A0A087XPS1_POEFO Loading...

Transcription factor binding to IGHM enhancer 3b

AlphaFold DB , UniProt , Accession A0A087XPS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 445 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
1M52.2Low77.5Confident232 Ų232128.5 Ų128.5100%1.14364%0.64SS**  01.80-62.1-147.8-17200114.9
2S55.7Low78.3Confident86 Ų86126.3 Ų126.360%0.60163%0.629SS**Hα-helixtrans-73-25.4-177.7-1630000115.2R4 V5 L6S2-R4 PolarHBondContact O-N 3.27Å; S2-V5 PolarHBondContact O-N 3.19Å; S2-L6 PolarHBondContact O-N 2.86Å
3S69.4Low79.2Confident96 Ų96125.8 Ų125.867%0.67162%0.616SS**Hα-helixtrans-64.5-36.2-172.5172.30000114.6L7S3-L7 WeakPolarHBondContact O-CB 3.43Å; S3-L7 PolarHBondContact O-N 3.05Å
4R70.9Confident80.1Confident218 Ų218124.9 Ų124.982%0.82361%0.609SS**Hα-helixtrans-73.4-33.2-177.6-162.2175.5-176.6178.50.7112.7S2 R8S2-R4 PolarHBondContact O-N 3.27Å; R4-R8 PolarHBondContact O-N 2.97Å; R4-R8 VanDerWaalsContact O-N 3.15Å
5V80.5Confident80.6Confident102 Ų102125.9 Ų125.962%0.61861%0.612SS**Hα-helixtrans-72.6-42.5176.6179.10000110.2S2 R8 Q9S2-V5 PolarHBondContact O-N 3.19Å; V5-R8 PolarHBondContact O-N 3.25Å; V5-Q9 PolarHBondContact O-N 3.22Å
6L85.8Confident81.1Confident103 Ų103121.7 Ų121.754%0.53960%0.604SS.*Hα-helixtrans-62.5-42.5174.5-77.2168.4000112.1S2 R8 Q9 Q10S2-L6 PolarHBondContact O-N 2.86Å; L6-R8 PolarHBondContact O-N 3.23Å; L6-Q9 PolarHBondContact O-N 3.4Å; L6-Q10 WeakPolarHBondContact O-CB 3.31Å; L6-Q10 PolarHBondContact O-N 2.9Å
7L87.4Confident81.6Confident104 Ų104121.9 Ų121.955%0.54560%0.603SS.*Hα-helixtrans-62.9-40.5176.9-175.962.5000112.3S3 Q9 Q10 L11S3-L7 WeakPolarHBondContact O-CB 3.43Å; S3-L7 PolarHBondContact O-N 3.05Å; L7-Q9 VanDerWaalsContact C-N 3.34Å; L7-Q10 PolarHBondContact O-N 3.1Å; L7-L11 HydrophobicContact CG-CD1 4.34Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.41Å
8R83.8Confident82.1Confident175 Ų175122.4 Ų122.466%0.6660%0.604SS**Hα-helixtrans-63.1-41.7174.9-177.1178.8176.1-84.2-1.1111.6R4 V5 L6 Q10 M12R4-R8 PolarHBondContact O-N 2.97Å; R4-R8 VanDerWaalsContact O-N 3.15Å; V5-R8 PolarHBondContact O-N 3.25Å; L6-R8 PolarHBondContact O-N 3.23Å; R8-Q10 VanDerWaalsContact C-N 3.35Å; R8-M12 WeakPolarHBondContact O-CB 3.45Å; R8-M12 PolarHBondContact O-N 2.85Å
9Q86.1Confident82.2Confident89 Ų89122.1 Ų122.142%0.41660%0.6SS.*Hα-helixtrans-69.2-35.1178.6-158.4-171.396.300111.8V5 L6 L7 M12 R13V5-Q9 PolarHBondContact O-N 3.22Å; L6-Q9 PolarHBondContact O-N 3.4Å; L7-Q9 VanDerWaalsContact C-N 3.34Å; Q9-M12 HydrophobicContact CG-CE 4.45Å; Q9-R13 WeakPolarHBondContact O-CB 3.48Å; Q9-R13 PolarHBondContact O-N 3.03Å; Q9-R13 VanDerWaalsContact O-N 3.08Å
10Q90.9Very high82.6Confident111 Ų111122.9 Ų122.952%0.51960%0.603SS.*Hα-helixtrans-62.3-50.5173.5-169.976.929.800111.1L6 L7 R8 M12 R13 E14L6-Q10 WeakPolarHBondContact O-CB 3.31Å; L6-Q10 PolarHBondContact O-N 2.9Å; L7-Q10 PolarHBondContact O-N 3.1Å; R8-Q10 VanDerWaalsContact C-N 3.35Å; Q10-M12 VanDerWaalsContact C-N 3.3Å; Q10-M12 PolarHBondContact O-N 3.16Å; Q10-R13 PolarHBondContact O-N 2.96Å; Q10-E14 PolarHBondContact O-N 3.23Å
11L89.8Confident82.8Confident97 Ų97125.3 Ų125.351%0.50861%0.605SS.*Hα-helixtrans-61.1-39.3179-77.6167.8000112.3L7 R13 E14 Q15L7-L11 HydrophobicContact CG-CD1 4.34Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.41Å; L11-R13 VanDerWaalsContact C-N 3.35Å; L11-E14 PolarHBondContact O-N 2.86Å; L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 2.8Å
12M87.8Confident84.3Confident102 Ų102122.4 Ų122.450%0.50258%0.582SS.*Hα-helixtrans-67-37.5178-164.8175.263.100111.8R8 Q9 Q10 A16R8-M12 WeakPolarHBondContact O-CB 3.45Å; R8-M12 PolarHBondContact O-N 2.85Å; Q9-M12 HydrophobicContact CG-CE 4.45Å; Q10-M12 VanDerWaalsContact C-N 3.3Å; Q10-M12 PolarHBondContact O-N 3.16Å; M12-A16 PolarHBondContact O-N 2.9Å
13R89.8Confident85.6Confident121 Ų121123 Ų12346%0.45758%0.575SS.*Hα-helixtrans-67.9-38.7174.5-170-179.3-71.5112.9-0111.7Q9 Q10 L11 Q17Q9-R13 WeakPolarHBondContact O-CB 3.48Å; Q9-R13 PolarHBondContact O-N 3.03Å; Q9-R13 VanDerWaalsContact O-N 3.08Å; Q10-R13 PolarHBondContact O-N 2.96Å; L11-R13 VanDerWaalsContact C-N 3.35Å; R13-Q17 PolarHBondContact O-N 3.49Å; R13-Q17 VanDerWaalsContact O-N 3.15Å
14E91.3Very high86.3Confident113 Ų113121.1 Ų121.153%0.52857%0.565SS.*Hα-helixtrans-66.5-44177.3-171.8173.5-176.500111.8Q10 L11 A16 Q17 E18Q10-E14 PolarHBondContact O-N 3.23Å; L11-E14 PolarHBondContact O-N 2.86Å; E14-A16 VanDerWaalsContact C-N 3.33Å; E14-A16 PolarHBondContact O-N 3.34Å; E14-Q17 PolarHBondContact O-N 3.05Å; E14-E18 PolarHBondContact O-N 3.02Å
15Q87.4Confident86.8Confident139 Ų139116.7 Ų116.765%0.6555%0.553SS**Hα-helixtrans-63.9-38.3178.1-163.3174.928.800112.3L11 E18 Q19L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 2.8Å; Q15-E18 PolarHBondContact O-N 3.42Å; Q15-Q19 PolarHBondContact O-N 2.84Å; Q15-Q19 VanDerWaalsContact O-N 3.1Å
16A89.1Confident86.6Confident59 Ų59117.6 Ų117.649%0.48855%0.551SS.*Hα-helixtrans-64.9-43.717500000112.2M12 E14 E18 Q19 E20M12-A16 PolarHBondContact O-N 2.9Å; E14-A16 VanDerWaalsContact C-N 3.33Å; E14-A16 PolarHBondContact O-N 3.34Å; A16-E18 VanDerWaalsContact C-N 3.33Å; A16-E18 PolarHBondContact O-N 3.31Å; A16-Q19 PolarHBondContact O-N 3.14Å; A16-E20 PolarHBondContact O-N 3.03Å
17Q90Very high86Confident125 Ų125119.3 Ų119.358%0.58456%0.556SS**Hα-helixtrans-64.9-37176.7-78.2-176.3-14.300112.4R13 E14 R21R13-Q17 PolarHBondContact O-N 3.49Å; R13-Q17 VanDerWaalsContact O-N 3.15Å; E14-Q17 PolarHBondContact O-N 3.05Å; Q17-R21 WeakPolarHBondContact O-CB 3.46Å; Q17-R21 PolarHBondContact O-N 3.38Å
18E89.8Confident85.3Confident131 Ų131117 Ų11761%0.61255%0.552SS**Hα-helixtrans-68-37.1177.7-171.7160.7-142.600112E14 Q15 A16 R21 R22E14-E18 PolarHBondContact O-N 3.02Å; Q15-E18 PolarHBondContact O-N 3.42Å; A16-E18 VanDerWaalsContact C-N 3.33Å; A16-E18 PolarHBondContact O-N 3.31Å; E18-R21 PolarHBondContact O-N 3.16Å; E18-R22 WeakPolarHBondContact O-CB 3.46Å; E18-R22 PolarHBondContact O-N 3.21Å
19Q84.7Confident84.5Confident116 Ų116111.7 Ų111.754%0.54254%0.542SS..Hα-helixtrans-66.4-45.8174.7-173.9163.5-15.900112Q15 A16 R21 R22 E23Q15-Q19 PolarHBondContact O-N 2.84Å; Q15-Q19 VanDerWaalsContact O-N 3.1Å; A16-Q19 PolarHBondContact O-N 3.14Å; Q19-R21 VanDerWaalsContact C-N 3.3Å; Q19-R21 PolarHBondContact O-N 3.03Å; Q19-R22 WeakPolarHBondContact O-CB 3.26Å; Q19-R22 PolarHBondContact O-N 3.35Å; Q19-R22 VanDerWaalsContact O-N 3.07Å; Q19-E23 PolarHBondContact NE2-OE1 3.19Å; Q19-E23 PolarHBondContact O-N 2.99Å
20E89.9Confident83.4Confident138 Ų138110.1 Ų110.165%0.64554%0.544SS*.Hα-helixtrans-59.7-41.1175.1-173.4-179.2-177.900111.4A16 R22 E23 A24A16-E20 PolarHBondContact O-N 3.03Å; E20-R22 VanDerWaalsContact C-N 3.29Å; E20-R22 PolarHBondContact O-N 3.37Å; E20-E23 PolarHBondContact O-N 2.73Å; E20-A24 WeakPolarHBondContact O-CB 3.41Å; E20-A24 PolarHBondContact O-N 3.12Å
21R87.6Confident81.8Confident174 Ų174109 Ų10966%0.65755%0.548SS*.Hα-helixtrans-63.5-37176.2-151.7-176.586.1140.44.1111.8Q17 E18 Q19 Q25Q17-R21 WeakPolarHBondContact O-CB 3.46Å; Q17-R21 PolarHBondContact O-N 3.38Å; E18-R21 PolarHBondContact O-N 3.16Å; Q19-R21 VanDerWaalsContact C-N 3.3Å; Q19-R21 PolarHBondContact O-N 3.03Å; R21-Q25 VanDerWaalsContact O-CB 3.31Å; R21-Q25 WeakPolarHBondContact O-CB 3.48Å; R21-Q25 PolarHBondContact O-N 3.28Å
22R83.7Confident80.2Confident172 Ų172112.3 Ų112.365%0.64956%0.561SS**Hα-helixtrans-70.3-40.2178.7-152.4-179.8-166.31430.8111.6E18 Q19 E20 Q25 Q26E18-R22 WeakPolarHBondContact O-CB 3.46Å; E18-R22 PolarHBondContact O-N 3.21Å; Q19-R22 WeakPolarHBondContact O-CB 3.26Å; Q19-R22 PolarHBondContact O-N 3.35Å; Q19-R22 VanDerWaalsContact O-N 3.07Å; E20-R22 VanDerWaalsContact C-N 3.29Å; E20-R22 PolarHBondContact O-N 3.37Å; R22-Q25 PolarHBondContact O-N 3.4Å; R22-Q26 WeakPolarHBondContact O-CG 3.38Å; R22-Q26 PolarHBondContact O-N 2.95Å
23E82.9Confident78.3Confident99 Ų99114.5 Ų114.546%0.46357%0.574SS.*Hα-helixtrans-67.8-42.6174.7-73.2177-165.700111.7Q19 E20 Q25 Q26 Q27Q19-E23 PolarHBondContact NE2-OE1 3.19Å; Q19-E23 PolarHBondContact O-N 2.99Å; E20-E23 PolarHBondContact O-N 2.73Å; E23-Q25 VanDerWaalsContact C-N 3.3Å; E23-Q25 PolarHBondContact O-N 3.45Å; E23-Q26 PolarHBondContact O-N 2.99Å; E23-Q27 WeakPolarHBondContact O-CB 3.48Å; E23-Q27 PolarHBondContact O-N 3.14Å
24A82.4Confident76Confident55 Ų55119.7 Ų119.746%0.45559%0.594SS.*Hα-helixtrans-61.6-38.5173.600000111.9E20 Q27 A28E20-A24 WeakPolarHBondContact O-CB 3.41Å; E20-A24 PolarHBondContact O-N 3.12Å; A24-Q27 PolarHBondContact O-N 3.15Å; A24-A28 VanDerWaalsContact O-CB 3.29Å; A24-A28 WeakPolarHBondContact O-CB 3.46Å; A24-A28 PolarHBondContact O-N 2.88Å
25Q81.6Confident73.5Confident125 Ų125116.6 Ų116.658%0.58459%0.593SS**Hα-helixtrans-70.4-37.2176.4-151.316534.800111.8R21 R22 E23 S29R21-Q25 VanDerWaalsContact O-CB 3.31Å; R21-Q25 WeakPolarHBondContact O-CB 3.48Å; R21-Q25 PolarHBondContact O-N 3.28Å; R22-Q25 PolarHBondContact O-N 3.4Å; E23-Q25 VanDerWaalsContact C-N 3.3Å; E23-Q25 PolarHBondContact O-N 3.45Å; Q25-S29 WeakPolarHBondContact O-CB 3.26Å; Q25-S29 PolarHBondContact O-N 2.86Å; Q25-S29 PolarHBondContact O-OG 3.26Å
26Q76.9Confident71.8Confident122 Ų122115.3 Ų115.357%0.5760%0.599SS**Hα-helixtrans-65.1-45.3171.3-80.3-177.52000111.8R22 E23 A28 S29 A30R22-Q26 WeakPolarHBondContact O-CG 3.38Å; R22-Q26 PolarHBondContact O-N 2.95Å; E23-Q26 PolarHBondContact O-N 2.99Å; Q26-A28 PolarHBondContact O-N 2.79Å; Q26-S29 WeakPolarHBondContact CA-OG 3.42Å; Q26-S29 PolarHBondContact O-N 2.7Å; Q26-S29 PolarHBondContact O-OG 3.08Å; Q26-A30 WeakPolarHBondContact O-CB 3.18Å; Q26-A30 PolarHBondContact O-N 3.33Å
27Q73.2Confident69.1Low139 Ų139120.1 Ų120.165%0.6562%0.616SS**Hα-helixtrans-64.7-38.7176.8-78.5-178.4-0.100112.4E23 A24 A30 S31E23-Q27 WeakPolarHBondContact O-CB 3.48Å; E23-Q27 PolarHBondContact O-N 3.14Å; A24-Q27 PolarHBondContact O-N 3.15Å; Q27-A30 PolarHBondContact O-N 2.82Å; Q27-S31 WeakPolarHBondContact O-CB 3.29Å; Q27-S31 PolarHBondContact O-N 3.42Å; Q27-S31 PolarHBondContact O-OG 3.3Å
28A72.4Confident66.9Low55 Ų55119.8 Ų119.846%0.45563%0.628SS.*Hα-helixtrans-63.9-40.6172.900000111.7A24 Q26 S31 Q32A24-A28 VanDerWaalsContact O-CB 3.29Å; A24-A28 WeakPolarHBondContact O-CB 3.46Å; A24-A28 PolarHBondContact O-N 2.88Å; Q26-A28 PolarHBondContact O-N 2.79Å; A28-S31 PolarHBondContact O-N 3.45Å; A28-Q32 PolarHBondContact O-N 2.92Å; A28-Q32 VanDerWaalsContact O-N 3.07Å
29S66.5Low64Low63 Ų63119.6 Ų119.644%0.44164%0.636SS.*Hα-helixtrans-69-37.6175.472.30000113Q25 Q26 S31 Q32 L33Q25-S29 WeakPolarHBondContact O-CB 3.26Å; Q25-S29 PolarHBondContact O-N 2.86Å; Q25-S29 PolarHBondContact O-OG 3.26Å; Q26-S29 WeakPolarHBondContact CA-OG 3.42Å; Q26-S29 PolarHBondContact O-N 2.7Å; Q26-S29 PolarHBondContact O-OG 3.08Å; S29-S31 VanDerWaalsContact C-N 3.29Å; S29-S31 PolarHBondContact O-N 3.23Å; S29-Q32 PolarHBondContact O-N 3.46Å; S29-L33 PolarHBondContact O-N 3.33Å; S29-L33 VanDerWaalsContact O-N 3.15Å
30A63.4Low62.4Low57 Ų57119.9 Ų119.947%0.47165%0.648SS.*Hα-helixtrans-67.4-31.517500000111.8Q26 Q27 L33Q26-A30 WeakPolarHBondContact O-CB 3.18Å; Q26-A30 PolarHBondContact O-N 3.33Å; Q27-A30 PolarHBondContact O-N 2.82Å; A30-L33 PolarHBondContact O-N 3.33Å
31S57.7Low59.7Low86 Ų86117.7 Ų117.760%0.60165%0.653SS**Hα-helixtrans-75.2-30.9174.8-55.50000112.5Q27 A28 S29 L33 R34Q27-S31 WeakPolarHBondContact O-CB 3.29Å; Q27-S31 PolarHBondContact O-N 3.42Å; Q27-S31 PolarHBondContact O-OG 3.3Å; A28-S31 PolarHBondContact O-N 3.45Å; S29-S31 VanDerWaalsContact C-N 3.29Å; S29-S31 PolarHBondContact O-N 3.23Å; S31-L33 VanDerWaalsContact C-N 3.34Å; S31-R34 PolarHBondContact O-N 3.39Å
32Q55.8Low57.3Low167 Ų167116.9 Ų116.978%0.7866%0.66SS**Hα-helixtrans-72.9-23.8171.6-76.8-172.46.400113.3A28 S29 R34 G35A28-Q32 PolarHBondContact O-N 2.92Å; A28-Q32 VanDerWaalsContact O-N 3.07Å; S29-Q32 PolarHBondContact O-N 3.46Å; Q32-R34 PolarHBondContact O-N 3.28Å; Q32-G35 PolarHBondContact O-N 3.47Å
33L48.6Very low55.2Low149 Ų149114.1 Ų114.178%0.7867%0.667SS**THydrogen-bonded Turntrans-78.3-2.1172.1-73.7166.5000113.6S29 A30 S31 G35S29-L33 PolarHBondContact O-N 3.33Å; S29-L33 VanDerWaalsContact O-N 3.15Å; A30-L33 PolarHBondContact O-N 3.33Å; S31-L33 VanDerWaalsContact C-N 3.34Å; L33-G35 PolarHBondContact O-N 3Å
34R41.8Very low53Low229 Ų229115.9 Ų115.986%0.86468%0.684SS**  trans-87.648160.5-74.4-79.4-179.9166.7-2.5110.1S31 Q32S31-R34 PolarHBondContact O-N 3.39Å; Q32-R34 PolarHBondContact O-N 3.28Å
35G39Very low51Low49 Ų49118.2 Ų118.251%0.50570%0.698SS.*  trans-73.1120161.700000108.9Q32 L33 D37Q32-G35 PolarHBondContact O-N 3.47Å; L33-G35 PolarHBondContact O-N 3Å; G35-D37 PolarHBondContact O-N 2.91Å
36S50.4Low48.9Very low111 Ų111119.5 Ų119.578%0.77671%0.707SS**  trans-22.6108167.153.10000116.3
37D33.4Very low47.5Very low161 Ų161119.5 Ų119.586%0.86172%0.718SS**  trans-116.983.4152.5-81.9-31.6000108.2G35G35-D37 PolarHBondContact O-N 2.91Å
38S42.2Very low46.6Very low118 Ų118117.7 Ų117.783%0.82572%0.719SS**  trans-92.6117.1158.8-176.50000107
39T30.8Very low45.1Very low127 Ų127123.2 Ų123.278%0.77974%0.741SS**  trans-129.1149.416815.90000109.7
40P50.7Low43.8Very low122 Ų122124.8 Ų124.879%0.79276%0.757SS**  trans-96.6140.5-138.935.7-34.1000112.3
41A31.6Very low42.8Very low92 Ų92126.5 Ų126.576%0.7677%0.772SS**  trans-145.4110162.300000111
42I38.4Very low42.4Very low156 Ų156134 Ų13480%0.879%0.786SS**  trans62.9102.5146.2-61.9167.9000116.3V44I42-V44 HydrophobicContact CG2-CG2 4.23Å; I42-V44 PolarHBondContact O-N 2.93Å
43S40.3Very low42.1Very low114 Ų114131 Ų13180%0.79778%0.782SS**  trans-64.6118.2161.2450000111.7
44V36.4Very low42.5Very low136 Ų136129.2 Ų129.282%0.82478%0.779SS**  trans-132.9123.3152.3-179.10000108.9I42I42-V44 HydrophobicContact CG2-CG2 4.23Å; I42-V44 PolarHBondContact O-N 2.93Å
45S39Very low42.7Very low105 Ų105124.5 Ų124.573%0.73478%0.778SS**  trans-82.2126.5-171.7-41.60000112.5
46L39.3Very low42.7Very low151 Ų151126.5 Ų126.579%0.79179%0.79SS**  trans36.3142.1137.3-77.7156.9000121
47P46.2Very low42.6Very low122 Ų122130.3 Ų130.379%0.79280%0.796SS**  -140.2170.476.429.9-8.7000117.5
48P55.6Low43.1Very low102 Ų102128.9 Ų128.966%0.66279%0.792SS**  trans-100.8126.1-167.235.8-24.8000112.1
49N40.3Very low43.5Very low171 Ų171128 Ų12891%0.91478%0.784SS**  trans171122.2146.6-105.2-15.8000109.9
50A38.5Very low44.8Very low95 Ų95129 Ų12979%0.78579%0.79SS**  trans154.3118.4130.600000110.6
51A41.9Very low45.1Very low94 Ų94131.2 Ų131.278%0.77779%0.789SS**  trans39.1110.614700000119.5P53A51-P53 WeakPolarHBondContact O-CD 3.41Å
52R51.2Low46.3Very low242 Ų242133.2 Ų133.291%0.91379%0.792SS**PPolyproline II helixtrans-46.3126.9156.9-178.1-174.2-156.3179.57.1112.4
53P49.3Very low46.8Very low106 Ų106133 Ų13369%0.68879%0.792SS**PPolyproline II helixtrans-94156.6157.42.118.6000111.2A51A51-P53 WeakPolarHBondContact O-CD 3.41Å
54P56.5Low47.6Very low110 Ų110136.9 Ų136.971%0.71479%0.794SS**PPolyproline II helixtrans-70.3163.1-178.531.2-33.9000111.9A56P54-A56 PolarHBondContact O-N 2.65Å; P54-A56 VanDerWaalsContact O-N 3.14Å
55P46.1Very low48.2Very low130 Ų130135.8 Ų135.884%0.84479%0.787SS**PPolyproline II helixtrans-59.6120.6-179.724.8-33.2000110.4Q57P55-Q57 PolarHBondContact O-N 2.88Å
56A39.4Very low48.6Very low92 Ų92137.8 Ų137.876%0.7679%0.785SS**PPolyproline II helixtrans-64.2120.9175.400000109.5P54 V58P54-A56 PolarHBondContact O-N 2.65Å; P54-A56 VanDerWaalsContact O-N 3.14Å; A56-V58 PolarHBondContact O-N 3.33Å
57Q47Very low49.3Very low191 Ų191134.1 Ų134.189%0.89377%0.769SS**PPolyproline II helixtrans-59.4117.9169.9-126.8161.4-9.600108.5P55 P59P55-Q57 PolarHBondContact O-N 2.88Å; Q57-P59 VanDerWaalsContact O-CD 3.31Å; Q57-P59 WeakPolarHBondContact O-CD 3.38Å
58V45.2Very low49.6Very low130 Ų130136.6 Ų136.679%0.78877%0.77SS**PPolyproline II helixtrans-74.8120.2179-178.10000108.7A56 V60A56-V58 PolarHBondContact O-N 3.33Å; V58-V60 PolarHBondContact O-N 3.41Å
59P48.9Very low49.7Very low100 Ų100136.8 Ų136.865%0.64976%0.764SS**PPolyproline II helixtrans-65.6127.7169.2-18.933.1000109.8Q57 E61Q57-P59 VanDerWaalsContact O-CD 3.31Å; Q57-P59 WeakPolarHBondContact O-CD 3.38Å; P59-E61 PolarHBondContact O-N 3.01Å
60V59.4Low50.5Low149 Ų149137.9 Ų137.990%0.90376%0.764SS**  trans-74.660.3165.6-96.60000109.4V58V58-V60 PolarHBondContact O-N 3.41Å
61E57Low51.2Low167 Ų167139.2 Ų139.278%0.7876%0.758SS**  trans-113.6101.1165.2-70.6-168.9170.400107.2P59 L63P59-E61 PolarHBondContact O-N 3.01Å; E61-L63 PolarHBondContact O-N 3.3Å; E61-L63 VanDerWaalsContact O-N 3.11Å
62V56.6Low52.5Low134 Ų134138.9 Ų138.981%0.81275%0.748SS**  trans-54.8116.3176.1-1720000107.4K64V62-K64 PolarHBondContact O-N 2.84Å
63L48.3Very low53.6Low153 Ų153130 Ų13080%0.80172%0.72SS**  trans-54.1105.4167.4-87.7104.6000107.6E61 V65E61-L63 PolarHBondContact O-N 3.3Å; E61-L63 VanDerWaalsContact O-N 3.11Å; L63-V65 VanDerWaalsContact C-N 3.26Å; L63-V65 PolarHBondContact O-N 3.07Å
64K57.9Low54.5Low194 Ų194130 Ų13084%0.84371%0.71SS**  trans-69.391.9167.5-84.5-178.1174.1175.40107.2V62 Q66V62-K64 PolarHBondContact O-N 2.84Å; K64-Q66 PolarHBondContact O-N 2.94Å
65V49.6Very low55.3Low113 Ų113131.7 Ų131.769%0.68570%0.703SS**  trans-70.496.7169.5-175.50000106.9L63 T67L63-V65 VanDerWaalsContact C-N 3.26Å; L63-V65 PolarHBondContact O-N 3.07Å; V65-T67 HydrophobicContact CG1-CG2 3.77Å; V65-T67 PolarHBondContact O-N 2.98Å
66Q47.3Very low56.6Low147 Ų147130 Ų13069%0.68768%0.684SS**  trans-71.393.8174.3-163.487.131.200108.1K64K64-Q66 PolarHBondContact O-N 2.94Å
67T53Low58.3Low74 Ų74129.3 Ų129.345%0.45467%0.666SS.*  trans-89.8109.2171.961.10000108.3V65 L69V65-T67 HydrophobicContact CG1-CG2 3.77Å; V65-T67 PolarHBondContact O-N 2.98Å; T67-L69 PolarHBondContact O-N 3.48Å
68H52.6Low59.6Low175 Ų175123.2 Ų123.281%0.8164%0.638SS**  trans-77.775.2171.5-73.3-85.1000108.8
69L56.8Low61Low105 Ų105120.5 Ų120.555%0.5562%0.617SS.*  trans-91.4123171.1-80.8154.8000108.5T67 N71 T73T67-L69 PolarHBondContact O-N 3.48Å; L69-N71 WeakPolarHBondContact CB-O 3.33Å; L69-N71 PolarHBondContact O-N 3.41Å; L69-T73 WeakPolarHBondContact CD1-OG1 3.31Å
70E58Low62.2Low194 Ų194118.3 Ų118.391%0.90761%0.607SS**SBendtrans-63.8-8.7-179.2-159175.1136.700113.1
71N52.3Low63Low124 Ų124116.6 Ų116.666%0.66359%0.589SS**SBendtrans-136136.6169.7-68.5-74.1000109.1L69 T73L69-N71 WeakPolarHBondContact CB-O 3.33Å; L69-N71 PolarHBondContact O-N 3.41Å; N71-T73 PolarHBondContact O-N 3.45Å
72P70.5Confident63.8Low86 Ų86112.4 Ų112.456%0.55857%0.566SS**  trans-59131.9-176.622.8-31.5000110.7H76 I77P72-H76 HydrophobicContact CB-CB 4.38Å; P72-I77 HydrophobicContact CB-CD1 4.49Å; P72-I77 HydrophobicContact CB-CG1 3.91Å; P72-I77 HydrophobicContact CG-CD1 4.04Å; P72-I77 HydrophobicContact CG-CG1 3.77Å; P72-I77 WeakPolarHBondContact O-CD1 3.4Å
73T74.8Confident64.9Low55 Ų55111.3 Ų111.334%0.33755%0.552SS.*  trans-55.4146.7178.2-31.70000110.2L69 N71 Y75 H76 I77L69-T73 WeakPolarHBondContact CD1-OG1 3.31Å; N71-T73 PolarHBondContact O-N 3.45Å; T73-Y75 PolarHBondContact O-N 2.8Å; T73-H76 WeakPolarHBondContact O-CA 3.32Å; T73-H76 WeakPolarHBondContact O-CB 3.49Å; T73-H76 PolarHBondContact O-N 3.47Å; T73-H76 PolarHBondContact OG1-ND1 3.26Å; T73-I77 PolarHBondContact O-N 2.97Å; T73-I77 VanDerWaalsContact O-N 3.09Å
74K68.3Low66.2Low107 Ų107110.4 Ų110.447%0.46554%0.544SS..Hα-helixtrans-45.1-41.5176.8-172.6-174.1176.5-162.40112.4I77 Q78 D156K74-I77 PolarHBondContact O-N 3.35Å; K74-Q78 WeakPolarHBondContact O-CB 3.28Å; K74-Q78 PolarHBondContact O-N 2.8Å; K74-D156 IonicContact NZ-OD1 3.39Å; K74-D156 PolarHBondContact NZ-OD1 3.42Å
75Y71.9Confident67Low145 Ų145104.4 Ų104.457%0.56952%0.523SS*.Hα-helixtrans-57.7-47.1174.6179.5-96.9000113.3T73 Q78 Q79T73-Y75 PolarHBondContact O-N 2.8Å; Y75-Q78 PolarHBondContact O-N 3.25Å; Y75-Q79 VanDerWaalsContact O-CB 3.25Å; Y75-Q79 WeakPolarHBondContact O-CB 3.42Å; Y75-Q79 PolarHBondContact O-N 3.01Å
76H73.8Confident68.1Low95 Ų95103.6 Ų103.644%0.4451%0.511SS..Hα-helixtrans-66.9-38.9179.3-70.699.6000112.1P72 T73 Q79 A80P72-H76 HydrophobicContact CB-CB 4.38Å; T73-H76 WeakPolarHBondContact O-CA 3.32Å; T73-H76 WeakPolarHBondContact O-CB 3.49Å; T73-H76 PolarHBondContact O-N 3.47Å; T73-H76 PolarHBondContact OG1-ND1 3.26Å; H76-Q79 PolarHBondContact O-N 3.46Å; H76-A80 VanDerWaalsContact O-CB 3.25Å; H76-A80 WeakPolarHBondContact O-CB 3.32Å; H76-A80 PolarHBondContact O-N 2.96Å
77I75.4Confident69.3Low77 Ų77102.8 Ų102.840%0.39551%0.507SS..Hα-helixtrans-62.9-47.3175.8-61.7172000109.9P72 T73 K74 A80 Q81P72-I77 HydrophobicContact CB-CD1 4.49Å; P72-I77 HydrophobicContact CB-CG1 3.91Å; P72-I77 HydrophobicContact CG-CD1 4.04Å; P72-I77 HydrophobicContact CG-CG1 3.77Å; P72-I77 WeakPolarHBondContact O-CD1 3.4Å; T73-I77 PolarHBondContact O-N 2.97Å; T73-I77 VanDerWaalsContact O-N 3.09Å; K74-I77 PolarHBondContact O-N 3.35Å; I77-A80 PolarHBondContact O-N 2.9Å; I77-Q81 WeakPolarHBondContact O-CG 3.48Å; I77-Q81 PolarHBondContact O-N 3.46Å
78Q74.8Confident70.1Confident64 Ų64106.9 Ų106.930%0.29952%0.515SS..Hα-helixtrans-67.8-38-179-159.4172.533.200111.6K74 Y75 Q81 R82K74-Q78 WeakPolarHBondContact O-CB 3.28Å; K74-Q78 PolarHBondContact O-N 2.8Å; Y75-Q78 PolarHBondContact O-N 3.25Å; Q78-Q81 PolarHBondContact O-N 3.39Å; Q78-R82 WeakPolarHBondContact O-CG 3.46Å; Q78-R82 PolarHBondContact O-N 3.23Å
79Q73.9Confident70.8Confident73 Ų73102.1 Ų102.134%0.34150%0.495SS..Hα-helixtrans-68.7-38.2175.6-167.4172.813.100112Y75 H76 R82 Q83Y75-Q79 VanDerWaalsContact O-CB 3.25Å; Y75-Q79 WeakPolarHBondContact O-CB 3.42Å; Y75-Q79 PolarHBondContact O-N 3.01Å; H76-Q79 PolarHBondContact O-N 3.46Å; Q79-R82 WeakPolarHBondContact O-CB 3.38Å; Q79-R82 PolarHBondContact O-N 2.71Å; Q79-Q83 WeakPolarHBondContact O-CG 3.35Å; Q79-Q83 PolarHBondContact O-N 2.86Å
80A74.6Confident71.3Confident54 Ų54100.5 Ų100.545%0.44649%0.493SS..Hα-helixtrans-65-42.6174.500000111.7H76 I77 R82 Q83 Q84H76-A80 VanDerWaalsContact O-CB 3.25Å; H76-A80 WeakPolarHBondContact O-CB 3.32Å; H76-A80 PolarHBondContact O-N 2.96Å; I77-A80 PolarHBondContact O-N 2.9Å; A80-R82 VanDerWaalsContact C-N 3.35Å; A80-R82 PolarHBondContact O-N 3.33Å; A80-Q83 PolarHBondContact O-N 3Å; A80-Q84 WeakPolarHBondContact O-CB 3.41Å; A80-Q84 PolarHBondContact O-N 3.21Å
81Q74.8Confident71.5Confident113 Ų11395.3 Ų95.353%0.52847%0.474SS..Hα-helixtrans-60.9-43.2173.1-73.4177.44.400111.5I77 Q78 Q83 Q84 V85I77-Q81 WeakPolarHBondContact O-CG 3.48Å; I77-Q81 PolarHBondContact O-N 3.46Å; Q78-Q81 PolarHBondContact O-N 3.39Å; Q81-Q83 PolarHBondContact O-N 3.28Å; Q81-Q84 PolarHBondContact O-N 3.17Å; Q81-V85 WeakPolarHBondContact O-CG2 3.43Å; Q81-V85 PolarHBondContact O-N 2.97Å
82R75.4Confident71.6Confident78 Ų7893.6 Ų93.629%0.29447%0.468SS..Hα-helixtrans-58.8-44.3174.2-78178.4177-102.93.4112.2Q78 Q79 A80 V85 K86 I148 S152Q78-R82 WeakPolarHBondContact O-CG 3.46Å; Q78-R82 PolarHBondContact O-N 3.23Å; Q79-R82 WeakPolarHBondContact O-CB 3.38Å; Q79-R82 PolarHBondContact O-N 2.71Å; A80-R82 VanDerWaalsContact C-N 3.35Å; A80-R82 PolarHBondContact O-N 3.33Å; R82-V85 PolarHBondContact O-N 2.81Å; R82-K86 WeakPolarHBondContact O-CB 3.49Å; R82-K86 PolarHBondContact O-N 3.04Å; R82-I148 HydrophobicContact CG-CG2 4.2Å; R82-I148 VanDerWaalsContact NH1-CG2 3.32Å; R82-S152 PolarHBondContact NH2-OG 2.97Å; R82-S152 VanDerWaalsContact NH2-OG 3.13Å
83Q78.1Confident70.8Confident112 Ų11296.3 Ų96.352%0.52348%0.477SS..Hα-helixtrans-65-39.2176.9-72.2179.316.400112.2Q79 A80 Q81 K86 Q87Q79-Q83 WeakPolarHBondContact O-CG 3.35Å; Q79-Q83 PolarHBondContact O-N 2.86Å; A80-Q83 PolarHBondContact O-N 3Å; Q81-Q83 PolarHBondContact O-N 3.28Å; Q83-K86 PolarHBondContact O-N 3.38Å; Q83-Q87 WeakPolarHBondContact O-CB 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.35Å; Q83-Q87 PolarHBondContact O-N 3.45Å
84Q77.3Confident69.6Low133 Ų13395.7 Ų95.762%0.62148%0.482SS*.Hα-helixtrans-65.2-43.8178.4-168.3175.225.100111.9A80 Q81 Q87 Y88A80-Q84 WeakPolarHBondContact O-CB 3.41Å; A80-Q84 PolarHBondContact O-N 3.21Å; Q81-Q84 PolarHBondContact O-N 3.17Å; Q84-Q87 PolarHBondContact O-N 2.86Å; Q84-Y88 WeakPolarHBondContact O-CB 3.27Å; Q84-Y88 PolarHBondContact O-N 3.35Å
85V72.8Confident68.4Low68 Ų6897.5 Ų97.541%0.41250%0.497SS..Hα-helixtrans-65.1-43.4174.9174.10000110.6Q81 R82 Q87 Y88 L89Q81-V85 WeakPolarHBondContact O-CG2 3.43Å; Q81-V85 PolarHBondContact O-N 2.97Å; R82-V85 PolarHBondContact O-N 2.81Å; V85-Q87 VanDerWaalsContact C-N 3.32Å; V85-Q87 PolarHBondContact O-N 3.29Å; V85-Y88 PolarHBondContact O-N 3.47Å; V85-L89 HydrophobicContact CG1-CD1 3.82Å; V85-L89 HydrophobicContact CG1-CG 4.37Å; V85-L89 WeakPolarHBondContact O-CG 3.45Å; V85-L89 PolarHBondContact O-N 3.3Å
86K73.6Confident67.4Low97 Ų97100.7 Ų100.742%0.42251%0.513SS..Hα-helixtrans-60.3-41.1176.7-171.6162.2-175.1141.30111.9R82 Q83 S90 D141R82-K86 WeakPolarHBondContact O-CB 3.49Å; R82-K86 PolarHBondContact O-N 3.04Å; Q83-K86 PolarHBondContact O-N 3.38Å; K86-S90 VanDerWaalsContact O-CB 3.23Å; K86-S90 WeakPolarHBondContact O-CB 3.45Å; K86-S90 PolarHBondContact O-N 3.15Å; K86-S90 PolarHBondContact O-OG 3.36Å; K86-D141 IonicContact NZ-OD1 2.89Å; K86-D141 PolarHBondContact NZ-OD1 3.11Å; K86-D141 IonicContact NZ-OD2 3.44Å; K86-D141 PolarHBondContact NZ-OD2 3.1Å
87Q72.1Confident66Low129 Ų129100 Ų10060%0.60352%0.524SS*.Hα-helixtrans-66.4-42.6174.5-75.4177.7-10.400112.5Q83 Q84 V85 L89 S90 T91Q83-Q87 WeakPolarHBondContact O-CB 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.35Å; Q83-Q87 PolarHBondContact O-N 3.45Å; Q84-Q87 PolarHBondContact O-N 2.86Å; V85-Q87 VanDerWaalsContact C-N 3.32Å; V85-Q87 PolarHBondContact O-N 3.29Å; Q87-L89 PolarHBondContact O-N 2.81Å; Q87-S90 PolarHBondContact O-N 3.43Å; Q87-T91 WeakPolarHBondContact O-CB 3.19Å; Q87-T91 VanDerWaalsContact O-CG2 3.25Å; Q87-T91 WeakPolarHBondContact O-CG2 3.31Å; Q87-T91 PolarHBondContact O-N 2.95Å; Q87-T91 PolarHBondContact O-OG1 3.11Å
88Y70.8Confident64.3Low161 Ų161102.9 Ų102.963%0.63155%0.545SS*.Hα-helixtrans-62.4-42.5178.9-178.1-101.3000112.3Q84 V85 T91 T92Q84-Y88 WeakPolarHBondContact O-CB 3.27Å; Q84-Y88 PolarHBondContact O-N 3.35Å; V85-Y88 PolarHBondContact O-N 3.47Å; Y88-T91 WeakPolarHBondContact CA-OG1 3.21Å; Y88-T91 PolarHBondContact O-OG1 3.41Å; Y88-T92 PolarHBondContact O-N 3.03Å; Y88-T92 VanDerWaalsContact O-N 3.1Å; Y88-T92 PolarHBondContact O-OG1 2.94Å
89L67.3Low62.5Low75 Ų75106.5 Ų106.539%0.39357%0.572SS.*Hα-helixtrans-71.8-37176.8-65.6172.3000111.8V85 Q87 T92 L93 I144V85-L89 HydrophobicContact CG1-CD1 3.82Å; V85-L89 HydrophobicContact CG1-CG 4.37Å; V85-L89 WeakPolarHBondContact O-CG 3.45Å; V85-L89 PolarHBondContact O-N 3.3Å; Q87-L89 PolarHBondContact O-N 2.81Å; L89-T92 WeakPolarHBondContact CA-OG1 3.37Å; L89-T92 PolarHBondContact O-OG1 3.47Å; L89-L93 PolarHBondContact O-N 3.19Å; L89-I144 HydrophobicContact CD1-CD1 4.45Å
90S66.7Low60.6Low71 Ų71112.2 Ų112.250%0.49760%0.599SS.*Hα-helixtrans-67.8-35.8175.7-59.60000112.8K86 Q87 G94K86-S90 VanDerWaalsContact O-CB 3.23Å; K86-S90 WeakPolarHBondContact O-CB 3.45Å; K86-S90 PolarHBondContact O-N 3.15Å; K86-S90 PolarHBondContact O-OG 3.36Å; Q87-S90 PolarHBondContact O-N 3.43Å; S90-G94 WeakPolarHBondContact O-CA 3.4Å; S90-G94 PolarHBondContact O-N 2.92Å
91T61.4Low58.5Low84 Ų84115 Ų11552%0.51562%0.615SS.*Hα-helixtrans-77.4-32.2179.449.60000112.6Q87 Y88 N95Q87-T91 WeakPolarHBondContact O-CB 3.19Å; Q87-T91 VanDerWaalsContact O-CG2 3.25Å; Q87-T91 WeakPolarHBondContact O-CG2 3.31Å; Q87-T91 PolarHBondContact O-N 2.95Å; Q87-T91 PolarHBondContact O-OG1 3.11Å; Y88-T91 WeakPolarHBondContact CA-OG1 3.21Å; Y88-T91 PolarHBondContact O-OG1 3.41Å; T91-N95 PolarHBondContact O-OD1 2.86Å
92T55.7Low56.5Low88 Ų88118.4 Ų118.454%0.5464%0.635SS.*Hα-helixtrans-75.1-25.1175.740.70000113.2Y88 L89Y88-T92 PolarHBondContact O-N 3.03Å; Y88-T92 VanDerWaalsContact O-N 3.1Å; Y88-T92 PolarHBondContact O-OG1 2.94Å; L89-T92 WeakPolarHBondContact CA-OG1 3.37Å; L89-T92 PolarHBondContact O-OG1 3.47Å
93L53.8Low54.3Low143 Ų143118.5 Ų118.575%0.74966%0.661SS**Hα-helixtrans-96.2-15.9175-156.766.7000113.9L89L89-L93 PolarHBondContact O-N 3.19Å
94G48.5Very low52.1Low42 Ų42119.9 Ų119.943%0.43368%0.677SS.*  trans-89.50.5-174.400000117.4S90 K96S90-G94 WeakPolarHBondContact O-CA 3.4Å; S90-G94 PolarHBondContact O-N 2.92Å; G94-K96 PolarHBondContact O-N 3.43Å
95N44.3Very low49.8Very low145 Ų145118.6 Ų118.678%0.77568%0.682SS**  trans-78.739.7-175.9-84.816.5000115.1T91T91-N95 PolarHBondContact O-OD1 2.86Å
96K50.3Low48.4Very low212 Ų212120.7 Ų120.792%0.92270%0.697SS**SBendtrans-132.145.9162.1-70.1-160.2172.8-171.80112.1G94G94-K96 PolarHBondContact O-N 3.43Å
97A45.3Very low46.1Very low81 Ų81121.2 Ų121.267%0.66971%0.708SS**SBendtrans-162.5153.4158.900000108
98V38.6Very low44.2Very low138 Ų138123.4 Ų123.484%0.83672%0.718SS**  trans8862.3-172.9-163.20000114
99T36.7Very low42.3Very low139 Ų139124 Ų12485%0.85373%0.727SS**  trans-133.376.9136.6-33.10000106.7
100Q35.2Very low40.5Very low194 Ų194125.4 Ų125.491%0.90774%0.743SS**  trans-179.5102.1162.7-105.9172.887.300109.8
101S30.2Very low38.8Very low113 Ų113127.1 Ų127.179%0.7976%0.755SS**  trans-171.9117.4134.461.10000110.5
102L31.8Very low37.3Very low183 Ų183128.7 Ų128.796%0.95877%0.77SS**  trans158.798.9136.6-83.6162.6000108.4
103G29.1Very low36.1Very low81 Ų81129 Ų12984%0.83578%0.781SS**  trans169.6103.4175.400000110.8
104V32.2Very low35.7Very low140 Ų140127.8 Ų127.885%0.84878%0.782SS**  trans-75125.8-173.81640000112.1
105S28.9Very low34.8Very low106 Ų106134.3 Ų134.374%0.74180%0.801SS**  trans35.5165.7143.9-63.10000123.7
106P43.7Very low34.2Very low112 Ų112133.5 Ų133.573%0.72780%0.801SS**  cis-136.7-170.4-49.637-17000113.9
107V26.4Very low33.3Very low108 Ų108126.6 Ų126.666%0.65579%0.79SS**  trans99.9105.9156.6-152.60000119.3
108H32.1Very low33.1Very low175 Ų175129.2 Ų129.281%0.8180%0.8SS**  173.9151.2107-94.8-69.1000113
109Q30Very low32.7Very low174 Ų174128.6 Ų128.681%0.81380%0.8SS**  trans-79.6156.8-164.7-61.5160.8-30.200115.1
110S29.6Very low32.8Very low104 Ų104126.5 Ų126.573%0.72780%0.797SS**  149127.7112.1-79.80000116.1
111S30.1Very low33.1Very low108 Ų108123.2 Ų123.276%0.75580%0.796SS**  trans30.8128.9144.457.90000120.2
112S30.8Very low33.5Very low117 Ų117123.2 Ų123.282%0.81880%0.796SS**  -179.3153.169.5-46.50000110.4
113A29.6Very low34Very low95 Ų95118.9 Ų118.979%0.78579%0.786SS**  trans-99.3-176.4175.100000112
114P46Very low34.8Very low116 Ų116120.7 Ų120.775%0.75378%0.784SS**  cis-137174.1-6.939.6-20000117.1
115E29.6Very low35.5Very low180 Ų180121.6 Ų121.684%0.84178%0.783SS**  trans86137.4142.9-123.1-165.6145.300124.9
116V32.7Very low36.1Very low127 Ų127120.6 Ų120.677%0.7778%0.777SS**  trans94103156.7-157.90000120.5
117G31.8Very low36.5Very low68 Ų68121.5 Ų121.570%0.70178%0.783SS**  trans92.5126.5132.900000119.6
118P39.8Very low37.5Very low135 Ų135124.1 Ų124.188%0.87779%0.79SS**  trans-93.7132.6-17835.7-28.9000112.4
119C31.1Very low38.5Very low125 Ų125119.7 Ų119.785%0.84578%0.783SS**  trans-136.296.5163.2-139.80000107.6
120A38.4Very low39.2Very low95 Ų95119 Ų11979%0.78578%0.784SS**  61.389.710000000112.8
121S40.5Very low40.2Very low126 Ų126120.4 Ų120.488%0.88178%0.783SS**  trans-133.793.3159.1179.50000109.2
122S39.3Very low41Very low113 Ų113123 Ų12379%0.7979%0.788SS**SBendtrans-153.7130.6158.444.20000108.2
123A42Very low41.9Very low91 Ų91123 Ų12375%0.75278%0.778SS**  trans-51.8139.8-169.700000114.4N125A123-N125 PolarHBondContact O-N 3.43Å
124P47.3Very low42.9Very low120 Ų120120.6 Ų120.678%0.77976%0.763SS**SBendtrans-98.742.2-165.140.1-37.2000114.2
125N46Very low43.2Very low158 Ų158120.9 Ų120.985%0.84577%0.768SS**  trans-144.740.1-175.7-90.2-22.2000115.8A123A123-N125 PolarHBondContact O-N 3.43Å
126S41.2Very low44.3Very low86 Ų86116.4 Ų116.460%0.60175%0.749SS**  trans-126.8131.4167.4-990000111.1M128 A129S126-M128 PolarHBondContact O-N 2.96Å; S126-A129 PolarHBondContact O-N 2.87Å
127P51.4Low45.4Very low131 Ų131118.4 Ų118.485%0.85175%0.747SS**THydrogen-bonded Turntrans-66-4.2-178.326.5-33.9000114.4
128M48.8Very low46.7Very low163 Ų163122.9 Ų122.980%0.80375%0.75SS**THydrogen-bonded Turntrans-90.4-7176.5-74.5-171.666.200114.7S126 L130S126-M128 PolarHBondContact O-N 2.96Å; M128-L130 PolarHBondContact O-N 3.22Å
129A52.4Low47.6Very low81 Ų81122.2 Ų122.267%0.66974%0.735SS**THydrogen-bonded Turntrans-76.2-0.9-173.400000115S126S126-A129 PolarHBondContact O-N 2.87Å
130L45.8Very low49.2Very low161 Ų161119.1 Ų119.184%0.84371%0.71SS**THydrogen-bonded Turntrans-102.34.5-173.6-70.8175.6000115.2M128 N132M128-L130 PolarHBondContact O-N 3.22Å; L130-N132 PolarHBondContact O-N 3.43Å
131L48.7Very low50.4Low133 Ų133117 Ų11770%0.69669%0.685SS**  trans-96.676.3176.5-58-177.2000110.2I133L131-I133 HydrophobicContact CB-CD1 3.93Å; L131-I133 HydrophobicContact CB-CG1 4.24Å; L131-I133 PolarHBondContact O-N 3.04Å
132N47.8Very low51.6Low161 Ų161115.8 Ų115.886%0.86167%0.669SS**  trans-7476.3166.5-173.277.3000109.2L130 G134L130-N132 PolarHBondContact O-N 3.43Å; N132-G134 PolarHBondContact O-N 2.95Å
133I50.8Low53.1Low117 Ų117114.3 Ų114.360%0.666%0.655SS**  trans-81113.2174.7-62.8152.3000106.7L131 I140L131-I133 HydrophobicContact CB-CD1 3.93Å; L131-I133 HydrophobicContact CB-CG1 4.24Å; L131-I133 PolarHBondContact O-N 3.04Å; I133-I140 HydrophobicContact CG2-CD1 4.04Å
134G49.3Very low54.2Low46 Ų46111.6 Ų111.647%0.47463%0.628SS.*  trans-55.8142.1174.500000110.9N132 N136N132-G134 PolarHBondContact O-N 2.95Å; G134-N136 VanDerWaalsContact C-N 3.28Å; G134-N136 PolarHBondContact O-N 3.19Å
135S51.9Low55.3Low122 Ų122109.8 Ų109.885%0.85361%0.611SS**  trans-67.176.5-176.3173.60000112.4
136N52.8Low56.5Low86 Ų86107.4 Ų107.446%0.4660%0.598SS.*  trans-113.993.5166.8-58.8-21.8000107.8G134 E138 E139 I140G134-N136 VanDerWaalsContact C-N 3.28Å; G134-N136 PolarHBondContact O-N 3.19Å; N136-E138 PolarHBondContact O-N 2.87Å; N136-E139 HydrophobicContact CB-CB 4.25Å; N136-E139 HydrophobicContact CB-CG 4.49Å; N136-E139 PolarHBondContact ND2-OE2 3.32Å; N136-I140 WeakPolarHBondContact O-CD1 3.46Å; N136-I140 WeakPolarHBondContact O-CG1 3.44Å
137K57.2Low58.1Low168 Ų168108.1 Ų108.173%0.7359%0.594SS**Hα-helixtrans-62.5-28.8-176.5-174.9-179.2174-172.20112.6D141K137-D141 PolarHBondContact O-N 3.27Å
138E58.7Low58.6Low162 Ų162103.1 Ų103.176%0.75756%0.56SS**Hα-helixtrans-77.6-46.1-176.5-70142.7-169.300112.2N136 I140 D141 D142N136-E138 PolarHBondContact O-N 2.87Å; E138-I140 PolarHBondContact O-N 3.1Å; E138-D141 PolarHBondContact O-N 2.65Å; E138-D142 PolarHBondContact O-N 2.91Å; E138-D142 VanDerWaalsContact O-N 3.13Å
139E58.1Low59.6Low121 Ų12198.4 Ų98.457%0.56554%0.543SS*.Hα-helixtrans-62.9-29177-79.6-177.414500113.1N136 V143N136-E139 HydrophobicContact CB-CB 4.25Å; N136-E139 HydrophobicContact CB-CG 4.49Å; N136-E139 PolarHBondContact ND2-OE2 3.32Å; E139-V143 VanDerWaalsContact O-CG2 3.25Å; E139-V143 WeakPolarHBondContact O-CG2 3.29Å; E139-V143 PolarHBondContact O-N 3.4Å; E139-V143 VanDerWaalsContact O-N 3.1Å
140I64.3Low60.1Low61 Ų61100.6 Ų100.631%0.31354%0.543SS..Hα-helixtrans-77-36.2179.4-64.2164.7000110.9I133 N136 E138 D142 V143 I144I133-I140 HydrophobicContact CG2-CD1 4.04Å; N136-I140 WeakPolarHBondContact O-CD1 3.46Å; N136-I140 WeakPolarHBondContact O-CG1 3.44Å; E138-I140 PolarHBondContact O-N 3.1Å; I140-D142 VanDerWaalsContact C-N 3.34Å; I140-V143 PolarHBondContact O-N 2.97Å; I140-I144 HydrophobicContact CG2-CD1 3.83Å; I140-I144 HydrophobicContact CG2-CG1 4.46Å; I140-I144 WeakPolarHBondContact O-CB 3.49Å; I140-I144 WeakPolarHBondContact O-CD1 3.34Å; I140-I144 WeakPolarHBondContact O-CG1 3.47Å; I140-I144 PolarHBondContact O-N 3.37Å
141D63.5Low60.8Low50 Ų5098.7 Ų98.727%0.26753%0.53SS..Hα-helixtrans-65.9-38.5173.4-95.3-27.8000110.4K86 K137 E138 I144 D145K86-D141 IonicContact NZ-OD1 2.89Å; K86-D141 PolarHBondContact NZ-OD1 3.11Å; K86-D141 IonicContact NZ-OD2 3.44Å; K86-D141 PolarHBondContact NZ-OD2 3.1Å; K137-D141 PolarHBondContact O-N 3.27Å; E138-D141 PolarHBondContact O-N 2.65Å; D141-I144 PolarHBondContact O-N 3.39Å; D141-D145 PolarHBondContact O-N 3.01Å
142D67Low61.1Low101 Ų10193.3 Ų93.354%0.5450%0.504SS..Hα-helixtrans-64.3-43.5175.1-68.3-27.1000112.4E138 I140 I144 D145 D146E138-D142 PolarHBondContact O-N 2.91Å; E138-D142 VanDerWaalsContact O-N 3.13Å; I140-D142 VanDerWaalsContact C-N 3.34Å; D142-I144 VanDerWaalsContact C-N 3.31Å; D142-I144 PolarHBondContact O-N 2.85Å; D142-D145 PolarHBondContact O-N 3.1Å; D142-D146 PolarHBondContact O-N 3.14Å
143V69.9Low61.4Low81 Ų8189.4 Ų89.449%0.49149%0.489SS..Hα-helixtrans-66.5-34.4176.4171.50000111.6E139 I140 I147E139-V143 VanDerWaalsContact O-CG2 3.25Å; E139-V143 WeakPolarHBondContact O-CG2 3.29Å; E139-V143 PolarHBondContact O-N 3.4Å; E139-V143 VanDerWaalsContact O-N 3.1Å; I140-V143 PolarHBondContact O-N 2.97Å; V143-I147 HydrophobicContact CG1-CD1 3.85Å; V143-I147 WeakPolarHBondContact O-CB 3.4Å; V143-I147 WeakPolarHBondContact O-CD1 3.33Å; V143-I147 WeakPolarHBondContact O-CG1 3.27Å; V143-I147 PolarHBondContact O-N 2.85Å
144I65.2Low61.5Low35 Ų3591 Ų9118%0.17949%0.492CS..Hα-helixtrans-67.3-42.8174.1-71.9165.7000110.2L89 I140 D141 D142 D146 I147 I148L89-I144 HydrophobicContact CD1-CD1 4.45Å; I140-I144 HydrophobicContact CG2-CD1 3.83Å; I140-I144 HydrophobicContact CG2-CG1 4.46Å; I140-I144 WeakPolarHBondContact O-CB 3.49Å; I140-I144 WeakPolarHBondContact O-CD1 3.34Å; I140-I144 WeakPolarHBondContact O-CG1 3.47Å; I140-I144 PolarHBondContact O-N 3.37Å; D141-I144 PolarHBondContact O-N 3.39Å; D142-I144 VanDerWaalsContact C-N 3.31Å; D142-I144 PolarHBondContact O-N 2.85Å; I144-D146 VanDerWaalsContact C-N 3.34Å; I144-I147 PolarHBondContact O-N 3.44Å; I144-I148 HydrophobicContact CG2-CD1 3.55Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CB 3.46Å; I144-I148 WeakPolarHBondContact O-CG1 3.37Å; I144-I148 PolarHBondContact O-N 3.37Å
145D70.1Confident62Low81 Ų8192.6 Ų92.643%0.43349%0.489SS..Hα-helixtrans-66.8-35177.3-81.3-24.9000112.2D141 D142 S149D141-D145 PolarHBondContact O-N 3.01Å; D142-D145 PolarHBondContact O-N 3.1Å; D145-S149 WeakPolarHBondContact O-CB 3.37Å; D145-S149 PolarHBondContact O-N 2.93Å; D145-S149 PolarHBondContact O-OG 3.14Å
146D72Confident62.1Low108 Ų10890.3 Ų90.358%0.57847%0.468SS*.Hα-helixtrans-65.1-46.8172.3-79.7-15.6000112D142 I144 I148 S149 L150D142-D146 PolarHBondContact O-N 3.14Å; I144-D146 VanDerWaalsContact C-N 3.34Å; D146-I148 PolarHBondContact O-N 2.93Å; D146-S149 PolarHBondContact O-N 3.34Å; D146-L150 WeakPolarHBondContact O-CB 3.28Å; D146-L150 WeakPolarHBondContact O-CD1 3.18Å; D146-L150 WeakPolarHBondContact O-CG 3.41Å; D146-L150 PolarHBondContact O-N 3.4Å
147I73.4Confident62.1Low101 Ų10191.9 Ų91.952%0.51848%0.476SS..Hα-helixtrans-63.1-42.7179.3-69.9166000111V143 I144 L150 E151V143-I147 HydrophobicContact CG1-CD1 3.85Å; V143-I147 WeakPolarHBondContact O-CB 3.4Å; V143-I147 WeakPolarHBondContact O-CD1 3.33Å; V143-I147 WeakPolarHBondContact O-CG1 3.27Å; V143-I147 PolarHBondContact O-N 2.85Å; I144-I147 PolarHBondContact O-N 3.44Å; I147-L150 PolarHBondContact O-N 2.68Å; I147-E151 PolarHBondContact O-N 3.07Å; I147-E151 VanDerWaalsContact O-N 3.11Å
148I63.6Low62Low26 Ų2687.9 Ų87.913%0.13346%0.462CS..Hα-helixtrans-76.3-31.2-178.9-58.5169.3000111R82 I144 D146 E151 S152R82-I148 HydrophobicContact CG-CG2 4.2Å; R82-I148 VanDerWaalsContact NH1-CG2 3.32Å; I144-I148 HydrophobicContact CG2-CD1 3.55Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CB 3.46Å; I144-I148 WeakPolarHBondContact O-CG1 3.37Å; I144-I148 PolarHBondContact O-N 3.37Å; D146-I148 PolarHBondContact O-N 2.93Å; I148-E151 PolarHBondContact O-N 2.95Å; I148-S152 WeakPolarHBondContact O-CB 3.43Å; I148-S152 PolarHBondContact O-N 3.42Å; I148-S152 PolarHBondContact O-OG 3.19Å
149S68.6Low61.8Low64 Ų6483.9 Ų83.945%0.44845%0.445SS..Hα-helixtrans-67.1-37.7172.1-63.70000111.7D145 D146 S152 S153D145-S149 WeakPolarHBondContact O-CB 3.37Å; D145-S149 PolarHBondContact O-N 2.93Å; D145-S149 PolarHBondContact O-OG 3.14Å; D146-S149 PolarHBondContact O-N 3.34Å; S149-S152 PolarHBondContact O-N 2.91Å; S149-S153 PolarHBondContact O-N 3.43Å; S149-S153 VanDerWaalsContact O-N 3.11Å
150L63.4Low61.6Low127 Ų12782.5 Ų82.567%0.66545%0.445SS*.Hα-helixtrans-64.4-37.3172.6-72.9165.1000112.5D146 I147 F154D146-L150 WeakPolarHBondContact O-CB 3.28Å; D146-L150 WeakPolarHBondContact O-CD1 3.18Å; D146-L150 WeakPolarHBondContact O-CG 3.41Å; D146-L150 PolarHBondContact O-N 3.4Å; I147-L150 PolarHBondContact O-N 2.68Å; L150-F154 PolarHBondContact O-N 3.03Å
151E60.8Low61Low121 Ų12186.2 Ų86.257%0.56546%0.464SS*.Hα-helixtrans-73.3-27.2175.3-168.9169.3-157.900112.9I147 I148 F154 N155I147-E151 PolarHBondContact O-N 3.07Å; I147-E151 VanDerWaalsContact O-N 3.11Å; I148-E151 PolarHBondContact O-N 2.95Å; E151-F154 PolarHBondContact O-N 3.36Å; E151-N155 PolarHBondContact O-N 3.06Å; E151-N155 PolarHBondContact O-ND2 2.98Å
152S54.8Low60.6Low21 Ų2188.8 Ų88.815%0.14748%0.477CS..Hα-helixtrans-72-40.2175.6-55.70000111.7R82 I148 S149 F154 N155 D156R82-S152 PolarHBondContact NH2-OG 2.97Å; R82-S152 VanDerWaalsContact NH2-OG 3.13Å; I148-S152 WeakPolarHBondContact O-CB 3.43Å; I148-S152 PolarHBondContact O-N 3.42Å; I148-S152 PolarHBondContact O-OG 3.19Å; S149-S152 PolarHBondContact O-N 2.91Å; S152-F154 PolarHBondContact O-N 3.28Å; S152-N155 PolarHBondContact O-N 2.7Å; S152-D156 PolarHBondContact O-N 3.16Å
153S54.2Low59.4Low79 Ų7990.9 Ų90.955%0.55249%0.488SS*.Hα-helixtrans-60.3-33.2173.7-179.20000112.8S149S149-S153 PolarHBondContact O-N 3.43Å; S149-S153 VanDerWaalsContact O-N 3.11Å
154F53.2Low58.4Low151 Ų15192.2 Ų92.266%0.66250%0.501SS*.Hα-helixtrans-79-26.2179.3-148.6-92000112.7L150 E151 S152L150-F154 PolarHBondContact O-N 3.03Å; E151-F154 PolarHBondContact O-N 3.36Å; S152-F154 PolarHBondContact O-N 3.28Å
155N59.1Low57.6Low78 Ų7893 Ų9342%0.41752%0.518SS..Hα-helixtrans-84.6-30.6178.3-90.3-42.4000113.4E151 S152 I158 I159E151-N155 PolarHBondContact O-N 3.06Å; E151-N155 PolarHBondContact O-ND2 2.98Å; S152-N155 PolarHBondContact O-N 2.7Å; N155-I158 PolarHBondContact O-N 3.42Å; N155-I159 VanDerWaalsContact O-CG1 3.31Å; N155-I159 WeakPolarHBondContact O-CG1 3.39Å; N155-I159 PolarHBondContact O-N 3.33Å; N155-I159 VanDerWaalsContact O-N 3.12Å
156D54.3Low56.4Low75 Ų7595.5 Ų95.540%0.40153%0.531SS..Hα-helixtrans-68.4-36.6176.3-82.7-29.1000112.1K74 S152 I158 I159 T160K74-D156 IonicContact NZ-OD1 3.39Å; K74-D156 PolarHBondContact NZ-OD1 3.42Å; S152-D156 PolarHBondContact O-N 3.16Å; D156-I158 VanDerWaalsContact C-N 3.26Å; D156-I158 PolarHBondContact O-N 3.04Å; D156-I159 PolarHBondContact O-N 3.31Å; D156-I159 VanDerWaalsContact O-N 3.16Å; D156-T160 PolarHBondContact O-N 2.88Å; D156-T160 PolarHBondContact O-OG1 3.39Å
157D52.1Low54.8Low118 Ų11899.8 Ų99.863%0.63155%0.548SS*.Hα-helixtrans-62-31.2173.8-75.7-20000113.3L161D157-L161 WeakPolarHBondContact O-CB 3.4Å
158I55.5Low53.3Low85 Ų85101.9 Ų101.944%0.43656%0.559SS.*Hα-helixtrans-78.2-35.6176.9-65.5179.5000110.9N155 D156 I162N155-I158 PolarHBondContact O-N 3.42Å; D156-I158 VanDerWaalsContact C-N 3.26Å; D156-I158 PolarHBondContact O-N 3.04Å; I158-I162 HydrophobicContact CG2-CD1 4.3Å; I158-I162 WeakPolarHBondContact O-CD1 3.31Å; I158-I162 WeakPolarHBondContact O-CG1 3.43Å; I158-I162 PolarHBondContact O-N 3.03Å
159I55Low52.2Low78 Ų78106.6 Ų106.640%0.459%0.591SS.*Hα-helixtrans-75.6-41179.8-66.4-80.9000111.4N155 D156 L161 I162 D163N155-I159 VanDerWaalsContact O-CG1 3.31Å; N155-I159 WeakPolarHBondContact O-CG1 3.39Å; N155-I159 PolarHBondContact O-N 3.33Å; N155-I159 VanDerWaalsContact O-N 3.12Å; D156-I159 PolarHBondContact O-N 3.31Å; D156-I159 VanDerWaalsContact O-N 3.16Å; I159-L161 PolarHBondContact O-N 3.45Å; I159-I162 PolarHBondContact O-N 3.37Å; I159-I162 VanDerWaalsContact O-N 3.09Å; I159-D163 PolarHBondContact O-N 2.67Å
160T54.4Low50.5Low91 Ų91108.9 Ų108.956%0.55861%0.607SS**Hα-helixtrans-63.8-27.8176.8-49.30000112.1D156 S164D156-T160 PolarHBondContact O-N 2.88Å; D156-T160 PolarHBondContact O-OG1 3.39Å; T160-S164 PolarHBondContact O-OG 2.94Å
161L51.6Low49.4Very low139 Ų139109.2 Ų109.273%0.72862%0.615SS**Hα-helixtrans-75.3-25.5175.5-167.463.6000113.3D157 I159D157-L161 WeakPolarHBondContact O-CB 3.4Å; I159-L161 PolarHBondContact O-N 3.45Å
162I55Low48.6Very low105 Ų105111.4 Ų111.454%0.53863%0.63SS.*Hα-helixtrans-82-35.1177.3-66.5165.7000111I158 I159 S164 G165I158-I162 HydrophobicContact CG2-CD1 4.3Å; I158-I162 WeakPolarHBondContact O-CD1 3.31Å; I158-I162 WeakPolarHBondContact O-CG1 3.43Å; I158-I162 PolarHBondContact O-N 3.03Å; I159-I162 PolarHBondContact O-N 3.37Å; I159-I162 VanDerWaalsContact O-N 3.09Å; I162-S164 VanDerWaalsContact C-N 3.32Å; I162-S164 PolarHBondContact O-N 3.48Å; I162-G165 PolarHBondContact O-N 3.12Å
163D41.7Very low48.1Very low145 Ų145116.5 Ų116.578%0.77566%0.662SS**Hα-helixtrans-72-23.2-177.1-160.432.4000113.4I159 G165I159-D163 PolarHBondContact O-N 2.67Å; D163-G165 VanDerWaalsContact C-N 3.27Å; D163-G165 PolarHBondContact O-N 3Å
164S49Very low47.2Very low108 Ų108116 Ų11676%0.75567%0.669SS**THydrogen-bonded Turntrans-80-0.4177.4-60.50000114.3T160 I162T160-S164 PolarHBondContact O-OG 2.94Å; I162-S164 VanDerWaalsContact C-N 3.32Å; I162-S164 PolarHBondContact O-N 3.48Å
165G48.8Very low46.6Very low53 Ų53116.6 Ų116.655%0.54668%0.68SS.*SBendtrans-125.5-5.5-159.400000119.4I162 D163I162-G165 PolarHBondContact O-N 3.12Å; D163-G165 VanDerWaalsContact C-N 3.27Å; D163-G165 PolarHBondContact O-N 3Å
166L43.1Very low45.8Very low133 Ų133120.8 Ų120.870%0.69670%0.701SS**  trans-14084.6-171.6-69.3174.1000114.2L168L166-L168 HydrophobicContact CD2-CD1 3.99Å; L166-L168 HydrophobicContact CD2-CG 4.32Å
167Q39.6Very low45.2Very low198 Ų198124 Ų12493%0.92572%0.717SS**  trans-105.6103.5143.5-76-174.344.400107.8
168L42Very low44.6Very low145 Ų145125.7 Ų125.776%0.75973%0.726SS**  trans-117128.7169.6-72.5176.3000109.4L166L166-L168 HydrophobicContact CD2-CD1 3.99Å; L166-L168 HydrophobicContact CD2-CG 4.32Å
169P39.3Very low44Very low124 Ų124126.2 Ų126.281%0.80573%0.734SS**  trans-74131.1167.9-3.720.5000109.8
170S34.6Very low43.1Very low113 Ų113132.6 Ų132.679%0.7975%0.754SS**  trans-83.2116.8174.4177.30000110.8
171T39Very low42.2Very low133 Ų133136.8 Ų136.882%0.81677%0.767SS**  trans-142.4120.1155.754.10000110.4
172L44.1Very low41.5Very low168 Ų168135.7 Ų135.788%0.8877%0.771SS**  trans-80.1153.2170.6-74.8163.9000110.6
173P44.6Very low41.3Very low127 Ų127136.9 Ų136.983%0.82579%0.786SS**  trans-122.7132.5143.633.4-21.4000111.8
174G35.1Very low40.9Very low69 Ų69133.4 Ų133.471%0.71178%0.783SS**  trans-94.5156.417300000113.6
175N40.7Very low40.4Very low164 Ų164137.1 Ų137.188%0.87779%0.791SS**  trans20.8123153.4-68.814.2000121.3
176L42.3Very low39.7Very low165 Ų165139 Ų13986%0.86480%0.802SS**  trans-157.399.8133.2-101172.8000107.2
177L41.8Very low39.3Very low142 Ų142137 Ų13774%0.74380%0.804SS**  81.597.696-155.388.5000113.2V179L177-V179 HydrophobicContact CD2-CG2 3.7Å; L177-V179 HydrophobicContact CG-CG2 4.02Å
178D39.6Very low39.4Very low154 Ų154134 Ų13482%0.82480%0.802SS**  trans-65.8121.5164.3-174.719.1000110.4
179V43.6Very low39.1Very low97 Ų97132.9 Ų132.959%0.58880%0.801SS**  trans-149.1120.9166.1-150.60000110.9L177L177-V179 HydrophobicContact CD2-CG2 3.7Å; L177-V179 HydrophobicContact CG-CG2 4.02Å
180Y35.3Very low39.7Very low211 Ų211135 Ų13583%0.82781%0.805SS**  trans80.694.6168.8-75.1-81.6000119.5
181H36.7Very low40Very low180 Ų180135.1 Ų135.183%0.83380%0.801SS**  trans-124.7122.6143.2-84.179.5000109.9
182S36.5Very low40.5Very low116 Ų116134.9 Ų134.981%0.81180%0.799SS**  trans-155.7153.2155.3-86.80000110.4
183P49.2Very low40Very low130 Ų130131.7 Ų131.784%0.84479%0.791SS**  trans-107144.6-139.536.5-28.5000113.1
184G33.6Very low40.7Very low71 Ų71133.2 Ų133.273%0.73279%0.792SS**  trans174.7119.7169.200000114.9
185M38.5Very low41.2Very low187 Ų187134.7 Ų134.792%0.92179%0.791SS**  trans82.8117.7153.2-67-78.7110.900120.9
186A35.7Very low41.3Very low93 Ų93132.9 Ų132.977%0.76979%0.79SS**  trans79.8113.513700000122.3
187A32.9Very low41.7Very low90 Ų90131.1 Ų131.174%0.74479%0.789SS**  trans65.6128.3143.300000121.1T189A187-T189 PolarHBondContact O-N 3.36Å
188P42.6Very low42.1Very low134 Ų134129.3 Ų129.387%0.8779%0.794SS**  trans-86.5112.117333.8-26.7000110
189T36.5Very low42.5Very low123 Ų123128.4 Ų128.476%0.75579%0.79SS**  trans-97.7120.1162.3-57.90000108.3A187 T191A187-T189 PolarHBondContact O-N 3.36Å; T189-T191 PolarHBondContact O-N 3.5Å
190L51.3Low42.8Very low167 Ų167130.4 Ų130.487%0.87480%0.796SS**  trans-54.9113.4172.4-66.7164.7000109.9
191T40.1Very low43.5Very low117 Ų117125.6 Ų125.672%0.71879%0.791SS**  trans-117102.4161.662.60000108.6T189 S193T189-T191 PolarHBondContact O-N 3.5Å; T191-S193 PolarHBondContact O-N 3.02Å
192V49Very low43.9Very low128 Ų128125.7 Ų125.778%0.77679%0.792SS**  trans-69.3101.2165.3174.10000106.7N194V192-N194 PolarHBondContact O-N 3Å
193S35.3Very low44.5Very low101 Ų101127.3 Ų127.371%0.70679%0.789SS**  trans-88.994.3169.1-72.70000109.7T191 S195T191-S193 PolarHBondContact O-N 3.02Å; S193-S195 PolarHBondContact O-N 3.25Å
194N58.8Low44.5Very low158 Ų158129.4 Ų129.485%0.84579%0.785SS**  trans-72.5106.3157.7-98.4-7.8000108.7V192V192-N194 PolarHBondContact O-N 3Å
195S45.8Very low45.4Very low100 Ų100137.3 Ų137.370%0.69979%0.793SS**  trans-160.170.1160.958.10000110.9S193S193-S195 PolarHBondContact O-N 3.25Å
196C42.9Very low46Very low126 Ų126135 Ų13585%0.85178%0.78SS**  trans-86.1116.9155.2-66.20000107.2A198C196-A198 PolarHBondContact O-N 3.22Å; C196-A198 VanDerWaalsContact O-N 3.14Å
197P49.3Very low46.9Very low129 Ų129135.8 Ų135.884%0.83877%0.77SS**  trans-72.2109.3168.128.7-27.8000107.7D199P197-D199 PolarHBondContact O-N 3.46Å
198A51.7Low48.5Very low103 Ų103135.3 Ų135.385%0.85176%0.758SS**  trans-75.898.2163.600000107.8C196C196-A198 PolarHBondContact O-N 3.22Å; C196-A198 VanDerWaalsContact O-N 3.14Å
199D47.3Very low49.7Very low136 Ų136134.8 Ų134.873%0.72775%0.748SS**  trans-179.4108.8133.7-155.63.2000110.1P197P197-D199 PolarHBondContact O-N 3.46Å
200L49.1Very low51.4Low139 Ų139131.9 Ų131.973%0.72874%0.737SS**  trans-133.3100.5162.4-91.7171.3000107.2Q202 I203L200-Q202 PolarHBondContact O-N 3.18Å; L200-I203 HydrophobicContact CB-CD1 4.5Å
201P50.8Low52.7Low110 Ų110127.9 Ų127.971%0.71472%0.716SS**THydrogen-bonded Turntrans-79.372.8177.732.4-32.5000109.6
202Q45.8Very low54.6Low182 Ų182124.2 Ų124.285%0.8570%0.698SS**THydrogen-bonded Turntrans-174.738.3159.7-111.2167.84.900113.2L200 K204L200-Q202 PolarHBondContact O-N 3.18Å; Q202-K204 PolarHBondContact O-N 3.46Å; Q202-K204 VanDerWaalsContact O-N 3.09Å
203I49.1Very low56.4Low149 Ų149124.3 Ų124.376%0.76469%0.688SS**  trans-88.666.1170.6-53.5170000109.2L200L200-I203 HydrophobicContact CB-CD1 4.5Å
204K48.3Very low58.7Low174 Ų174122 Ų12276%0.75768%0.675SS**  trans-145.258.3150.5-80.7-160.2177.8-168.20107.7Q202 E206Q202-K204 PolarHBondContact O-N 3.46Å; Q202-K204 VanDerWaalsContact O-N 3.09Å; K204-E206 PolarHBondContact O-N 3.18Å
205R52.6Low60.1Low237 Ų237119.3 Ų119.389%0.89466%0.66SS**  trans-70.383.6139.1-97.3-175.1-94.7168.1-6.8104.4I207R205-I207 PolarHBondContact O-N 3.48Å
206E50.4Low62Low139 Ų139119.7 Ų119.765%0.6565%0.653SS**  trans-48.1114.6157-70.3-177.2174.700103.8K204 T208K204-E206 PolarHBondContact O-N 3.18Å; E206-T208 PolarHBondContact O-N 2.94Å
207I55.7Low64.4Low109 Ų109120 Ų12056%0.55964%0.641SS**  trans-50.5108.7164.4-86.983.4000102.6R205 D209 D211 A212R205-I207 PolarHBondContact O-N 3.48Å; I207-D209 PolarHBondContact O-N 3.42Å; I207-D211 HydrophobicContact CG2-CB 3.95Å; I207-A212 HydrophobicContact CG2-CB 3.57Å; I207-A212 VanDerWaalsContact CG2-N 3.28Å
208T65.9Low66.4Low81 Ų81120 Ų12050%0.49763%0.629SS.*  trans-55.6142.9-178.1-43.30000105.7E206 A210 D211 A212E206-T208 PolarHBondContact O-N 2.94Å; T208-A210 HydrophobicContact CG2-CB 4.11Å; T208-A210 CarbonylContact O-C 3.5Å; T208-A210 PolarHBondContact O-N 3.36Å; T208-D211 VanDerWaalsContact CB-OD2 3.31Å; T208-D211 WeakPolarHBondContact CB-OD2 3.33Å; T208-D211 PolarHBondContact N-OD2 2.92Å; T208-D211 WeakPolarHBondContact O-CA 3.37Å; T208-D211 WeakPolarHBondContact O-CB 3.44Å; T208-D211 PolarHBondContact O-N 3.27Å; T208-D211 PolarHBondContact OG1-OD2 2.91Å; T208-A212 PolarHBondContact O-N 3.48Å
209D67.9Low68.5Low122 Ų122123 Ų12365%0.65262%0.618SS**Hα-helixtrans-50.6-26.7175.9-85.4-15.8000112I207 K213I207-D209 PolarHBondContact O-N 3.42Å; D209-K213 VanDerWaalsContact O-CB 3.28Å; D209-K213 WeakPolarHBondContact O-CB 3.28Å; D209-K213 WeakPolarHBondContact O-CD 3.09Å; D209-K213 WeakPolarHBondContact O-CG 3.38Å; D209-K213 PolarHBondContact O-N 2.77Å
210A72.5Confident70.7Confident63 Ų63122.9 Ų122.952%0.52161%0.614SS.*Hα-helixtrans-64.3-46.6169.800000113.6T208 K213 A214T208-A210 HydrophobicContact CG2-CB 4.11Å; T208-A210 CarbonylContact O-C 3.5Å; T208-A210 PolarHBondContact O-N 3.36Å; A210-K213 PolarHBondContact O-N 2.88Å; A210-A214 VanDerWaalsContact O-CB 3.31Å; A210-A214 WeakPolarHBondContact O-CB 3.44Å; A210-A214 PolarHBondContact O-N 3.35Å
211D79.3Confident73Confident82 Ų82123.8 Ų123.844%0.43961%0.612SS.*Hα-helixtrans-68.7-38.4177.6-59.6-36.5000111.2I207 T208 A214 L215I207-D211 HydrophobicContact CG2-CB 3.95Å; T208-D211 VanDerWaalsContact CB-OD2 3.31Å; T208-D211 WeakPolarHBondContact CB-OD2 3.33Å; T208-D211 PolarHBondContact N-OD2 2.92Å; T208-D211 WeakPolarHBondContact O-CA 3.37Å; T208-D211 WeakPolarHBondContact O-CB 3.44Å; T208-D211 PolarHBondContact O-N 3.27Å; T208-D211 PolarHBondContact OG1-OD2 2.91Å; D211-A214 PolarHBondContact O-N 3.3Å; D211-L215 WeakPolarHBondContact O-CB 3.39Å; D211-L215 VanDerWaalsContact O-CG 3.29Å; D211-L215 WeakPolarHBondContact O-CG 3.5Å; D211-L215 PolarHBondContact O-N 3.07Å
212A79.7Confident75.1Confident41 Ų41125.1 Ų125.134%0.33961%0.606SS.*Hα-helixtrans-62.9-44.8172.800000111.6I207 T208 A214 L215 L216I207-A212 HydrophobicContact CG2-CB 3.57Å; I207-A212 VanDerWaalsContact CG2-N 3.28Å; T208-A212 PolarHBondContact O-N 3.48Å; A212-A214 VanDerWaalsContact C-N 3.32Å; A212-L215 PolarHBondContact O-N 3.31Å; A212-L216 WeakPolarHBondContact O-CB 3.21Å; A212-L216 PolarHBondContact O-N 2.93Å
213K85.7Confident77.6Confident130 Ų130120.1 Ų120.157%0.56559%0.585SS**Hα-helixtrans-66.2-34.8175.7-74169-171174.10111.6D209 A210 K217D209-K213 VanDerWaalsContact O-CB 3.28Å; D209-K213 WeakPolarHBondContact O-CB 3.28Å; D209-K213 WeakPolarHBondContact O-CD 3.09Å; D209-K213 WeakPolarHBondContact O-CG 3.38Å; D209-K213 PolarHBondContact O-N 2.77Å; A210-K213 PolarHBondContact O-N 2.88Å; K213-K217 WeakPolarHBondContact O-CB 3.47Å; K213-K217 VanDerWaalsContact O-CG 3.31Å; K213-K217 WeakPolarHBondContact O-CG 3.5Å; K213-K217 PolarHBondContact O-N 2.93Å
214A83.6Confident79.9Confident53 Ų53117.3 Ų117.344%0.43857%0.572SS.*Hα-helixtrans-66.4-48.6175.500000111.4A210 D211 A212 L216 K217 E218A210-A214 VanDerWaalsContact O-CB 3.31Å; A210-A214 WeakPolarHBondContact O-CB 3.44Å; A210-A214 PolarHBondContact O-N 3.35Å; D211-A214 PolarHBondContact O-N 3.3Å; A212-A214 VanDerWaalsContact C-N 3.32Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 3.17Å; A214-K217 PolarHBondContact O-N 2.99Å; A214-E218 PolarHBondContact O-N 3.21Å
215L87.9Confident82.2Confident100 Ų100114.9 Ų114.952%0.52456%0.563SS.*Hα-helixtrans-62.4-36.8176.3-70.1172.1000112.3D211 A212 E218 R219D211-L215 WeakPolarHBondContact O-CB 3.39Å; D211-L215 VanDerWaalsContact O-CG 3.29Å; D211-L215 WeakPolarHBondContact O-CG 3.5Å; D211-L215 PolarHBondContact O-N 3.07Å; A212-L215 PolarHBondContact O-N 3.31Å; L215-E218 PolarHBondContact O-N 3.18Å; L215-R219 WeakPolarHBondContact O-CB 3.3Å; L215-R219 PolarHBondContact O-N 3.33Å
216L87.3Confident84.4Confident108 Ų108107 Ų10757%0.56554%0.538SS*.Hα-helixtrans-65.8-42.7174.8-174.366.9000111.8A212 A214 E218 R219 Q220A212-L216 WeakPolarHBondContact O-CB 3.21Å; A212-L216 PolarHBondContact O-N 2.93Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 3.17Å; L216-E218 VanDerWaalsContact C-N 3.35Å; L216-R219 PolarHBondContact O-N 3.39Å; L216-Q220 WeakPolarHBondContact O-CB 3.48Å; L216-Q220 PolarHBondContact O-N 3.46Å
217K91.7Very high86.7Confident134 Ų134105.3 Ų105.358%0.58353%0.534SS*.Hα-helixtrans-64.6-38.9174.3-75.3177.7179.3-1770111.5K213 A214 Q220 K221K213-K217 WeakPolarHBondContact O-CB 3.47Å; K213-K217 VanDerWaalsContact O-CG 3.31Å; K213-K217 WeakPolarHBondContact O-CG 3.5Å; K213-K217 PolarHBondContact O-N 2.93Å; A214-K217 PolarHBondContact O-N 2.99Å; K217-Q220 PolarHBondContact O-N 3.2Å; K217-K221 WeakPolarHBondContact O-CG 3.42Å; K217-K221 PolarHBondContact O-N 3.3Å
218E92Very high88.7Confident128 Ų128105 Ų10560%0.59853%0.532SS*.Hα-helixtrans-62.7-45.1175-174.8178.8-170.900111.4A214 L215 L216 Q220 K221 K222A214-E218 PolarHBondContact O-N 3.21Å; L215-E218 PolarHBondContact O-N 3.18Å; L216-E218 VanDerWaalsContact C-N 3.35Å; E218-Q220 PolarHBondContact O-N 2.99Å; E218-K221 PolarHBondContact O-N 2.85Å; E218-K222 PolarHBondContact O-N 3.39Å
219R95.7Very high90.3Very high165 Ų165103.3 Ų103.362%0.62352%0.518SS*.Hα-helixtrans-59.6-45.1173-176.1176.7178.5-113.5-2.7111.7L215 L216 K221 K222 D223L215-R219 WeakPolarHBondContact O-CB 3.3Å; L215-R219 PolarHBondContact O-N 3.33Å; L216-R219 PolarHBondContact O-N 3.39Å; R219-K221 VanDerWaalsContact C-N 3.34Å; R219-K221 PolarHBondContact O-N 2.86Å; R219-K222 WeakPolarHBondContact O-CB 3.44Å; R219-K222 PolarHBondContact O-N 3.39Å; R219-D223 PolarHBondContact O-N 3.44Å
220Q94.6Very high91.7Very high135 Ų135104.5 Ų104.563%0.63151%0.514SS*.Hα-helixtrans-62.7-40.1178.1-170.5178.321.700112.1L216 K217 E218 D223 N224L216-Q220 WeakPolarHBondContact O-CB 3.48Å; L216-Q220 PolarHBondContact O-N 3.46Å; K217-Q220 PolarHBondContact O-N 3.2Å; E218-Q220 PolarHBondContact O-N 2.99Å; Q220-D223 PolarHBondContact O-N 3.19Å; Q220-N224 VanDerWaalsContact O-CB 3.28Å; Q220-N224 WeakPolarHBondContact O-CB 3.36Å; Q220-N224 PolarHBondContact O-N 2.87Å
221K95.7Very high93Very high158 Ų158111.1 Ų111.169%0.68753%0.525SS*.Hα-helixtrans-61.9-43.6173.8-74.6176.7179.9-175.70111.3K217 E218 R219 N224 H225K217-K221 WeakPolarHBondContact O-CG 3.42Å; K217-K221 PolarHBondContact O-N 3.3Å; E218-K221 PolarHBondContact O-N 2.85Å; R219-K221 VanDerWaalsContact C-N 3.34Å; R219-K221 PolarHBondContact O-N 2.86Å; K221-N224 PolarHBondContact O-N 2.86Å; K221-H225 WeakPolarHBondContact O-CB 3.47Å; K221-H225 PolarHBondContact O-N 3.4Å
222K96.4Very high93.9Very high138 Ų138114 Ų11460%0.653%0.53SS*.Hα-helixtrans-63.5-43.2175.9-175.9177178.9175.80112E218 R219 H225 N226E218-K222 PolarHBondContact O-N 3.39Å; R219-K222 WeakPolarHBondContact O-CB 3.44Å; R219-K222 PolarHBondContact O-N 3.39Å; K222-H225 PolarHBondContact O-N 3.42Å; K222-N226 WeakPolarHBondContact O-CB 3.49Å; K222-N226 PolarHBondContact O-N 2.96Å; K222-N226 PolarHBondContact O-ND2 3.32Å
223D96.9Very high94.8Very high76 Ų76119 Ų11941%0.40654%0.54SS..Hα-helixtrans-66.1-39.2177.7-71.2-21.6000111.5R219 Q220 N226 L227R219-D223 PolarHBondContact O-N 3.44Å; Q220-D223 PolarHBondContact O-N 3.19Å; D223-N226 PolarHBondContact O-N 3.37Å; D223-L227 WeakPolarHBondContact O-CB 3.28Å; D223-L227 PolarHBondContact O-N 3.2Å
224N97.6Very high95.4Very high91 Ų91118.5 Ų118.549%0.48754%0.538SS..Hα-helixtrans-63.7-46.9173.6-172.3-91000111.6Q220 K221 N226 L227 I228Q220-N224 VanDerWaalsContact O-CB 3.28Å; Q220-N224 WeakPolarHBondContact O-CB 3.36Å; Q220-N224 PolarHBondContact O-N 2.87Å; K221-N224 PolarHBondContact O-N 2.86Å; N224-N226 VanDerWaalsContact C-N 3.33Å; N224-N226 PolarHBondContact O-N 3.39Å; N224-L227 WeakPolarHBondContact O-CB 3.31Å; N224-L227 PolarHBondContact O-N 3.32Å; N224-I228 WeakPolarHBondContact O-CG1 3.39Å; N224-I228 PolarHBondContact O-N 3.46Å; N224-I228 VanDerWaalsContact OD1-CD1 3.31Å; N224-I228 WeakPolarHBondContact OD1-CD1 3.38Å
225H98.1Very high96.1Very high123 Ų123120.2 Ų120.257%0.56954%0.54SS*.Hα-helixtrans-57.5-46.1174.317975.7000111.6K221 K222 L227 I228 E229K221-H225 WeakPolarHBondContact O-CB 3.47Å; K221-H225 PolarHBondContact O-N 3.4Å; K222-H225 PolarHBondContact O-N 3.42Å; H225-L227 VanDerWaalsContact C-N 3.31Å; H225-L227 PolarHBondContact O-N 2.9Å; H225-I228 PolarHBondContact O-N 2.89Å; H225-E229 WeakPolarHBondContact O-CB 3.45Å; H225-E229 PolarHBondContact O-N 3.39Å
226N98.3Very high96.6Very high70 Ų70118.7 Ų118.737%0.37453%0.532SS..Hα-helixtrans-61-38.6176.9-74.3-26.7000112.5K222 D223 N224 R230K222-N226 WeakPolarHBondContact O-CB 3.49Å; K222-N226 PolarHBondContact O-N 2.96Å; K222-N226 PolarHBondContact O-ND2 3.32Å; D223-N226 PolarHBondContact O-N 3.37Å; N224-N226 VanDerWaalsContact C-N 3.33Å; N224-N226 PolarHBondContact O-N 3.39Å; N226-R230 WeakPolarHBondContact O-CB 3.46Å; N226-R230 PolarHBondContact O-N 3.38Å
227L98.1Very high97.1Very high105 Ų105115.7 Ų115.755%0.5552%0.516SS..Hα-helixtrans-66.3-45.8177.3179.463.2000111.4D223 N224 H225 R230 R231D223-L227 WeakPolarHBondContact O-CB 3.28Å; D223-L227 PolarHBondContact O-N 3.2Å; N224-L227 WeakPolarHBondContact O-CB 3.31Å; N224-L227 PolarHBondContact O-N 3.32Å; H225-L227 VanDerWaalsContact C-N 3.31Å; H225-L227 PolarHBondContact O-N 2.9Å; L227-R230 PolarHBondContact O-N 2.86Å; L227-R231 PolarHBondContact O-N 3.46Å
228I98.2Very high97.5Very high103 Ų103113.2 Ų113.253%0.52851%0.509SS..Hα-helixtrans-61.3-48.4177.8-68.1171000110.1N224 H225 R230 R231 R232N224-I228 WeakPolarHBondContact O-CG1 3.39Å; N224-I228 PolarHBondContact O-N 3.46Å; N224-I228 VanDerWaalsContact OD1-CD1 3.31Å; N224-I228 WeakPolarHBondContact OD1-CD1 3.38Å; H225-I228 PolarHBondContact O-N 2.89Å; I228-R230 VanDerWaalsContact C-N 3.32Å; I228-R230 PolarHBondContact O-N 3.47Å; I228-R231 WeakPolarHBondContact O-CB 3.33Å; I228-R231 PolarHBondContact O-N 2.96Å; I228-R232 PolarHBondContact O-N 2.83Å
229E98.4Very high97.8Very high44 Ų44113.6 Ų113.621%0.20651%0.505CS..Hα-helixtrans-65-37.9179.7175.155.6-167.600111.5H225 R231 R232 R233H225-E229 WeakPolarHBondContact O-CB 3.45Å; H225-E229 PolarHBondContact O-N 3.39Å; E229-R231 PolarHBondContact O-N 3.4Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-NH1 3.07Å; E229-R232 PolarHBondContact OE1-NH1 3.28Å; E229-R232 IonicContact OE2-CZ 2.71Å; E229-R232 IonicContact OE2-NH1 3.56Å; E229-R232 PolarHBondContact OE2-NH1 3.02Å; E229-R232 VanDerWaalsContact OE2-NH1 3.07Å; E229-R233 WeakPolarHBondContact O-CB 3.31Å; E229-R233 VanDerWaalsContact O-CG 3.3Å; E229-R233 WeakPolarHBondContact O-CG 3.48Å; E229-R233 PolarHBondContact O-N 3.39Å; E229-R233 WeakPolarHBondContact OE1-CG 3.29Å; E229-R233 IonicContact OE1-CZ 3.14Å; E229-R233 IonicContact OE1-NE 3.73Å; E229-R233 PolarHBondContact OE1-NE 3.19Å; E229-R233 IonicContact OE1-NH2 4Å; E229-R233 PolarHBondContact OE1-NH2 2.91Å
230R98.6Very high97.9Very high147 Ų147106.7 Ų106.756%0.55548%0.48SS*.Hα-helixtrans-61.2-45.2173.3-177.1-179.7-65.6145.6-0.2111.2N226 L227 I228 R232 R233 F234N226-R230 WeakPolarHBondContact O-CB 3.46Å; N226-R230 PolarHBondContact O-N 3.38Å; L227-R230 PolarHBondContact O-N 2.86Å; I228-R230 VanDerWaalsContact C-N 3.32Å; I228-R230 PolarHBondContact O-N 3.47Å; R230-R232 VanDerWaalsContact C-N 3.35Å; R230-R232 PolarHBondContact O-N 3.14Å; R230-R233 PolarHBondContact O-N 2.94Å; R230-F234 HydrophobicContact CG-CD2 3.68Å; R230-F234 HydrophobicContact CG-CE2 3.27Å; R230-F234 HydrophobicContact CG-CZ 4.19Å; R230-F234 WeakPolarHBondContact O-CD2 3.46Å; R230-F234 PolarHBondContact O-N 2.88Å
231R98.6Very high98Very high203 Ų203106.8 Ų106.877%0.76648%0.479SS*.Hα-helixtrans-60.7-43.3176.3-173178-178.2-178.20.5111.7L227 I228 E229 F234 N235L227-R231 PolarHBondContact O-N 3.46Å; I228-R231 WeakPolarHBondContact O-CB 3.33Å; I228-R231 PolarHBondContact O-N 2.96Å; E229-R231 PolarHBondContact O-N 3.4Å; R231-F234 PolarHBondContact O-N 3.22Å; R231-N235 PolarHBondContact O-N 3.1Å
232R98.5Very high98.1Very high141 Ų141103.5 Ų103.553%0.53247%0.466SS..Hα-helixtrans-59.5-47.6174.4176.5176166.9-83.6-5.6111.6I228 E229 R230 F234 N235 I236I228-R232 PolarHBondContact O-N 2.83Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-NH1 3.07Å; E229-R232 PolarHBondContact OE1-NH1 3.28Å; E229-R232 IonicContact OE2-CZ 2.71Å; E229-R232 IonicContact OE2-NH1 3.56Å; E229-R232 PolarHBondContact OE2-NH1 3.02Å; E229-R232 VanDerWaalsContact OE2-NH1 3.07Å; R230-R232 VanDerWaalsContact C-N 3.35Å; R230-R232 PolarHBondContact O-N 3.14Å; R232-F234 PolarHBondContact O-N 2.68Å; R232-N235 PolarHBondContact O-N 2.86Å; R232-I236 HydrophobicContact CG-CD1 4.08Å; R232-I236 WeakPolarHBondContact O-CG1 3.39Å; R232-I236 PolarHBondContact O-N 2.95Å
233R98.6Very high98.1Very high148 Ų14899.8 Ų99.856%0.55845%0.452SS*.Hα-helixtrans-60.4-42.3177.3-72.6176.5-173.9-170.64.1112.5E229 R230 I236 N237E229-R233 WeakPolarHBondContact O-CB 3.31Å; E229-R233 VanDerWaalsContact O-CG 3.3Å; E229-R233 WeakPolarHBondContact O-CG 3.48Å; E229-R233 PolarHBondContact O-N 3.39Å; E229-R233 WeakPolarHBondContact OE1-CG 3.29Å; E229-R233 IonicContact OE1-CZ 3.14Å; E229-R233 IonicContact OE1-NE 3.73Å; E229-R233 PolarHBondContact OE1-NE 3.19Å; E229-R233 IonicContact OE1-NH2 4Å; E229-R233 PolarHBondContact OE1-NH2 2.91Å; R230-R233 PolarHBondContact O-N 2.94Å; R233-I236 PolarHBondContact O-N 3.33Å; R233-N237 WeakPolarHBondContact O-CB 3.43Å; R233-N237 PolarHBondContact O-N 3.48Å; R233-N237 PolarHBondContact O-ND2 3.49Å; R233-N237 PolarHBondContact O-OD1 3.03Å
234F98.6Very high98Very high118 Ų11896.6 Ų96.652%0.51844%0.437SS..Hα-helixtrans-61.3-47.6174.9-77.6-59.3000111.6R230 R231 R232 I236 N237 D238R230-F234 HydrophobicContact CG-CD2 3.68Å; R230-F234 HydrophobicContact CG-CE2 3.27Å; R230-F234 HydrophobicContact CG-CZ 4.19Å; R230-F234 WeakPolarHBondContact O-CD2 3.46Å; R230-F234 PolarHBondContact O-N 2.88Å; R231-F234 PolarHBondContact O-N 3.22Å; R232-F234 PolarHBondContact O-N 2.68Å; F234-I236 VanDerWaalsContact C-N 3.34Å; F234-I236 PolarHBondContact O-N 3.21Å; F234-N237 PolarHBondContact O-N 2.96Å; F234-N237 VanDerWaalsContact O-N 3.12Å; F234-D238 PolarHBondContact O-N 2.87Å
235N98.4Very high97.9Very high89 Ų8997 Ų9748%0.47644%0.443SS..Hα-helixtrans-58.4-45.4179-170.2-100.3000112.3R231 R232 N237 D238 R239R231-N235 PolarHBondContact O-N 3.1Å; R232-N235 PolarHBondContact O-N 2.86Å; N235-N237 PolarHBondContact O-N 3.01Å; N235-D238 PolarHBondContact O-N 3.4Å; N235-R239 WeakPolarHBondContact O-CG 3.4Å; N235-R239 PolarHBondContact O-N 2.79Å
236I98.5Very high97.8Very high69 Ų6996.5 Ų96.535%0.35444%0.444SS..Hα-helixtrans-60.5-46.2175.7-67.1168000111R232 R233 F234 D238 R239 I240R232-I236 HydrophobicContact CG-CD1 4.08Å; R232-I236 WeakPolarHBondContact O-CG1 3.39Å; R232-I236 PolarHBondContact O-N 2.95Å; R233-I236 PolarHBondContact O-N 3.33Å; F234-I236 VanDerWaalsContact C-N 3.34Å; F234-I236 PolarHBondContact O-N 3.21Å; I236-D238 VanDerWaalsContact C-N 3.28Å; I236-D238 PolarHBondContact O-N 2.96Å; I236-R239 PolarHBondContact O-N 3.27Å; I236-I240 HydrophobicContact CG2-CD1 3.96Å; I236-I240 WeakPolarHBondContact O-CG1 3.46Å; I236-I240 PolarHBondContact O-N 2.82Å
237N98.5Very high97.6Very high44 Ų4493.8 Ų93.824%0.23543%0.429CS..Hα-helixtrans-62.2-38.1180-68-20000112R233 F234 N235 I240 K241 K262R233-N237 WeakPolarHBondContact O-CB 3.43Å; R233-N237 PolarHBondContact O-N 3.48Å; R233-N237 PolarHBondContact O-ND2 3.49Å; R233-N237 PolarHBondContact O-OD1 3.03Å; F234-N237 PolarHBondContact O-N 2.96Å; F234-N237 VanDerWaalsContact O-N 3.12Å; N235-N237 PolarHBondContact O-N 3.01Å; N237-I240 PolarHBondContact O-N 2.98Å; N237-K241 WeakPolarHBondContact O-CG 3.25Å; N237-K241 PolarHBondContact O-N 2.88Å; N237-K262 VanDerWaalsContact OD1-CE 3.28Å; N237-K262 WeakPolarHBondContact OD1-CE 3.31Å; N237-K262 PolarHBondContact OD1-NZ 3.36Å
238D98.4Very high97.2Very high83 Ų8392 Ų9244%0.44442%0.424SS..Hα-helixtrans-68.8-41.5178.8-70.7-11.8000111.4F234 N235 I236 I240 K241 E242F234-D238 PolarHBondContact O-N 2.87Å; N235-D238 PolarHBondContact O-N 3.4Å; I236-D238 VanDerWaalsContact C-N 3.28Å; I236-D238 PolarHBondContact O-N 2.96Å; D238-I240 VanDerWaalsContact C-N 3.32Å; D238-I240 PolarHBondContact O-N 3.4Å; D238-K241 PolarHBondContact O-N 3.11Å; D238-K241 VanDerWaalsContact O-N 3.16Å; D238-E242 WeakPolarHBondContact O-CB 3.38Å; D238-E242 PolarHBondContact O-N 3.38Å
239R98.6Very high96.3Very high136 Ų13693.6 Ų93.651%0.51343%0.427SS..Hα-helixtrans-61.7-39.7173.7-64.2-59.8168.2-169.3-1112.4N235 I236 E242 L243N235-R239 WeakPolarHBondContact O-CG 3.4Å; N235-R239 PolarHBondContact O-N 2.79Å; I236-R239 PolarHBondContact O-N 3.27Å; R239-E242 WeakPolarHBondContact CD-OE2 3.32Å; R239-E242 IonicContact CZ-OE2 3.51Å; R239-E242 IonicContact NE-OE2 2.77Å; R239-E242 IonicContact NH1-OE1 3.3Å; R239-E242 IonicContact NH1-OE2 3.35Å; R239-E242 PolarHBondContact NH1-OE2 2.79Å; R239-E242 PolarHBondContact O-N 3.45Å; R239-L243 WeakPolarHBondContact O-CG 3.46Å; R239-L243 PolarHBondContact O-N 3.03Å
240I98Very high94.6Very high19 Ų1996.7 Ų96.710%0.09745%0.454CS..Hα-helixtrans-65.1-41.6174.7-65.6169.5000110.7I236 N237 D238 L243 G244 K262 I265 L266I236-I240 HydrophobicContact CG2-CD1 3.96Å; I236-I240 WeakPolarHBondContact O-CG1 3.46Å; I236-I240 PolarHBondContact O-N 2.82Å; N237-I240 PolarHBondContact O-N 2.98Å; D238-I240 VanDerWaalsContact C-N 3.32Å; D238-I240 PolarHBondContact O-N 3.4Å; I240-L243 PolarHBondContact O-N 3.38Å; I240-G244 PolarHBondContact O-N 2.96Å; I240-G244 VanDerWaalsContact O-N 3.1Å; I240-K262 HydrophobicContact CD1-CB 4.34Å; I240-K262 HydrophobicContact CD1-CD 4.16Å; I240-K262 HydrophobicContact CD1-CG 4.33Å; I240-K262 HydrophobicContact CG2-CB 4.19Å; I240-K262 HydrophobicContact CG2-CG 4.16Å; I240-I265 HydrophobicContact CG2-CB 4.2Å; I240-I265 HydrophobicContact CG2-CD1 4.06Å; I240-I265 HydrophobicContact CG2-CG2 4.08Å; I240-I265 WeakPolarHBondContact O-CG2 3.46Å; I240-L266 HydrophobicContact CD1-CD1 4.41Å; I240-L266 HydrophobicContact CG1-CD2 4.25Å
241K96.6Very high92.6Very high138 Ų13895 Ų9560%0.647%0.465SS*.Hα-helixtrans-63.5-41.7175.8-73.3173.4-177.5174.80112.2N237 D238 G244 T245N237-K241 WeakPolarHBondContact O-CG 3.25Å; N237-K241 PolarHBondContact O-N 2.88Å; D238-K241 PolarHBondContact O-N 3.11Å; D238-K241 VanDerWaalsContact O-N 3.16Å; K241-G244 WeakPolarHBondContact O-CA 3.49Å; K241-G244 PolarHBondContact O-N 2.96Å; K241-G244 VanDerWaalsContact O-N 3.11Å; K241-T245 PolarHBondContact O-N 3.42Å
242E97.6Very high90.7Very high89 Ų8990 Ų9042%0.41645%0.453SS..Hα-helixtrans-59.1-47.7175.7-177.1-178.8-168.600111D238 R239 G244 T245 L246D238-E242 WeakPolarHBondContact O-CB 3.38Å; D238-E242 PolarHBondContact O-N 3.38Å; R239-E242 WeakPolarHBondContact CD-OE2 3.32Å; R239-E242 IonicContact CZ-OE2 3.51Å; R239-E242 IonicContact NE-OE2 2.77Å; R239-E242 IonicContact NH1-OE1 3.3Å; R239-E242 IonicContact NH1-OE2 3.35Å; R239-E242 PolarHBondContact NH1-OE2 2.79Å; R239-E242 PolarHBondContact O-N 3.45Å; E242-G244 PolarHBondContact O-N 2.73Å; E242-T245 WeakPolarHBondContact O-CB 3.49Å; E242-T245 PolarHBondContact O-N 3.28Å; E242-T245 PolarHBondContact O-OG1 3.39Å; E242-L246 PolarHBondContact O-N 3Å
243L97.7Very high88.8Confident60 Ų6087.7 Ų87.731%0.31446%0.456SS..Hα-helixtrans-53.7-43.4172.5-71174.7000111.6R239 I240 T245 L246 I247 I265 L266R239-L243 WeakPolarHBondContact O-CG 3.46Å; R239-L243 PolarHBondContact O-N 3.03Å; I240-L243 PolarHBondContact O-N 3.38Å; L243-T245 PolarHBondContact O-N 3.19Å; L243-T245 VanDerWaalsContact O-N 3.1Å; L243-L246 PolarHBondContact O-N 3.2Å; L243-I247 WeakPolarHBondContact O-CD1 3.19Å; L243-I247 VanDerWaalsContact O-CG1 3.27Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.69Å; L243-I265 HydrophobicContact CB-CG2 3.94Å; L243-L266 HydrophobicContact CD1-CD2 4.11Å
244G94.5Very high86.8Confident8 Ų887.2 Ų87.28%0.08247%0.472CS..Hα-helixtrans-60.9-17.7176.400000115.1I240 K241 E242 K249I240-G244 PolarHBondContact O-N 2.96Å; I240-G244 VanDerWaalsContact O-N 3.1Å; K241-G244 WeakPolarHBondContact O-CA 3.49Å; K241-G244 PolarHBondContact O-N 2.96Å; K241-G244 VanDerWaalsContact O-N 3.11Å; E242-G244 PolarHBondContact O-N 2.73Å; G244-K249 VanDerWaalsContact O-CE 3.28Å; G244-K249 WeakPolarHBondContact O-CE 3.49Å
245T94.6Very high84.7Confident100 Ų10089.2 Ų89.261%0.61349%0.488SS*.Hα-helixtrans-87.9-25.5173.569.80000113.4K241 E242 L243K241-T245 PolarHBondContact O-N 3.42Å; E242-T245 WeakPolarHBondContact O-CB 3.49Å; E242-T245 PolarHBondContact O-N 3.28Å; E242-T245 PolarHBondContact O-OG1 3.39Å; L243-T245 PolarHBondContact O-N 3.19Å; L243-T245 VanDerWaalsContact O-N 3.1Å
246L95.9Very high82.8Confident112 Ų11293.3 Ų93.359%0.58650%0.497SS*.Hα-helixtrans-86.3-21.2-178.3-61.6176.2000113.1E242 L243E242-L246 PolarHBondContact O-N 3Å; L243-L246 PolarHBondContact O-N 3.2Å
247I93.8Very high80.8Confident13 Ų1398.3 Ų98.37%0.06752%0.519CS..SBendtrans-78.3130.5-179.1-60.4157.7000109.7L243 K249 W260 I265 A268 S269L243-I247 WeakPolarHBondContact O-CD1 3.19Å; L243-I247 VanDerWaalsContact O-CG1 3.27Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.69Å; I247-K249 PolarHBondContact O-N 3.09Å; I247-W260 HydrophobicContact CD1-CZ3 4.29Å; I247-W260 HydrophobicContact CG2-CH2 3.96Å; I247-W260 HydrophobicContact CG2-CZ3 4.27Å; I247-I265 HydrophobicContact CD1-CG2 3.87Å; I247-I265 VanDerWaalsContact CD1-O 3.27Å; I247-I265 WeakPolarHBondContact CD1-O 3.1Å; I247-A268 HydrophobicContact CD1-CB 4.09Å; I247-A268 HydrophobicContact CG2-CB 3.85Å; I247-S269 WeakPolarHBondContact CD1-OG 3.28Å
248P91.2Very high79.4Confident68 Ų6899.8 Ų99.844%0.44253%0.525SS..  trans-58.1127.6173.6-23.633.5000111.7Y272P248-Y272 HydrophobicContact CG-CD2 4Å; P248-Y272 HydrophobicContact CG-CE1 4.32Å; P248-Y272 HydrophobicContact CG-CE2 3.56Å
249K78.6Confident78.4Confident137 Ų137104.6 Ų104.660%0.59654%0.537SS*.  trans-96-7.1-175-60.1-175.8-179.4177.90114.2G244 I247 W260G244-K249 VanDerWaalsContact O-CE 3.28Å; G244-K249 WeakPolarHBondContact O-CE 3.49Å; I247-K249 PolarHBondContact O-N 3.09Å; K249-W260 HydrophobicContact CB-CZ2 4.41Å; K249-W260 HydrophobicContact CG-CZ2 4Å
250S62.8Low77.8Confident109 Ų109102.8 Ų102.876%0.76253%0.53SS*.  trans-118.289.3-166.7560000111.4
251S56.3Low77.6Confident112 Ų112106 Ų10678%0.78355%0.548SS*.SBendtrans-161.118.6150.276.40000113.8
252D58.3Low77.5Confident97 Ų97104.9 Ų104.952%0.51954%0.543SS..SBendtrans-119.5141.1170.9-81.2-30.3000108.7M258D252-M258 WeakPolarHBondContact OD2-CE 3.33Å
253P58.4Low77.4Confident92 Ų92103 Ų10360%0.59755%0.548SS*.  trans-52.1150.8-179.9-23.631.2000112.2D255 R256P253-D255 PolarHBondContact O-N 2.96Å; P253-R256 PolarHBondContact O-N 3.47Å
254P57.3Low77.2Confident139 Ų139102.8 Ų102.890%0.90355%0.549SS*.THydrogen-bonded Turntrans-60.8-0.4-176.125.8-35.5000115.2
255D55.2Low77.3Confident159 Ų159103.1 Ų103.185%0.8555%0.549SS*.THydrogen-bonded Turntrans-97.5-10-175.5-142.519000113.6P253 E257P253-D255 PolarHBondContact O-N 2.96Å; D255-E257 PolarHBondContact O-N 3.34Å
256R57.5Low77.4Confident176 Ų176102 Ų10266%0.66454%0.539SS*.SBendtrans-95.590.1163.6-165174.6-117.7-120.82.9106.6P253 M258P253-R256 PolarHBondContact O-N 3.47Å; R256-M258 HydrophobicContact CG-SD 4.16Å; R256-M258 PolarHBondContact O-N 3.49Å
257E57.3Low77.4Confident173 Ų173103.2 Ų103.281%0.80854%0.539SS*.  trans-58.785.6168.9-166.2176.1-149.700107.7D255 R259D255-E257 PolarHBondContact O-N 3.34Å; E257-R259 VanDerWaalsContact C-N 3.29Å; E257-R259 PolarHBondContact O-N 2.95Å
258M68.6Low77.4Confident75 Ų75103.9 Ų103.937%0.36955%0.547SS..  trans-73.392-169.9-160.973.9115.800106.2D252 R256 W260D252-M258 WeakPolarHBondContact OD2-CE 3.33Å; R256-M258 HydrophobicContact CG-SD 4.16Å; R256-M258 PolarHBondContact O-N 3.49Å; M258-W260 PolarHBondContact O-N 3.44Å; M258-W260 PolarHBondContact O-NE1 3.22Å
259R77.8Confident77.7Confident184 Ų184101.1 Ų101.169%0.69453%0.529SS*.  trans-65.2108.8179.6-64.7-179.273.4-168.15108.1E257 N261 T264E257-R259 VanDerWaalsContact C-N 3.29Å; E257-R259 PolarHBondContact O-N 2.95Å; R259-N261 VanDerWaalsContact C-N 3.35Å; R259-N261 VanDerWaalsContact C-OD1 3.25Å; R259-N261 WeakPolarHBondContact CB-OD1 3.12Å; R259-N261 PolarHBondContact O-N 3.37Å; R259-N261 PolarHBondContact O-OD1 3.35Å; R259-T264 PolarHBondContact O-OG1 3.41Å
260W86Confident78.6Confident99 Ų9997.8 Ų97.838%0.37552%0.52SS..  trans-76.789.7178.8-69.397.5000109.4I247 K249 M258 I265 A268I247-W260 HydrophobicContact CD1-CZ3 4.29Å; I247-W260 HydrophobicContact CG2-CH2 3.96Å; I247-W260 HydrophobicContact CG2-CZ3 4.27Å; K249-W260 HydrophobicContact CB-CZ2 4.41Å; K249-W260 HydrophobicContact CG-CZ2 4Å; M258-W260 PolarHBondContact O-N 3.44Å; M258-W260 PolarHBondContact O-NE1 3.22Å; W260-I265 HydrophobicContact CB-CD1 4.32Å; W260-I265 HydrophobicContact CB-CG1 4.19Å; W260-I265 HydrophobicContact CD2-CG1 4.48Å; W260-I265 HydrophobicContact CE3-CG1 3.64Å; W260-I265 HydrophobicContact CZ3-CG1 4.44Å; W260-A268 HydrophobicContact CH2-CB 4.48Å; W260-A268 HydrophobicContact CZ3-CB 4.08Å
261N93.9Very high80.2Confident86 Ų8695.6 Ų95.646%0.4650%0.5SS..  trans-96.9162177.1-51.5-1000107.7R259 G263 T264 I265R259-N261 VanDerWaalsContact C-N 3.35Å; R259-N261 VanDerWaalsContact C-OD1 3.25Å; R259-N261 WeakPolarHBondContact CB-OD1 3.12Å; R259-N261 PolarHBondContact O-N 3.37Å; R259-N261 PolarHBondContact O-OD1 3.35Å; N261-G263 PolarHBondContact O-N 3.49Å; N261-G263 VanDerWaalsContact O-N 3.14Å; N261-T264 PolarHBondContact N-OG1 2.93Å; N261-T264 PolarHBondContact O-N 2.92Å; N261-T264 VanDerWaalsContact O-N 3.1Å; N261-T264 PolarHBondContact O-OG1 2.9Å; N261-I265 WeakPolarHBondContact O-CG1 3.31Å; N261-I265 PolarHBondContact O-N 2.9Å
262K94.8Very high82.2Confident114 Ų11493.6 Ų93.650%0.49648%0.475SS..Hα-helixtrans-52.1-41.9176-62.1-174.7-170.91780112.2N237 I240 L266N237-K262 VanDerWaalsContact OD1-CE 3.28Å; N237-K262 WeakPolarHBondContact OD1-CE 3.31Å; N237-K262 PolarHBondContact OD1-NZ 3.36Å; I240-K262 HydrophobicContact CD1-CB 4.34Å; I240-K262 HydrophobicContact CD1-CD 4.16Å; I240-K262 HydrophobicContact CD1-CG 4.33Å; I240-K262 HydrophobicContact CG2-CB 4.19Å; I240-K262 HydrophobicContact CG2-CG 4.16Å; K262-L266 WeakPolarHBondContact O-CB 3.45Å; K262-L266 WeakPolarHBondContact O-CG 3.4Å; K262-L266 PolarHBondContact O-N 2.98Å; K262-L266 VanDerWaalsContact O-N 3.07Å
263G95.8Very high84.1Confident51 Ų5193.2 Ų93.253%0.52647%0.473SS..Hα-helixtrans-66.1-44177.900000114N261 L266 K267N261-G263 PolarHBondContact O-N 3.49Å; N261-G263 VanDerWaalsContact O-N 3.14Å; G263-L266 PolarHBondContact O-N 3.04Å; G263-K267 WeakPolarHBondContact O-CB 3.36Å; G263-K267 PolarHBondContact O-N 2.86Å
264T93.6Very high86Confident55 Ų5595.7 Ų95.734%0.33747%0.47SS..Hα-helixtrans-72-36.6-178.953.20000111.7R259 N261 K267 A268R259-T264 PolarHBondContact O-OG1 3.41Å; N261-T264 PolarHBondContact N-OG1 2.93Å; N261-T264 PolarHBondContact O-N 2.92Å; N261-T264 VanDerWaalsContact O-N 3.1Å; N261-T264 PolarHBondContact O-OG1 2.9Å; T264-K267 PolarHBondContact O-N 2.98Å; T264-A268 VanDerWaalsContact O-CB 3.29Å; T264-A268 WeakPolarHBondContact O-CB 3.23Å; T264-A268 PolarHBondContact O-N 3.2Å
265I94.9Very high87.8Confident14 Ų1495.2 Ų95.27%0.07245%0.454CS..Hα-helixtrans-60.6-48.5171.9-65.4166.2000110.7I240 L243 I247 W260 N261 A268 S269I240-I265 HydrophobicContact CG2-CB 4.2Å; I240-I265 HydrophobicContact CG2-CD1 4.06Å; I240-I265 HydrophobicContact CG2-CG2 4.08Å; I240-I265 WeakPolarHBondContact O-CG2 3.46Å; L243-I265 HydrophobicContact CB-CG2 3.94Å; I247-I265 HydrophobicContact CD1-CG2 3.87Å; I247-I265 VanDerWaalsContact CD1-O 3.27Å; I247-I265 WeakPolarHBondContact CD1-O 3.1Å; W260-I265 HydrophobicContact CB-CD1 4.32Å; W260-I265 HydrophobicContact CB-CG1 4.19Å; W260-I265 HydrophobicContact CD2-CG1 4.48Å; W260-I265 HydrophobicContact CE3-CG1 3.64Å; W260-I265 HydrophobicContact CZ3-CG1 4.44Å; N261-I265 WeakPolarHBondContact O-CG1 3.31Å; N261-I265 PolarHBondContact O-N 2.9Å; I265-A268 PolarHBondContact O-N 3.35Å; I265-S269 WeakPolarHBondContact O-CB 3.46Å; I265-S269 PolarHBondContact O-N 3.15Å; I265-S269 PolarHBondContact O-OG 3.46Å
266L97.6Very high89.9Confident77 Ų7791.2 Ų91.240%0.40343%0.432SS..Hα-helixtrans-63.8-44.1-179.9-71.5172.7000111.6I240 L243 K262 G263 S269 V270I240-L266 HydrophobicContact CD1-CD1 4.41Å; I240-L266 HydrophobicContact CG1-CD2 4.25Å; L243-L266 HydrophobicContact CD1-CD2 4.11Å; K262-L266 WeakPolarHBondContact O-CB 3.45Å; K262-L266 WeakPolarHBondContact O-CG 3.4Å; K262-L266 PolarHBondContact O-N 2.98Å; K262-L266 VanDerWaalsContact O-N 3.07Å; G263-L266 PolarHBondContact O-N 3.04Å; L266-S269 WeakPolarHBondContact O-CB 3.38Å; L266-S269 PolarHBondContact O-N 3.49Å; L266-V270 WeakPolarHBondContact O-CG2 3.48Å; L266-V270 PolarHBondContact O-N 3.32Å
267K95.2Very high91.8Very high138 Ų13888.4 Ų88.460%0.643%0.426SS*.Hα-helixtrans-58.7-51.4176.1-179.8173.1171.255.60111.4G263 T264 S269 V270 D271G263-K267 WeakPolarHBondContact O-CB 3.36Å; G263-K267 PolarHBondContact O-N 2.86Å; T264-K267 PolarHBondContact O-N 2.98Å; K267-S269 VanDerWaalsContact C-N 3.28Å; K267-S269 PolarHBondContact O-N 3.24Å; K267-V270 PolarHBondContact O-N 3.5Å; K267-D271 IonicContact NZ-OD2 2.7Å; K267-D271 PolarHBondContact O-N 2.92Å
268A94Very high93.8Very high27 Ų2788.2 Ų88.222%0.22342%0.423CS..Hα-helixtrans-65-32.1179.400000112.4I247 W260 T264 I265 Y272I247-A268 HydrophobicContact CD1-CB 4.09Å; I247-A268 HydrophobicContact CG2-CB 3.85Å; W260-A268 HydrophobicContact CH2-CB 4.48Å; W260-A268 HydrophobicContact CZ3-CB 4.08Å; T264-A268 VanDerWaalsContact O-CB 3.29Å; T264-A268 WeakPolarHBondContact O-CB 3.23Å; T264-A268 PolarHBondContact O-N 3.2Å; I265-A268 PolarHBondContact O-N 3.35Å; A268-Y272 WeakPolarHBondContact O-CB 3.4Å; A268-Y272 PolarHBondContact O-N 3.1Å
269S97.2Very high95.2Very high10 Ų1089.9 Ų89.97%0.0743%0.43CS..Hα-helixtrans-61.8-47.7172.8-57.20000111.3I247 I265 L266 K267 Y272 I273I247-S269 WeakPolarHBondContact CD1-OG 3.28Å; I265-S269 WeakPolarHBondContact O-CB 3.46Å; I265-S269 PolarHBondContact O-N 3.15Å; I265-S269 PolarHBondContact O-OG 3.46Å; L266-S269 WeakPolarHBondContact O-CB 3.38Å; L266-S269 PolarHBondContact O-N 3.49Å; K267-S269 VanDerWaalsContact C-N 3.28Å; K267-S269 PolarHBondContact O-N 3.24Å; S269-Y272 PolarHBondContact O-N 3.28Å; S269-I273 VanDerWaalsContact O-CG1 3.28Å; S269-I273 WeakPolarHBondContact O-CG1 3.32Å; S269-I273 PolarHBondContact O-N 3.5Å
270V98.1Very high96.1Very high66 Ų6687 Ų8740%0.442%0.424SS..Hα-helixtrans-64.6-45.3179.7173.50000110.5L266 K267 Y272 I273 R274L266-V270 WeakPolarHBondContact O-CG2 3.48Å; L266-V270 PolarHBondContact O-N 3.32Å; K267-V270 PolarHBondContact O-N 3.5Å; V270-Y272 VanDerWaalsContact C-N 3.3Å; V270-Y272 PolarHBondContact O-N 2.86Å; V270-I273 PolarHBondContact O-N 3.02Å; V270-R274 WeakPolarHBondContact O-CG 3.34Å; V270-R274 PolarHBondContact O-N 2.89Å
271D96.5Very high96.7Very high64 Ų6486.9 Ų86.934%0.34243%0.427SS..Hα-helixtrans-63.8-38178.8-67.1-24.4000111.2K267 R274 K275K267-D271 IonicContact NZ-OD2 2.7Å; K267-D271 PolarHBondContact O-N 2.92Å; D271-R274 PolarHBondContact O-N 3.28Å; D271-R274 IonicContact OD1-NH1 3.68Å; D271-R274 PolarHBondContact OD1-NH1 3.37Å; D271-K275 WeakPolarHBondContact O-CB 3.39Å; D271-K275 PolarHBondContact O-N 3.11Å
272Y97.3Very high96.9Very high69 Ų6991.5 Ų91.527%0.27144%0.439SS..Hα-helixtrans-68.5-40.8176-174.1-130.1000112.9P248 A268 S269 V270 R274 K275 L276P248-Y272 HydrophobicContact CG-CD2 4Å; P248-Y272 HydrophobicContact CG-CE1 4.32Å; P248-Y272 HydrophobicContact CG-CE2 3.56Å; A268-Y272 WeakPolarHBondContact O-CB 3.4Å; A268-Y272 PolarHBondContact O-N 3.1Å; S269-Y272 PolarHBondContact O-N 3.28Å; V270-Y272 VanDerWaalsContact C-N 3.3Å; V270-Y272 PolarHBondContact O-N 2.86Å; Y272-R274 VanDerWaalsContact C-N 3.34Å; Y272-R274 PolarHBondContact O-N 3.46Å; Y272-K275 HydrophobicContact CD2-CD 4.46Å; Y272-K275 WeakPolarHBondContact O-CB 3.45Å; Y272-K275 PolarHBondContact O-N 2.99Å; Y272-L276 HydrophobicContact CD1-CD1 3.99Å; Y272-L276 HydrophobicContact CD2-CD1 4.5Å; Y272-L276 HydrophobicContact CD2-CG 4.22Å; Y272-L276 HydrophobicContact CE1-CD1 3.56Å; Y272-L276 HydrophobicContact CE1-CG 4.22Å; Y272-L276 HydrophobicContact CE2-CD1 4.1Å; Y272-L276 HydrophobicContact CE2-CD2 4Å; Y272-L276 HydrophobicContact CE2-CG 3.82Å; Y272-L276 HydrophobicContact CG-CD1 4.44Å; Y272-L276 WeakPolarHBondContact O-CG 3.25Å; Y272-L276 PolarHBondContact O-N 3.38Å
273I98.3Very high97.1Very high90 Ų9088.9 Ų88.946%0.46244%0.438SS..Hα-helixtrans-59.4-46.1173.9-70.5164.8000110.4S269 V270 K275 L276 Q277S269-I273 VanDerWaalsContact O-CG1 3.28Å; S269-I273 WeakPolarHBondContact O-CG1 3.32Å; S269-I273 PolarHBondContact O-N 3.5Å; V270-I273 PolarHBondContact O-N 3.02Å; I273-K275 VanDerWaalsContact C-N 3.32Å; I273-K275 PolarHBondContact O-N 3.25Å; I273-L276 PolarHBondContact O-N 3.3Å; I273-Q277 HydrophobicContact CG2-CG 4.44Å; I273-Q277 VanDerWaalsContact O-CG 3.31Å; I273-Q277 WeakPolarHBondContact O-CG 3.17Å; I273-Q277 PolarHBondContact O-N 3.44Å
274R98.3Very high97.2Very high144 Ų14491.7 Ų91.754%0.54344%0.436SS..Hα-helixtrans-61.3-41.7176.6-68.6-179.8-168.7133.8-4.8111.9V270 D271 Y272 Q277 K278V270-R274 WeakPolarHBondContact O-CG 3.34Å; V270-R274 PolarHBondContact O-N 2.89Å; D271-R274 PolarHBondContact O-N 3.28Å; D271-R274 IonicContact OD1-NH1 3.68Å; D271-R274 PolarHBondContact OD1-NH1 3.37Å; Y272-R274 VanDerWaalsContact C-N 3.34Å; Y272-R274 PolarHBondContact O-N 3.46Å; R274-Q277 PolarHBondContact O-N 3.28Å; R274-K278 PolarHBondContact O-N 2.69Å
275K97.1Very high97.4Very high129 Ų12993 Ų9356%0.56144%0.441SS*.Hα-helixtrans-59.4-50.1175.3-178.6-176.3173.2-177.70110.9D271 Y272 I273 Q277 K278 E279D271-K275 WeakPolarHBondContact O-CB 3.39Å; D271-K275 PolarHBondContact O-N 3.11Å; Y272-K275 HydrophobicContact CD2-CD 4.46Å; Y272-K275 WeakPolarHBondContact O-CB 3.45Å; Y272-K275 PolarHBondContact O-N 2.99Å; I273-K275 VanDerWaalsContact C-N 3.32Å; I273-K275 PolarHBondContact O-N 3.25Å; K275-Q277 VanDerWaalsContact C-N 3.33Å; K275-Q277 PolarHBondContact O-N 3.35Å; K275-K278 PolarHBondContact O-N 2.9Å; K275-E279 WeakPolarHBondContact O-CB 3.25Å; K275-E279 PolarHBondContact O-N 3.44Å
276L98.1Very high97.5Very high74 Ų7496.2 Ų96.239%0.38746%0.461SS..Hα-helixtrans-62.3-38179.1-74.6176.4000112.5Y272 I273 E279 Q280Y272-L276 HydrophobicContact CD1-CD1 3.99Å; Y272-L276 HydrophobicContact CD2-CD1 4.5Å; Y272-L276 HydrophobicContact CD2-CG 4.22Å; Y272-L276 HydrophobicContact CE1-CD1 3.56Å; Y272-L276 HydrophobicContact CE1-CG 4.22Å; Y272-L276 HydrophobicContact CE2-CD1 4.1Å; Y272-L276 HydrophobicContact CE2-CD2 4Å; Y272-L276 HydrophobicContact CE2-CG 3.82Å; Y272-L276 HydrophobicContact CG-CD1 4.44Å; Y272-L276 WeakPolarHBondContact O-CG 3.25Å; Y272-L276 PolarHBondContact O-N 3.38Å; I273-L276 PolarHBondContact O-N 3.3Å; L276-E279 PolarHBondContact O-N 2.99Å; L276-Q280 VanDerWaalsContact O-CB 3.31Å; L276-Q280 WeakPolarHBondContact O-CB 3.41Å; L276-Q280 PolarHBondContact O-N 3.44Å
277Q98.3Very high97.6Very high118 Ų11897.1 Ų97.155%0.55146%0.463SS*.Hα-helixtrans-63-44.4174.6-74.2173.3-21.800111.8I273 R274 K275 E279 Q280 Q281I273-Q277 HydrophobicContact CG2-CG 4.44Å; I273-Q277 VanDerWaalsContact O-CG 3.31Å; I273-Q277 WeakPolarHBondContact O-CG 3.17Å; I273-Q277 PolarHBondContact O-N 3.44Å; R274-Q277 PolarHBondContact O-N 3.28Å; K275-Q277 VanDerWaalsContact C-N 3.33Å; K275-Q277 PolarHBondContact O-N 3.35Å; Q277-E279 VanDerWaalsContact C-N 3.34Å; Q277-Q280 PolarHBondContact O-N 3.05Å; Q277-Q281 PolarHBondContact O-N 2.75Å
278K97.8Very high97.7Very high169 Ų16995.9 Ų95.974%0.73546%0.461SS*.Hα-helixtrans-63.9-41175.4-174176.7-178.4178.30111.6R274 K275 Q281 R282R274-K278 PolarHBondContact O-N 2.69Å; K275-K278 PolarHBondContact O-N 2.9Å; K278-Q281 PolarHBondContact O-N 3.13Å; K278-R282 WeakPolarHBondContact O-CB 3.47Å; K278-R282 PolarHBondContact O-N 3.16Å
279E97.8Very high97.9Very high110 Ų110103.1 Ų103.151%0.51448%0.482SS..Hα-helixtrans-66.9-40177.9-171.6167.1-174.400111.8K275 L276 Q277 Q281 R282 A283K275-E279 WeakPolarHBondContact O-CB 3.25Å; K275-E279 PolarHBondContact O-N 3.44Å; L276-E279 PolarHBondContact O-N 2.99Å; Q277-E279 VanDerWaalsContact C-N 3.34Å; E279-Q281 PolarHBondContact O-N 3Å; E279-R282 PolarHBondContact O-N 2.94Å; E279-A283 WeakPolarHBondContact O-CB 3.38Å; E279-A283 PolarHBondContact O-N 2.9Å
280Q98.3Very high98Very high123 Ų123107.5 Ų107.558%0.57550%0.501SS*.Hα-helixtrans-62.3-41.2173.6-173-177.156.100111.8L276 Q277 A283 K284L276-Q280 VanDerWaalsContact O-CB 3.31Å; L276-Q280 WeakPolarHBondContact O-CB 3.41Å; L276-Q280 PolarHBondContact O-N 3.44Å; Q277-Q280 PolarHBondContact O-N 3.05Å; Q280-A283 PolarHBondContact O-N 3.33Å; Q280-K284 WeakPolarHBondContact O-CG 3.13Å; Q280-K284 PolarHBondContact O-N 3.12Å
281Q97.8Very high98Very high96 Ų96109.2 Ų109.245%0.44950%0.504SS..Hα-helixtrans-65.2-45.8175.2-1755641.600111.3Q277 K278 E279 A283 K284 D285Q277-Q281 PolarHBondContact O-N 2.75Å; K278-Q281 PolarHBondContact O-N 3.13Å; E279-Q281 PolarHBondContact O-N 3Å; Q281-A283 VanDerWaalsContact C-N 3.29Å; Q281-A283 PolarHBondContact O-N 3.18Å; Q281-K284 WeakPolarHBondContact O-CB 3.19Å; Q281-K284 PolarHBondContact O-N 3.39Å; Q281-K284 VanDerWaalsContact O-N 3.15Å; Q281-D285 PolarHBondContact NE2-OD1 3.37Å; Q281-D285 PolarHBondContact O-N 3.47Å; Q281-D285 VanDerWaalsContact O-N 3.11Å
282R98.2Very high98.1Very high184 Ų184112.4 Ų112.469%0.69451%0.514SS*.Hα-helixtrans-59.5-39.7175.8-176.2179.1177.11560.8112K278 E279 K284 D285 V286K278-R282 WeakPolarHBondContact O-CB 3.47Å; K278-R282 PolarHBondContact O-N 3.16Å; E279-R282 PolarHBondContact O-N 2.94Å; R282-K284 VanDerWaalsContact C-N 3.32Å; R282-K284 PolarHBondContact O-N 2.89Å; R282-D285 PolarHBondContact O-N 3.09Å; R282-V286 HydrophobicContact CG-CG2 4.47Å; R282-V286 WeakPolarHBondContact O-CG2 3.4Å; R282-V286 PolarHBondContact O-N 3.28Å
283A98.3Very high98.2Very high58 Ų58114.2 Ų114.248%0.47953%0.528SS..Hα-helixtrans-61-41.5177.100000111.6E279 Q280 Q281 V286 E287E279-A283 WeakPolarHBondContact O-CB 3.38Å; E279-A283 PolarHBondContact O-N 2.9Å; Q280-A283 PolarHBondContact O-N 3.33Å; Q281-A283 VanDerWaalsContact C-N 3.29Å; Q281-A283 PolarHBondContact O-N 3.18Å; A283-V286 PolarHBondContact O-N 3.34Å; A283-E287 WeakPolarHBondContact O-CB 3.49Å; A283-E287 PolarHBondContact O-N 3.38Å
284K98.2Very high98.2Very high110 Ų110114.9 Ų114.948%0.47853%0.529SS..Hα-helixtrans-62.8-42.4174.7-68.9175-178.5176.10112.4Q280 Q281 R282 V286 E287 M288Q280-K284 WeakPolarHBondContact O-CG 3.13Å; Q280-K284 PolarHBondContact O-N 3.12Å; Q281-K284 WeakPolarHBondContact O-CB 3.19Å; Q281-K284 PolarHBondContact O-N 3.39Å; Q281-K284 VanDerWaalsContact O-N 3.15Å; R282-K284 VanDerWaalsContact C-N 3.32Å; R282-K284 PolarHBondContact O-N 2.89Å; K284-V286 VanDerWaalsContact C-N 3.34Å; K284-E287 PolarHBondContact O-N 3.09Å; K284-M288 PolarHBondContact O-N 3.48Å
285D97.9Very high98.2Very high83 Ų83114 Ų11444%0.44453%0.532SS..Hα-helixtrans-65.8-40179.3-60.4-24.9000111.3Q281 R282 M288 R289Q281-D285 PolarHBondContact NE2-OD1 3.37Å; Q281-D285 PolarHBondContact O-N 3.47Å; Q281-D285 VanDerWaalsContact O-N 3.11Å; R282-D285 PolarHBondContact O-N 3.09Å; D285-M288 PolarHBondContact O-N 2.94Å; D285-R289 WeakPolarHBondContact O-CB 3.37Å; D285-R289 PolarHBondContact O-N 3.26Å
286V98.4Very high98.2Very high82 Ų82110 Ų11050%0.49752%0.523SS..Hα-helixtrans-65-44174.5172.10000111R282 A283 K284 M288 R289 Q290R282-V286 HydrophobicContact CG-CG2 4.47Å; R282-V286 WeakPolarHBondContact O-CG2 3.4Å; R282-V286 PolarHBondContact O-N 3.28Å; A283-V286 PolarHBondContact O-N 3.34Å; K284-V286 VanDerWaalsContact C-N 3.34Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 3.41Å; V286-R289 PolarHBondContact O-N 3.38Å; V286-Q290 WeakPolarHBondContact O-CB 3.36Å; V286-Q290 PolarHBondContact O-N 2.98Å
287E98.4Very high98.3Very high96 Ų96111.3 Ų111.345%0.44953%0.53SS..Hα-helixtrans-61.1-43176.6-168.5-165156.900111.5A283 K284 Q290 K291A283-E287 WeakPolarHBondContact O-CB 3.49Å; A283-E287 PolarHBondContact O-N 3.38Å; K284-E287 PolarHBondContact O-N 3.09Å; E287-Q290 WeakPolarHBondContact O-CB 3.49Å; E287-Q290 PolarHBondContact O-N 2.84Å; E287-K291 WeakPolarHBondContact O-CG 3.25Å; E287-K291 PolarHBondContact O-N 3.22Å; E287-K291 WeakPolarHBondContact OE1-CE 3.49Å; E287-K291 IonicContact OE1-NZ 3.94Å; E287-K291 PolarHBondContact OE1-NZ 2.88Å
288M98.4Very high98.3Very high111 Ų111110.7 Ų110.755%0.54753%0.527SS..Hα-helixtrans-63.4-44.1175.9-173.6-169.3-6100111.6K284 D285 V286 Q290 K291 K292K284-M288 PolarHBondContact O-N 3.48Å; D285-M288 PolarHBondContact O-N 2.94Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 3.41Å; M288-Q290 VanDerWaalsContact C-N 3.31Å; M288-K291 PolarHBondContact O-N 3.38Å; M288-K292 WeakPolarHBondContact O-CG 3.31Å; M288-K292 PolarHBondContact O-N 3.06Å; M288-K292 VanDerWaalsContact O-N 3.17Å
289R98.3Very high98.3Very high180 Ų180108 Ų10868%0.67952%0.519SS*.Hα-helixtrans-63.1-40.5176.4-176176.4-177.7155.10.4111.3D285 V286 K292 L293D285-R289 WeakPolarHBondContact O-CB 3.37Å; D285-R289 PolarHBondContact O-N 3.26Å; V286-R289 PolarHBondContact O-N 3.38Å; R289-K292 PolarHBondContact O-N 3.34Å; R289-L293 HydrophobicContact CG-CD1 4.25Å; R289-L293 WeakPolarHBondContact O-CG 3.39Å; R289-L293 PolarHBondContact O-N 3.32Å
290Q98.4Very high98.3Very high101 Ų101108 Ų10847%0.47252%0.522SS..Hα-helixtrans-59.1-49.5176.4179.3179.1-4.800110.9V286 E287 M288 K292 L293 E294V286-Q290 WeakPolarHBondContact O-CB 3.36Å; V286-Q290 PolarHBondContact O-N 2.98Å; E287-Q290 WeakPolarHBondContact O-CB 3.49Å; E287-Q290 PolarHBondContact O-N 2.84Å; M288-Q290 VanDerWaalsContact C-N 3.31Å; Q290-K292 VanDerWaalsContact C-N 3.29Å; Q290-K292 PolarHBondContact O-N 3.05Å; Q290-L293 PolarHBondContact O-N 2.97Å; Q290-E294 HydrophobicContact CG-CG 4.38Å; Q290-E294 VanDerWaalsContact CG-OE1 3.31Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.42Å; Q290-E294 PolarHBondContact NE2-OE1 2.87Å; Q290-E294 WeakPolarHBondContact O-CG 3.34Å; Q290-E294 PolarHBondContact O-N 3.35Å
291K98.4Very high98.3Very high103 Ų103106.8 Ų106.845%0.44852%0.518SS..Hα-helixtrans-57.7-40.5176.7-72.1174.9-174.61660112.7E287 M288 E294 Q295E287-K291 WeakPolarHBondContact O-CG 3.25Å; E287-K291 PolarHBondContact O-N 3.22Å; E287-K291 WeakPolarHBondContact OE1-CE 3.49Å; E287-K291 IonicContact OE1-NZ 3.94Å; E287-K291 PolarHBondContact OE1-NZ 2.88Å; M288-K291 PolarHBondContact O-N 3.38Å; K291-E294 PolarHBondContact O-N 3.08Å; K291-Q295 VanDerWaalsContact O-CG 3.28Å; K291-Q295 WeakPolarHBondContact O-CG 3.45Å; K291-Q295 PolarHBondContact O-N 3.21Å
292K98.4Very high98.3Very high131 Ų131106.4 Ų106.457%0.5752%0.518SS*.Hα-helixtrans-63.7-42.4175.6-70.7177.5-179.3179.20111.9M288 R289 Q290 Q295 A296M288-K292 WeakPolarHBondContact O-CG 3.31Å; M288-K292 PolarHBondContact O-N 3.06Å; M288-K292 VanDerWaalsContact O-N 3.17Å; R289-K292 PolarHBondContact O-N 3.34Å; Q290-K292 VanDerWaalsContact C-N 3.29Å; Q290-K292 PolarHBondContact O-N 3.05Å; K292-Q295 PolarHBondContact O-N 3.13Å; K292-A296 WeakPolarHBondContact O-CB 3.46Å; K292-A296 PolarHBondContact O-N 2.8Å
293L98.5Very high98.3Very high107 Ų107103.2 Ų103.256%0.5651%0.506SS*.Hα-helixtrans-66.8-40177.1-72.2173000111.7R289 Q290 A296 N297R289-L293 HydrophobicContact CG-CD1 4.25Å; R289-L293 WeakPolarHBondContact O-CG 3.39Å; R289-L293 PolarHBondContact O-N 3.32Å; Q290-L293 PolarHBondContact O-N 2.97Å; L293-A296 PolarHBondContact O-N 2.92Å; L293-N297 WeakPolarHBondContact O-CB 3.45Å; L293-N297 PolarHBondContact O-N 3.02Å
294E98.4Very high98.2Very high104 Ų104104.8 Ų104.849%0.48651%0.506SS..Hα-helixtrans-62.9-43.4175.6-72.9169.8-179.500111.5Q290 K291 N297 H298Q290-E294 HydrophobicContact CG-CG 4.38Å; Q290-E294 VanDerWaalsContact CG-OE1 3.31Å; Q290-E294 WeakPolarHBondContact CG-OE1 3.42Å; Q290-E294 PolarHBondContact NE2-OE1 2.87Å; Q290-E294 WeakPolarHBondContact O-CG 3.34Å; Q290-E294 PolarHBondContact O-N 3.35Å; K291-E294 PolarHBondContact O-N 3.08Å; E294-N297 PolarHBondContact O-N 3.22Å; E294-H298 WeakPolarHBondContact O-CB 3.42Å; E294-H298 PolarHBondContact O-N 2.94Å
295Q98.5Very high98.2Very high126 Ų126105.5 Ų105.559%0.58951%0.511SS*.Hα-helixtrans-62.8-47.4174.4-72.6172.3-000112.1K291 K292 N297 H298 I299K291-Q295 VanDerWaalsContact O-CG 3.28Å; K291-Q295 WeakPolarHBondContact O-CG 3.45Å; K291-Q295 PolarHBondContact O-N 3.21Å; K292-Q295 PolarHBondContact O-N 3.13Å; Q295-N297 VanDerWaalsContact C-N 3.32Å; Q295-N297 PolarHBondContact O-N 2.97Å; Q295-H298 PolarHBondContact O-N 3.15Å; Q295-I299 WeakPolarHBondContact O-CG1 3.49Å; Q295-I299 PolarHBondContact O-N 3.18Å
296A98.4Very high98.1Very high45 Ų45105.4 Ų105.437%0.37251%0.507SS..Hα-helixtrans-61.8-41.9177.400000111.6K292 L293 I299 L300K292-A296 WeakPolarHBondContact O-CB 3.46Å; K292-A296 PolarHBondContact O-N 2.8Å; L293-A296 PolarHBondContact O-N 2.92Å; A296-I299 PolarHBondContact O-N 3.45Å; A296-L300 WeakPolarHBondContact O-CB 3.48Å; A296-L300 VanDerWaalsContact O-CG 3.29Å; A296-L300 WeakPolarHBondContact O-CG 3.46Å; A296-L300 PolarHBondContact O-N 2.97Å
297N98.4Very high97.9Very high100 Ų100105.1 Ų105.154%0.53550%0.503SS..Hα-helixtrans-63.1-42.9177-165.7-49000111.1L293 E294 Q295 I299 L300 M301L293-N297 WeakPolarHBondContact O-CB 3.45Å; L293-N297 PolarHBondContact O-N 3.02Å; E294-N297 PolarHBondContact O-N 3.22Å; Q295-N297 VanDerWaalsContact C-N 3.32Å; Q295-N297 PolarHBondContact O-N 2.97Å; N297-I299 PolarHBondContact O-N 3.1Å; N297-L300 PolarHBondContact O-N 3.26Å; N297-M301 WeakPolarHBondContact O-CB 3.42Å; N297-M301 PolarHBondContact O-N 3.01Å
298H98.4Very high97.7Very high106 Ų106103.9 Ų103.949%0.49150%0.497SS..Hα-helixtrans-59.8-45.5174.9-176.361.8000112.5E294 Q295 M301 L302E294-H298 WeakPolarHBondContact O-CB 3.42Å; E294-H298 PolarHBondContact O-N 2.94Å; Q295-H298 PolarHBondContact O-N 3.15Å; H298-M301 PolarHBondContact O-N 3.18Å; H298-L302 WeakPolarHBondContact O-CG 3.4Å; H298-L302 PolarHBondContact O-N 3.42Å; H298-L302 VanDerWaalsContact O-N 3.08Å
299I98.5Very high97.5Very high111 Ų111103.7 Ų103.757%0.56950%0.496SS*.Hα-helixtrans-62.6-44.8177.1-66.6165000110.9Q295 A296 N297 M301 L302 R303Q295-I299 WeakPolarHBondContact O-CG1 3.49Å; Q295-I299 PolarHBondContact O-N 3.18Å; A296-I299 PolarHBondContact O-N 3.45Å; N297-I299 PolarHBondContact O-N 3.1Å; I299-M301 VanDerWaalsContact C-N 3.32Å; I299-M301 PolarHBondContact O-N 3.01Å; I299-L302 PolarHBondContact O-N 2.98Å; I299-R303 WeakPolarHBondContact O-CB 3.46Å; I299-R303 PolarHBondContact O-N 3.04Å
300L98.5Very high97.3Very high110 Ų11098.6 Ų98.658%0.57648%0.48SS*.Hα-helixtrans-62.5-40.3177.9-72.9172000111.8A296 N297 R303 I304A296-L300 WeakPolarHBondContact O-CB 3.48Å; A296-L300 VanDerWaalsContact O-CG 3.29Å; A296-L300 WeakPolarHBondContact O-CG 3.46Å; A296-L300 PolarHBondContact O-N 2.97Å; N297-L300 PolarHBondContact O-N 3.26Å; L300-R303 PolarHBondContact O-N 3.45Å; L300-I304 VanDerWaalsContact O-CG1 3.26Å; L300-I304 WeakPolarHBondContact O-CG1 3.33Å; L300-I304 PolarHBondContact O-N 3.38Å
301M98.3Very high97Very high99 Ų9995.2 Ų95.249%0.48847%0.469SS..Hα-helixtrans-61.2-45.5176.5-170.6-171.8-51.500111.9N297 H298 I299 R303 I304 Q305N297-M301 WeakPolarHBondContact O-CB 3.42Å; N297-M301 PolarHBondContact O-N 3.01Å; H298-M301 PolarHBondContact O-N 3.18Å; I299-M301 VanDerWaalsContact C-N 3.32Å; I299-M301 PolarHBondContact O-N 3.01Å; M301-R303 VanDerWaalsContact C-N 3.35Å; M301-I304 PolarHBondContact O-N 3.47Å; M301-Q305 PolarHBondContact O-N 3.37Å
302L97.8Very high96.7Very high87 Ų8797.2 Ų97.246%0.45547%0.474SS..Hα-helixtrans-63.6-40.6175-69.4174.7000111.7H298 I299 Q305 E306H298-L302 WeakPolarHBondContact O-CG 3.4Å; H298-L302 PolarHBondContact O-N 3.42Å; H298-L302 VanDerWaalsContact O-N 3.08Å; I299-L302 PolarHBondContact O-N 2.98Å; L302-Q305 PolarHBondContact O-N 2.85Å; L302-E306 PolarHBondContact O-N 3.35Å
303R97.9Very high96.3Very high117 Ų11797.6 Ų97.644%0.44248%0.482SS..Hα-helixtrans-64.7-39.8177.3-177.256.4175.5172.72.1112.1I299 L300 M301 E306 L307I299-R303 WeakPolarHBondContact O-CB 3.46Å; I299-R303 PolarHBondContact O-N 3.04Å; L300-R303 PolarHBondContact O-N 3.45Å; M301-R303 VanDerWaalsContact C-N 3.35Å; R303-E306 WeakPolarHBondContact CD-OE2 3.4Å; R303-E306 IonicContact CZ-OE2 3.67Å; R303-E306 IonicContact NH1-OE1 2.7Å; R303-E306 PolarHBondContact NH1-OE1 3.34Å; R303-E306 VanDerWaalsContact NH1-OE1 3.14Å; R303-E306 IonicContact NH1-OE2 3.16Å; R303-E306 PolarHBondContact NH1-OE2 3.03Å; R303-E306 PolarHBondContact O-N 2.92Å; R303-L307 HydrophobicContact CG-CD1 4.12Å; R303-L307 WeakPolarHBondContact O-CB 3.41Å; R303-L307 VanDerWaalsContact O-CG 3.26Å; R303-L307 WeakPolarHBondContact O-CG 3.4Å; R303-L307 PolarHBondContact O-N 2.9Å
304I96.6Very high96Very high92 Ų92100.2 Ų100.247%0.47249%0.491SS..Hα-helixtrans-61.3-48173.8-70.1163.6000109.7L300 M301 E306 L307 E308L300-I304 VanDerWaalsContact O-CG1 3.26Å; L300-I304 WeakPolarHBondContact O-CG1 3.33Å; L300-I304 PolarHBondContact O-N 3.38Å; M301-I304 PolarHBondContact O-N 3.47Å; I304-E306 VanDerWaalsContact C-N 3.31Å; I304-E306 PolarHBondContact O-N 3.07Å; I304-L307 PolarHBondContact O-N 3.44Å; I304-E308 HydrophobicContact CG2-CG 4.28Å; I304-E308 WeakPolarHBondContact O-CB 3.29Å; I304-E308 WeakPolarHBondContact O-CG 3.48Å; I304-E308 PolarHBondContact O-N 2.84Å
305Q96.4Very high95.4Very high125 Ų12598.3 Ų98.358%0.58450%0.498SS*.Hα-helixtrans-58.4-41.8178-174.3-1798.600112.5M301 L302 M309M301-Q305 PolarHBondContact O-N 3.37Å; L302-Q305 PolarHBondContact O-N 2.85Å; Q305-M309 PolarHBondContact O-N 2.8Å
306E96Very high94.5Very high80 Ų8097.7 Ų97.737%0.37450%0.499SS..Hα-helixtrans-62.5-47.8175.9-172.3-162.6168.100111.7L302 R303 I304 M309 Q310L302-E306 PolarHBondContact O-N 3.35Å; R303-E306 WeakPolarHBondContact CD-OE2 3.4Å; R303-E306 IonicContact CZ-OE2 3.67Å; R303-E306 IonicContact NH1-OE1 2.7Å; R303-E306 PolarHBondContact NH1-OE1 3.34Å; R303-E306 VanDerWaalsContact NH1-OE1 3.14Å; R303-E306 IonicContact NH1-OE2 3.16Å; R303-E306 PolarHBondContact NH1-OE2 3.03Å; R303-E306 PolarHBondContact O-N 2.92Å; I304-E306 VanDerWaalsContact C-N 3.31Å; I304-E306 PolarHBondContact O-N 3.07Å; E306-M309 WeakPolarHBondContact O-CB 3.48Å; E306-M309 PolarHBondContact O-N 3.22Å; E306-Q310 WeakPolarHBondContact O-CG 3.31Å; E306-Q310 PolarHBondContact O-N 3.33Å; E306-Q310 PolarHBondContact OE1-NE2 2.89Å; E306-Q310 VanDerWaalsContact OE1-NE2 3.15Å
307L95.9Very high93.2Very high77 Ų77101.6 Ų101.640%0.40352%0.52SS..Hα-helixtrans-65-39.3179.2-71.1172.1000111.9R303 I304 M309 Q310 A311R303-L307 HydrophobicContact CG-CD1 4.12Å; R303-L307 WeakPolarHBondContact O-CB 3.41Å; R303-L307 VanDerWaalsContact O-CG 3.26Å; R303-L307 WeakPolarHBondContact O-CG 3.4Å; R303-L307 PolarHBondContact O-N 2.9Å; I304-L307 PolarHBondContact O-N 3.44Å; L307-M309 VanDerWaalsContact C-N 3.33Å; L307-M309 PolarHBondContact O-N 2.96Å; L307-Q310 PolarHBondContact O-N 3.4Å; L307-A311 WeakPolarHBondContact O-CB 3.31Å; L307-A311 PolarHBondContact O-N 2.9Å
308E93.8Very high91.5Very high69 Ų6998.4 Ų98.432%0.32251%0.508SS..Hα-helixtrans-61.5-41.7173.6-76.1-176.6-173.700111.8I304 A311 R312I304-E308 HydrophobicContact CG2-CG 4.28Å; I304-E308 WeakPolarHBondContact O-CB 3.29Å; I304-E308 WeakPolarHBondContact O-CG 3.48Å; I304-E308 PolarHBondContact O-N 2.84Å; E308-A311 PolarHBondContact O-N 3.11Å; E308-R312 VanDerWaalsContact O-CG 3.31Å; E308-R312 WeakPolarHBondContact O-CG 3.42Å; E308-R312 PolarHBondContact O-N 2.99Å; E308-R312 IonicContact OE2-NH2 2.87Å; E308-R312 PolarHBondContact OE2-NH2 3.48Å; E308-R312 VanDerWaalsContact OE2-NH2 3.16Å
309M93.2Very high89.7Confident107 Ų10797.4 Ų97.453%0.52752%0.518SS..Hα-helixtrans-63.7-44.4176.3-175.6-175.768.200111.3Q305 E306 L307 R312 L313Q305-M309 PolarHBondContact O-N 2.8Å; E306-M309 WeakPolarHBondContact O-CB 3.48Å; E306-M309 PolarHBondContact O-N 3.22Å; L307-M309 VanDerWaalsContact C-N 3.33Å; L307-M309 PolarHBondContact O-N 2.96Å; M309-R312 PolarHBondContact O-N 3.41Å; M309-L313 WeakPolarHBondContact O-CG 3.34Å; M309-L313 PolarHBondContact O-N 3.48Å
310Q94.6Very high87.6Confident73 Ų73101.4 Ų101.434%0.34153%0.534SS..Hα-helixtrans-60.8-45.3175.7-69.9173.411.500111.4E306 L307 R312 L313 H314E306-Q310 WeakPolarHBondContact O-CG 3.31Å; E306-Q310 PolarHBondContact O-N 3.33Å; E306-Q310 PolarHBondContact OE1-NE2 2.89Å; E306-Q310 VanDerWaalsContact OE1-NE2 3.15Å; L307-Q310 PolarHBondContact O-N 3.4Å; Q310-R312 VanDerWaalsContact C-N 3.32Å; Q310-R312 PolarHBondContact O-N 3.2Å; Q310-L313 WeakPolarHBondContact O-CB 3.36Å; Q310-L313 PolarHBondContact O-N 3.15Å; Q310-L313 VanDerWaalsContact O-N 3.14Å; Q310-H314 PolarHBondContact O-CD2 3.4Å; Q310-H314 PolarHBondContact O-N 3.27Å
311A92.8Very high85.5Confident30 Ų30104 Ų10425%0.24854%0.543CS..Hα-helixtrans-59.9-40.7177.200000112.3L307 E308 H314 G315 L316L307-A311 WeakPolarHBondContact O-CB 3.31Å; L307-A311 PolarHBondContact O-N 2.9Å; E308-A311 PolarHBondContact O-N 3.11Å; A311-H314 CarbonylContact O-C 3.53Å; A311-H314 PolarHBondContact O-N 2.73Å; A311-G315 PolarHBondContact O-N 2.79Å; A311-L316 HydrophobicContact CB-CB 4.32Å; A311-L316 PolarHBondContact O-N 3.07Å
312R90.6Very high83.1Confident145 Ų145108.3 Ų108.355%0.54756%0.562SS.*Hα-helixtrans-63-41.5174.3-71174.7-162.4154.712.2112.1E308 M309 Q310 H314 G315 A318E308-R312 VanDerWaalsContact O-CG 3.31Å; E308-R312 WeakPolarHBondContact O-CG 3.42Å; E308-R312 PolarHBondContact O-N 2.99Å; E308-R312 IonicContact OE2-NH2 2.87Å; E308-R312 PolarHBondContact OE2-NH2 3.48Å; E308-R312 VanDerWaalsContact OE2-NH2 3.16Å; M309-R312 PolarHBondContact O-N 3.41Å; Q310-R312 VanDerWaalsContact C-N 3.32Å; Q310-R312 PolarHBondContact O-N 3.2Å; R312-H314 VanDerWaalsContact C-N 3.26Å; R312-H314 PolarHBondContact O-N 3.41Å; R312-G315 PolarHBondContact O-N 2.89Å; R312-G315 VanDerWaalsContact O-N 3.1Å; R312-A318 HydrophobicContact CG-CB 4.13Å
313L90.8Very high80.9Confident140 Ų140111.6 Ų111.673%0.73358%0.576SS**Hα-helixtrans-62.1-35.1175.3-71172.7000112.1M309 Q310 G315M309-L313 WeakPolarHBondContact O-CG 3.34Å; M309-L313 PolarHBondContact O-N 3.48Å; Q310-L313 WeakPolarHBondContact O-CB 3.36Å; Q310-L313 PolarHBondContact O-N 3.15Å; Q310-L313 VanDerWaalsContact O-N 3.14Å; L313-G315 PolarHBondContact O-N 3.44Å
314H92.4Very high78.4Confident162 Ų162114.8 Ų114.875%0.7560%0.595SS**THydrogen-bonded Turntrans-82.57.4175.7-72-71.5000114.2Q310 A311 R312Q310-H314 PolarHBondContact O-CD2 3.4Å; Q310-H314 PolarHBondContact O-N 3.27Å; A311-H314 CarbonylContact O-C 3.53Å; A311-H314 PolarHBondContact O-N 2.73Å; R312-H314 VanDerWaalsContact C-N 3.26Å; R312-H314 PolarHBondContact O-N 3.41Å
315G86Confident76Confident63 Ų63118.9 Ų118.965%0.64961%0.612SS**THydrogen-bonded Turntrans81.914.6173.900000115.3A311 R312 L313A311-G315 PolarHBondContact O-N 2.79Å; R312-G315 PolarHBondContact O-N 2.89Å; R312-G315 VanDerWaalsContact O-N 3.1Å; L313-G315 PolarHBondContact O-N 3.44Å
316L80.3Confident73.4Confident114 Ų114117 Ų11760%0.59762%0.618SS**PPolyproline II helixtrans-89.4127.5175-61.2176.3000110.4A311 A318A311-L316 HydrophobicContact CB-CB 4.32Å; A311-L316 PolarHBondContact O-N 3.07Å; L316-A318 PolarHBondContact O-N 2.74Å
317P69.7Low70.8Confident126 Ų126117.1 Ų117.182%0.81863%0.633SS**PPolyproline II helixtrans-68.8117.1177.526.1-30.8000110A319P317-A319 PolarHBondContact O-N 3.38Å
318A63.5Low68.4Low33 Ų33120.2 Ų120.227%0.27366%0.655SS.*PPolyproline II helixtrans-67.7117.6172.500000109R312 L316 Q320R312-A318 HydrophobicContact CG-CB 4.13Å; L316-A318 PolarHBondContact O-N 2.74Å; A318-Q320 PolarHBondContact O-N 2.93Å
319A59.6Low65.9Low86 Ų86120.8 Ų120.871%0.71167%0.671SS**  trans-59.1113.3171.400000108.5P317 Q321P317-A319 PolarHBondContact O-N 3.38Å; A319-Q321 PolarHBondContact O-N 3.43Å
320Q54.1Low63.5Low195 Ų195121.6 Ų121.691%0.91168%0.682SS**  trans-62.197.1173.5-77.2176.7-75.500108.7A318 Q322A318-Q320 PolarHBondContact O-N 2.93Å; Q320-Q322 PolarHBondContact O-N 3.26Å
321Q55.8Low60.9Low164 Ų164123.5 Ų123.577%0.76670%0.701SS**  trans-73106.6163.2-72.9-173.3-7.800107.3A319 Q323A319-Q321 PolarHBondContact O-N 3.43Å; Q321-Q323 VanDerWaalsContact C-N 3.26Å; Q321-Q323 PolarHBondContact O-N 3.48Å
322Q48Very low58.4Low189 Ų189131.4 Ų131.488%0.88373%0.732SS**  trans-54.996.2158.4-89.3163.8-32.300107.8Q320 Q324Q320-Q322 PolarHBondContact O-N 3.26Å; Q322-Q324 PolarHBondContact O-N 3.48Å
323Q51Low55.6Low157 Ų157129.4 Ų129.473%0.73475%0.746SS**  trans-65.987.9163.4-95.3172.1-3.400107.5Q321 Q325Q321-Q323 VanDerWaalsContact C-N 3.26Å; Q321-Q323 PolarHBondContact O-N 3.48Å; Q323-Q325 PolarHBondContact O-N 3.3Å
324Q45.5Very low52.9Low184 Ų184125.7 Ų125.786%0.8674%0.742SS**  trans-63.197.3152.1-117.4153.223.900105.8Q322 A326Q322-Q324 PolarHBondContact O-N 3.48Å; Q324-A326 PolarHBondContact O-N 3.25Å
325Q45.1Very low50.2Low177 Ų177127.6 Ų127.683%0.82775%0.751SS**  trans-5986.5156.2-77.8174.93.500106.7Q323 A327Q323-Q325 PolarHBondContact O-N 3.3Å; Q325-A327 PolarHBondContact O-N 3.33Å
326A42.8Very low47.7Very low86 Ų86132.4 Ų132.471%0.71176%0.762SS**  trans-69.479.8154.600000106.1Q324 V328Q324-A326 PolarHBondContact O-N 3.25Å; A326-V328 PolarHBondContact O-N 3.28Å; A326-V328 VanDerWaalsContact O-N 3.12Å
327A41.6Very low45.9Very low82 Ų82132.7 Ų132.768%0.67877%0.771SS**  trans-52118.1150.300000105.4Q325 A329Q325-A327 PolarHBondContact O-N 3.33Å; A327-A329 PolarHBondContact O-N 3.14Å
328V44.8Very low44Very low143 Ų143130.2 Ų130.287%0.86777%0.768SS**  trans-68.774.1165.4-178.30000106A326A326-V328 PolarHBondContact O-N 3.28Å; A326-V328 VanDerWaalsContact O-N 3.12Å
329A41.9Very low42.5Very low80 Ų80133.6 Ų133.666%0.66180%0.796SS**  trans-81.9110.5165.700000106.2A327A327-A329 PolarHBondContact O-N 3.14Å
330V43.5Very low41.3Very low125 Ų125134.2 Ų134.276%0.75880%0.801SS**  trans-52122166.3178.40000108.1H332V330-H332 PolarHBondContact O-N 3.49Å
331P40Very low40.4Very low113 Ų113131.7 Ų131.773%0.73480%0.799SS**  trans-78.1109.2-179.429.8-29.7000109.3
332H38.8Very low39.4Very low195 Ų195129.9 Ų129.990%0.90380%0.799SS**  trans-97.699.4148.7-11843.7000106.9V330V330-H332 PolarHBondContact O-N 3.49Å
333A33.5Very low38.8Very low103 Ų103129.1 Ų129.185%0.85180%0.801SS**  trans-74.9137.4-178.200000111.3
334G33.7Very low38.1Very low62 Ų62129.3 Ų129.364%0.63981%0.807SS**  trans14079.7150.600000115.6
335Q34.3Very low37.3Very low202 Ų202129 Ų12994%0.94481%0.81SS**  trans-172.8137130.3-101.4157.483.500113.4
336N34.5Very low36.7Very low165 Ų165125.9 Ų125.988%0.88281%0.808SS**  trans-75163.6178.3-111.8-10.7000112.5
337P41.3Very low36.2Very low120 Ų120126.2 Ų126.278%0.77981%0.811SS**  trans-95.4157.6-168.637.5-32.6000113.4
338G30.8Very low35.7Very low74 Ų74130.8 Ų130.876%0.76382%0.823SS**  trans-176.1100.7170.200000114.9
339A32.7Very low35.1Very low104 Ų104127.3 Ų127.386%0.8682%0.816SS**  trans65.6120.9151.100000120.7
340A34.1Very low34.5Very low98 Ų98128 Ų12881%0.8182%0.821SS**  trans-73.6139.5163.400000111.5
341T34.2Very low34Very low143 Ų143130 Ų13088%0.87783%0.826SS**  trans-159.1130.1135.6-42.30000110.4
342T35.7Very low33.6Very low125 Ų125129.1 Ų129.177%0.76783%0.828SS**  trans-66132.2173.7-39.80000112.1
343L34.3Very low33.3Very low174 Ų174128.7 Ų128.791%0.91183%0.827SS**  trans-161.3126.1141-79.6-167.5000110.7
344N36.3Very low33.9Very low161 Ų161128.4 Ų128.486%0.86182%0.817SS**  trans-79.3135.3164.5-89.6-34000109.8
345L30.4Very low33.8Very low176 Ų176133.1 Ų133.192%0.92183%0.826SS**  trans-167140138.5-147.467.1000112.7
346S32.4Very low34.3Very low112 Ų112129.2 Ų129.278%0.78382%0.818SS**  trans-81158.8-174-42.80000115
347A30.9Very low34.1Very low94 Ų94125.5 Ų125.578%0.77781%0.811SS**  trans94.8128.3143.700000122
348L32.6Very low33.6Very low177 Ų177125.3 Ų125.393%0.92781%0.812SS**  trans68.1123.4144.6-112.274.7000122.5
349G30.2Very low33.7Very low71 Ų71131 Ų13173%0.73282%0.816SS**  97.193121.800000120.6
350A30.9Very low33.8Very low93 Ų93134.5 Ų134.577%0.76982%0.82SS**  70.8136.9127.200000123.5
351I32.7Very low33.6Very low167 Ų167134.5 Ų134.586%0.85681%0.814SS**  trans78.3112149.1-27.7-174.1000120.3
352A32Very low34.7Very low95 Ų95133.3 Ų133.379%0.78581%0.808SS**  152.3139.1117.200000113.5
353Q32.5Very low35Very low186 Ų186133.5 Ų133.587%0.86981%0.812SS**  trans-79.7-160.7178.1-47.1-166.2-53.200112.9
354P46.1Very low34.8Very low98 Ų98130.5 Ų130.564%0.63681%0.806SS**  cis-142.4172.5-12.625.6-0.1000118.7
355L30.5Very low34.5Very low160 Ų160128.5 Ų128.584%0.83880%0.804SS**  trans71.2165148.4-74.4154.3000121.7
356P45.3Very low34.5Very low120 Ų120127.6 Ų127.678%0.77980%0.8SS**  cis-133.4-170.4-26.834.3-12.6000115.8
357A30.9Very low34.4Very low88 Ų88127.2 Ų127.273%0.72780%0.798SS**  trans-81.9167.4-165.100000119.7
358S30.1Very low35.1Very low116 Ų116129 Ų12981%0.81180%0.801SS**  trans173.1112.7136.7-74.60000109.7
359F33.6Very low35.1Very low193 Ų193125.7 Ų125.785%0.84680%0.799SS**  42.4119.188-90.5-84.5000116.5
360L33.6Very low35.1Very low177 Ų177125.5 Ų125.593%0.92780%0.797SS**  trans-163.5142.8148.7-101.3159.7000111.1
361S31.2Very low35.1Very low98 Ų98128 Ų12869%0.68580%0.803SS**  trans-122177.3-177.4-63.90000109.5
362P57Low35.2Very low118 Ų118125.8 Ų125.877%0.76680%0.797SS**  trans-95.3-175.1-151.642.1-38.1000114.8
363P42.1Very low35.4Very low130 Ų130129 Ų12984%0.84480%0.8SS**  -159.9-166.897.541-18.2000117.6
364S30.3Very low35.4Very low111 Ų111125.7 Ų125.778%0.77680%0.797SS**  trans-101.5-179.1-163.5-41.30000118.3
365S30.2Very low34.9Very low119 Ų119126.6 Ų126.683%0.83281%0.805SS**  trans77.6150.7162.9-62.40000116.5
366D28.8Very low35.7Very low157 Ų157124.3 Ų124.384%0.8480%0.8SS**  cis-163.9166.424.6-155.2-4.5000110.7
367S31.3Very low35.2Very low104 Ų104127.4 Ų127.473%0.72781%0.809SS**  trans-94.1167.7172.7-78.90000112.7
368P45.8Very low35.3Very low130 Ų130129.6 Ų129.684%0.84481%0.809SS**  -143.8155.8123.232.8-15.1000116.3
369A32.2Very low35.6Very low108 Ų108131.6 Ų131.689%0.89381%0.81SS**  trans-66.7166.516800000112.3
370G29.9Very low35.6Very low67 Ų67125.5 Ų125.569%0.69180%0.801SS**  cis175.6173.56.500000108.6
371V31.2Very low35.6Very low145 Ų145122.2 Ų122.288%0.87979%0.793SS**  trans158.3114.8149165.80000111
372T34.9Very low35.9Very low121 Ų121126 Ų12674%0.74281%0.805SS**  trans-32.6147.216755.60000120.3
373I35.9Very low34.7Very low163 Ų163125.4 Ų125.484%0.83680%0.803SS**  -161.4128109.7-3.3164.1000113.4
374S31.4Very low34.3Very low116 Ų116129.7 Ų129.781%0.81181%0.809SS**  trans69.2128.2147.1-54.80000125.2
375S37.1Very low34.6Very low117 Ų117128.1 Ų128.182%0.81880%0.803SS**  trans-77.4-164.1-170.3-39.90000117.6
376P46.5Very low34.7Very low113 Ų113131.2 Ų131.273%0.73480%0.804SS**  -132.7163.3-6234-15.9000113.5
377L34.1Very low35.1Very low184 Ų184132 Ų13296%0.96381%0.807SS**  trans-144136.7150.5-79.7-175.5000112.3
378D33.1Very low35.2Very low135 Ų135134.7 Ų134.772%0.72281%0.814SS**  trans-87.2140.1-174.1171.638.5000111.3
379L36.8Very low34.6Very low158 Ų158135.5 Ų135.583%0.82781%0.811SS**  179.4124128.3-120.469.8000111
380G33.7Very low35.2Very low65 Ų65134.9 Ų134.967%0.6780%0.797SS**  trans-78.6152.2-178.200000116
381S34.1Very low35.6Very low108 Ų108138 Ų13876%0.75580%0.803SS**  33.2110.8125.9-179.90000118.2
382L36.7Very low35.7Very low178 Ų178137.7 Ų137.793%0.93280%0.802SS**  trans-139.6121.5140.9-74-177.2000112.3
383S31.9Very low35.8Very low104 Ų104137.7 Ų137.773%0.72781%0.807SS**  trans-72.7142.8173.6172.20000111.2
384F34.6Very low35.6Very low221 Ų221134.4 Ų134.497%0.96980%0.804SS**  trans-9592.8174.7-132.5-93.5000108.9
385A37Very low35.9Very low78 Ų78136 Ų13665%0.64580%0.803SS**  trans-137.4139.1166.700000108.5
386E32.3Very low35.9Very low184 Ų184140.7 Ų140.786%0.8680%0.804SS**  trans80.3105153.4-154.2165.9-156.200117.8
387L37.3Very low36Very low173 Ų173140.4 Ų140.491%0.90680%0.802SS**  trans-167.797132.5-112.4135.1000110.7
388D31.8Very low36.1Very low161 Ų161138.8 Ų138.886%0.86180%0.795SS**  trans-119.2116.1155.4-117.7-31.2000104.2
389D33.1Very low36.4Very low146 Ų146139.4 Ų139.478%0.78180%0.803SS**  trans167.6163.7132.5-117-1000112.9
390P46.6Very low36.4Very low95 Ų95134.9 Ų134.962%0.61780%0.795SS**  -136.199.3-129.833.6-7.8000111.9
391T37.3Very low37Very low133 Ų133140.3 Ų140.382%0.81681%0.807SS**  trans-169.2110.416920.40000109.1
392T34.3Very low37.1Very low138 Ų138138.6 Ų138.685%0.84781%0.806SS**  trans160.7109.8144.848.50000108.7
393S35.3Very low37.1Very low122 Ų122137.2 Ų137.285%0.85380%0.8SS**  trans166.381.9134.2-75.30000109.6
394A33.3Very low37.7Very low93 Ų93140.1 Ų140.177%0.76981%0.806SS**  trans-89.6125.7144.800000106.3
395L36.7Very low38Very low151 Ų151135.7 Ų135.779%0.79179%0.792SS**  trans166.1133.8135.6-87.3163.4000111.5
396Y37.6Very low38.5Very low214 Ų214139.2 Ų139.284%0.83980%0.796SS**  trans107.1138167.8-64.6-73.9000118
397P48.7Very low38.8Very low107 Ų107136.7 Ų136.770%0.69579%0.789SS**  trans-125166.1-132.929.8-7.5000114.5
398D35.4Very low38.9Very low151 Ų151136.5 Ų136.581%0.80779%0.789SS**  trans27107.3141.7-164.332.7000119.4
399V41Very low39.1Very low148 Ų148131.6 Ų131.690%0.89778%0.777SS**  trans-147.6108.3143.9-120.60000108.9
400G36.8Very low39.2Very low63 Ų63131 Ų13165%0.64978%0.782SS**  trans-73.8141172.200000112.8
401L44.4Very low38.6Very low178 Ų178130.6 Ų130.693%0.93279%0.787SS**  trans-137.4103.2157.3-82.9171.7000107.3
402G37.3Very low38.4Very low72 Ų72131.8 Ų131.874%0.74279%0.787SS**  trans-82153.1161.600000111
403D36.3Very low38.3Very low149 Ų149130.3 Ų130.380%0.79778%0.783SS**  trans79.997.1143.2-156.628.3000120.4
404I44.3Very low39.2Very low165 Ų165129.2 Ų129.285%0.84677%0.773SS**  trans-159.9127.2140.8-57.6-171.3000105.5
405L42Very low39Very low129 Ų129131.5 Ų131.568%0.67577%0.768SS**  cis-176.9134.4-5.2-178.678.6000107.9
406M46.1Very low38.9Very low151 Ų151133.6 Ų133.674%0.74477%0.765SS**  trans61.2124.3147.5-64.9174.394.900121.6
407D38.9Very low38.5Very low132 Ų132132.1 Ų132.171%0.70677%0.768SS**  86.912355.6-171.542.7000113.4
408D39Very low37.7Very low168 Ų168130.8 Ų130.890%0.89877%0.773SS**  trans-160.9110.8149.8-110.8-25.8000109.6
409G36.3Very low37.5Very low59 Ų59132.3 Ų132.361%0.60878%0.776SS**  trans122.169.7134.700000120.1
410C35Very low37.9Very low132 Ų132129.8 Ų129.889%0.89276%0.763SS**  42.1123.4127.5-72.80000121.6
411A34.1Very low37.7Very low87 Ų87133 Ų13372%0.71976%0.764SS**  169.3115.988.100000114.9
412L33.4Very low37.2Very low158 Ų158133.6 Ų133.683%0.82776%0.759SS**  58.3106.6129.8-50.3178.3000120
413S32.7Very low36.9Very low107 Ų107135.4 Ų135.475%0.74876%0.76SS**  94.5163.776.2-75.80000113.5
414P53.6Low37.7Very low100 Ų100133.6 Ų133.665%0.64976%0.757SS**  -142-165.9-75.938.5-15.8000114
415E29.9Very low37.1Very low141 Ų141134 Ų13466%0.65976%0.76SS**  trans76.6147.2151.3-82.2-175.298.700119.4
416R34.6Very low36.8Very low195 Ų195133 Ų13374%0.73676%0.764SS**  cis-175.7148.1-12.3-131.2-177.1-161.3155.1-6.1106
417M29.8Very low37Very low183 Ų183131.8 Ų131.890%0.90177%0.767SS**  trans71.9121.7133.2-147.6138.5-175.400121.1
418G30.3Very low36.7Very low78 Ų78129.3 Ų129.380%0.80477%0.773SS**  trans153.876.8154.500000117.8
419E31Very low36.6Very low183 Ų183125.8 Ų125.886%0.85577%0.767SS**  trans-96.5173.5150.4-80.9-87.6159.400107.7
420P49.5Very low36.5Very low96 Ų96128.9 Ų128.962%0.62378%0.779SS**  cis-137.3177.82.725.51.5000113.3
421L34.3Very low37Very low129 Ų129131.9 Ų131.968%0.67578%0.777SS**  167136.791.1-73.6169.5000105.7
422F32.3Very low37.2Very low192 Ų192134.3 Ų134.384%0.84278%0.783SS**  -169.4138.964-91-84.3000111.3
423S31.1Very low37.4Very low109 Ų109132 Ų13276%0.76278%0.781SS**  trans-72.7179.2161.4-28.80000111.1
424P53Low37.7Very low112 Ų112131.9 Ų131.973%0.72778%0.78SS**  cis-149.3158.245.937.5-14.8000117.8
425L32.3Very low37.2Very low172 Ų172137.7 Ų137.790%0.90179%0.789SS**  165.6117.8120.1-95.2127.8000109.9
426S35.1Very low37.8Very low109 Ų109141.7 Ų141.776%0.76280%0.798SS**  trans-92.2-172.4169.1-141.60000108.4
427P51.8Low38Very low125 Ų125137.3 Ų137.381%0.81280%0.797SS**  cis-140.9178.3-5.737.8-18000115
428G31.8Very low38.5Very low80 Ų80133.8 Ų133.883%0.82579%0.79SS**  trans151.1111.5147.400000117.4
429A36.7Very low39.1Very low95 Ų95137.8 Ų137.879%0.78579%0.792SS**  trans-86.2160.3179.300000114.2
430S35.3Very low39.4Very low123 Ų123136.6 Ų136.686%0.8679%0.787SS**  153.9155.2118.5-70.60000116
431K43.8Very low39.8Very low195 Ų195141 Ų14185%0.84880%0.802SS**  trans-65.2167.8-176.2-65.5164.6168.5173.80116.1
432T38.5Very low40.4Very low138 Ų138141.9 Ų141.985%0.84781%0.807SS**  trans144.6119.713554.10000110.1
433S37.8Very low41.3Very low110 Ų110141.1 Ų141.177%0.76981%0.806SS**  91.7109.683.9-1790000115.6
434S38.4Very low42.1Very low104 Ų104143.1 Ų143.173%0.72781%0.808SS**  54.8139.8125.1-150.30000123.9
435R43Very low41.7Very low222 Ų222149.7 Ų149.784%0.83884%0.836SS**  trans109.5111.5150-62.2-164.9171-146.3-1.3115.6
436R42.8Very low42.2Very low226 Ų226148.6 Ų148.685%0.85383%0.832SS**  85.8118.560.5-166.3-171.5-149.1-88.42.8111.3
437S38.9Very low42.5Very low102 Ų102150.7 Ų150.771%0.71384%0.836SS**  -179131.7121.5-156.20000113.3
438S40.6Very low42Very low110 Ų110152.1 Ų152.177%0.76984%0.838SS**  trans-93.6161.6163-520000110.5
439L43.5Very low42.6Very low161 Ų161156.4 Ų156.484%0.84384%0.838SS**  trans-165.3109.8161.8-98.8147.4000103.4
440E36.3Very low43Very low158 Ų158160.2 Ų160.274%0.73884%0.842SS**  cis61.5104.243.2-155.8169-146.900113.2
441M57.8Low43.5Very low190 Ų190162.7 Ų162.794%0.93684%0.84SS**  trans-138.4124.9154.9-83-158.8-70.200108.7
442D47Very low43.5Very low147 Ų147160.4 Ų160.479%0.78684%0.84SS**  trans-67.4165.4-177-78.1-76.1000115.8
443E52.9Low43.9Very low176 Ų176162.1 Ų162.182%0.82284%0.839SS**  trans-88.1173.4167.4-57.8-141.912400113
444D47.8Very low44.4Very low150 Ų150166.4 Ų166.480%0.80285%0.845SS**  trans99.1100.2161.8-64.6-25000119.6
445L43.4Very low44.9Very low251 Ų251172.1 Ų172.1100%1.31486%0.856SS**  -165.70117.1-117.1131.8000113.2

Retrieved 445 of 445 residues in 287.4 ms (Link to these results)