų2578.8 Ų78.813%0.13141%0.41CS..Hα-helixtrans-60.2-42.2173.9-72.1-177.8000112.1I169 I172 E173 K176 L182 Q186 L187 I188 H192 K193I169-L190 HydrophobicContact CG2-CD2 4.16Å; I172-L190 HydrophobicContact CB-CD2 4.14Å; I172-L190 HydrophobicContact CG2-CD1 4.01Å; I172-L190 HydrophobicContact CG2-CD2 3.64Å; I172-L190 HydrophobicContact CG2-CG 3.63Å; E173-L190 HydrophobicContact CB-CD2 4.28Å; E173-L190 HydrophobicContact CG-CD2 3.27Å; K176-L190 HydrophobicContact CD-CD1 3.82Å; L182-L190 HydrophobicContact CD2-CD1 3.49Å; L182-L190 VanDerWaalsContact CD2-CD1 3.49Å; L182-L190 HydrophobicContact CD2-CG 4.25Å; Q186-L190 WeakPolarHBondContact O-CG 3.14Å; Q186-L190 PolarHBondContact O-N 3.45Å; L187-L190 PolarHBondContact O-N 3.27Å; I188-L190 VanDerWaalsContact C-N 3.33Å; I188-L190 PolarHBondContact O-N 3.17Å; L190-H192 PolarHBondContact O-N 3.25Å; L190-K193 WeakPolarHBondContact O-CB 3.23Å; L190-K193 PolarHBondContact O-N 3.18Å
191G94.3Very high95.1Very high61 Ų6179.1 Ų79.163%0.62941%0.411SS*.Hα-helixtrans-62.3-22.5176.800000113.9L187 I188 K189L187-G191 PolarHBondContact O-N 3.08Å; L187-G191 VanDerWaalsContact O-N 3.13Å; I188-G191 PolarHBondContact O-N 3.45Å; I188-G191 VanDerWaalsContact O-N 3.12Å; K189-G191 VanDerWaalsContact C-N 3.33Å; K189-G191 PolarHBondContact O-N 3.36Å
192H94.8Very high95.3Very high81 Ų8177.1 Ų77.138%0.37540%0.397SS..THydrogen-bonded Turntrans-89.2-0.6-178.7-70.9-149.6000113.6R165 I188 K189 L190 Q194 A195 V196R165-H192 PolarHBondContact NH2-ND1 3.26Å; R165-H192 VanDerWaalsContact NH2-ND1 3.17Å; I188-H192 PolarHBondContact O-CD2 3.22Å; I188-H192 PolarHBondContact O-N 2.81Å; K189-H192 PolarHBondContact O-N 3.33Å; K189-H192 VanDerWaalsContact O-N 3.15Å; L190-H192 PolarHBondContact O-N 3.25Å; H192-Q194 PolarHBondContact O-N 2.7Å; H192-A195 PolarHBondContact O-N 3.44Å; H192-A195 VanDerWaalsContact O-N 3.15Å; H192-V196 WeakPolarHBondContact O-CG2 3.48Å; H192-V196 PolarHBondContact O-N 2.92Å; H192-V196 VanDerWaalsContact O-N 3.1Å
193K96.2Very high95.5Very high50 Ų5075.7 Ų75.722%0.21739%0.389CS..Hα-helixtrans-52.2-52.4-175.8-175.5171.4173.4-179.10112.9L166 I169 E173 L190 A195 V196 E197L166-K193 HydrophobicContact CD1-CG 4.44Å; I169-K193 HydrophobicContact CG2-CB 3.84Å; I169-K193 HydrophobicContact CG2-CD 4.06Å; I169-K193 HydrophobicContact CG2-CG 3.98Å; E173-K193 WeakPolarHBondContact OE1-CD 3.11Å; E173-K193 IonicContact OE1-NZ 2.71Å; E173-K193 PolarHBondContact OE1-NZ 3.14Å; E173-K193 IonicContact OE2-NZ 2.72Å; E173-K193 PolarHBondContact OE2-NZ 3.33Å; L190-K193 WeakPolarHBondContact O-CB 3.23Å; L190-K193 PolarHBondContact O-N 3.18Å; K193-A195 VanDerWaalsContact C-N 3.29Å; K193-A195 PolarHBondContact O-N 3.08Å; K193-V196 PolarHBondContact O-N 3.5Å; K193-V196 VanDerWaalsContact O-N 3.1Å; K193-E197 WeakPolarHBondContact CE-OE1 3.47Å; K193-E197 WeakPolarHBondContact O-CG 3.4Å; K193-E197 PolarHBondContact O-N 3.2Å
194Q96.7Very high95.5Very high143 Ų14373.3 Ų73.367%0.66838%0.379SS*.Hα-helixtrans-60.7-38-178.9-67.3-179.7-36.400112.4H192 V196 E197 Q198H192-Q194 PolarHBondContact O-N 2.7Å; Q194-V196 VanDerWaalsContact C-N 3.35Å; Q194-E197 PolarHBondContact O-N 3.41Å; Q194-Q198 WeakPolarHBondContact O-CB 3.43Å; Q194-Q198 VanDerWaalsContact O-CG 3.27Å; Q194-Q198 WeakPolarHBondContact O-CG 3.04Å; Q194-Q198 PolarHBondContact O-N 3.34Å
195A96.5Very high95.3Very high57 Ų5769 Ų6947%0.47136%0.364SS..Hα-helixtrans-67.8-35.6178.100000112.2H192 K193 L199H192-A195 PolarHBondContact O-N 3.44Å; H192-A195 VanDerWaalsContact O-N 3.15Å; K193-A195 VanDerWaalsContact C-N 3.29Å; K193-A195 PolarHBondContact O-N 3.08Å; A195-L199 WeakPolarHBondContact O-CB 3.28Å; A195-L199 PolarHBondContact O-N 3.42Å; A195-L199 VanDerWaalsContact O-N 3.08Å
196V96.8Very high95.1Very high2 Ų269.5 Ų69.51%0.01237%0.366CS..Hα-helixtrans-69.5-42.8175.8176.90000110.7E162 R165 L166 I169 H192 K193 Q194 L199 I200E162-V196 HydrophobicContact CB-CG1 4.3Å; R165-V196 HydrophobicContact CB-CG1 4.31Å; R165-V196 HydrophobicContact CG-CG2 3.96Å; L166-V196 HydrophobicContact CB-CG1 4.04Å; I169-V196 HydrophobicContact CD1-CB 4.5Å; I169-V196 HydrophobicContact CD1-CG2 3.96Å; H192-V196 WeakPolarHBondContact O-CG2 3.48Å; H192-V196 PolarHBondContact O-N 2.92Å; H192-V196 VanDerWaalsContact O-N 3.1Å; K193-V196 PolarHBondContact O-N 3.5Å; K193-V196 VanDerWaalsContact O-N 3.1Å; Q194-V196 VanDerWaalsContact C-N 3.35Å; V196-L199 PolarHBondContact O-N 2.96Å; V196-I200 HydrophobicContact CG1-CD1 4.01Å; V196-I200 VanDerWaalsContact O-CG1 3.29Å; V196-I200 WeakPolarHBondContact O-CG1 3.02Å; V196-I200 PolarHBondContact O-N 3.2Å
197E97Very high94.8Very high81 Ų8173 Ų7338%0.37938%0.381SS..Hα-helixtrans-61.7-47.6176.6-70.6170.3171.500111.8L166 K193 Q194 L199 I200 E201L166-E197 HydrophobicContact CD1-CG 3.84Å; K193-E197 WeakPolarHBondContact CE-OE1 3.47Å; K193-E197 WeakPolarHBondContact O-CG 3.4Å; K193-E197 PolarHBondContact O-N 3.2Å; Q194-E197 PolarHBondContact O-N 3.41Å; E197-L199 VanDerWaalsContact C-N 3.31Å; E197-L199 PolarHBondContact O-N 2.75Å; E197-I200 PolarHBondContact O-N 2.84Å; E197-E201 PolarHBondContact O-N 3.3Å
198Q97Very high94.4Very high111 Ų11173.8 Ų73.852%0.51939%0.39SS..Hα-helixtrans-60.2-40.4176-74.3174.7-2.800112.3Q194 E201 Q202Q194-Q198 WeakPolarHBondContact O-CB 3.43Å; Q194-Q198 VanDerWaalsContact O-CG 3.27Å; Q194-Q198 WeakPolarHBondContact O-CG 3.04Å; Q194-Q198 PolarHBondContact O-N 3.34Å; Q198-E201 PolarHBondContact O-N 2.83Å; Q198-Q202 WeakPolarHBondContact O-CB 3.28Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.48Å; Q198-Q202 PolarHBondContact O-N 2.68Å
199L94.9Very high93.2Very high57 Ų5777.7 Ų77.730%0.29841%0.411SS..Hα-helixtrans-68-38.2178.4-177.758.1000111.6E162 A195 V196 E197 Q202 L203E162-L199 HydrophobicContact CG-CD2 3.68Å; E162-L199 HydrophobicContact CG-CG 4.08Å; A195-L199 WeakPolarHBondContact O-CB 3.28Å; A195-L199 PolarHBondContact O-N 3.42Å; A195-L199 VanDerWaalsContact O-N 3.08Å; V196-L199 PolarHBondContact O-N 2.96Å; E197-L199 VanDerWaalsContact C-N 3.31Å; E197-L199 PolarHBondContact O-N 2.75Å; L199-Q202 PolarHBondContact O-N 3.25Å; L199-L203 HydrophobicContact CD1-CD1 4.18Å; L199-L203 HydrophobicContact CD1-CG 4.16Å; L199-L203 HydrophobicContact CG-CD1 4.02Å; L199-L203 HydrophobicContact CG-CG 4.44Å; L199-L203 WeakPolarHBondContact O-CB 3.5Å; L199-L203 WeakPolarHBondContact O-CG 3.31Å; L199-L203 PolarHBondContact O-N 2.7Å
200I96.6Very high93.1Very high18 Ų1879 Ų799%0.09242%0.421CS..Hα-helixtrans-61-48.8172.8-69.1165.3000109.6L159 E162 L166 V196 E197 Q202 L203 T204L159-I200 HydrophobicContact CD2-CG2 4.25Å; E162-I200 HydrophobicContact CB-CD1 4.15Å; E162-I200 HydrophobicContact CB-CG1 3.62Å; L166-I200 HydrophobicContact CB-CD1 4.18Å; L166-I200 HydrophobicContact CD2-CD1 3.92Å; V196-I200 HydrophobicContact CG1-CD1 4.01Å; V196-I200 VanDerWaalsContact O-CG1 3.29Å; V196-I200 WeakPolarHBondContact O-CG1 3.02Å; V196-I200 PolarHBondContact O-N 3.2Å; E197-I200 PolarHBondContact O-N 2.84Å; I200-Q202 PolarHBondContact O-N 3.2Å; I200-L203 PolarHBondContact O-N 2.89Å; I200-T204 HydrophobicContact CG2-CG2 4.22Å; I200-T204 VanDerWaalsContact O-CG2 3.31Å; I200-T204 WeakPolarHBondContact O-CG2 3.4Å; I200-T204 PolarHBondContact O-N 2.79Å; I200-T204 PolarHBondContact O-OG1 2.81Å
201E95.7Very high93.1Very high121 Ų12181.8 Ų81.857%0.56544%0.436SS*.Hα-helixtrans-56.2-49.7177.9-173.3179.6-17300111.5E197 Q198 L203 T204 L205E197-E201 PolarHBondContact O-N 3.3Å; Q198-E201 PolarHBondContact O-N 2.83Å; E201-L203 PolarHBondContact O-N 3.41Å; E201-T204 WeakPolarHBondContact CA-OG1 3.45Å; E201-T204 PolarHBondContact O-N 2.77Å; E201-T204 PolarHBondContact O-OG1 2.87Å; E201-L205 HydrophobicContact CG-CD1 4.25Å; E201-L205 WeakPolarHBondContact O-CG 3.37Å; E201-L205 PolarHBondContact O-N 2.8Å
202Q95Very high93Very high114 Ų11482.9 Ų82.953%0.53343%0.425SS..Hα-helixtrans-58.1-46.1176.4-73.2174.3300112.5Q198 L199 I200 T204 L205 L206Q198-Q202 WeakPolarHBondContact O-CB 3.28Å; Q198-Q202 VanDerWaalsContact O-CG 3.29Å; Q198-Q202 WeakPolarHBondContact O-CG 3.48Å; Q198-Q202 PolarHBondContact O-N 2.68Å; L199-Q202 PolarHBondContact O-N 3.25Å; I200-Q202 PolarHBondContact O-N 3.2Å; Q202-T204 VanDerWaalsContact C-N 3.32Å; Q202-T204 PolarHBondContact O-N 3.22Å; Q202-L205 PolarHBondContact O-N 2.95Å; Q202-L206 VanDerWaalsContact O-CG 3.32Å; Q202-L206 WeakPolarHBondContact O-CG 3.19Å; Q202-L206 PolarHBondContact O-N 2.77Å
203L94Very high92.9Very high8 Ų883.1 Ų83.14%0.04243%0.428CS..Hα-helixtrans-67.9-33.2178.9-70.8172.2000112.3I155 Q158 L159 E162 L199 I200 E201 K207I155-L203 HydrophobicContact CG2-CB 4.36Å; I155-L203 HydrophobicContact CG2-CD2 4.35Å; I155-L203 WeakPolarHBondContact CG2-O 3.47Å; Q158-L203 HydrophobicContact CB-CD1 3.63Å; Q158-L203 HydrophobicContact CB-CD2 4.24Å; L159-L203 HydrophobicContact CD2-CB 3.52Å; L159-L203 HydrophobicContact CD2-CD1 4.36Å; L159-L203 HydrophobicContact CG-CB 3.84Å; L159-L203 HydrophobicContact CG-CD1 4.48Å; E162-L203 HydrophobicContact CG-CD1 4.37Å; L199-L203 HydrophobicContact CD1-CD1 4.18Å; L199-L203 HydrophobicContact CD1-CG 4.16Å; L199-L203 HydrophobicContact CG-CD1 4.02Å; L199-L203 HydrophobicContact CG-CG 4.44Å; L199-L203 WeakPolarHBondContact O-CB 3.5Å; L199-L203 WeakPolarHBondContact O-CG 3.31Å; L199-L203 PolarHBondContact O-N 2.7Å; I200-L203 PolarHBondContact O-N 2.89Å; E201-L203 PolarHBondContact O-N 3.41Å; L203-K207 WeakPolarHBondContact O-CB 3.31Å; L203-K207 PolarHBondContact O-N 3.05Å; L203-K207 VanDerWaalsContact O-N 3.08Å
204T93.4Very high92.7Very high58 Ų5885.1 Ų85.136%0.35644%0.441SS..Hα-helixtrans-67.7-42.3173.556.70000111.5L159 I200 E201 Q202 L206 K207 T208L159-T204 HydrophobicContact CD2-CG2 3.8Å; I200-T204 HydrophobicContact CG2-CG2 4.22Å; I200-T204 VanDerWaalsContact O-CG2 3.31Å; I200-T204 WeakPolarHBondContact O-CG2 3.4Å; I200-T204 PolarHBondContact O-N 2.79Å; I200-T204 PolarHBondContact O-OG1 2.81Å; E201-T204 WeakPolarHBondContact CA-OG1 3.45Å; E201-T204 PolarHBondContact O-N 2.77Å; E201-T204 PolarHBondContact O-OG1 2.87Å; Q202-T204 VanDerWaalsContact C-N 3.32Å; Q202-T204 PolarHBondContact O-N 3.22Å; T204-L206 VanDerWaalsContact C-N 3.33Å; T204-L206 PolarHBondContact O-N 3.4Å; T204-K207 WeakPolarHBondContact O-CB 3.45Å; T204-K207 PolarHBondContact O-N 3.2Å; T204-K207 VanDerWaalsContact O-N 3.1Å; T204-T208 PolarHBondContact O-N 3.09Å; T204-T208 VanDerWaalsContact O-N 3.13Å; T204-T208 PolarHBondContact O-OG1 2.77Å
205L92.6Very high92.4Very high90 Ų9081.3 Ų81.347%0.47143%0.426SS..Hα-helixtrans-62.7-39.1175.3-70.9168.5000112.1E201 Q202 K207 T208 N209E201-L205 HydrophobicContact CG-CD1 4.25Å; E201-L205 WeakPolarHBondContact O-CG 3.37Å; E201-L205 PolarHBondContact O-N 2.8Å; Q202-L205 PolarHBondContact O-N 2.95Å; L205-K207 VanDerWaalsContact C-N 3.26Å; L205-K207 PolarHBondContact O-N 3.19Å; L205-T208 WeakPolarHBondContact CA-OG1 3.41Å; L205-T208 PolarHBondContact O-N 2.83Å; L205-T208 PolarHBondContact O-OG1 3.34Å; L205-N209 PolarHBondContact O-N 3.25Å; L205-N209 PolarHBondContact O-ND2 2.86Å
206L90.2Very high92.1Very high102 Ų10283 Ų8353%0.53442%0.423SS..Hα-helixtrans-71.3-20.3175.3-71.9174.5000113.5I155 Q202 T204I155-L206 HydrophobicContact CD1-CB 4.18Å; Q202-L206 VanDerWaalsContact O-CG 3.32Å; Q202-L206 WeakPolarHBondContact O-CG 3.19Å; Q202-L206 PolarHBondContact O-N 2.77Å; T204-L206 VanDerWaalsContact C-N 3.33Å; T204-L206 PolarHBondContact O-N 3.4Å
207K88.6Confident91.8Very high108 Ų10889.2 Ų89.247%0.4745%0.454SS..Hα-helixtrans-82.8-30.5175.6-174.3173.9176.1177.50112I155 D156 L159 L203 T204 L205I155-K207 HydrophobicContact CG2-CB 4.01Å; D156-K207 WeakPolarHBondContact OD1-CD 3.46Å; D156-K207 WeakPolarHBondContact OD1-CE 3.16Å; D156-K207 IonicContact OD1-NZ 3.66Å; D156-K207 PolarHBondContact OD1-NZ 2.95Å; D156-K207 IonicContact OD2-NZ 2.71Å; L159-K207 HydrophobicContact CD1-CD 3.92Å; L203-K207 WeakPolarHBondContact O-CB 3.31Å; L203-K207 PolarHBondContact O-N 3.05Å; L203-K207 VanDerWaalsContact O-N 3.08Å; T204-K207 WeakPolarHBondContact O-CB 3.45Å; T204-K207 PolarHBondContact O-N 3.2Å; T204-K207 VanDerWaalsContact O-N 3.1Å; L205-K207 VanDerWaalsContact C-N 3.26Å; L205-K207 PolarHBondContact O-N 3.19Å
208T86.4Confident91.3Very high111 Ų11189.9 Ų89.968%0.68146%0.461SS*.Hα-helixtrans-83.4-25.8-178.750.70000113.7T204 L205T204-T208 PolarHBondContact O-N 3.09Å; T204-T208 VanDerWaalsContact O-N 3.13Å; T204-T208 PolarHBondContact O-OG1 2.77Å; L205-T208 WeakPolarHBondContact CA-OG1 3.41Å; L205-T208 PolarHBondContact O-N 2.83Å; L205-T208 PolarHBondContact O-OG1 3.34Å
209N71.5Confident90.8Very high181 Ų18188 Ų8897%0.96846%0.455SS*.  trans-90.90174.4-66.2-49.4000111.2L205L205-N209 PolarHBondContact O-N 3.25Å; L205-N209 PolarHBondContact O-ND2 2.86Å

Retrieved 209 of 209 residues in 216.3 ms (Link to these results)