A0A060XAG8_ONCMY Loading...

Pre-mRNA-splicing factor SPF27

AlphaFold DB , UniProt , Accession A0A060XAG8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110492257, Length 225 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.6Very low43.6Very low249 Ų249122.7 Ų122.7100%1.22779%0.788SS**  073.70-68.7-95.1-11100108
2S38.1Very low45.3Very low116 Ų116126.9 Ų126.981%0.81179%0.785SS**  trans-106.2114.1169.960.70000106.8T4S2-T4 PolarHBondContact O-N 3.16Å
3G36.3Very low47.4Very low70 Ų70126.5 Ų126.572%0.72278%0.782SS**  trans-57.2128.7-17700000111.3S5G3-S5 VanDerWaalsContact C-N 3.31Å; G3-S5 PolarHBondContact O-N 3.03Å
4T38.9Very low49.5Very low141 Ų141124.1 Ų124.187%0.86576%0.762SS**  trans-58.197.2157.744.90000107.3S2 S6S2-T4 PolarHBondContact O-N 3.16Å; T4-S6 PolarHBondContact O-N 3.11Å
5S40.5Very low51.8Low110 Ų110119.3 Ų119.377%0.76974%0.739SS**  trans-63.7104.5168-74.80000107.2G3 V7G3-S5 VanDerWaalsContact C-N 3.31Å; G3-S5 PolarHBondContact O-N 3.03Å; S5-V7 PolarHBondContact O-N 3.04Å
6S46.6Very low54.2Low89 Ų89112.9 Ų112.962%0.62270%0.699SS**  trans-52.2111.7166.3177.40000108.5T4T4-S6 PolarHBondContact O-N 3.11Å
7V43.4Very low56.3Low135 Ų135111.1 Ų111.182%0.81869%0.689SS**SBendtrans-109114.1171.7-176.10000106.4S5S5-V7 PolarHBondContact O-N 3.04Å
8A44.3Very low58.3Low80 Ų80109.4 Ų109.466%0.66167%0.668SS**SBendtrans69.4114.8-163.900000112.2E10A8-E10 PolarHBondContact O-N 3.25Å
9G45Very low60Low59 Ų59106.1 Ų106.161%0.60864%0.644SS**SBendtrans-47.2134.5178.600000109.9V11G9-V11 VanDerWaalsContact C-N 3.29Å; G9-V11 WeakPolarHBondContact O-CG2 3.3Å; G9-V11 PolarHBondContact O-N 3.48Å
10E52.3Low61.4Low188 Ų188103.6 Ų103.688%0.87963%0.627SS**  trans-42.992.3-169.4-75.1-180151.100111.2A8 F12A8-E10 PolarHBondContact O-N 3.25Å; E10-F12 VanDerWaalsContact C-N 3.34Å; E10-F12 PolarHBondContact O-N 3.28Å
11V56.8Low62.6Low113 Ų113106.3 Ų106.369%0.68563%0.633SS**  trans-72104.8167.9179.50000102.7G9 V13G9-V11 VanDerWaalsContact C-N 3.29Å; G9-V11 WeakPolarHBondContact O-CG2 3.3Å; G9-V11 PolarHBondContact O-N 3.48Å; V11-V13 HydrophobicContact CB-CG2 4.39Å; V11-V13 HydrophobicContact CG1-CG2 3.89Å; V11-V13 PolarHBondContact O-N 3.08Å
12F63.4Low64.7Low173 Ų17396.9 Ų96.976%0.75960%0.599SS**  trans-6593.4170.3-177.1-101.5000107.2E10 D14E10-F12 VanDerWaalsContact C-N 3.34Å; E10-F12 PolarHBondContact O-N 3.28Å; F12-D14 HydrophobicContact CD1-CB 4.08Å; F12-D14 HydrophobicContact CE1-CB 3.61Å; F12-D14 HydrophobicContact CZ-CB 4.4Å; F12-D14 PolarHBondContact O-N 3.13Å
13V72.8Confident66.7Low122 Ų12297 Ų9774%0.73958%0.582SS**  trans-82.8103.1174.2-178.70000106.3V11V11-V13 HydrophobicContact CB-CG2 4.39Å; V11-V13 HydrophobicContact CG1-CG2 3.89Å; V11-V13 PolarHBondContact O-N 3.08Å
14D77.8Confident68.8Low93 Ų9399.5 Ų99.550%0.49758%0.579SS.*  trans-89.7126.2175.4-161.22.5000110.3F12 L16F12-D14 HydrophobicContact CD1-CB 4.08Å; F12-D14 HydrophobicContact CE1-CB 3.61Å; F12-D14 HydrophobicContact CZ-CB 4.4Å; F12-D14 PolarHBondContact O-N 3.13Å; D14-L16 VanDerWaalsContact OD1-CD2 3.23Å; D14-L16 WeakPolarHBondContact OD1-CD2 3.36Å
15A83.1Confident71.1Confident52 Ų5295.3 Ų95.343%0.4356%0.559SS.*  trans-145.5130.8168.100000106.8P17A15-P17 WeakPolarHBondContact O-CD 3.5Å
16L90.6Very high73.5Confident16 Ų1695.2 Ų95.28%0.08457%0.565CS.*  trans-112.468.3-172.7-54.9176.8000111.9D14 Y18 F19 D20 Q171 L178D14-L16 VanDerWaalsContact OD1-CD2 3.23Å; D14-L16 WeakPolarHBondContact OD1-CD2 3.36Å; L16-Y18 PolarHBondContact O-N 3.43Å; L16-F19 HydrophobicContact CB-CB 3.95Å; L16-F19 WeakPolarHBondContact O-CA 3.24Å; L16-F19 PolarHBondContact O-N 2.88Å; L16-D20 PolarHBondContact N-OD2 3.26Å; L16-D20 PolarHBondContact O-N 3.47Å; L16-Q171 HydrophobicContact CB-CB 4.39Å; L16-Q171 HydrophobicContact CB-CG 4.4Å; L16-Q171 HydrophobicContact CD2-CB 4.07Å; L16-Q171 HydrophobicContact CD2-CG 3.68Å; L16-L178 HydrophobicContact CD1-CD1 3.73Å
17P90.3Very high75.6Confident82 Ų8292.7 Ų92.753%0.53255%0.553SS.*THydrogen-bonded Turntrans-50.6-32.3-177.1-29.130.6000116.4A15 F19A15-P17 WeakPolarHBondContact O-CD 3.5Å; P17-F19 VanDerWaalsContact C-N 3.32Å
18Y91.5Very high77.8Confident81 Ų8189.1 Ų89.132%0.31853%0.531SS..THydrogen-bonded Turntrans-76.5-18.6177.9-73.5-67.6000113.6L16 R167 K168L16-Y18 PolarHBondContact O-N 3.43Å; Y18-R167 HydrophobicContact CD2-CG 4.29Å; Y18-R167 HydrophobicContact CE2-CB 4.35Å; Y18-R167 HydrophobicContact CE2-CG 4.17Å; Y18-K168 HydrophobicContact CD1-CB 4.23Å; Y18-K168 HydrophobicContact CD1-CD 4.24Å; Y18-K168 HydrophobicContact CD1-CG 4.05Å; Y18-K168 HydrophobicContact CD2-CB 3.89Å; Y18-K168 HydrophobicContact CD2-CG 4.41Å; Y18-K168 HydrophobicContact CE1-CB 4.43Å; Y18-K168 HydrophobicContact CE1-CD 4.49Å; Y18-K168 HydrophobicContact CE2-CB 4.09Å; Y18-K168 HydrophobicContact CG-CB 3.97Å; Y18-K168 HydrophobicContact CG-CG 3.98Å
19F90.4Very high80Confident47 Ų4793.1 Ų93.121%0.20653%0.529CS..THydrogen-bonded Turntrans-100.7-44.8177.4-174.1-98.2000111.6L16 P17 Q21 L172 G175L16-F19 HydrophobicContact CB-CB 3.95Å; L16-F19 WeakPolarHBondContact O-CA 3.24Å; L16-F19 PolarHBondContact O-N 2.88Å; P17-F19 VanDerWaalsContact C-N 3.32Å; F19-Q21 PolarHBondContact O-N 3.17Å; F19-L172 HydrophobicContact CD2-CD2 4.34Å; F19-G175 VanDerWaalsContact CE2-CA 3.47Å; F19-G175 WeakPolarHBondContact CE2-O 3.46Å; F19-G175 WeakPolarHBondContact CZ-O 3.36Å
20D89.3Confident82.4Confident56 Ų5696.2 Ų96.230%0.29953%0.528SS..  trans-81.578.7-178-64.5-30.5000111.5L16 G22 Y23L16-D20 PolarHBondContact N-OD2 3.26Å; L16-D20 PolarHBondContact O-N 3.47Å; D20-G22 PolarHBondContact O-N 2.94Å; D20-Y23 HydrophobicContact CB-CD2 3.82Å; D20-Y23 HydrophobicContact CB-CE2 3.36Å; D20-Y23 WeakPolarHBondContact O-CD2 3.15Å
21Q85.2Confident84.3Confident161 Ų16189.9 Ų89.975%0.75251%0.508SS*.G310 helixtrans-74.8-6-178.1-61.8-175.74.900114.1F19 Y23F19-Q21 PolarHBondContact O-N 3.17Å; Q21-Y23 VanDerWaalsContact C-N 3.27Å; Q21-Y23 PolarHBondContact O-N 3.3Å
22G83.1Confident86Confident50 Ų5086.9 Ų86.952%0.51550%0.495SS..G310 helixtrans-70.4-16.8-177.500000114.8D20 D24 A25D20-G22 PolarHBondContact O-N 2.94Å; G22-D24 PolarHBondContact O-N 2.91Å; G22-A25 VanDerWaalsContact O-CB 3.27Å; G22-A25 WeakPolarHBondContact O-CB 3.47Å; G22-A25 PolarHBondContact O-N 3Å; G22-A25 VanDerWaalsContact O-N 3.14Å
23Y79.5Confident87.5Confident119 Ų11981.4 Ų81.447%0.46748%0.482SS..G310 helixtrans-65.8-22.4-179.5-67.6-65.6000114.3D20 Q21 A25D20-Y23 HydrophobicContact CB-CD2 3.82Å; D20-Y23 HydrophobicContact CB-CE2 3.36Å; D20-Y23 WeakPolarHBondContact O-CD2 3.15Å; Q21-Y23 VanDerWaalsContact C-N 3.27Å; Q21-Y23 PolarHBondContact O-N 3.3Å; Y23-A25 VanDerWaalsContact C-N 3.33Å
24D80.7Confident88.5Confident122 Ų12278.2 Ų78.265%0.65247%0.468SS*.G310 helixtrans-89.90.2178.2-68.3-29.2000112.7G22 R29G22-D24 PolarHBondContact O-N 2.91Å; D24-R29 IonicContact OD1-CZ 3.2Å; D24-R29 IonicContact OD1-NE 2.95Å; D24-R29 IonicContact OD1-NH2 2.78Å; D24-R29 PolarHBondContact OD1-NH2 3.32Å
25A87.7Confident89.3Confident53 Ų5379.3 Ų79.344%0.43847%0.473SS..SBendtrans-65.6138.8171.700000110.6G22 Y23 G27 V28G22-A25 VanDerWaalsContact O-CB 3.27Å; G22-A25 WeakPolarHBondContact O-CB 3.47Å; G22-A25 PolarHBondContact O-N 3Å; G22-A25 VanDerWaalsContact O-N 3.14Å; Y23-A25 VanDerWaalsContact C-N 3.33Å; A25-G27 PolarHBondContact O-N 3.48Å; A25-V28 HydrophobicContact CB-CG2 3.91Å; A25-V28 PolarHBondContact O-N 3.14Å
26A89.6Confident89.8Confident108 Ų10881.2 Ų81.289%0.89348%0.48SS*.THydrogen-bonded Turntrans-57.8132.6-179.300000111.2
27G90.1Very high89.9Confident37 Ų3786.2 Ų86.238%0.38150%0.502SS..THydrogen-bonded Turntrans91.2-17.2178.200000115.1A25 E30 A31A25-G27 PolarHBondContact O-N 3.48Å; G27-E30 WeakPolarHBondContact CA-OE2 3.49Å; G27-E30 PolarHBondContact N-OE2 3.5Å; G27-E30 VanDerWaalsContact N-OE2 3.12Å; G27-A31 VanDerWaalsContact O-CB 3.26Å; G27-A31 WeakPolarHBondContact O-CB 3.32Å; G27-A31 PolarHBondContact O-N 3.17Å
28V91.3Very high90.1Very high59 Ų5986.7 Ų86.736%0.35850%0.497SS..Hα-helixtrans-69.6-43.1-177.7175.70000111.4A25 A31 A32A25-V28 HydrophobicContact CB-CG2 3.91Å; A25-V28 PolarHBondContact O-N 3.14Å; V28-A31 PolarHBondContact O-N 3.44Å; V28-A32 WeakPolarHBondContact O-CB 3.48Å; V28-A32 PolarHBondContact O-N 3.38Å
29R90.3Very high90.1Very high164 Ų16486.9 Ų86.962%0.61950%0.501SS*.Hα-helixtrans-67.6-39.6178.7-66.3-173.9-175.5-171.81.9111.4D24 A32 A33D24-R29 IonicContact OD1-CZ 3.2Å; D24-R29 IonicContact OD1-NE 2.95Å; D24-R29 IonicContact OD1-NH2 2.78Å; D24-R29 PolarHBondContact OD1-NH2 3.32Å; R29-A32 PolarHBondContact O-N 3.04Å; R29-A33 VanDerWaalsContact O-CB 3.29Å; R29-A33 WeakPolarHBondContact O-CB 3.34Å; R29-A33 PolarHBondContact O-N 2.99Å
30E93.9Very high90Very high124 Ų12487.8 Ų87.858%0.57951%0.511SS*.Hα-helixtrans-65.2-44.2177-63.978.7-174.900111.1G27 A33 A34G27-E30 WeakPolarHBondContact CA-OE2 3.49Å; G27-E30 PolarHBondContact N-OE2 3.5Å; G27-E30 VanDerWaalsContact N-OE2 3.12Å; E30-A33 PolarHBondContact O-N 3.14Å; E30-A34 WeakPolarHBondContact O-CB 3.37Å; E30-A34 PolarHBondContact O-N 3.01Å
31A93.8Very high90Very high56 Ų5694.2 Ų94.246%0.46353%0.531SS..Hα-helixtrans-62.9-45.2175.800000111.8G27 V28 A33 A34 L35G27-A31 VanDerWaalsContact O-CB 3.26Å; G27-A31 WeakPolarHBondContact O-CB 3.32Å; G27-A31 PolarHBondContact O-N 3.17Å; V28-A31 PolarHBondContact O-N 3.44Å; A31-A33 PolarHBondContact O-N 2.87Å; A31-A34 PolarHBondContact O-N 3.2Å; A31-L35 WeakPolarHBondContact O-CG 3.46Å; A31-L35 PolarHBondContact O-N 2.88Å; A31-L35 VanDerWaalsContact O-N 3.1Å
32A92.5Very high90.2Very high50 Ų5094 Ų9441%0.41352%0.523SS..Hα-helixtrans-61.7-43.517600000111.7V28 R29 A34 L35 V36V28-A32 WeakPolarHBondContact O-CB 3.48Å; V28-A32 PolarHBondContact O-N 3.38Å; R29-A32 PolarHBondContact O-N 3.04Å; A32-A34 PolarHBondContact O-N 3.4Å; A32-L35 PolarHBondContact O-N 3.43Å; A32-V36 WeakPolarHBondContact O-CG2 3.38Å; A32-V36 PolarHBondContact O-N 3.43Å
33A93.6Very high90.1Very high58 Ų5899.7 Ų99.748%0.47953%0.53SS..Hα-helixtrans-62.5-40.4176.800000112.3R29 E30 A31 V36 E37R29-A33 VanDerWaalsContact O-CB 3.29Å; R29-A33 WeakPolarHBondContact O-CB 3.34Å; R29-A33 PolarHBondContact O-N 2.99Å; E30-A33 PolarHBondContact O-N 3.14Å; A31-A33 PolarHBondContact O-N 2.87Å; A33-V36 PolarHBondContact O-N 2.99Å; A33-E37 WeakPolarHBondContact O-CB 3.49Å; A33-E37 PolarHBondContact O-N 2.99Å
34A95.2Very high90Very high55 Ų55103.9 Ų103.946%0.45555%0.545SS..Hα-helixtrans-63-41.3176.600000112.3E30 A31 A32 E37 E38E30-A34 WeakPolarHBondContact O-CB 3.37Å; E30-A34 PolarHBondContact O-N 3.01Å; A31-A34 PolarHBondContact O-N 3.2Å; A32-A34 PolarHBondContact O-N 3.4Å; A34-E37 PolarHBondContact O-N 3.48Å; A34-E38 PolarHBondContact O-N 2.84Å
35L94.3Very high89.8Confident115 Ų115103 Ų10360%0.60255%0.546SS*.Hα-helixtrans-64.8-42.2174.8-67.9173.2000111.8A31 A32 E37 E38 E39A31-L35 WeakPolarHBondContact O-CG 3.46Å; A31-L35 PolarHBondContact O-N 2.88Å; A31-L35 VanDerWaalsContact O-N 3.1Å; A32-L35 PolarHBondContact O-N 3.43Å; L35-E37 VanDerWaalsContact C-N 3.34Å; L35-E38 PolarHBondContact O-N 2.93Å; L35-E39 PolarHBondContact O-N 3.44Å; L35-E39 VanDerWaalsContact O-N 3.11Å
36V92.8Very high89.1Confident93 Ų93107.1 Ų107.156%0.56457%0.566SS**Hα-helixtrans-60.8-45.7174.2171.70000110.2A32 A33 E38 E39 T40A32-V36 WeakPolarHBondContact O-CG2 3.38Å; A32-V36 PolarHBondContact O-N 3.43Å; A33-V36 PolarHBondContact O-N 2.99Å; V36-E38 PolarHBondContact O-N 2.86Å; V36-E39 PolarHBondContact O-N 3.26Å; V36-T40 WeakPolarHBondContact O-CB 3.46Å; V36-T40 PolarHBondContact O-N 3.16Å; V36-T40 PolarHBondContact O-OG1 3.31Å
37E92.9Very high88.6Confident121 Ų121110.5 Ų110.557%0.56556%0.561SS**Hα-helixtrans-61.4-42.7178.7-171.6-177.8172.500112A33 A34 L35 E39 T40 R41A33-E37 WeakPolarHBondContact O-CB 3.49Å; A33-E37 PolarHBondContact O-N 2.99Å; A34-E37 PolarHBondContact O-N 3.48Å; L35-E37 VanDerWaalsContact C-N 3.34Å; E37-E39 PolarHBondContact O-N 2.81Å; E37-T40 PolarHBondContact O-N 2.9Å; E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 3.31Å
38E93.8Very high88.1Confident91 Ų91113.6 Ų113.643%0.42557%0.569SS.*Hα-helixtrans-59.3-46.3176.7-173.1174.9-176.300111.7A34 L35 V36 T40 R41 R42A34-E38 PolarHBondContact O-N 2.84Å; L35-E38 PolarHBondContact O-N 2.93Å; V36-E38 PolarHBondContact O-N 2.86Å; E38-T40 VanDerWaalsContact C-N 3.34Å; E38-T40 PolarHBondContact O-N 3.1Å; E38-R41 PolarHBondContact O-N 3.02Å; E38-R42 WeakPolarHBondContact O-CG 3.43Å; E38-R42 PolarHBondContact O-N 3.01Å; E38-R42 VanDerWaalsContact O-N 3.14Å; E38-R42 IonicContact OE1-CZ 3.52Å; E38-R42 IonicContact OE1-NE 2.7Å; E38-R42 IonicContact OE1-NH2 3.95Å; E38-R42 PolarHBondContact OE1-NH2 2.7Å
39E91.4Very high87.6Confident85 Ų85119.3 Ų119.340%0.39759%0.585SS.*Hα-helixtrans-65.5-37.3175.7-74-58131.400111.9L35 V36 E37 R41 R42 Y43L35-E39 PolarHBondContact O-N 3.44Å; L35-E39 VanDerWaalsContact O-N 3.11Å; V36-E39 PolarHBondContact O-N 3.26Å; E37-E39 PolarHBondContact O-N 2.81Å; E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.43Å; E39-R42 PolarHBondContact O-N 3.24Å; E39-R42 IonicContact OE1-CZ 3.43Å; E39-R42 IonicContact OE1-NH1 3.71Å; E39-R42 PolarHBondContact OE1-NH1 2.96Å; E39-Y43 PolarHBondContact O-N 3.2Å; E39-Y43 WeakPolarHBondContact OE2-CD2 3.37Å; E39-Y43 WeakPolarHBondContact OE2-CE2 3.5Å
40T88.7Confident87.3Confident66 Ų66115 Ų11541%0.40557%0.573SS.*Hα-helixtrans-68-28.7176.7-36.80000112.1V36 E37 E38 Y43V36-T40 WeakPolarHBondContact O-CB 3.46Å; V36-T40 PolarHBondContact O-N 3.16Å; V36-T40 PolarHBondContact O-OG1 3.31Å; E37-T40 PolarHBondContact O-N 2.9Å; E38-T40 VanDerWaalsContact C-N 3.34Å; E38-T40 PolarHBondContact O-N 3.1Å; T40-Y43 CarbonylContact O-C 3.6Å
41R89.4Confident86.9Confident192 Ų192113.7 Ų113.773%0.72558%0.579SS**Hα-helixtrans-71-38.2172.2-76.4-178.381.81410.6112E37 E38 E39E37-R41 WeakPolarHBondContact O-CG 3.44Å; E37-R41 PolarHBondContact O-N 3.31Å; E38-R41 PolarHBondContact O-N 3.02Å; E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.43Å
42R88.8Confident86.5Confident155 Ų155119.5 Ų119.559%0.58559%0.59SS**Hα-helixtrans-72.3-45.6178.2-68.8172.5-178.4-171.7-1.3111.5E38 E39E38-R42 WeakPolarHBondContact O-CG 3.43Å; E38-R42 PolarHBondContact O-N 3.01Å; E38-R42 VanDerWaalsContact O-N 3.14Å; E38-R42 IonicContact OE1-CZ 3.52Å; E38-R42 IonicContact OE1-NE 2.7Å; E38-R42 IonicContact OE1-NH2 3.95Å; E38-R42 PolarHBondContact OE1-NH2 2.7Å; E39-R42 PolarHBondContact O-N 3.24Å; E39-R42 IonicContact OE1-CZ 3.43Å; E39-R42 IonicContact OE1-NH1 3.71Å; E39-R42 PolarHBondContact OE1-NH1 2.96Å
43Y82.4Confident86.3Confident170 Ų170121 Ų12167%0.66759%0.59SS**SBendtrans-111.987179.7-62.3-75.7000110.1E39 T40 P45E39-Y43 PolarHBondContact O-N 3.2Å; E39-Y43 WeakPolarHBondContact OE2-CD2 3.37Å; E39-Y43 WeakPolarHBondContact OE2-CE2 3.5Å; T40-Y43 CarbonylContact O-C 3.6Å; Y43-P45 WeakPolarHBondContact O-CD 3.48Å
44R75.9Confident85.9Confident207 Ų207123.4 Ų123.478%0.78160%0.601SS**  trans-63.6128.8170.5-69.8-165.3-179.2-133.51.8109.2T46R44-T46 PolarHBondContact O-N 2.93Å
45P76.4Confident85.4Confident104 Ų104127 Ų12768%0.67562%0.617SS**  trans-55.1114.1177.9-25.333.5000110.7Y43Y43-P45 WeakPolarHBondContact O-CD 3.48Å
46T73.9Confident85Confident140 Ų140125.4 Ų125.486%0.85961%0.613SS**  trans-90.7-21.7179.946.90000112.7R44R44-T46 PolarHBondContact O-N 2.93Å
47K79.3Confident84.8Confident178 Ų178124.7 Ų124.777%0.77461%0.606SS**SBendtrans-110.6129.6174-66.8-175.7-179.6179.20109.4Y49K47-Y49 PolarHBondContact O-N 3.31Å; K47-Y49 VanDerWaalsContact O-N 3.11Å
48N80.6Confident84.2Confident103 Ų103125.9 Ų125.955%0.55161%0.61SS**  trans-68.9106.4167.2-177.5-3.9000107.9L50 S51N48-L50 PolarHBondContact O-N 3.45Å; N48-L50 VanDerWaalsContact O-N 3.09Å; N48-L50 WeakPolarHBondContact OD1-CA 3.47Å; N48-L50 VanDerWaalsContact OD1-CB 3.31Å; N48-L50 WeakPolarHBondContact OD1-CB 3.4Å; N48-L50 PolarHBondContact OD1-N 3.37Å; N48-S51 VanDerWaalsContact O-CB 3.25Å; N48-S51 WeakPolarHBondContact O-CB 3.34Å; N48-S51 PolarHBondContact O-N 3.46Å; N48-S51 PolarHBondContact O-OG 3.48Å
49Y80.2Confident83.7Confident179 Ų179125.4 Ų125.470%0.70261%0.613SS**THydrogen-bonded Turntrans-63.6-13.4178.664-87.9000112.4K47 Y52K47-Y49 PolarHBondContact O-N 3.31Å; K47-Y49 VanDerWaalsContact O-N 3.11Å; Y49-Y52 WeakPolarHBondContact O-CD1 3.46Å; Y49-Y52 WeakPolarHBondContact O-CE1 3.28Å
50L83.6Confident83.5Confident72 Ų72126 Ų12638%0.37762%0.623SS.*THydrogen-bonded Turntrans-93.46.6173.7-53.9174000113N48 Y52 I53N48-L50 PolarHBondContact O-N 3.45Å; N48-L50 VanDerWaalsContact O-N 3.09Å; N48-L50 WeakPolarHBondContact OD1-CA 3.47Å; N48-L50 VanDerWaalsContact OD1-CB 3.31Å; N48-L50 WeakPolarHBondContact OD1-CB 3.4Å; N48-L50 PolarHBondContact OD1-N 3.37Å; L50-Y52 PolarHBondContact O-N 3.41Å; L50-Y52 VanDerWaalsContact O-N 3.12Å; L50-I53 HydrophobicContact CB-CD1 4.44Å; L50-I53 HydrophobicContact CD2-CD1 3.76Å; L50-I53 WeakPolarHBondContact O-CB 3.32Å; L50-I53 PolarHBondContact O-N 2.95Å
51S85.4Confident83.3Confident98 Ų98130.5 Ų130.569%0.68564%0.637SS**THydrogen-bonded Turntrans-63-20.9-176.267.20000114.1N48 I53N48-S51 VanDerWaalsContact O-CB 3.25Å; N48-S51 WeakPolarHBondContact O-CB 3.34Å; N48-S51 PolarHBondContact O-N 3.46Å; N48-S51 PolarHBondContact O-OG 3.48Å; S51-I53 VanDerWaalsContact C-N 3.27Å
52Y85.9Confident83.3Confident178 Ų178123.9 Ų123.970%0.69862%0.615SS**THydrogen-bonded Turntrans-77.5-15.6174.470.7-92.9000112.7Y49 L50Y49-Y52 WeakPolarHBondContact O-CD1 3.46Å; Y49-Y52 WeakPolarHBondContact O-CE1 3.28Å; L50-Y52 PolarHBondContact O-N 3.41Å; L50-Y52 VanDerWaalsContact O-N 3.12Å
53I86.9Confident83.4Confident82 Ų82120.2 Ų120.242%0.42161%0.609SS.*SBendtrans-88.5117.1177.8-53.3-175.9000107.1L50 S51 T55L50-I53 HydrophobicContact CB-CD1 4.44Å; L50-I53 HydrophobicContact CD2-CD1 3.76Å; L50-I53 WeakPolarHBondContact O-CB 3.32Å; L50-I53 PolarHBondContact O-N 2.95Å; S51-I53 VanDerWaalsContact C-N 3.27Å; I53-T55 PolarHBondContact O-N 3.15Å
54P86.8Confident83.9Confident108 Ų108118.9 Ų118.970%0.70161%0.609SS**PPolyproline II helixtrans-61.2141.7175.226.5-33000109.4P56P54-P56 WeakPolarHBondContact O-CD 3.44Å
55T83.8Confident84.7Confident131 Ų131115.2 Ų115.280%0.80460%0.604SS**PPolyproline II helixtrans-60.3123.8171.5-45.40000107.8I53 D57I53-T55 PolarHBondContact O-N 3.15Å; T55-D57 PolarHBondContact O-N 3.49Å
56P86.4Confident85.4Confident80 Ų80114.1 Ų114.152%0.51959%0.591SS.*PPolyproline II helixtrans-59.8126.8179.822-31.5000109.2P54 F58P54-P56 WeakPolarHBondContact O-CD 3.44Å; P56-F58 HydrophobicContact CB-CE1 4.24Å; P56-F58 HydrophobicContact CB-CE2 4.32Å; P56-F58 HydrophobicContact CB-CZ 4.02Å; P56-F58 HydrophobicContact CG-CE1 4.12Å; P56-F58 HydrophobicContact CG-CE2 3.72Å; P56-F58 HydrophobicContact CG-CZ 3.44Å; P56-F58 VanDerWaalsContact CG-CZ 3.44Å; P56-F58 WeakPolarHBondContact O-CD2 3.34Å; P56-F58 PolarHBondContact O-N 3.26Å
57D87.5Confident86.3Confident78 Ų78113 Ų11342%0.41757%0.571SS.*  trans-78.999.8172.3176.923.8000109.2T55 T59 T60T55-D57 PolarHBondContact O-N 3.49Å; D57-T59 VanDerWaalsContact CG-OG1 3.29Å; D57-T59 PolarHBondContact O-N 3.14Å; D57-T59 WeakPolarHBondContact OD1-CB 3.41Å; D57-T59 PolarHBondContact OD1-N 2.9Å; D57-T59 PolarHBondContact OD1-OG1 2.88Å; D57-T59 PolarHBondContact OD2-OG1 2.88Å; D57-T60 PolarHBondContact OD2-N 3.49Å; D57-T60 PolarHBondContact OD2-OG1 2.82Å
58F81.4Confident86.9Confident146 Ų146108.6 Ų108.664%0.6456%0.556SS**G310 helixtrans-71.8-19.9177.4-61.5-72.5000112.6P56 T60 F61P56-F58 HydrophobicContact CB-CE1 4.24Å; P56-F58 HydrophobicContact CB-CE2 4.32Å; P56-F58 HydrophobicContact CB-CZ 4.02Å; P56-F58 HydrophobicContact CG-CE1 4.12Å; P56-F58 HydrophobicContact CG-CE2 3.72Å; P56-F58 HydrophobicContact CG-CZ 3.44Å; P56-F58 VanDerWaalsContact CG-CZ 3.44Å; P56-F58 WeakPolarHBondContact O-CD2 3.34Å; P56-F58 PolarHBondContact O-N 3.26Å; F58-T60 VanDerWaalsContact C-N 3.28Å; F58-T60 PolarHBondContact O-N 3.32Å; F58-F61 PolarHBondContact O-N 3.2Å
59T84.1Confident87.4Confident81 Ų81107.1 Ų107.150%0.49755%0.545SS..G310 helixtrans-72.2-24.4-179.372.10000112.3D57 F61 E62D57-T59 VanDerWaalsContact CG-OG1 3.29Å; D57-T59 PolarHBondContact O-N 3.14Å; D57-T59 WeakPolarHBondContact OD1-CB 3.41Å; D57-T59 PolarHBondContact OD1-N 2.9Å; D57-T59 PolarHBondContact OD1-OG1 2.88Å; D57-T59 PolarHBondContact OD2-OG1 2.88Å; T59-F61 PolarHBondContact O-N 3.39Å; T59-E62 WeakPolarHBondContact O-CB 3.34Å; T59-E62 PolarHBondContact O-N 3.24Å
60T85.3Confident87.9Confident99 Ų99103.3 Ų103.361%0.60753%0.533SS*.G310 helixtrans-58.2-29.1173.8-70.80000112.5D57 F58D57-T60 PolarHBondContact OD2-N 3.49Å; D57-T60 PolarHBondContact OD2-OG1 2.82Å; F58-T60 VanDerWaalsContact C-N 3.28Å; F58-T60 PolarHBondContact O-N 3.32Å
61F85.6Confident88.4Confident159 Ų159105.6 Ų105.670%0.69754%0.541SS*.G310 helixtrans-97.20.9-179.7-56.1-76.8000113.3F58 T59 T63F58-F61 PolarHBondContact O-N 3.2Å; T59-F61 PolarHBondContact O-N 3.39Å; F61-T63 PolarHBondContact O-N 3.11Å
62E89.8Confident88.9Confident54 Ų54103.2 Ų103.225%0.25252%0.518SS..  trans-75.8113.4178.1-70.3177.6-174.900110.4T59 F70T59-E62 WeakPolarHBondContact O-CB 3.34Å; T59-E62 PolarHBondContact O-N 3.24Å; E62-F70 HydrophobicContact CG-CE2 4.23Å
63T90.9Very high89.2Confident77 Ų7799.5 Ų99.547%0.47251%0.509SS..  trans-72.6158.3166.162.80000110.2F61 I65 M66 R67F61-T63 PolarHBondContact O-N 3.11Å; T63-I65 PolarHBondContact O-N 3.47Å; T63-M66 WeakPolarHBondContact O-CB 3.45Å; T63-M66 PolarHBondContact O-N 3.01Å; T63-M66 VanDerWaalsContact OG1-CG 3.32Å; T63-M66 WeakPolarHBondContact OG1-CG 3.43Å; T63-M66 PolarHBondContact OG1-N 2.9Å; T63-R67 PolarHBondContact O-N 3.23Å
64E91.8Very high89.5Confident143 Ų14399.7 Ų99.767%0.66852%0.523SS*.Hα-helixtrans-55.2-37176.8-171.2172.3-171.100112.4R67 N68E64-R67 PolarHBondContact O-N 2.98Å; E64-N68 PolarHBondContact O-N 3.33Å; E64-N68 PolarHBondContact O-ND2 3.46Å; E64-N68 PolarHBondContact O-OD1 2.87Å
65I92.6Very high90Very high130 Ų13097.4 Ų97.467%0.66751%0.513SS*.Hα-helixtrans-62.4-44.8175.3-61.1172.6000110.9T63 R67 N68 E69T63-I65 PolarHBondContact O-N 3.47Å; I65-R67 PolarHBondContact O-N 3.48Å; I65-N68 PolarHBondContact O-N 2.93Å; I65-E69 WeakPolarHBondContact O-CG 3.41Å; I65-E69 PolarHBondContact O-N 3.39Å
66M92.4Very high90.5Very high81 Ų81102.1 Ų102.140%0.39952%0.516SS..Hα-helixtrans-64-41.9178.8-70.5171.168.100111.5T63 E69 F70T63-M66 WeakPolarHBondContact O-CB 3.45Å; T63-M66 PolarHBondContact O-N 3.01Å; T63-M66 VanDerWaalsContact OG1-CG 3.32Å; T63-M66 WeakPolarHBondContact OG1-CG 3.43Å; T63-M66 PolarHBondContact OG1-N 2.9Å; M66-E69 PolarHBondContact O-N 2.87Å; M66-F70 HydrophobicContact CB-CE2 4.16Å; M66-F70 HydrophobicContact CE-CE2 4.26Å; M66-F70 HydrophobicContact CE-CZ 4.17Å; M66-F70 WeakPolarHBondContact O-CD2 3.41Å; M66-F70 VanDerWaalsContact O-CG 3.25Å; M66-F70 WeakPolarHBondContact O-CG 3.47Å; M66-F70 PolarHBondContact O-N 3.34Å
67R91.3Very high90.8Very high116 Ų116103.8 Ų103.844%0.43852%0.517SS..Hα-helixtrans-60.5-47.5177.7-166.8-177.1-56.8140.57.4111.6T63 E64 I65 E69 F70 E71T63-R67 PolarHBondContact O-N 3.23Å; E64-R67 PolarHBondContact O-N 2.98Å; I65-R67 PolarHBondContact O-N 3.48Å; R67-E69 VanDerWaalsContact C-N 3.31Å; R67-E69 PolarHBondContact O-N 2.96Å; R67-F70 PolarHBondContact O-N 2.95Å; R67-E71 WeakPolarHBondContact O-CG 3.48Å; R67-E71 PolarHBondContact O-N 3.45Å
68N91.8Very high91Very high86 Ų86105.7 Ų105.746%0.4653%0.534SS..Hα-helixtrans-60.9-40.3177.2-66.3-11.7000111.8E64 I65 E71 R72E64-N68 PolarHBondContact O-N 3.33Å; E64-N68 PolarHBondContact O-ND2 3.46Å; E64-N68 PolarHBondContact O-OD1 2.87Å; I65-N68 PolarHBondContact O-N 2.93Å; N68-E71 PolarHBondContact O-N 3.38Å; N68-R72 WeakPolarHBondContact O-CB 3.45Å; N68-R72 PolarHBondContact O-N 3.32Å
69E91.6Very high91.4Very high71 Ų71103.8 Ų103.833%0.33253%0.53SS..Hα-helixtrans-67.1-39.1175.3-77-59.714200112.7I65 M66 R67 R72 L73I65-E69 WeakPolarHBondContact O-CG 3.41Å; I65-E69 PolarHBondContact O-N 3.39Å; M66-E69 PolarHBondContact O-N 2.87Å; R67-E69 VanDerWaalsContact C-N 3.31Å; R67-E69 PolarHBondContact O-N 2.96Å; E69-R72 PolarHBondContact O-N 3.1Å; E69-R72 IonicContact OE1-NE 3.18Å; E69-R72 IonicContact OE2-CZ 3.68Å; E69-R72 IonicContact OE2-NE 3.95Å; E69-R72 PolarHBondContact OE2-NE 3.34Å; E69-R72 IonicContact OE2-NH2 2.71Å; E69-R72 PolarHBondContact OE2-NH2 2.6Å; E69-L73 WeakPolarHBondContact O-CB 3.48Å; E69-L73 VanDerWaalsContact O-CG 3.29Å; E69-L73 WeakPolarHBondContact O-CG 3.39Å; E69-L73 PolarHBondContact O-N 3.19Å
70F91.9Very high91.5Very high99 Ų99108.4 Ų108.443%0.43455%0.546SS..Hα-helixtrans-65-40.9174.4-66.8-36.3000112E62 M66 R67 L73 A74E62-F70 HydrophobicContact CG-CE2 4.23Å; M66-F70 HydrophobicContact CB-CE2 4.16Å; M66-F70 HydrophobicContact CE-CE2 4.26Å; M66-F70 HydrophobicContact CE-CZ 4.17Å; M66-F70 WeakPolarHBondContact O-CD2 3.41Å; M66-F70 VanDerWaalsContact O-CG 3.25Å; M66-F70 WeakPolarHBondContact O-CG 3.47Å; M66-F70 PolarHBondContact O-N 3.34Å; R67-F70 PolarHBondContact O-N 2.95Å; F70-L73 PolarHBondContact O-N 2.87Å; F70-A74 VanDerWaalsContact O-CB 3.3Å; F70-A74 WeakPolarHBondContact O-CB 3.47Å; F70-A74 PolarHBondContact O-N 3Å
71E93.5Very high91.5Very high120 Ų120111 Ų11156%0.56156%0.555SS**Hα-helixtrans-62.3-44.7173.5-74.1179.2-170.900111.8R67 N68 L73 A74 A75R67-E71 WeakPolarHBondContact O-CG 3.48Å; R67-E71 PolarHBondContact O-N 3.45Å; N68-E71 PolarHBondContact O-N 3.38Å; E71-L73 PolarHBondContact O-N 2.98Å; E71-A74 PolarHBondContact O-N 3.34Å; E71-A75 VanDerWaalsContact O-CB 3.32Å; E71-A75 WeakPolarHBondContact O-CB 3.23Å; E71-A75 PolarHBondContact O-N 3.38Å
72R94.7Very high91.3Very high49 Ų49109.5 Ų109.519%0.18555%0.553CS.*Hα-helixtrans-57.8-47175-174-171.265.190.1-4.9111.7N68 E69 A75 R76 Q77 P78 L79N68-R72 WeakPolarHBondContact O-CB 3.45Å; N68-R72 PolarHBondContact O-N 3.32Å; E69-R72 PolarHBondContact O-N 3.1Å; E69-R72 IonicContact OE1-NE 3.18Å; E69-R72 IonicContact OE2-CZ 3.68Å; E69-R72 IonicContact OE2-NE 3.95Å; E69-R72 PolarHBondContact OE2-NE 3.34Å; E69-R72 IonicContact OE2-NH2 2.71Å; E69-R72 PolarHBondContact OE2-NH2 2.6Å; R72-A75 CarbonylContact O-C 3.5Å; R72-A75 PolarHBondContact O-N 2.72Å; R72-R76 PolarHBondContact O-N 2.89Å; R72-R76 VanDerWaalsContact O-N 3.11Å; R72-Q77 HydrophobicContact CG-CB 3.68Å; R72-Q77 PolarHBondContact NH1-O 3.21Å; R72-Q77 PolarHBondContact O-N 3.11Å; R72-P78 VanDerWaalsContact NH1-C 3.33Å; R72-L79 VanDerWaalsContact NH1-CA 3.26Å
73L93.6Very high90.8Very high100 Ų100110.5 Ų110.552%0.52457%0.567SS.*Hα-helixtrans-65.1-42.1178.1-73.4172.9000112E69 F70 E71 A75 R76E69-L73 WeakPolarHBondContact O-CB 3.48Å; E69-L73 VanDerWaalsContact O-CG 3.29Å; E69-L73 WeakPolarHBondContact O-CG 3.39Å; E69-L73 PolarHBondContact O-N 3.19Å; F70-L73 PolarHBondContact O-N 2.87Å; E71-L73 PolarHBondContact O-N 2.98Å; L73-A75 VanDerWaalsContact C-N 3.3Å; L73-A75 PolarHBondContact O-N 2.9Å; L73-R76 WeakPolarHBondContact O-CA 3.33Å; L73-R76 PolarHBondContact O-N 3.37Å
74A93.6Very high90.3Very high86 Ų86112 Ų11271%0.71157%0.57SS**Hα-helixtrans-62.3-39.1175.600000111.6F70 E71 R76F70-A74 VanDerWaalsContact O-CB 3.3Å; F70-A74 WeakPolarHBondContact O-CB 3.47Å; F70-A74 PolarHBondContact O-N 3Å; E71-A74 PolarHBondContact O-N 3.34Å; A74-R76 PolarHBondContact O-N 2.91Å
75A95.6Very high89.3Confident60 Ų60112.4 Ų112.450%0.49657%0.569SS.*THydrogen-bonded Turntrans-74.6-1.4172.600000113.7E71 R72 L73 Q77E71-A75 VanDerWaalsContact O-CB 3.32Å; E71-A75 WeakPolarHBondContact O-CB 3.23Å; E71-A75 PolarHBondContact O-N 3.38Å; R72-A75 CarbonylContact O-C 3.5Å; R72-A75 PolarHBondContact O-N 2.72Å; L73-A75 VanDerWaalsContact C-N 3.3Å; L73-A75 PolarHBondContact O-N 2.9Å; A75-Q77 HydrophobicContact CB-CG 3.96Å; A75-Q77 PolarHBondContact O-N 3.48Å
76R94.7Very high88.4Confident230 Ų230114.8 Ų114.887%0.86857%0.57SS**THydrogen-bonded Turntrans5331.7-176.2-59.3-178.1175.7-177.6-1.4113.3R72 L73 A74R72-R76 PolarHBondContact O-N 2.89Å; R72-R76 VanDerWaalsContact O-N 3.11Å; L73-R76 WeakPolarHBondContact O-CA 3.33Å; L73-R76 PolarHBondContact O-N 3.37Å; A74-R76 PolarHBondContact O-N 2.91Å
77Q93.8Very high87.8Confident115 Ų115118.5 Ų118.554%0.53758%0.58SS.*PPolyproline II helixtrans-79.7128.1178.4-71.9-179.7-7.300109.6R72 A75R72-Q77 HydrophobicContact CG-CB 3.68Å; R72-Q77 PolarHBondContact NH1-O 3.21Å; R72-Q77 PolarHBondContact O-N 3.11Å; A75-Q77 HydrophobicContact CB-CG 3.96Å; A75-Q77 PolarHBondContact O-N 3.48Å
78P90.9Very high87.3Confident118 Ų118118.1 Ų118.177%0.76658%0.584SS**PPolyproline II helixtrans-62.5153.4175.227.6-33.5000110.3R72 E80R72-P78 VanDerWaalsContact NH1-C 3.33Å; P78-E80 PolarHBondContact O-N 3.18Å
79L90.5Very high86.9Confident105 Ų105119.2 Ų119.255%0.5559%0.589SS.*PPolyproline II helixtrans-69.1133178-174.470000108.2R72 L81R72-L79 VanDerWaalsContact NH1-CA 3.26Å; L79-L81 PolarHBondContact O-N 2.87Å
80E85.7Confident86.5Confident179 Ų179118.7 Ų118.784%0.83659%0.592SS**PPolyproline II helixtrans-65.6122172.1-169.9171.8-176.100108.9P78P78-E80 PolarHBondContact O-N 3.18Å
81L84.8Confident86.1Confident152 Ų152117.7 Ų117.780%0.79660%0.602SS**PPolyproline II helixtrans-71.2136.5178.3-64.8174.2000109.2L79 S83L79-L81 PolarHBondContact O-N 2.87Å; L81-S83 PolarHBondContact O-N 3.12Å; L81-S83 VanDerWaalsContact O-N 3.14Å
82L81.8Confident85.8Confident128 Ų128112.5 Ų112.567%0.6758%0.578SS**PPolyproline II helixtrans-59.7120.5173.9-163.689.2000109.5M84L82-M84 HydrophobicContact CD2-CE 3.71Å; L82-M84 HydrophobicContact CD2-SD 4.09Å; L82-M84 PolarHBondContact O-N 2.91Å
83S78.3Confident85.5Confident76 Ų76113 Ų11353%0.53159%0.59SS.*  trans-72.4114176.1-178.80000110.4L81 K85L81-S83 PolarHBondContact O-N 3.12Å; L81-S83 VanDerWaalsContact O-N 3.14Å; S83-K85 VanDerWaalsContact C-N 3.27Å
84M80.4Confident85Confident109 Ų109113.4 Ų113.454%0.53760%0.601SS.*G310 helixtrans-79.7-10174.4-64.4-60.3178.100113.3L82 R86 Y87L82-M84 HydrophobicContact CD2-CE 3.71Å; L82-M84 HydrophobicContact CD2-SD 4.09Å; L82-M84 PolarHBondContact O-N 2.91Å; M84-R86 PolarHBondContact O-N 3.09Å; M84-Y87 PolarHBondContact O-N 3.17Å; M84-Y87 HydrophobicContact SD-CD2 4Å; M84-Y87 HydrophobicContact SD-CE2 4.31Å
85K72.6Confident84.6Confident150 Ų150113 Ų11365%0.65261%0.605SS**G310 helixtrans-57.4-27.7-178.8-66.9-175.8176.4-179.30113.1S83 Y87 E88S83-K85 VanDerWaalsContact C-N 3.27Å; K85-Y87 PolarHBondContact O-N 2.95Å; K85-E88 PolarHBondContact O-N 2.84Å
86R73.6Confident84.2Confident180 Ų180114.4 Ų114.468%0.67960%0.601SS**G310 helixtrans-66.4-24.6176.3-179.5175.6-74.5-164.5-1.3113.1M84 N109 Q113M84-R86 PolarHBondContact O-N 3.09Å; R86-N109 PolarHBondContact O-OD1 3.48Å; R86-Q113 PolarHBondContact O-NE2 3.45Å
87Y79.1Confident83.8Confident159 Ų159109.3 Ų109.362%0.62459%0.585SS**G310 helixtrans-980.5179.4-55.4-67.3000113M84 K85M84-Y87 PolarHBondContact O-N 3.17Å; M84-Y87 HydrophobicContact SD-CD2 4Å; M84-Y87 HydrophobicContact SD-CE2 4.31Å; K85-Y87 PolarHBondContact O-N 2.95Å
88E81.3Confident83.6Confident109 Ų109111.7 Ų111.751%0.50960%0.602SS.*SBendtrans-105.3159.3175.8-64.5173.5-177.600109.2K85 P90 N109 Q113K85-E88 PolarHBondContact O-N 2.84Å; E88-P90 WeakPolarHBondContact O-CD 3.31Å; E88-N109 PolarHBondContact O-ND2 3.34Å; E88-Q113 PolarHBondContact O-NE2 3.18Å
89L82.9Confident83.6Confident109 Ų109109.2 Ų109.257%0.57158%0.582SS**  trans-110.462.4172.8-65.7167.9000109.9S110 Q113L89-S110 WeakPolarHBondContact CD2-OG 3.25Å; L89-Q113 HydrophobicContact CD2-CB 4.37Å; L89-Q113 HydrophobicContact CD2-CG 4.42Å; L89-Q113 VanDerWaalsContact CD2-OE1 3.25Å
90P82.4Confident83.7Confident60 Ų60110 Ų11039%0.3959%0.586SS.*PPolyproline II helixtrans-69.6137.9-179.331-34.5000109.7E88 C106E88-P90 WeakPolarHBondContact O-CD 3.31Å; P90-C106 PolarHBondContact O-SG 3.36Å
91A84.3Confident84Confident78 Ų78105.1 Ų105.165%0.64557%0.568SS**PPolyproline II helixtrans-70.1158.6164.400000110.1S93A91-S93 PolarHBondContact O-N 3.33Å
92P87.2Confident84.2Confident10 Ų1098.3 Ų98.37%0.06553%0.534CS..PPolyproline II helixtrans-54.5142.3171.9-25.535.6000110.9Q96 A102 W103 C106P92-Q96 HydrophobicContact CB-CB 4.25Å; P92-A102 HydrophobicContact CB-CB 4.16Å; P92-A102 HydrophobicContact CG-CB 4.46Å; P92-W103 HydrophobicContact CG-CD2 3.59Å; P92-W103 HydrophobicContact CG-CE3 3.79Å; P92-W103 HydrophobicContact CG-CG 3.99Å; P92-W103 HydrophobicContact CG-CH2 4.33Å; P92-W103 HydrophobicContact CG-CZ2 4.15Å; P92-W103 HydrophobicContact CG-CZ3 4.15Å; P92-C106 VanDerWaalsContact CD-SG 3.55Å; P92-C106 HydrophobicContact CG-CB 4.48Å
93S87.3Confident84.5Confident61 Ų6198 Ų9843%0.42752%0.524SS..PPolyproline II helixtrans-60157.3178.871.60000111.2A91 G95 Q96 K97A91-S93 PolarHBondContact O-N 3.33Å; S93-G95 PolarHBondContact O-N 3.03Å; S93-Q96 PolarHBondContact O-N 2.67Å; S93-Q96 WeakPolarHBondContact OG-CG 3.42Å; S93-Q96 PolarHBondContact OG-OE1 2.95Å; S93-K97 PolarHBondContact O-N 2.95Å
94S83.9Confident85.2Confident108 Ų10899.4 Ų99.476%0.75552%0.522SS*.THydrogen-bonded Turntrans-51.5-33-176.4-49.40000113.9
95G85.5Confident85.6Confident78 Ų7899.2 Ų99.280%0.80452%0.523SS*.THydrogen-bonded Turntrans-82-12.1177.200000115.3S93S93-G95 PolarHBondContact O-N 3.03Å
96Q87.8Confident86.3Confident88 Ų8893.3 Ų93.341%0.41150%0.5SS..THydrogen-bonded Turntrans-107.45.4-176.9-67.9173.9-55.900113P92 S93 N98 D99 A102P92-Q96 HydrophobicContact CB-CB 4.25Å; S93-Q96 PolarHBondContact O-N 2.67Å; S93-Q96 WeakPolarHBondContact OG-CG 3.42Å; S93-Q96 PolarHBondContact OG-OE1 2.95Å; Q96-N98 PolarHBondContact O-N 3.47Å; Q96-N98 VanDerWaalsContact O-N 3.17Å; Q96-D99 HydrophobicContact CB-CB 4.5Å; Q96-D99 WeakPolarHBondContact O-CB 3.46Å; Q96-D99 PolarHBondContact O-N 3.32Å; Q96-A102 HydrophobicContact CB-CB 3.9Å
97K85.3Confident87.1Confident123 Ų12388 Ų8854%0.53549%0.488SS..THydrogen-bonded Turntrans-63.1-23.7-177.5-70.5-174.5175.2-177.20114.5S93 W103S93-K97 PolarHBondContact O-N 2.95Å; K97-W103 PolarHBondContact O-NE1 2.93Å
98N89.2Confident87.7Confident166 Ų16684.9 Ų84.989%0.88848%0.482SS*.THydrogen-bonded Turntrans-93.5-3.4176.2-63.3-19.3000112.6Q96Q96-N98 PolarHBondContact O-N 3.47Å; Q96-N98 VanDerWaalsContact O-N 3.17Å
99D92.1Very high88.1Confident65 Ų6581.4 Ų81.435%0.34847%0.467SS..  trans-90.3111.8180179.14.6000110Q96 T101 A102 W103Q96-D99 HydrophobicContact CB-CB 4.5Å; Q96-D99 WeakPolarHBondContact O-CB 3.46Å; Q96-D99 PolarHBondContact O-N 3.32Å; D99-T101 VanDerWaalsContact CG-OG1 3.24Å; D99-T101 PolarHBondContact O-N 3.37Å; D99-T101 PolarHBondContact OD1-N 2.85Å; D99-T101 PolarHBondContact OD1-OG1 3.3Å; D99-T101 PolarHBondContact OD2-OG1 2.95Å; D99-A102 HydrophobicContact CB-CB 4.17Å; D99-A102 PolarHBondContact O-N 3.49Å; D99-W103 VanDerWaalsContact O-CD1 3.28Å; D99-W103 PolarHBondContact O-N 2.94Å
100I91.8Very high88.4Confident123 Ų12378.7 Ų78.763%0.63146%0.457SS*.Hα-helixtrans-62.2-33.7-178.5-62.5171.2000110.8W103 Q104I100-W103 PolarHBondContact O-N 2.85Å; I100-Q104 HydrophobicContact CG2-CG 4.39Å; I100-Q104 WeakPolarHBondContact O-CG 3.46Å; I100-Q104 PolarHBondContact O-N 3.4Å
101T91.9Very high88.8Confident76 Ų7681.3 Ų81.347%0.46647%0.465SS..Hα-helixtrans-69.4-42.7-17861.60000111.5D99 W103 Q104 D105D99-T101 VanDerWaalsContact CG-OG1 3.24Å; D99-T101 PolarHBondContact O-N 3.37Å; D99-T101 PolarHBondContact OD1-N 2.85Å; D99-T101 PolarHBondContact OD1-OG1 3.3Å; D99-T101 PolarHBondContact OD2-OG1 2.95Å; T101-W103 VanDerWaalsContact C-N 3.27Å; T101-W103 PolarHBondContact O-N 3.5Å; T101-Q104 WeakPolarHBondContact O-CB 3.29Å; T101-Q104 PolarHBondContact O-N 2.92Å; T101-Q104 VanDerWaalsContact O-N 3.08Å; T101-D105 PolarHBondContact O-N 3.47Å
102A88.6Confident89.1Confident9 Ų979.7 Ų79.77%0.07445%0.452CS..Hα-helixtrans-58.1-37.9173.300000112.7P92 Q96 D99 C106P92-A102 HydrophobicContact CB-CB 4.16Å; P92-A102 HydrophobicContact CG-CB 4.46Å; Q96-A102 HydrophobicContact CB-CB 3.9Å; D99-A102 HydrophobicContact CB-CB 4.17Å; D99-A102 PolarHBondContact O-N 3.49Å; A102-C106 PolarHBondContact O-N 3.46Å; A102-C106 PolarHBondContact O-SG 3.12Å; A102-C106 VanDerWaalsContact O-SG 3.36Å
103W89.7Confident89.3Confident120 Ų12080.7 Ų80.746%0.45546%0.456SS..Hα-helixtrans-69-41.3173.3-77.1104.9000112.8P92 K97 D99 I100 T101 D105 C106 V107P92-W103 HydrophobicContact CG-CD2 3.59Å; P92-W103 HydrophobicContact CG-CE3 3.79Å; P92-W103 HydrophobicContact CG-CG 3.99Å; P92-W103 HydrophobicContact CG-CH2 4.33Å; P92-W103 HydrophobicContact CG-CZ2 4.15Å; P92-W103 HydrophobicContact CG-CZ3 4.15Å; K97-W103 PolarHBondContact O-NE1 2.93Å; D99-W103 VanDerWaalsContact O-CD1 3.28Å; D99-W103 PolarHBondContact O-N 2.94Å; I100-W103 PolarHBondContact O-N 2.85Å; T101-W103 VanDerWaalsContact C-N 3.27Å; T101-W103 PolarHBondContact O-N 3.5Å; W103-D105 VanDerWaalsContact C-N 3.32Å; W103-D105 PolarHBondContact O-N 3.38Å; W103-C106 PolarHBondContact O-N 3.44Å; W103-V107 VanDerWaalsContact O-CG2 3.31Å; W103-V107 WeakPolarHBondContact O-CG2 3.49Å; W103-V107 PolarHBondContact O-N 3.22Å
104Q91.7Very high89.5Confident107 Ų10783.6 Ų83.650%0.547%0.466SS..Hα-helixtrans-59.9-42.6175.6-74.2171.6-13.700111.3I100 T101 V107 N108I100-Q104 HydrophobicContact CG2-CG 4.39Å; I100-Q104 WeakPolarHBondContact O-CG 3.46Å; I100-Q104 PolarHBondContact O-N 3.4Å; T101-Q104 WeakPolarHBondContact O-CB 3.29Å; T101-Q104 PolarHBondContact O-N 2.92Å; T101-Q104 VanDerWaalsContact O-N 3.08Å; Q104-V107 PolarHBondContact O-N 3.36Å; Q104-N108 WeakPolarHBondContact O-CB 3.31Å; Q104-N108 PolarHBondContact O-N 3.38Å; Q104-N108 PolarHBondContact O-ND2 3Å
105D88.8Confident90Very high104 Ų10484.4 Ų84.456%0.55646%0.458SS*.Hα-helixtrans-63.6-43.8177.3-72.2-18.4000112.1T101 W103 V107 N108 N109T101-D105 PolarHBondContact O-N 3.47Å; W103-D105 VanDerWaalsContact C-N 3.32Å; W103-D105 PolarHBondContact O-N 3.38Å; D105-V107 VanDerWaalsContact C-N 3.34Å; D105-V107 PolarHBondContact O-N 3.34Å; D105-N108 PolarHBondContact O-N 3.27Å; D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 PolarHBondContact O-N 3.5Å
106C88.4Confident90.3Very high26 Ų2687 Ų8718%0.17645%0.449CS..Hα-helixtrans-60.9-41.6174.3-73.80000112.1P90 P92 A102 W103 S110P90-C106 PolarHBondContact O-SG 3.36Å; P92-C106 VanDerWaalsContact CD-SG 3.55Å; P92-C106 HydrophobicContact CG-CB 4.48Å; A102-C106 PolarHBondContact O-N 3.46Å; A102-C106 PolarHBondContact O-SG 3.12Å; A102-C106 VanDerWaalsContact O-SG 3.36Å; W103-C106 PolarHBondContact O-N 3.44Å; C106-S110 WeakPolarHBondContact O-CB 3.46Å; C106-S110 PolarHBondContact O-N 2.9Å; C106-S110 PolarHBondContact O-OG 2.97Å
107V90.6Very high90.6Very high68 Ų6887.5 Ų87.541%0.41245%0.451SS..Hα-helixtrans-66.3-46.6177170.70000111W103 Q104 D105 N109 S110 M111W103-V107 VanDerWaalsContact O-CG2 3.31Å; W103-V107 WeakPolarHBondContact O-CG2 3.49Å; W103-V107 PolarHBondContact O-N 3.22Å; Q104-V107 PolarHBondContact O-N 3.36Å; D105-V107 VanDerWaalsContact C-N 3.34Å; D105-V107 PolarHBondContact O-N 3.34Å; V107-N109 VanDerWaalsContact C-N 3.34Å; V107-N109 PolarHBondContact O-N 3.42Å; V107-S110 WeakPolarHBondContact O-CB 3.43Å; V107-S110 PolarHBondContact O-N 2.89Å; V107-S110 VanDerWaalsContact O-N 3.11Å; V107-M111 HydrophobicContact CG1-CE 3.46Å; V107-M111 VanDerWaalsContact CG1-CE 3.46Å; V107-M111 HydrophobicContact CG1-CG 4.47Å; V107-M111 HydrophobicContact CG1-SD 4.18Å; V107-M111 WeakPolarHBondContact O-CG 3.25Å; V107-M111 PolarHBondContact O-N 3.27Å
108N90.6Very high91.1Very high94 Ų9484.1 Ų84.150%0.50345%0.446SS..Hα-helixtrans-59.7-43.9177.5-71.2-23.3000111.5Q104 D105 S110 M111 A112Q104-N108 WeakPolarHBondContact O-CB 3.31Å; Q104-N108 PolarHBondContact O-N 3.38Å; Q104-N108 PolarHBondContact O-ND2 3Å; D105-N108 PolarHBondContact O-N 3.27Å; N108-S110 VanDerWaalsContact C-N 3.33Å; N108-S110 PolarHBondContact O-N 3.4Å; N108-M111 PolarHBondContact O-N 3.48Å; N108-A112 WeakPolarHBondContact O-CB 3.45Å; N108-A112 PolarHBondContact O-N 3.25Å
109N89.4Confident91.4Very high36 Ų3679.4 Ų79.419%0.19342%0.423CS..Hα-helixtrans-62.9-39.9174.8-176.861.9000111.6R86 E88 D105 V107 A112 Q113R86-N109 PolarHBondContact O-OD1 3.48Å; E88-N109 PolarHBondContact O-ND2 3.34Å; D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 PolarHBondContact O-N 3.5Å; V107-N109 VanDerWaalsContact C-N 3.34Å; V107-N109 PolarHBondContact O-N 3.42Å; N109-A112 PolarHBondContact O-N 2.98Å; N109-Q113 PolarHBondContact ND2-NE2 3.09Å; N109-Q113 WeakPolarHBondContact O-CG 3.37Å; N109-Q113 PolarHBondContact O-N 3.31Å
110S90.2Very high91.7Very high52 Ų5283.4 Ų83.436%0.36443%0.433SS..Hα-helixtrans-64.9-43.3176.9-55.80000112.5L89 C106 V107 N108 Q113 L114L89-S110 WeakPolarHBondContact CD2-OG 3.25Å; C106-S110 WeakPolarHBondContact O-CB 3.46Å; C106-S110 PolarHBondContact O-N 2.9Å; C106-S110 PolarHBondContact O-OG 2.97Å; V107-S110 WeakPolarHBondContact O-CB 3.43Å; V107-S110 PolarHBondContact O-N 2.89Å; V107-S110 VanDerWaalsContact O-N 3.11Å; N108-S110 VanDerWaalsContact C-N 3.33Å; N108-S110 PolarHBondContact O-N 3.4Å; S110-Q113 PolarHBondContact O-N 2.6Å; S110-L114 PolarHBondContact O-N 2.97Å
111M91.4Very high91.9Very high115 Ų11582 Ų8257%0.56743%0.427SS*.Hα-helixtrans-62.4-47.2174.9-71175.8-177.900111.1V107 N108 Q113 L114 E115V107-M111 HydrophobicContact CG1-CE 3.46Å; V107-M111 VanDerWaalsContact CG1-CE 3.46Å; V107-M111 HydrophobicContact CG1-CG 4.47Å; V107-M111 HydrophobicContact CG1-SD 4.18Å; V107-M111 WeakPolarHBondContact O-CG 3.25Å; V107-M111 PolarHBondContact O-N 3.27Å; N108-M111 PolarHBondContact O-N 3.48Å; M111-Q113 VanDerWaalsContact C-N 3.29Å; M111-Q113 PolarHBondContact O-N 3.22Å; M111-L114 WeakPolarHBondContact O-CB 3.45Å; M111-L114 PolarHBondContact O-N 3.19Å; M111-E115 PolarHBondContact O-N 2.92Å; M111-E115 VanDerWaalsContact O-N 3.09Å
112A90.6Very high92.2Very high45 Ų4584 Ų8437%0.37243%0.43SS..Hα-helixtrans-59-41.8177.100000111.8N108 N109 E115 H116N108-A112 WeakPolarHBondContact O-CB 3.45Å; N108-A112 PolarHBondContact O-N 3.25Å; N109-A112 PolarHBondContact O-N 2.98Å; A112-E115 PolarHBondContact O-N 3.14Å; A112-H116 WeakPolarHBondContact O-CB 3.42Å; A112-H116 PolarHBondContact O-CD2 2.95Å; A112-H116 PolarHBondContact O-N 2.65Å
113Q90.4Very high92.7Very high30 Ų3087.6 Ų87.614%0.1445%0.449CS..Hα-helixtrans-66.8-38.8176.7-77.3-171.423.600113.2R86 E88 L89 N109 S110 M111 E115 H116 Q117R86-Q113 PolarHBondContact O-NE2 3.45Å; E88-Q113 PolarHBondContact O-NE2 3.18Å; L89-Q113 HydrophobicContact CD2-CB 4.37Å; L89-Q113 HydrophobicContact CD2-CG 4.42Å; L89-Q113 VanDerWaalsContact CD2-OE1 3.25Å; N109-Q113 PolarHBondContact ND2-NE2 3.09Å; N109-Q113 WeakPolarHBondContact O-CG 3.37Å; N109-Q113 PolarHBondContact O-N 3.31Å; S110-Q113 PolarHBondContact O-N 2.6Å; M111-Q113 VanDerWaalsContact C-N 3.29Å; M111-Q113 PolarHBondContact O-N 3.22Å; Q113-E115 VanDerWaalsContact C-N 3.35Å; Q113-H116 PolarHBondContact O-N 3.14Å; Q113-Q117 WeakPolarHBondContact O-CG 3.29Å; Q113-Q117 PolarHBondContact O-N 2.82Å
114L92.1Very high93.1Very high122 Ų12285.9 Ų85.964%0.63945%0.448SS*.Hα-helixtrans-58.8-48.3175.8-179.764.1000110.9S110 M111 H116 Q117 A118S110-L114 PolarHBondContact O-N 2.97Å; M111-L114 WeakPolarHBondContact O-CB 3.45Å; M111-L114 PolarHBondContact O-N 3.19Å; L114-H116 PolarHBondContact O-N 3.18Å; L114-Q117 PolarHBondContact O-N 3.11Å; L114-A118 PolarHBondContact O-N 3.08Å
115E93.8Very high93.3Very high125 Ų12586.1 Ų86.158%0.58445%0.449SS*.Hα-helixtrans-62.7-41.7176.5-65.3-57.3150.900111.7M111 A112 Q113 Q117 A118 V119M111-E115 PolarHBondContact O-N 2.92Å; M111-E115 VanDerWaalsContact O-N 3.09Å; A112-E115 PolarHBondContact O-N 3.14Å; Q113-E115 VanDerWaalsContact C-N 3.35Å; E115-Q117 VanDerWaalsContact C-N 3.3Å; E115-Q117 PolarHBondContact O-N 3.46Å; E115-A118 WeakPolarHBondContact O-CB 3.26Å; E115-A118 PolarHBondContact O-N 2.78Å; E115-V119 WeakPolarHBondContact O-CG2 3.35Å; E115-V119 PolarHBondContact O-N 2.95Å
116H92.5Very high93.8Very high132 Ų13285.2 Ų85.261%0.61144%0.443SS*.Hα-helixtrans-60.9-36.4174.2-81.5-59000113A112 Q113 L114 R120A112-H116 WeakPolarHBondContact O-CB 3.42Å; A112-H116 PolarHBondContact O-CD2 2.95Å; A112-H116 PolarHBondContact O-N 2.65Å; Q113-H116 PolarHBondContact O-N 3.14Å; L114-H116 PolarHBondContact O-N 3.18Å; H116-R120 VanDerWaalsContact O-CB 3.25Å; H116-R120 WeakPolarHBondContact O-CB 3.43Å; H116-R120 PolarHBondContact O-N 3.29Å
117Q92.9Very high94.2Very high100 Ų10089.7 Ų89.747%0.46746%0.464SS..Hα-helixtrans-69.6-39.1174.9-67.6-61.3-19.700111.6Q113 L114 E115 R120 I121Q113-Q117 WeakPolarHBondContact O-CG 3.29Å; Q113-Q117 PolarHBondContact O-N 2.82Å; L114-Q117 PolarHBondContact O-N 3.11Å; E115-Q117 VanDerWaalsContact C-N 3.3Å; E115-Q117 PolarHBondContact O-N 3.46Å; Q117-R120 WeakPolarHBondContact O-CB 3.39Å; Q117-R120 PolarHBondContact O-N 3.35Å; Q117-I121 WeakPolarHBondContact O-CG1 3.19Å; Q117-I121 PolarHBondContact O-N 2.87Å
118A96Very high94.5Very high52 Ų5290.2 Ų90.243%0.4348%0.475SS..Hα-helixtrans-59.6-49.7174.500000111.3L114 E115 R120 I121 E122L114-A118 PolarHBondContact O-N 3.08Å; E115-A118 WeakPolarHBondContact O-CB 3.26Å; E115-A118 PolarHBondContact O-N 2.78Å; A118-R120 VanDerWaalsContact C-N 3.3Å; A118-R120 PolarHBondContact O-N 3.23Å; A118-I121 PolarHBondContact O-N 3.07Å; A118-I121 VanDerWaalsContact O-N 3.17Å; A118-E122 PolarHBondContact O-N 3.3Å; A118-E122 VanDerWaalsContact O-N 3.1Å
119V97Very high94.8Very high67 Ų6792.2 Ų92.241%0.40648%0.481SS..Hα-helixtrans-62.4-36.9175.5172.50000111.8E115 I121 E122 N123E115-V119 WeakPolarHBondContact O-CG2 3.35Å; E115-V119 PolarHBondContact O-N 2.95Å; V119-I121 VanDerWaalsContact C-N 3.34Å; V119-E122 PolarHBondContact O-N 2.85Å; V119-N123 WeakPolarHBondContact CG1-ND2 3.46Å; V119-N123 WeakPolarHBondContact O-CB 3.43Å; V119-N123 PolarHBondContact O-N 2.71Å; V119-N123 PolarHBondContact O-ND2 3.34Å; V119-N123 VanDerWaalsContact O-ND2 3.15Å
120R96.4Very high95.2Very high148 Ų14898 Ų9856%0.55850%0.501SS*.Hα-helixtrans-62.8-41.6175.7179.8179.2179.6149.40.3111.5H116 Q117 A118 N123 L124H116-R120 VanDerWaalsContact O-CB 3.25Å; H116-R120 WeakPolarHBondContact O-CB 3.43Å; H116-R120 PolarHBondContact O-N 3.29Å; Q117-R120 WeakPolarHBondContact O-CB 3.39Å; Q117-R120 PolarHBondContact O-N 3.35Å; A118-R120 VanDerWaalsContact C-N 3.3Å; A118-R120 PolarHBondContact O-N 3.23Å; R120-N123 PolarHBondContact O-N 3.02Å; R120-L124 HydrophobicContact CG-CD1 4Å; R120-L124 HydrophobicContact CG-CG 4.38Å; R120-L124 WeakPolarHBondContact O-CB 3.31Å; R120-L124 VanDerWaalsContact O-CG 3.24Å; R120-L124 WeakPolarHBondContact O-CG 3.39Å; R120-L124 PolarHBondContact O-N 3.25Å
121I97.8Very high95.5Very high95 Ų9596.7 Ų96.749%0.48750%0.496SS..Hα-helixtrans-62.1-49.4176.9-68.7164.5000109.6Q117 A118 V119 N123 L124 E125Q117-I121 WeakPolarHBondContact O-CG1 3.19Å; Q117-I121 PolarHBondContact O-N 2.87Å; A118-I121 PolarHBondContact O-N 3.07Å; A118-I121 VanDerWaalsContact O-N 3.17Å; V119-I121 VanDerWaalsContact C-N 3.34Å; I121-N123 VanDerWaalsContact C-N 3.34Å; I121-N123 PolarHBondContact O-N 2.85Å; I121-L124 PolarHBondContact O-N 3.07Å; I121-L124 VanDerWaalsContact O-N 3.08Å; I121-E125 HydrophobicContact CG2-CG 4.44Å; I121-E125 WeakPolarHBondContact O-CG 2.98Å; I121-E125 PolarHBondContact O-N 3.29Å
122E97.8Very high95.8Very high116 Ų11695.6 Ų95.654%0.54250%0.496SS..Hα-helixtrans-56.1-46.4176.6-176.2-178.5-177.600111.9A118 V119 L124 E125 L126A118-E122 PolarHBondContact O-N 3.3Å; A118-E122 VanDerWaalsContact O-N 3.1Å; V119-E122 PolarHBondContact O-N 2.85Å; E122-L124 VanDerWaalsContact C-N 3.34Å; E122-L124 PolarHBondContact O-N 3.18Å; E122-E125 PolarHBondContact O-N 3.46Å; E122-L126 WeakPolarHBondContact O-CG 2.99Å; E122-L126 PolarHBondContact O-N 2.82Å
123N97.9Very high96.1Very high86 Ų8698.2 Ų98.246%0.4650%0.504SS..Hα-helixtrans-63.6-37.6176.8-75.9-37000112.9V119 R120 I121 L126 M127V119-N123 WeakPolarHBondContact CG1-ND2 3.46Å; V119-N123 WeakPolarHBondContact O-CB 3.43Å; V119-N123 PolarHBondContact O-N 2.71Å; V119-N123 PolarHBondContact O-ND2 3.34Å; V119-N123 VanDerWaalsContact O-ND2 3.15Å; R120-N123 PolarHBondContact O-N 3.02Å; I121-N123 VanDerWaalsContact C-N 3.34Å; I121-N123 PolarHBondContact O-N 2.85Å; N123-L126 PolarHBondContact O-N 3.42Å; N123-M127 WeakPolarHBondContact O-CB 3.09Å; N123-M127 PolarHBondContact O-N 3.45Å
124L97.9Very high96.4Very high84 Ų8499.8 Ų99.844%0.4452%0.522SS..Hα-helixtrans-69.7-35.9176.6-75.2172.6000111.7R120 I121 E122 M127 A128R120-L124 HydrophobicContact CG-CD1 4Å; R120-L124 HydrophobicContact CG-CG 4.38Å; R120-L124 WeakPolarHBondContact O-CB 3.31Å; R120-L124 VanDerWaalsContact O-CG 3.24Å; R120-L124 WeakPolarHBondContact O-CG 3.39Å; R120-L124 PolarHBondContact O-N 3.25Å; I121-L124 PolarHBondContact O-N 3.07Å; I121-L124 VanDerWaalsContact O-N 3.08Å; E122-L124 VanDerWaalsContact C-N 3.34Å; E122-L124 PolarHBondContact O-N 3.18Å; L124-M127 HydrophobicContact CD2-CE 4.3Å; L124-M127 PolarHBondContact O-N 3.44Å; L124-A128 VanDerWaalsContact O-CB 3.32Å; L124-A128 WeakPolarHBondContact O-CB 3.01Å; L124-A128 PolarHBondContact O-N 2.96Å
125E97.6Very high96.7Very high111 Ų111101.3 Ų101.352%0.51952%0.519SS..Hα-helixtrans-62.9-48.6172.6-71.7175.4171.600110.4I121 E122 M127 A128 H129I121-E125 HydrophobicContact CG2-CG 4.44Å; I121-E125 WeakPolarHBondContact O-CG 2.98Å; I121-E125 PolarHBondContact O-N 3.29Å; E122-E125 PolarHBondContact O-N 3.46Å; E125-M127 VanDerWaalsContact C-N 3.3Å; E125-M127 PolarHBondContact O-N 2.89Å; E125-A128 PolarHBondContact O-N 3.4Å; E125-H129 PolarHBondContact O-CD2 3.39Å; E125-H129 PolarHBondContact O-N 2.96Å
126L97.7Very high96.9Very high85 Ų85101 Ų10145%0.44552%0.516SS..Hα-helixtrans-57.6-43.5174.1-70.4174.9000112E122 N123 H129 Y130E122-L126 WeakPolarHBondContact O-CG 2.99Å; E122-L126 PolarHBondContact O-N 2.82Å; N123-L126 PolarHBondContact O-N 3.42Å; L126-H129 PolarHBondContact O-N 2.95Å; L126-Y130 HydrophobicContact CD2-CD2 4.38Å; L126-Y130 HydrophobicContact CD2-CE2 4.09Å; L126-Y130 WeakPolarHBondContact O-CD2 3.17Å; L126-Y130 PolarHBondContact O-N 3.48Å
127M97.3Very high97.2Very high121 Ų12198.8 Ų98.860%0.59651%0.511SS*.Hα-helixtrans-65.3-40.2177.4-169.8-173.1-49.600112.1N123 L124 E125 H129 G131N123-M127 WeakPolarHBondContact O-CB 3.09Å; N123-M127 PolarHBondContact O-N 3.45Å; L124-M127 HydrophobicContact CD2-CE 4.3Å; L124-M127 PolarHBondContact O-N 3.44Å; E125-M127 VanDerWaalsContact C-N 3.3Å; E125-M127 PolarHBondContact O-N 2.89Å; M127-H129 VanDerWaalsContact C-N 3.3Å; M127-H129 PolarHBondContact O-N 3.38Å; M127-G131 WeakPolarHBondContact O-CA 3.47Å; M127-G131 PolarHBondContact O-N 2.95Å
128A96.9Very high97.5Very high78 Ų7899.7 Ų99.765%0.64551%0.511SS*.Hα-helixtrans-63.7-37.9176.200000111.4L124 E125L124-A128 VanDerWaalsContact O-CB 3.32Å; L124-A128 WeakPolarHBondContact O-CB 3.01Å; L124-A128 PolarHBondContact O-N 2.96Å; E125-A128 PolarHBondContact O-N 3.4Å
129H96.7Very high97.6Very high136 Ų136100.3 Ų100.363%0.6351%0.508SS*.Hα-helixtrans-73.2-45.7178.7-73.7-59.2000113.5E125 L126 M127E125-H129 PolarHBondContact O-CD2 3.39Å; E125-H129 PolarHBondContact O-N 2.96Å; L126-H129 PolarHBondContact O-N 2.95Å; M127-H129 VanDerWaalsContact C-N 3.3Å; M127-H129 PolarHBondContact O-N 3.38Å
130Y97.6Very high97.6Very high157 Ų157102.4 Ų102.462%0.61652%0.516SS*.Hα-helixtrans-112.7-20.6-168.4-59.5-71.4000114.6L126 T132 N133 A134L126-Y130 HydrophobicContact CD2-CD2 4.38Å; L126-Y130 HydrophobicContact CD2-CE2 4.09Å; L126-Y130 WeakPolarHBondContact O-CD2 3.17Å; L126-Y130 PolarHBondContact O-N 3.48Å; Y130-T132 PolarHBondContact O-N 2.93Å; Y130-N133 PolarHBondContact O-N 2.99Å; Y130-A134 WeakPolarHBondContact O-CB 3.46Å; Y130-A134 PolarHBondContact O-N 3.38Å
131G97.3Very high97.7Very high26 Ų2699.7 Ų99.727%0.26851%0.513SS..Hα-helixtrans-58.4-44.6-170.400000113.2M127 N133 A134 W135M127-G131 WeakPolarHBondContact O-CA 3.47Å; M127-G131 PolarHBondContact O-N 2.95Å; G131-N133 PolarHBondContact O-N 2.84Å; G131-A134 PolarHBondContact O-N 3.38Å; G131-W135 VanDerWaalsContact O-CB 3.29Å; G131-W135 WeakPolarHBondContact O-CB 3.23Å; G131-W135 PolarHBondContact O-N 2.91Å
132T97.2Very high97.8Very high91 Ų9198.7 Ų98.756%0.55851%0.508SS*.Hα-helixtrans-61.1-42.8179.7-55.80000112.3Y130 K136Y130-T132 PolarHBondContact O-N 2.93Å; T132-K136 WeakPolarHBondContact O-CG 3.37Å; T132-K136 PolarHBondContact O-N 2.87Å; T132-K136 VanDerWaalsContact O-N 3.14Å
133N97.1Very high97.8Very high101 Ų10195.9 Ų95.954%0.5451%0.505SS..Hα-helixtrans-74.1-40.4-179.3-71.1-26000111.6Y130 G131 W135 K136 V137Y130-N133 PolarHBondContact O-N 2.99Å; G131-N133 PolarHBondContact O-N 2.84Å; N133-W135 VanDerWaalsContact C-N 3.3Å; N133-W135 PolarHBondContact O-N 3.19Å; N133-K136 PolarHBondContact O-N 2.92Å; N133-V137 PolarHBondContact O-N 3.45Å
134A97.8Very high97.8Very high62 Ų6297.9 Ų97.951%0.51251%0.51SS..Hα-helixtrans-59.6-41.9173.200000111.6Y130 G131 V137 Y138Y130-A134 WeakPolarHBondContact O-CB 3.46Å; Y130-A134 PolarHBondContact O-N 3.38Å; G131-A134 PolarHBondContact O-N 3.38Å; A134-V137 PolarHBondContact O-N 2.94Å; A134-Y138 WeakPolarHBondContact O-CB 3.42Å; A134-Y138 PolarHBondContact O-N 3.44Å
135W97.9Very high97.9Very high154 Ų15499.8 Ų99.858%0.58352%0.518SS*.Hα-helixtrans-66.9-36.9179.2-161.9-112.1000113G131 N133 Y138 N139G131-W135 VanDerWaalsContact O-CB 3.29Å; G131-W135 WeakPolarHBondContact O-CB 3.23Å; G131-W135 PolarHBondContact O-N 2.91Å; N133-W135 VanDerWaalsContact C-N 3.3Å; N133-W135 PolarHBondContact O-N 3.19Å; W135-Y138 HydrophobicContact CD2-CD1 4.38Å; W135-Y138 HydrophobicContact CE3-CD1 4.06Å; W135-Y138 HydrophobicContact CH2-CD1 4Å; W135-Y138 AromaticContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CZ2-CD1 4.32Å; W135-Y138 HydrophobicContact CZ2-CE1 4.38Å; W135-Y138 AromaticContact CZ3-CD1 3.87Å; W135-Y138 HydrophobicContact CZ3-CD1 3.87Å; W135-Y138 HydrophobicContact CZ3-CE1 4.13Å; W135-Y138 HydrophobicContact CZ3-CG 4.47Å; W135-Y138 PolarHBondContact O-N 3.4Å; W135-N139 VanDerWaalsContact CD1-ND2 3.3Å; W135-N139 PolarHBondContact NE1-ND2 3.36Å; W135-N139 WeakPolarHBondContact O-CB 3.5Å; W135-N139 PolarHBondContact O-N 3.43Å; W135-N139 PolarHBondContact O-ND2 3.5Å
136K98Very high97.9Very high119 Ų11998.5 Ų98.552%0.51751%0.514SS..Hα-helixtrans-60.7-49.7173.4-74172.4-178.9177.60111.5T132 N133 Y138 N139 D140T132-K136 WeakPolarHBondContact O-CG 3.37Å; T132-K136 PolarHBondContact O-N 2.87Å; T132-K136 VanDerWaalsContact O-N 3.14Å; N133-K136 PolarHBondContact O-N 2.92Å; K136-Y138 VanDerWaalsContact C-N 3.3Å; K136-Y138 PolarHBondContact O-N 3.03Å; K136-N139 WeakPolarHBondContact O-CB 3.5Å; K136-N139 PolarHBondContact O-N 3.06Å; K136-N139 VanDerWaalsContact O-N 3.11Å; K136-D140 PolarHBondContact O-N 3.46Å
137V98.3Very high97.9Very high85 Ų8598.8 Ų98.852%0.51551%0.513SS..Hα-helixtrans-61.4-40.8177.6174.40000111.3N133 A134 N139 D140 N141N133-V137 PolarHBondContact O-N 3.45Å; A134-V137 PolarHBondContact O-N 2.94Å; V137-N139 VanDerWaalsContact C-N 3.34Å; V137-N139 PolarHBondContact O-N 3.03Å; V137-D140 PolarHBondContact O-N 3.21Å; V137-N141 PolarHBondContact O-N 3.27Å; V137-N141 PolarHBondContact O-ND2 2.87Å
138Y98.3Very high98Very high119 Ų11997.5 Ų97.547%0.46751%0.508SS..Hα-helixtrans-59.5-44.4174.2176.1-98.8000112.1A134 W135 K136 D140 N141 L142A134-Y138 WeakPolarHBondContact O-CB 3.42Å; A134-Y138 PolarHBondContact O-N 3.44Å; W135-Y138 HydrophobicContact CD2-CD1 4.38Å; W135-Y138 HydrophobicContact CE3-CD1 4.06Å; W135-Y138 HydrophobicContact CH2-CD1 4Å; W135-Y138 AromaticContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CH2-CE1 3.93Å; W135-Y138 HydrophobicContact CZ2-CD1 4.32Å; W135-Y138 HydrophobicContact CZ2-CE1 4.38Å; W135-Y138 AromaticContact CZ3-CD1 3.87Å; W135-Y138 HydrophobicContact CZ3-CD1 3.87Å; W135-Y138 HydrophobicContact CZ3-CE1 4.13Å; W135-Y138 HydrophobicContact CZ3-CG 4.47Å; W135-Y138 PolarHBondContact O-N 3.4Å; K136-Y138 VanDerWaalsContact C-N 3.3Å; K136-Y138 PolarHBondContact O-N 3.03Å; Y138-D140 PolarHBondContact O-N 3.27Å; Y138-N141 PolarHBondContact O-N 2.94Å; Y138-L142 PolarHBondContact O-N 3.28Å
139N98.3Very high98.1Very high66 Ų6696.8 Ų96.835%0.35350%0.502SS..Hα-helixtrans-64.7-38.9177.2-69.3-27.8000112.3W135 K136 V137 N141 L142 A143W135-N139 VanDerWaalsContact CD1-ND2 3.3Å; W135-N139 PolarHBondContact NE1-ND2 3.36Å; W135-N139 WeakPolarHBondContact O-CB 3.5Å; W135-N139 PolarHBondContact O-N 3.43Å; W135-N139 PolarHBondContact O-ND2 3.5Å; K136-N139 WeakPolarHBondContact O-CB 3.5Å; K136-N139 PolarHBondContact O-N 3.06Å; K136-N139 VanDerWaalsContact O-N 3.11Å; V137-N139 VanDerWaalsContact C-N 3.34Å; V137-N139 PolarHBondContact O-N 3.03Å; N139-N141 VanDerWaalsContact C-N 3.35Å; N139-L142 PolarHBondContact O-N 3.32Å; N139-A143 WeakPolarHBondContact O-CB 3.27Å; N139-A143 PolarHBondContact O-N 2.91Å
140D98.4Very high98.2Very high111 Ų11195.8 Ų95.859%0.59450%0.497SS*.Hα-helixtrans-62.7-43.4175.9-66.4-23.8000111K136 V137 Y138 L142 A143 F144K136-D140 PolarHBondContact O-N 3.46Å; V137-D140 PolarHBondContact O-N 3.21Å; Y138-D140 PolarHBondContact O-N 3.27Å; D140-L142 VanDerWaalsContact C-N 3.35Å; D140-L142 PolarHBondContact O-N 3.09Å; D140-A143 PolarHBondContact O-N 3.42Å; D140-F144 WeakPolarHBondContact O-CB 3.3Å; D140-F144 PolarHBondContact O-N 2.97Å
141N98.4Very high98.2Very high91 Ų9193.8 Ų93.849%0.48749%0.492SS..Hα-helixtrans-61.6-43.2174.2-72.3-30000111.7V137 Y138 N139 F144 M145V137-N141 PolarHBondContact O-N 3.27Å; V137-N141 PolarHBondContact O-ND2 2.87Å; Y138-N141 PolarHBondContact O-N 2.94Å; N139-N141 VanDerWaalsContact C-N 3.35Å; N141-F144 PolarHBondContact O-N 3.28Å; N141-M145 WeakPolarHBondContact O-CG 3.32Å; N141-M145 PolarHBondContact O-N 3.45Å
142L98.5Very high98.3Very high74 Ų7497 Ų9739%0.38750%0.5SS..Hα-helixtrans-63.9-43.1178.2-174.164.3000111.4Y138 N139 D140 F144 M145 I146Y138-L142 PolarHBondContact O-N 3.28Å; N139-L142 PolarHBondContact O-N 3.32Å; D140-L142 VanDerWaalsContact C-N 3.35Å; D140-L142 PolarHBondContact O-N 3.09Å; L142-F144 VanDerWaalsContact C-N 3.34Å; L142-F144 PolarHBondContact O-N 3.04Å; L142-M145 PolarHBondContact O-N 2.73Å; L142-I146 HydrophobicContact CG-CD1 4.22Å; L142-I146 VanDerWaalsContact O-CG1 3.31Å; L142-I146 WeakPolarHBondContact O-CG1 3.3Å; L142-I146 PolarHBondContact O-N 3.43Å
143A98.5Very high98.3Very high57 Ų5796.6 Ų96.647%0.47149%0.494SS..Hα-helixtrans-60.9-43.4175.900000111.5N139 D140 I146 E147N139-A143 WeakPolarHBondContact O-CB 3.27Å; N139-A143 PolarHBondContact O-N 2.91Å; D140-A143 PolarHBondContact O-N 3.42Å; A143-I146 PolarHBondContact O-N 3.42Å; A143-E147 PolarHBondContact O-N 3.35Å
144F98.5Very high98.4Very high128 Ų12897.1 Ų97.156%0.56149%0.493SS*.Hα-helixtrans-61.5-44.1175.2177.4-101.5000112.5D140 N141 L142 I146 E147 L148D140-F144 WeakPolarHBondContact O-CB 3.3Å; D140-F144 PolarHBondContact O-N 2.97Å; N141-F144 PolarHBondContact O-N 3.28Å; L142-F144 VanDerWaalsContact C-N 3.34Å; L142-F144 PolarHBondContact O-N 3.04Å; F144-I146 VanDerWaalsContact C-N 3.32Å; F144-I146 PolarHBondContact O-N 2.99Å; F144-E147 PolarHBondContact O-N 2.93Å; F144-L148 PolarHBondContact O-N 3.13Å
145M98.6Very high98.5Very high124 Ų12499.3 Ų99.361%0.61149%0.491SS*.Hα-helixtrans-61.7-40.7176.6-71.7177.469.600112.1N141 L142 L148 A149N141-M145 WeakPolarHBondContact O-CG 3.32Å; N141-M145 PolarHBondContact O-N 3.45Å; L142-M145 PolarHBondContact O-N 2.73Å; M145-L148 PolarHBondContact O-N 2.79Å; M145-A149 WeakPolarHBondContact O-CB 3.34Å; M145-A149 PolarHBondContact O-N 3.41Å
146I98.6Very high98.5Very high84 Ų8494.7 Ų94.743%0.43148%0.482SS..Hα-helixtrans-62.3-46.8175.5-70.3166.5000110.4L142 A143 F144 L148 A149 Q150L142-I146 HydrophobicContact CG-CD1 4.22Å; L142-I146 VanDerWaalsContact O-CG1 3.31Å; L142-I146 WeakPolarHBondContact O-CG1 3.3Å; L142-I146 PolarHBondContact O-N 3.43Å; A143-I146 PolarHBondContact O-N 3.42Å; F144-I146 VanDerWaalsContact C-N 3.32Å; F144-I146 PolarHBondContact O-N 2.99Å; I146-L148 VanDerWaalsContact C-N 3.32Å; I146-L148 PolarHBondContact O-N 3.34Å; I146-A149 PolarHBondContact O-N 2.93Å; I146-Q150 HydrophobicContact CG2-CG 4.31Å; I146-Q150 WeakPolarHBondContact O-CB 3.42Å; I146-Q150 VanDerWaalsContact O-CG 3.29Å; I146-Q150 WeakPolarHBondContact O-CG 3.42Å; I146-Q150 PolarHBondContact O-N 3.27Å
147E98.6Very high98.5Very high90 Ų9094.9 Ų94.942%0.42148%0.479SS..Hα-helixtrans-60.2-43.1179-169.5-172161.400111.5A143 F144 Q150 K151A143-E147 PolarHBondContact O-N 3.35Å; F144-E147 PolarHBondContact O-N 2.93Å; E147-Q150 PolarHBondContact O-N 2.99Å; E147-K151 HydrophobicContact CG-CD 4.46Å; E147-K151 WeakPolarHBondContact O-CG 3.47Å; E147-K151 PolarHBondContact O-N 3.03Å; E147-K151 WeakPolarHBondContact OE1-CE 3.35Å; E147-K151 IonicContact OE1-NZ 3.72Å; E147-K151 PolarHBondContact OE1-NZ 3.47Å
148L98.5Very high98.5Very high94 Ų9497.1 Ų97.149%0.49248%0.482SS..Hα-helixtrans-61.9-47.7177.3-174.965.8000111.7F144 M145 I146 Q150 K151 E152F144-L148 PolarHBondContact O-N 3.13Å; M145-L148 PolarHBondContact O-N 2.79Å; I146-L148 VanDerWaalsContact C-N 3.32Å; I146-L148 PolarHBondContact O-N 3.34Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.44Å; L148-K151 PolarHBondContact O-N 2.82Å; L148-E152 PolarHBondContact O-N 3.46Å; L148-E152 VanDerWaalsContact O-N 3.09Å
149A98.6Very high98.5Very high64 Ų6496.4 Ų96.453%0.52948%0.483SS..Hα-helixtrans-62.5-39.8177.900000112M145 I146 E152 L153M145-A149 WeakPolarHBondContact O-CB 3.34Å; M145-A149 PolarHBondContact O-N 3.41Å; I146-A149 PolarHBondContact O-N 2.93Å; A149-E152 PolarHBondContact O-N 3.38Å; A149-L153 WeakPolarHBondContact O-CB 3.3Å; A149-L153 PolarHBondContact O-N 3.36Å
150Q98.6Very high98.5Very high114 Ų11497.8 Ų97.853%0.53349%0.489SS..Hα-helixtrans-64.8-41.2175.7-74.5177.6-6.900112I146 E147 L148 L153 Q154I146-Q150 HydrophobicContact CG2-CG 4.31Å; I146-Q150 WeakPolarHBondContact O-CB 3.42Å; I146-Q150 VanDerWaalsContact O-CG 3.29Å; I146-Q150 WeakPolarHBondContact O-CG 3.42Å; I146-Q150 PolarHBondContact O-N 3.27Å; E147-Q150 PolarHBondContact O-N 2.99Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.44Å; Q150-L153 PolarHBondContact O-N 2.92Å; Q150-Q154 WeakPolarHBondContact O-CG 3.5Å; Q150-Q154 PolarHBondContact O-N 2.98Å
151K98.6Very high98.5Very high116 Ų11698.7 Ų98.750%0.50449%0.49SS..Hα-helixtrans-60.7-46.5175.9-77.5173.6-177.6167.50111.9E147 L148 L153 Q154 K155E147-K151 HydrophobicContact CG-CD 4.46Å; E147-K151 WeakPolarHBondContact O-CG 3.47Å; E147-K151 PolarHBondContact O-N 3.03Å; E147-K151 WeakPolarHBondContact OE1-CE 3.35Å; E147-K151 IonicContact OE1-NZ 3.72Å; E147-K151 PolarHBondContact OE1-NZ 3.47Å; L148-K151 PolarHBondContact O-N 2.82Å; K151-L153 PolarHBondContact O-N 3.42Å; K151-Q154 PolarHBondContact O-N 3.4Å; K151-K155 WeakPolarHBondContact O-CB 3.19Å; K151-K155 PolarHBondContact O-N 2.92Å
152E98.6Very high98.5Very high92 Ų9298 Ų9843%0.4349%0.486SS..Hα-helixtrans-63.8-40.8176.6-73.1-58.1133.400111.7L148 A149 Q154 K155 C156L148-E152 PolarHBondContact O-N 3.46Å; L148-E152 VanDerWaalsContact O-N 3.09Å; A149-E152 PolarHBondContact O-N 3.38Å; E152-Q154 VanDerWaalsContact C-N 3.34Å; E152-Q154 PolarHBondContact O-N 3.48Å; E152-K155 WeakPolarHBondContact O-CB 3.38Å; E152-K155 PolarHBondContact O-N 2.84Å; E152-K155 IonicContact OE1-NZ 2.79Å; E152-K155 IonicContact OE2-NZ 2.73Å; E152-C156 PolarHBondContact O-N 3.24Å; E152-C156 PolarHBondContact O-SG 3.3Å; E152-C156 VanDerWaalsContact O-SG 3.41Å
153L98.6Very high98.5Very high84 Ų8499.2 Ų99.244%0.4449%0.493SS..Hα-helixtrans-59-44.5174.3178.963.4000112.1A149 Q150 K151 K155 C156 R157A149-L153 WeakPolarHBondContact O-CB 3.3Å; A149-L153 PolarHBondContact O-N 3.36Å; Q150-L153 PolarHBondContact O-N 2.92Å; K151-L153 PolarHBondContact O-N 3.42Å; L153-K155 VanDerWaalsContact C-N 3.35Å; L153-C156 PolarHBondContact O-N 3.5Å; L153-R157 HydrophobicContact CD1-CG 4.45Å; L153-R157 WeakPolarHBondContact O-CB 3.43Å; L153-R157 VanDerWaalsContact O-CG 3.32Å; L153-R157 WeakPolarHBondContact O-CG 3.25Å; L153-R157 PolarHBondContact O-N 3.32Å
154Q98.6Very high98.4Very high111 Ų11199 Ų9952%0.51948%0.484SS..Hα-helixtrans-66.1-38.7178.4-67.6-58.4-19.600112Q150 K151 E152 R157 K158Q150-Q154 WeakPolarHBondContact O-CG 3.5Å; Q150-Q154 PolarHBondContact O-N 2.98Å; K151-Q154 PolarHBondContact O-N 3.4Å; E152-Q154 VanDerWaalsContact C-N 3.34Å; E152-Q154 PolarHBondContact O-N 3.48Å; Q154-R157 PolarHBondContact O-N 2.91Å; Q154-K158 WeakPolarHBondContact O-CB 3.29Å; Q154-K158 PolarHBondContact O-N 2.97Å
155K98.6Very high98.4Very high109 Ų109100.8 Ų100.847%0.47449%0.487SS..Hα-helixtrans-60.9-48.3174.2-177.9-175.4173.9-168.70111.5K151 E152 L153 R157 K158 Q159K151-K155 WeakPolarHBondContact O-CB 3.19Å; K151-K155 PolarHBondContact O-N 2.92Å; E152-K155 WeakPolarHBondContact O-CB 3.38Å; E152-K155 PolarHBondContact O-N 2.84Å; E152-K155 IonicContact OE1-NZ 2.79Å; E152-K155 IonicContact OE2-NZ 2.73Å; L153-K155 VanDerWaalsContact C-N 3.35Å; K155-R157 PolarHBondContact O-N 3.48Å; K155-K158 PolarHBondContact O-N 3.14Å; K155-Q159 WeakPolarHBondContact O-CG 3.43Å; K155-Q159 PolarHBondContact O-N 3.24Å
156C98.5Very high98.3Very high56 Ų5699.8 Ų99.838%0.37848%0.481SS..Hα-helixtrans-61.7-43.1176-69.10000111.9E152 L153 K158 Q159 I160E152-C156 PolarHBondContact O-N 3.24Å; E152-C156 PolarHBondContact O-SG 3.3Å; E152-C156 VanDerWaalsContact O-SG 3.41Å; L153-C156 PolarHBondContact O-N 3.5Å; C156-K158 VanDerWaalsContact C-N 3.34Å; C156-K158 PolarHBondContact O-N 3.24Å; C156-Q159 PolarHBondContact O-N 3.44Å; C156-I160 VanDerWaalsContact O-CG1 3.28Å; C156-I160 WeakPolarHBondContact O-CG1 3.21Å; C156-I160 PolarHBondContact O-N 3.37Å
157R98.6Very high98.2Very high124 Ų124102 Ų10247%0.46848%0.484SS..Hα-helixtrans-59.8-44176.2-78176.2173.8175.7-2112.1L153 Q154 K155 I160 Q161L153-R157 HydrophobicContact CD1-CG 4.45Å; L153-R157 WeakPolarHBondContact O-CB 3.43Å; L153-R157 VanDerWaalsContact O-CG 3.32Å; L153-R157 WeakPolarHBondContact O-CG 3.25Å; L153-R157 PolarHBondContact O-N 3.32Å; Q154-R157 PolarHBondContact O-N 2.91Å; K155-R157 PolarHBondContact O-N 3.48Å; R157-I160 PolarHBondContact O-N 3.36Å; R157-Q161 WeakPolarHBondContact O-CB 3.45Å; R157-Q161 VanDerWaalsContact O-CG 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.34Å; R157-Q161 PolarHBondContact O-N 3.47Å
158K98.6Very high98Very high131 Ų131102.4 Ų102.457%0.5748%0.484SS*.Hα-helixtrans-61-47.4175.9-176.2177.9177-178.90111.2Q154 K155 C156 I160 Q161 D162Q154-K158 WeakPolarHBondContact O-CB 3.29Å; Q154-K158 PolarHBondContact O-N 2.97Å; K155-K158 PolarHBondContact O-N 3.14Å; C156-K158 VanDerWaalsContact C-N 3.34Å; C156-K158 PolarHBondContact O-N 3.24Å; K158-I160 VanDerWaalsContact C-N 3.33Å; K158-I160 PolarHBondContact O-N 2.9Å; K158-Q161 PolarHBondContact O-N 3.31Å; K158-Q161 VanDerWaalsContact O-N 3.13Å; K158-D162 WeakPolarHBondContact O-CB 3.35Å; K158-D162 VanDerWaalsContact O-CG 3.25Å; K158-D162 PolarHBondContact O-N 3.02Å
159Q98.5Very high98Very high104 Ų104101 Ų10149%0.48648%0.477SS..Hα-helixtrans-58.7-43.1177.2-71.3173.3-2600112.4K155 C156 D162 L163K155-Q159 WeakPolarHBondContact O-CG 3.43Å; K155-Q159 PolarHBondContact O-N 3.24Å; C156-Q159 PolarHBondContact O-N 3.44Å; Q159-D162 PolarHBondContact O-N 3.09Å; Q159-L163 WeakPolarHBondContact O-CB 3.28Å; Q159-L163 WeakPolarHBondContact O-CG 3.23Å; Q159-L163 PolarHBondContact O-N 3.26Å
160I98.4Very high97.8Very high96 Ų96103.5 Ų103.549%0.49248%0.481SS..Hα-helixtrans-62.5-43.7175.8-68.5164.9000110.7C156 R157 K158 N164C156-I160 VanDerWaalsContact O-CG1 3.28Å; C156-I160 WeakPolarHBondContact O-CG1 3.21Å; C156-I160 PolarHBondContact O-N 3.37Å; R157-I160 PolarHBondContact O-N 3.36Å; K158-I160 VanDerWaalsContact C-N 3.33Å; K158-I160 PolarHBondContact O-N 2.9Å; I160-N164 WeakPolarHBondContact O-CB 3.37Å; I160-N164 VanDerWaalsContact O-CG 3.3Å; I160-N164 PolarHBondContact O-N 2.95Å; I160-N164 PolarHBondContact O-ND2 2.69Å
161Q98.3Very high97.6Very high129 Ų12999 Ų9960%0.60346%0.461SS*.Hα-helixtrans-64.9-45.3178.4-75.1176.8-200112.1R157 K158 L163 N164 W165R157-Q161 WeakPolarHBondContact O-CB 3.45Å; R157-Q161 VanDerWaalsContact O-CG 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.34Å; R157-Q161 PolarHBondContact O-N 3.47Å; K158-Q161 PolarHBondContact O-N 3.31Å; K158-Q161 VanDerWaalsContact O-N 3.13Å; Q161-L163 PolarHBondContact O-N 3.28Å; Q161-N164 PolarHBondContact O-N 2.93Å; Q161-W165 WeakPolarHBondContact O-CB 3.43Å; Q161-W165 PolarHBondContact O-N 2.95Å
162D98.3Very high97.4Very high77 Ų7796.9 Ų96.941%0.41245%0.454SS..Hα-helixtrans-60.7-45.1178.7-67.9-18.7000110.7K158 Q159 W165 Q166K158-D162 WeakPolarHBondContact O-CB 3.35Å; K158-D162 VanDerWaalsContact O-CG 3.25Å; K158-D162 PolarHBondContact O-N 3.02Å; Q159-D162 PolarHBondContact O-N 3.09Å; D162-W165 PolarHBondContact O-N 2.65Å; D162-Q166 WeakPolarHBondContact O-CG 3.38Å; D162-Q166 PolarHBondContact O-N 3.18Å
163L97.9Very high97.2Very high100 Ų10095.6 Ų95.652%0.52446%0.459SS..Hα-helixtrans-62.8-45.2175.3-76.5170.7000112.5Q159 Q161 W165 Q166 R167Q159-L163 WeakPolarHBondContact O-CB 3.28Å; Q159-L163 WeakPolarHBondContact O-CG 3.23Å; Q159-L163 PolarHBondContact O-N 3.26Å; Q161-L163 PolarHBondContact O-N 3.28Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.4Å; L163-Q166 PolarHBondContact O-N 3.06Å; L163-R167 WeakPolarHBondContact O-CB 3.17Å; L163-R167 PolarHBondContact O-N 2.98Å
164N97Very high97Very high52 Ų5293.1 Ų93.128%0.27845%0.454SS..Hα-helixtrans-65.6-35.5177.9-78.9-22.6000111.8I160 Q161 K168I160-N164 WeakPolarHBondContact O-CB 3.37Å; I160-N164 VanDerWaalsContact O-CG 3.3Å; I160-N164 PolarHBondContact O-N 2.95Å; I160-N164 PolarHBondContact O-ND2 2.69Å; Q161-N164 PolarHBondContact O-N 2.93Å; N164-K168 VanDerWaalsContact O-CB 3.28Å; N164-K168 WeakPolarHBondContact O-CB 3.34Å; N164-K168 PolarHBondContact O-N 3.43Å
165W97.9Very high96.7Very high165 Ų16587.9 Ų87.963%0.62543%0.429SS*.Hα-helixtrans-65.8-46.9175.8-179.177.2000111.5Q161 D162 L163 K168 N169Q161-W165 WeakPolarHBondContact O-CB 3.43Å; Q161-W165 PolarHBondContact O-N 2.95Å; D162-W165 PolarHBondContact O-N 2.65Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.4Å; W165-K168 PolarHBondContact O-N 3.29Å; W165-N169 WeakPolarHBondContact CH2-ND2 3.49Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.32Å; W165-N169 PolarHBondContact O-N 3.48Å
166Q97.2Very high96.6Very high104 Ų10485.3 Ų85.349%0.48643%0.429SS..Hα-helixtrans-57.3-52.4173.3-72.6174.8-7.400111D162 L163 K168 N169 D170D162-Q166 WeakPolarHBondContact O-CG 3.38Å; D162-Q166 PolarHBondContact O-N 3.18Å; L163-Q166 PolarHBondContact O-N 3.06Å; Q166-K168 VanDerWaalsContact C-N 3.3Å; Q166-K168 PolarHBondContact O-N 2.95Å; Q166-N169 PolarHBondContact O-N 3.33Å; Q166-N169 VanDerWaalsContact O-N 3.09Å; Q166-D170 PolarHBondContact O-N 2.96Å
167R95.4Very high96.4Very high131 Ų13187.3 Ų87.349%0.49443%0.431SS..Hα-helixtrans-55.9-43.7178-173.8-177.7-65.1157-1.6112Y18 L163 D170 Q171Y18-R167 HydrophobicContact CD2-CG 4.29Å; Y18-R167 HydrophobicContact CE2-CB 4.35Å; Y18-R167 HydrophobicContact CE2-CG 4.17Å; L163-R167 WeakPolarHBondContact O-CB 3.17Å; L163-R167 PolarHBondContact O-N 2.98Å; R167-D170 PolarHBondContact O-N 3.31Å; R167-Q171 HydrophobicContact CG-CG 4.28Å; R167-Q171 VanDerWaalsContact CG-NE2 3.35Å; R167-Q171 WeakPolarHBondContact O-CB 3.43Å; R167-Q171 WeakPolarHBondContact O-CG 3.32Å; R167-Q171 PolarHBondContact O-N 3.44Å
168K95.6Very high96.3Very high97 Ų9785.7 Ų85.742%0.42243%0.431SS..Hα-helixtrans-61.7-44.7177.9-178.3177.7179.7-179.70111.5Y18 N164 W165 Q166 L172Y18-K168 HydrophobicContact CD1-CB 4.23Å; Y18-K168 HydrophobicContact CD1-CD 4.24Å; Y18-K168 HydrophobicContact CD1-CG 4.05Å; Y18-K168 HydrophobicContact CD2-CB 3.89Å; Y18-K168 HydrophobicContact CD2-CG 4.41Å; Y18-K168 HydrophobicContact CE1-CB 4.43Å; Y18-K168 HydrophobicContact CE1-CD 4.49Å; Y18-K168 HydrophobicContact CE2-CB 4.09Å; Y18-K168 HydrophobicContact CG-CB 3.97Å; Y18-K168 HydrophobicContact CG-CG 3.98Å; N164-K168 VanDerWaalsContact O-CB 3.28Å; N164-K168 WeakPolarHBondContact O-CB 3.34Å; N164-K168 PolarHBondContact O-N 3.43Å; W165-K168 PolarHBondContact O-N 3.29Å; Q166-K168 VanDerWaalsContact C-N 3.3Å; Q166-K168 PolarHBondContact O-N 2.95Å; K168-L172 HydrophobicContact CG-CD1 3.87Å; K168-L172 HydrophobicContact CG-CG 4.3Å; K168-L172 WeakPolarHBondContact O-CB 3.48Å; K168-L172 VanDerWaalsContact O-CG 3.23Å; K168-L172 WeakPolarHBondContact O-CG 3.32Å; K168-L172 PolarHBondContact O-N 3.01Å
169N96.8Very high96.1Very high64 Ų6487 Ų8734%0.34243%0.433SS..Hα-helixtrans-62.8-46.9179.1-69.8-17.6000111.4W165 Q166 Q171 L172 A173W165-N169 WeakPolarHBondContact CH2-ND2 3.49Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.32Å; W165-N169 PolarHBondContact O-N 3.48Å; Q166-N169 PolarHBondContact O-N 3.33Å; Q166-N169 VanDerWaalsContact O-N 3.09Å; N169-Q171 PolarHBondContact O-N 2.63Å; N169-L172 PolarHBondContact O-N 2.97Å; N169-A173 WeakPolarHBondContact O-CB 3.28Å; N169-A173 PolarHBondContact O-N 3.42Å
170D94.6Very high96Very high118 Ų11886.5 Ų86.563%0.63143%0.43SS*.Hα-helixtrans-61.8-45.3179.7-64.1-19.6000111.2Q166 R167 A173 G174Q166-D170 PolarHBondContact O-N 2.96Å; R167-D170 PolarHBondContact O-N 3.31Å; D170-A173 PolarHBondContact O-N 3.27Å; D170-G174 PolarHBondContact O-N 2.97Å
171Q94.6Very high96Very high20 Ų2086.3 Ų86.39%0.09343%0.43CS..Hα-helixtrans-67.6-39.1179.6-69.4-174.65.300112.7L16 R167 N169 G175L16-Q171 HydrophobicContact CB-CB 4.39Å; L16-Q171 HydrophobicContact CB-CG 4.4Å; L16-Q171 HydrophobicContact CD2-CB 4.07Å; L16-Q171 HydrophobicContact CD2-CG 3.68Å; R167-Q171 HydrophobicContact CG-CG 4.28Å; R167-Q171 VanDerWaalsContact CG-NE2 3.35Å; R167-Q171 WeakPolarHBondContact O-CB 3.43Å; R167-Q171 WeakPolarHBondContact O-CG 3.32Å; R167-Q171 PolarHBondContact O-N 3.44Å; N169-Q171 PolarHBondContact O-N 2.63Å; Q171-G175 PolarHBondContact O-N 3.41Å
172L94.8Very high95.9Very high71 Ų7186.2 Ų86.237%0.37243%0.429SS..Hα-helixtrans-68.3-37.7176.4-71.5177.4000111.7F19 K168 N169 A176F19-L172 HydrophobicContact CD2-CD2 4.34Å; K168-L172 HydrophobicContact CG-CD1 3.87Å; K168-L172 HydrophobicContact CG-CG 4.3Å; K168-L172 WeakPolarHBondContact O-CB 3.48Å; K168-L172 VanDerWaalsContact O-CG 3.23Å; K168-L172 WeakPolarHBondContact O-CG 3.32Å; K168-L172 PolarHBondContact O-N 3.01Å; N169-L172 PolarHBondContact O-N 2.97Å; L172-A176 VanDerWaalsContact O-CB 3.3Å; L172-A176 WeakPolarHBondContact O-CB 3.45Å; L172-A176 PolarHBondContact O-N 3.29Å
173A95.1Very high95.9Very high65 Ų6586.2 Ų86.254%0.53744%0.435SS..Hα-helixtrans-65.7-47.8174.700000111.6N169 D170 A176 K177N169-A173 WeakPolarHBondContact O-CB 3.28Å; N169-A173 PolarHBondContact O-N 3.42Å; D170-A173 PolarHBondContact O-N 3.27Å; A173-A176 PolarHBondContact O-N 3.33Å; A173-K177 PolarHBondContact O-N 3.33Å; A173-K177 VanDerWaalsContact O-N 3.14Å
174G94Very high95.9Very high32 Ų3285.1 Ų85.133%0.3343%0.43SS..Hα-helixtrans-60.7-47175.600000112.3D170 A176 K177 L178D170-G174 PolarHBondContact O-N 2.97Å; G174-A176 PolarHBondContact O-N 3.17Å; G174-K177 WeakPolarHBondContact O-CA 3.32Å; G174-K177 WeakPolarHBondContact O-CB 3.48Å; G174-K177 PolarHBondContact O-N 2.8Å; G174-K177 VanDerWaalsContact O-N 3.08Å; G174-L178 PolarHBondContact O-N 3.36Å
175G93Very high96Very high0 Ų090.5 Ų90.50%045%0.446CS..Hα-helixtrans-63.7-37.7177.500000113.6F19 Q171 K177 L178 R179F19-G175 VanDerWaalsContact CE2-CA 3.47Å; F19-G175 WeakPolarHBondContact CE2-O 3.46Å; F19-G175 WeakPolarHBondContact CZ-O 3.36Å; Q171-G175 PolarHBondContact O-N 3.41Å; G175-K177 VanDerWaalsContact C-N 3.28Å; G175-K177 PolarHBondContact O-N 2.82Å; G175-L178 PolarHBondContact O-N 3.48Å; G175-R179 PolarHBondContact O-N 3.38Å
176A94.8Very high96Very high56 Ų5685.9 Ų85.946%0.46344%0.436SS..Hα-helixtrans-60.7-40171.900000111.5L172 A173 G174 R179 E180L172-A176 VanDerWaalsContact O-CB 3.3Å; L172-A176 WeakPolarHBondContact O-CB 3.45Å; L172-A176 PolarHBondContact O-N 3.29Å; A173-A176 PolarHBondContact O-N 3.33Å; G174-A176 PolarHBondContact O-N 3.17Å; A176-R179 PolarHBondContact O-N 2.8Å; A176-E180 PolarHBondContact O-N 3.32Å; A176-E180 VanDerWaalsContact O-N 3.09Å
177K95.8Very high96Very high98 Ų9884.4 Ų84.443%0.42644%0.438SS..Hα-helixtrans-67-39.7175.6-171.258.5-178.3176.50112.3A173 G174 G175 R179 E180 L181A173-K177 PolarHBondContact O-N 3.33Å; A173-K177 VanDerWaalsContact O-N 3.14Å; G174-K177 WeakPolarHBondContact O-CA 3.32Å; G174-K177 WeakPolarHBondContact O-CB 3.48Å; G174-K177 PolarHBondContact O-N 2.8Å; G174-K177 VanDerWaalsContact O-N 3.08Å; G175-K177 VanDerWaalsContact C-N 3.28Å; G175-K177 PolarHBondContact O-N 2.82Å; K177-R179 VanDerWaalsContact C-N 3.34Å; K177-R179 PolarHBondContact O-N 2.87Å; K177-E180 VanDerWaalsContact CD-OE2 3.3Å; K177-E180 WeakPolarHBondContact CD-OE2 3.49Å; K177-E180 IonicContact NZ-OE1 2.63Å; K177-E180 PolarHBondContact NZ-OE1 3.08Å; K177-E180 IonicContact NZ-OE2 3.89Å; K177-E180 PolarHBondContact NZ-OE2 2.97Å; K177-E180 WeakPolarHBondContact O-CB 3.46Å; K177-E180 PolarHBondContact O-N 3.4Å; K177-L181 HydrophobicContact CG-CD1 4.24Å; K177-L181 VanDerWaalsContact O-CG 3.31Å; K177-L181 WeakPolarHBondContact O-CG 3.49Å; K177-L181 PolarHBondContact O-N 2.97Å
178L94.6Very high96.1Very high90 Ų9083.3 Ų83.347%0.47144%0.441SS..Hα-helixtrans-59.1-45.1174.2-71.6174.4000111.6L16 G174 G175 E180 L181 E182L16-L178 HydrophobicContact CD1-CD1 3.73Å; G174-L178 PolarHBondContact O-N 3.36Å; G175-L178 PolarHBondContact O-N 3.48Å; L178-E180 VanDerWaalsContact C-N 3.35Å; L178-E180 PolarHBondContact O-N 3.14Å; L178-L181 PolarHBondContact O-N 3.17Å; L178-E182 WeakPolarHBondContact O-CB 3.33Å; L178-E182 PolarHBondContact O-N 3.47Å
179R94.9Very high96.2Very high159 Ų15981.9 Ų81.960%0.644%0.44SS*.Hα-helixtrans-62.4-40.2177.5-169.9-179-64.3158.32.2112.7G175 A176 K177 S183G175-R179 PolarHBondContact O-N 3.38Å; A176-R179 PolarHBondContact O-N 2.8Å; K177-R179 VanDerWaalsContact C-N 3.34Å; K177-R179 PolarHBondContact O-N 2.87Å; R179-S183 WeakPolarHBondContact O-CB 3.39Å; R179-S183 PolarHBondContact O-N 3.39Å
180E97.4Very high96.3Very high93 Ų9381.4 Ų81.444%0.43544%0.442SS..Hα-helixtrans-62-46.7174.4-170.9-157.6142.400111.1A176 K177 L178 E182 S183 N184A176-E180 PolarHBondContact O-N 3.32Å; A176-E180 VanDerWaalsContact O-N 3.09Å; K177-E180 VanDerWaalsContact CD-OE2 3.3Å; K177-E180 WeakPolarHBondContact CD-OE2 3.49Å; K177-E180 IonicContact NZ-OE1 2.63Å; K177-E180 PolarHBondContact NZ-OE1 3.08Å; K177-E180 IonicContact NZ-OE2 3.89Å; K177-E180 PolarHBondContact NZ-OE2 2.97Å; K177-E180 WeakPolarHBondContact O-CB 3.46Å; K177-E180 PolarHBondContact O-N 3.4Å; L178-E180 VanDerWaalsContact C-N 3.35Å; L178-E180 PolarHBondContact O-N 3.14Å; E180-E182 PolarHBondContact O-N 2.9Å; E180-S183 PolarHBondContact O-N 2.83Å; E180-N184 WeakPolarHBondContact O-CB 3.46Å; E180-N184 PolarHBondContact O-N 3.46Å; E180-N184 PolarHBondContact O-ND2 2.9Å
181L97.6Very high96.4Very high91 Ų9181.7 Ų81.748%0.47644%0.437SS..Hα-helixtrans-63.7-40.6178.6-70.5172.7000112.1K177 L178 N184 W185K177-L181 HydrophobicContact CG-CD1 4.24Å; K177-L181 VanDerWaalsContact O-CG 3.31Å; K177-L181 WeakPolarHBondContact O-CG 3.49Å; K177-L181 PolarHBondContact O-N 2.97Å; L178-L181 PolarHBondContact O-N 3.17Å; L181-N184 PolarHBondContact O-N 3.34Å; L181-W185 WeakPolarHBondContact O-CB 3.29Å; L181-W185 PolarHBondContact O-N 3.24Å
182E96.9Very high96.6Very high127 Ų12785.2 Ų85.259%0.59346%0.457SS*.Hα-helixtrans-62.5-47.7175.2-174.5179.6-168.100111.2L178 E180 N184 W185 V186L178-E182 WeakPolarHBondContact O-CB 3.33Å; L178-E182 PolarHBondContact O-N 3.47Å; E180-E182 PolarHBondContact O-N 2.9Å; E182-N184 VanDerWaalsContact C-N 3.32Å; E182-N184 PolarHBondContact O-N 2.91Å; E182-W185 WeakPolarHBondContact O-CB 3.32Å; E182-W185 PolarHBondContact O-N 3.19Å; E182-V186 WeakPolarHBondContact O-CG2 3.43Å; E182-V186 PolarHBondContact O-N 3.43Å
183S97.6Very high96.7Very high77 Ų7789 Ų8954%0.53847%0.467SS..Hα-helixtrans-60.3-42176.1-176.20000112.2R179 E180 W185 V186 S187R179-S183 WeakPolarHBondContact O-CB 3.39Å; R179-S183 PolarHBondContact O-N 3.39Å; E180-S183 PolarHBondContact O-N 2.83Å; S183-W185 VanDerWaalsContact C-N 3.34Å; S183-V186 PolarHBondContact O-N 2.76Å; S183-S187 WeakPolarHBondContact O-CB 3.09Å; S183-S187 PolarHBondContact O-N 3.06Å
184N98.1Very high96.8Very high77 Ų7791.8 Ų91.841%0.41247%0.469SS..Hα-helixtrans-63.8-42176.2-72.9-20.7000111.1E180 L181 E182 S187 L188E180-N184 WeakPolarHBondContact O-CB 3.46Å; E180-N184 PolarHBondContact O-N 3.46Å; E180-N184 PolarHBondContact O-ND2 2.9Å; L181-N184 PolarHBondContact O-N 3.34Å; E182-N184 VanDerWaalsContact C-N 3.32Å; E182-N184 PolarHBondContact O-N 2.91Å; N184-S187 PolarHBondContact O-N 2.93Å; N184-L188 WeakPolarHBondContact O-CB 3.37Å; N184-L188 VanDerWaalsContact O-CG 3.25Å; N184-L188 WeakPolarHBondContact O-CG 3.31Å; N184-L188 PolarHBondContact O-N 3.27Å
185W98.3Very high97Very high165 Ų16594.1 Ų94.163%0.62547%0.473SS*.Hα-helixtrans-61.7-49.2176.117683.3000111.7L181 E182 S183 S187 L188 V189L181-W185 WeakPolarHBondContact O-CB 3.29Å; L181-W185 PolarHBondContact O-N 3.24Å; E182-W185 WeakPolarHBondContact O-CB 3.32Å; E182-W185 PolarHBondContact O-N 3.19Å; S183-W185 VanDerWaalsContact C-N 3.34Å; W185-S187 VanDerWaalsContact C-N 3.29Å; W185-S187 PolarHBondContact O-N 3.48Å; W185-L188 PolarHBondContact O-N 3.45Å; W185-V189 HydrophobicContact CD2-CG2 4.1Å; W185-V189 HydrophobicContact CG-CG2 4.44Å; W185-V189 HydrophobicContact CZ2-CG2 3.89Å; W185-V189 WeakPolarHBondContact O-CG2 3.07Å; W185-V189 PolarHBondContact O-N 3.26Å
186V98.2Very high97.2Very high69 Ų69100 Ų10042%0.41850%0.501SS..Hα-helixtrans-58-43.4176.8173.50000111.1E182 S183 S190E182-V186 WeakPolarHBondContact O-CG2 3.43Å; E182-V186 PolarHBondContact O-N 3.43Å; S183-V186 PolarHBondContact O-N 2.76Å; V186-S190 VanDerWaalsContact O-CB 3.29Å; V186-S190 WeakPolarHBondContact O-CB 3.36Å; V186-S190 PolarHBondContact O-N 2.95Å; V186-S190 PolarHBondContact O-OG 3.41Å
187S97.9Very high97.3Very high73 Ų73104.1 Ų104.151%0.5150%0.504SS..Hα-helixtrans-62.2-46.5177.3-179.40000112.2S183 N184 W185 S190 K191S183-S187 WeakPolarHBondContact O-CB 3.09Å; S183-S187 PolarHBondContact O-N 3.06Å; N184-S187 PolarHBondContact O-N 2.93Å; W185-S187 VanDerWaalsContact C-N 3.29Å; W185-S187 PolarHBondContact O-N 3.48Å; S187-S190 PolarHBondContact O-N 3.33Å; S187-K191 VanDerWaalsContact O-CB 3.31Å; S187-K191 WeakPolarHBondContact O-CB 3.44Å; S187-K191 PolarHBondContact O-N 3.11Å
188L97.9Very high97.4Very high108 Ų108101.4 Ų101.457%0.56550%0.5SS*.Hα-helixtrans-63.8-44.1178.4-73.1170.9000112.1N184 W185 K191 N192N184-L188 WeakPolarHBondContact O-CB 3.37Å; N184-L188 VanDerWaalsContact O-CG 3.25Å; N184-L188 WeakPolarHBondContact O-CG 3.31Å; N184-L188 PolarHBondContact O-N 3.27Å; W185-L188 PolarHBondContact O-N 3.45Å; L188-K191 PolarHBondContact O-N 2.91Å; L188-N192 PolarHBondContact O-N 3.5Å
189V98Very high97.5Very high66 Ų66101 Ų10140%0.450%0.497SS..Hα-helixtrans-63.4-44.8176.7172.20000110.7W185 K191 N192 Y193W185-V189 HydrophobicContact CD2-CG2 4.1Å; W185-V189 HydrophobicContact CG-CG2 4.44Å; W185-V189 HydrophobicContact CZ2-CG2 3.89Å; W185-V189 WeakPolarHBondContact O-CG2 3.07Å; W185-V189 PolarHBondContact O-N 3.26Å; V189-K191 VanDerWaalsContact C-N 3.34Å; V189-K191 PolarHBondContact O-N 3.48Å; V189-N192 PolarHBondContact O-N 2.96Å; V189-Y193 PolarHBondContact O-N 2.87Å
190S97.8Very high97.6Very high54 Ų5497.1 Ų97.138%0.37849%0.492SS..Hα-helixtrans-62.1-43.1177.8-580000111.3V186 S187 Y193 E194V186-S190 VanDerWaalsContact O-CB 3.29Å; V186-S190 WeakPolarHBondContact O-CB 3.36Å; V186-S190 PolarHBondContact O-N 2.95Å; V186-S190 PolarHBondContact O-OG 3.41Å; S187-S190 PolarHBondContact O-N 3.33Å; S190-Y193 WeakPolarHBondContact O-CB 3.37Å; S190-Y193 PolarHBondContact O-N 3.11Å; S190-E194 WeakPolarHBondContact O-CG 3.35Å; S190-E194 PolarHBondContact O-N 3.01Å
191K97.9Very high97.5Very high125 Ų12597.3 Ų97.354%0.54349%0.492SS..Hα-helixtrans-65-41.1177.7-170.5173-175.21780112.3S187 L188 V189 Y193 E194 I195S187-K191 VanDerWaalsContact O-CB 3.31Å; S187-K191 WeakPolarHBondContact O-CB 3.44Å; S187-K191 PolarHBondContact O-N 3.11Å; L188-K191 PolarHBondContact O-N 2.91Å; V189-K191 VanDerWaalsContact C-N 3.34Å; V189-K191 PolarHBondContact O-N 3.48Å; K191-Y193 VanDerWaalsContact C-N 3.31Å; K191-Y193 PolarHBondContact O-N 2.7Å; K191-E194 PolarHBondContact O-N 3.43Å; K191-I195 HydrophobicContact CG-CD1 4.1Å; K191-I195 WeakPolarHBondContact O-CD1 3.34Å; K191-I195 VanDerWaalsContact O-CG1 3.23Å; K191-I195 WeakPolarHBondContact O-CG1 3.31Å; K191-I195 PolarHBondContact O-N 2.95Å
192N97.8Very high97.5Very high94 Ų9497.8 Ų97.850%0.50350%0.495SS..Hα-helixtrans-60.1-44.4173.5-76.8-13.2000110.9L188 V189 E194 I195 E196L188-N192 PolarHBondContact O-N 3.5Å; V189-N192 PolarHBondContact O-N 2.96Å; N192-E194 PolarHBondContact O-N 3.35Å; N192-I195 PolarHBondContact O-N 2.86Å; N192-E196 WeakPolarHBondContact O-CG 3.42Å; N192-E196 PolarHBondContact O-N 3.33Å
193Y97.6Very high97.4Very high149 Ų14997.7 Ų97.758%0.58449%0.494SS*.Hα-helixtrans-62.9-41.7176.7-177.5-102.7000112.9V189 S190 K191 I195 E196 R197V189-Y193 PolarHBondContact O-N 2.87Å; S190-Y193 WeakPolarHBondContact O-CB 3.37Å; S190-Y193 PolarHBondContact O-N 3.11Å; K191-Y193 VanDerWaalsContact C-N 3.31Å; K191-Y193 PolarHBondContact O-N 2.7Å; Y193-I195 VanDerWaalsContact C-N 3.34Å; Y193-I195 PolarHBondContact O-N 2.97Å; Y193-E196 PolarHBondContact O-N 3.48Å; Y193-R197 WeakPolarHBondContact O-CB 3.44Å; Y193-R197 PolarHBondContact O-N 2.97Å
194E97.4Very high97.2Very high124 Ų12498.6 Ų98.658%0.57949%0.493SS*.Hα-helixtrans-61.2-41.9174.6-74.7174.4-175.900112.1S190 K191 N192 R197 A198S190-E194 WeakPolarHBondContact O-CG 3.35Å; S190-E194 PolarHBondContact O-N 3.01Å; K191-E194 PolarHBondContact O-N 3.43Å; N192-E194 PolarHBondContact O-N 3.35Å; E194-R197 PolarHBondContact O-N 3.37Å; E194-A198 WeakPolarHBondContact O-CB 3.42Å; E194-A198 PolarHBondContact O-N 2.95Å
195I97.5Very high97Very high82 Ų82100.2 Ų100.242%0.42150%0.498SS..Hα-helixtrans-64.2-49.1176.5-69.2164.3000110.4K191 N192 Y193 R197 A198 I199K191-I195 HydrophobicContact CG-CD1 4.1Å; K191-I195 WeakPolarHBondContact O-CD1 3.34Å; K191-I195 VanDerWaalsContact O-CG1 3.23Å; K191-I195 WeakPolarHBondContact O-CG1 3.31Å; K191-I195 PolarHBondContact O-N 2.95Å; N192-I195 PolarHBondContact O-N 2.86Å; Y193-I195 VanDerWaalsContact C-N 3.34Å; Y193-I195 PolarHBondContact O-N 2.97Å; I195-R197 VanDerWaalsContact C-N 3.29Å; I195-R197 PolarHBondContact O-N 3.28Å; I195-A198 PolarHBondContact O-N 3.48Å; I195-A198 VanDerWaalsContact O-N 3.15Å; I195-I199 HydrophobicContact CG2-CD1 3.77Å; I195-I199 HydrophobicContact CG2-CG1 4.37Å; I195-I199 VanDerWaalsContact O-CG1 3.32Å; I195-I199 WeakPolarHBondContact O-CG1 3.41Å; I195-I199 PolarHBondContact O-N 3.09Å
196E97.1Very high96.8Very high122 Ų12295.7 Ų95.757%0.5749%0.489SS*.Hα-helixtrans-57.5-43.9177.2-75.3178.6-174.900111.4N192 Y193 A198 I199 V200N192-E196 WeakPolarHBondContact O-CG 3.42Å; N192-E196 PolarHBondContact O-N 3.33Å; Y193-E196 PolarHBondContact O-N 3.48Å; E196-A198 PolarHBondContact O-N 3.19Å; E196-I199 PolarHBondContact O-N 3.36Å; E196-V200 WeakPolarHBondContact O-CG2 3.47Å; E196-V200 PolarHBondContact O-N 3.48Å
197R97.6Very high96.5Very high144 Ų14494 Ų9454%0.54349%0.486SS..Hα-helixtrans-62.3-42.9176.5-163.7-176.891-174.34.1112.1Y193 E194 I195 V200 Q201Y193-R197 WeakPolarHBondContact O-CB 3.44Å; Y193-R197 PolarHBondContact O-N 2.97Å; E194-R197 PolarHBondContact O-N 3.37Å; I195-R197 VanDerWaalsContact C-N 3.29Å; I195-R197 PolarHBondContact O-N 3.28Å; R197-V200 PolarHBondContact O-N 2.9Å; R197-Q201 WeakPolarHBondContact O-CG 3.42Å; R197-Q201 PolarHBondContact O-N 3.17Å
198A97.2Very high96.2Very high41 Ų4197 Ų9734%0.33949%0.489SS..Hα-helixtrans-65.5-39.3177.900000111.8E194 I195 E196 Q201 L202E194-A198 WeakPolarHBondContact O-CB 3.42Å; E194-A198 PolarHBondContact O-N 2.95Å; I195-A198 PolarHBondContact O-N 3.48Å; I195-A198 VanDerWaalsContact O-N 3.15Å; E196-A198 PolarHBondContact O-N 3.19Å; A198-Q201 PolarHBondContact O-N 3.36Å; A198-L202 WeakPolarHBondContact O-CB 3.49Å; A198-L202 WeakPolarHBondContact O-CG 3.42Å; A198-L202 PolarHBondContact O-N 2.96Å
199I96.9Very high95.8Very high80 Ų8096.7 Ų96.741%0.4149%0.488SS..Hα-helixtrans-60.4-50174.6-69.3166.9000110I195 E196 Q201 L202 E203I195-I199 HydrophobicContact CG2-CD1 3.77Å; I195-I199 HydrophobicContact CG2-CG1 4.37Å; I195-I199 VanDerWaalsContact O-CG1 3.32Å; I195-I199 WeakPolarHBondContact O-CG1 3.41Å; I195-I199 PolarHBondContact O-N 3.09Å; E196-I199 PolarHBondContact O-N 3.36Å; I199-Q201 VanDerWaalsContact C-N 3.28Å; I199-Q201 PolarHBondContact O-N 2.9Å; I199-L202 PolarHBondContact O-N 3.19Å; I199-L202 VanDerWaalsContact O-N 3.16Å; I199-E203 HydrophobicContact CG2-CG 4.2Å; I199-E203 WeakPolarHBondContact O-CB 3.48Å; I199-E203 WeakPolarHBondContact O-CG 3.41Å; I199-E203 PolarHBondContact O-N 3.38Å
200V96.9Very high95.3Very high79 Ų79100.5 Ų100.548%0.47950%0.499SS..Hα-helixtrans-60.2-38.4178.4171.90000111.6E196 R197 N204E196-V200 WeakPolarHBondContact O-CG2 3.47Å; E196-V200 PolarHBondContact O-N 3.48Å; R197-V200 PolarHBondContact O-N 2.9Å; V200-N204 WeakPolarHBondContact O-CB 3.36Å; V200-N204 VanDerWaalsContact O-CG 3.3Å; V200-N204 PolarHBondContact O-N 2.92Å; V200-N204 VanDerWaalsContact O-N 3.1Å; V200-N204 PolarHBondContact O-ND2 3.19Å
201Q96.3Very high94.6Very high96 Ų96104.5 Ų104.545%0.44951%0.512SS..Hα-helixtrans-64.8-46.9175.3-74.4176.6-16.800111.7R197 A198 I199 N204 E205R197-Q201 WeakPolarHBondContact O-CG 3.42Å; R197-Q201 PolarHBondContact O-N 3.17Å; A198-Q201 PolarHBondContact O-N 3.36Å; I199-Q201 VanDerWaalsContact C-N 3.28Å; I199-Q201 PolarHBondContact O-N 2.9Å; Q201-N204 WeakPolarHBondContact O-CB 3.25Å; Q201-N204 PolarHBondContact O-N 3.42Å; Q201-E205 WeakPolarHBondContact O-CG 3.48Å; Q201-E205 PolarHBondContact O-N 3.43Å
202L96.1Very high93.8Very high102 Ų102104 Ų10453%0.53451%0.512SS..Hα-helixtrans-63.9-40.6177.4-74169.2000112.3A198 I199 N204 E205 V206A198-L202 WeakPolarHBondContact O-CB 3.49Å; A198-L202 WeakPolarHBondContact O-CG 3.42Å; A198-L202 PolarHBondContact O-N 2.96Å; I199-L202 PolarHBondContact O-N 3.19Å; I199-L202 VanDerWaalsContact O-N 3.16Å; L202-N204 VanDerWaalsContact C-N 3.31Å; L202-N204 PolarHBondContact O-N 3.15Å; L202-E205 PolarHBondContact O-N 2.86Å; L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 VanDerWaalsContact O-CG2 3.28Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 2.93Å
203E95.1Very high92.8Very high124 Ų124105.7 Ų105.758%0.57952%0.516SS*.Hα-helixtrans-61.1-41.1175.2-74.9178.6165.100111.5I199 G207I199-E203 HydrophobicContact CG2-CG 4.2Å; I199-E203 WeakPolarHBondContact O-CB 3.48Å; I199-E203 WeakPolarHBondContact O-CG 3.41Å; I199-E203 PolarHBondContact O-N 3.38Å; E203-G207 PolarHBondContact O-N 3.4Å
204N94.3Very high91.7Very high97 Ų97100 Ų10052%0.51950%0.503SS..Hα-helixtrans-65.5-41.1174.3-75.9-46.8000112.4V200 Q201 L202 G207 K208V200-N204 WeakPolarHBondContact O-CB 3.36Å; V200-N204 VanDerWaalsContact O-CG 3.3Å; V200-N204 PolarHBondContact O-N 2.92Å; V200-N204 VanDerWaalsContact O-N 3.1Å; V200-N204 PolarHBondContact O-ND2 3.19Å; Q201-N204 WeakPolarHBondContact O-CB 3.25Å; Q201-N204 PolarHBondContact O-N 3.42Å; L202-N204 VanDerWaalsContact C-N 3.31Å; L202-N204 PolarHBondContact O-N 3.15Å; N204-G207 PolarHBondContact O-N 3.44Å; N204-K208 WeakPolarHBondContact O-CG 3.45Å; N204-K208 PolarHBondContact O-N 3.39Å
205E94Very high90.4Very high110 Ų11098.1 Ų98.151%0.51450%0.497SS..Hα-helixtrans-64.6-45.8175.7-73.9176.7-172.900111.9Q201 L202 G207 K208 L209Q201-E205 WeakPolarHBondContact O-CG 3.48Å; Q201-E205 PolarHBondContact O-N 3.43Å; L202-E205 PolarHBondContact O-N 2.86Å; E205-G207 VanDerWaalsContact C-N 3.3Å; E205-G207 PolarHBondContact O-N 2.96Å; E205-K208 PolarHBondContact O-N 3.39Å; E205-L209 WeakPolarHBondContact O-CG 3.41Å; E205-L209 PolarHBondContact O-N 3.14Å
206V93.4Very high89Confident70 Ų7099.8 Ų99.842%0.42450%0.503SS..Hα-helixtrans-61-40.8174.6170.70000110.8L202 L209 K210L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 VanDerWaalsContact O-CG2 3.28Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 2.93Å; V206-L209 PolarHBondContact O-N 3.37Å; V206-K210 HydrophobicContact CG1-CD 4.27Å; V206-K210 WeakPolarHBondContact O-CB 3.29Å; V206-K210 WeakPolarHBondContact O-CG 3.48Å; V206-K210 PolarHBondContact O-N 3Å
207G91.6Very high87.4Confident35 Ų3598.8 Ų98.836%0.36150%0.502SS..Hα-helixtrans-57.4-47.4173.500000112.5E203 N204 E205 K210 Q211E203-G207 PolarHBondContact O-N 3.4Å; N204-G207 PolarHBondContact O-N 3.44Å; E205-G207 VanDerWaalsContact C-N 3.3Å; E205-G207 PolarHBondContact O-N 2.96Å; G207-K210 PolarHBondContact O-N 3.18Å; G207-Q211 PolarHBondContact O-N 3.32Å; G207-Q211 VanDerWaalsContact O-N 3.14Å
208K91.8Very high85.7Confident134 Ų13498 Ų9858%0.58350%0.502SS*.Hα-helixtrans-63.4-45.2177-72.1173.4-176.21770112.6N204 E205 K210 Q211 Q212N204-K208 WeakPolarHBondContact O-CG 3.45Å; N204-K208 PolarHBondContact O-N 3.39Å; E205-K208 PolarHBondContact O-N 3.39Å; K208-K210 PolarHBondContact O-N 2.94Å; K208-Q211 WeakPolarHBondContact O-CB 3.49Å; K208-Q211 PolarHBondContact O-N 3.25Å; K208-Q212 WeakPolarHBondContact O-CG 3.44Å; K208-Q212 PolarHBondContact O-N 3.27Å
209L89.6Confident84Confident103 Ų103102.1 Ų102.154%0.53952%0.515SS..Hα-helixtrans-62.6-41.3178.9-73.9169.8000112E205 V206 Q211 Q212 Q213E205-L209 WeakPolarHBondContact O-CG 3.41Å; E205-L209 PolarHBondContact O-N 3.14Å; V206-L209 PolarHBondContact O-N 3.37Å; L209-Q211 VanDerWaalsContact C-N 3.29Å; L209-Q211 PolarHBondContact O-N 3.17Å; L209-Q212 PolarHBondContact O-N 3.08Å; L209-Q213 PolarHBondContact O-N 3.32Å
210K87.4Confident82.2Confident146 Ų146102.6 Ų102.664%0.63552%0.518SS*.Hα-helixtrans-62.7-36.5174.3-76.5-179.5178.91790112.4V206 G207 K208 G214V206-K210 HydrophobicContact CG1-CD 4.27Å; V206-K210 WeakPolarHBondContact O-CB 3.29Å; V206-K210 WeakPolarHBondContact O-CG 3.48Å; V206-K210 PolarHBondContact O-N 3Å; G207-K210 PolarHBondContact O-N 3.18Å; K208-K210 PolarHBondContact O-N 2.94Å; K210-G214 PolarHBondContact O-N 2.95Å
211Q83.3Confident80.4Confident137 Ų137104 Ų10464%0.6452%0.521SS*.Hα-helixtrans-64.7-48.1174.7-119.5173.1-3.400111.3G207 K208 L209 Q213 G214 D215G207-Q211 PolarHBondContact O-N 3.32Å; G207-Q211 VanDerWaalsContact O-N 3.14Å; K208-Q211 WeakPolarHBondContact O-CB 3.49Å; K208-Q211 PolarHBondContact O-N 3.25Å; L209-Q211 VanDerWaalsContact C-N 3.29Å; L209-Q211 PolarHBondContact O-N 3.17Å; Q211-Q213 PolarHBondContact O-N 3.1Å; Q211-G214 PolarHBondContact O-N 2.87Å; Q211-G214 VanDerWaalsContact O-N 3.14Å; Q211-D215 PolarHBondContact O-N 3.42Å
212Q80.6Confident78.6Confident115 Ų115109.1 Ų109.154%0.53754%0.537SS..Hα-helixtrans-59.9-47.1178.1-72.1175-11.200112.4K208 L209 G214 D215 E216K208-Q212 WeakPolarHBondContact O-CG 3.44Å; K208-Q212 PolarHBondContact O-N 3.27Å; L209-Q212 PolarHBondContact O-N 3.08Å; Q212-G214 VanDerWaalsContact C-N 3.29Å; Q212-G214 PolarHBondContact O-N 2.92Å; Q212-D215 PolarHBondContact O-N 3.36Å; Q212-E216 WeakPolarHBondContact O-CG 3.49Å; Q212-E216 PolarHBondContact O-N 3.17Å
213Q77.1Confident76.6Confident129 Ų129111.4 Ų111.460%0.60355%0.545SS*.Hα-helixtrans-62.6-36.1174.6-77.7-171.8-19.100112.9L209 Q211 D215 N217L209-Q213 PolarHBondContact O-N 3.32Å; Q211-Q213 PolarHBondContact O-N 3.1Å; Q213-D215 VanDerWaalsContact C-N 3.31Å; Q213-N217 WeakPolarHBondContact O-CB 3.34Å; Q213-N217 PolarHBondContact O-N 3.37Å
214G74.1Confident74.4Confident30 Ų30112.3 Ų112.331%0.30955%0.553SS.*Hα-helixtrans-65.5-35.1175.500000112.7K210 Q211 Q212 K218K210-G214 PolarHBondContact O-N 2.95Å; Q211-G214 PolarHBondContact O-N 2.87Å; Q211-G214 VanDerWaalsContact O-N 3.14Å; Q212-G214 VanDerWaalsContact C-N 3.29Å; Q212-G214 PolarHBondContact O-N 2.92Å; G214-K218 WeakPolarHBondContact O-CD 3.4Å; G214-K218 VanDerWaalsContact O-CG 3.24Å; G214-K218 WeakPolarHBondContact O-CG 3.4Å; G214-K218 PolarHBondContact O-N 2.91Å
215D70.3Confident72.1Confident85 Ų85118.8 Ų118.846%0.45558%0.577SS.*Hα-helixtrans-80.1-39.4178.3-68.2-22.6000111.9Q211 Q212 Q213 N217 K218 E219Q211-D215 PolarHBondContact O-N 3.42Å; Q212-D215 PolarHBondContact O-N 3.36Å; Q213-D215 VanDerWaalsContact C-N 3.31Å; D215-N217 PolarHBondContact O-N 3.44Å; D215-K218 PolarHBondContact O-N 3.5Å; D215-K218 VanDerWaalsContact O-N 3.13Å; D215-K218 IonicContact OD1-NZ 3.7Å; D215-E219 PolarHBondContact O-N 2.81Å
216E67.8Low71Confident116 Ų116119.2 Ų119.254%0.54258%0.58SS.*Hα-helixtrans-60-42.8170.9-75.7178.417000112Q212 K218 E219 N220Q212-E216 WeakPolarHBondContact O-CG 3.49Å; Q212-E216 PolarHBondContact O-N 3.17Å; E216-K218 VanDerWaalsContact C-N 3.31Å; E216-K218 PolarHBondContact O-N 2.97Å; E216-E219 PolarHBondContact O-N 3.36Å; E216-N220 WeakPolarHBondContact O-CB 3.34Å; E216-N220 PolarHBondContact O-N 3.31Å
217N63.9Low69.8Low101 Ų101121.8 Ų121.854%0.5459%0.589SS.*Hα-helixtrans-64.4-35.1174.7-86.5-24.7000112.3Q213 D215 I221Q213-N217 WeakPolarHBondContact O-CB 3.34Å; Q213-N217 PolarHBondContact O-N 3.37Å; D215-N217 PolarHBondContact O-N 3.44Å; N217-I221 WeakPolarHBondContact O-CB 3.32Å; N217-I221 VanDerWaalsContact O-CD1 3.32Å; N217-I221 WeakPolarHBondContact O-CD1 3.24Å; N217-I221 WeakPolarHBondContact O-CG1 3.44Å; N217-I221 PolarHBondContact O-N 2.91Å; N217-I221 VanDerWaalsContact O-N 3.08Å
218K63Low68.6Low127 Ų127126.6 Ų126.655%0.55260%0.601SS**Hα-helixtrans-71.9-34.9175.2-74.1168.9-169164.10112.4G214 D215 E216 R222G214-K218 WeakPolarHBondContact O-CD 3.4Å; G214-K218 VanDerWaalsContact O-CG 3.24Å; G214-K218 WeakPolarHBondContact O-CG 3.4Å; G214-K218 PolarHBondContact O-N 2.91Å; D215-K218 PolarHBondContact O-N 3.5Å; D215-K218 VanDerWaalsContact O-N 3.13Å; D215-K218 IonicContact OD1-NZ 3.7Å; E216-K218 VanDerWaalsContact C-N 3.31Å; E216-K218 PolarHBondContact O-N 2.97Å; K218-R222 WeakPolarHBondContact O-CG 3.18Å; K218-R222 PolarHBondContact O-N 2.95Å; K218-R222 VanDerWaalsContact O-N 3.11Å
219E61.4Low67.2Low129 Ų129126.2 Ų126.260%0.60360%0.602SS**Hα-helixtrans-69.1-43174.4-79.5-167.8154.100111.9D215 E216 I221 R222 Q223D215-E219 PolarHBondContact O-N 2.81Å; E216-E219 PolarHBondContact O-N 3.36Å; E219-I221 PolarHBondContact O-N 2.99Å; E219-R222 CarbonylContact O-C 3.44Å; E219-R222 WeakPolarHBondContact O-CB 3.34Å; E219-R222 PolarHBondContact O-N 2.78Å; E219-Q223 PolarHBondContact O-N 3.32Å
220N58.9Low65.8Low89 Ų89127.6 Ų127.648%0.47661%0.606SS.*Hα-helixtrans-60.8-44.4174-77.3-23.4000111.6E216 R222 Q223 D224E216-N220 WeakPolarHBondContact O-CB 3.34Å; E216-N220 PolarHBondContact O-N 3.31Å; N220-R222 PolarHBondContact O-N 3.19Å; N220-Q223 PolarHBondContact O-N 3.46Å; N220-Q223 VanDerWaalsContact O-N 3.16Å; N220-D224 PolarHBondContact O-N 3.4Å
221I58.9Low64.4Low108 Ų108126.4 Ų126.455%0.55461%0.605SS**Hα-helixtrans-62-29.9174.5-67.6164.8000111.5N217 E219 F225N217-I221 WeakPolarHBondContact O-CB 3.32Å; N217-I221 VanDerWaalsContact O-CD1 3.32Å; N217-I221 WeakPolarHBondContact O-CD1 3.24Å; N217-I221 WeakPolarHBondContact O-CG1 3.44Å; N217-I221 PolarHBondContact O-N 2.91Å; N217-I221 VanDerWaalsContact O-N 3.08Å; E219-I221 PolarHBondContact O-N 2.99Å; I221-F225 HydrophobicContact CG2-CE2 4.36Å; I221-F225 VanDerWaalsContact O-CD2 3.3Å; I221-F225 WeakPolarHBondContact O-CD2 3.35Å
222R57.3Low63Low204 Ų204125.6 Ų125.677%0.7760%0.602SS**Hα-helixtrans-80.4-20.2177-80.2178.6174.6-174.9-0.6114.4K218 E219 N220K218-R222 WeakPolarHBondContact O-CG 3.18Å; K218-R222 PolarHBondContact O-N 2.95Å; K218-R222 VanDerWaalsContact O-N 3.11Å; E219-R222 CarbonylContact O-C 3.44Å; E219-R222 WeakPolarHBondContact O-CB 3.34Å; E219-R222 PolarHBondContact O-N 2.78Å; N220-R222 PolarHBondContact O-N 3.19Å
223Q54.1Low61.7Low151 Ų151126.5 Ų126.571%0.70661%0.607SS**Hα-helixtrans-85.8-20.6176.3-73.1-174.4-0.600113E219 N220E219-Q223 PolarHBondContact O-N 3.32Å; N220-Q223 PolarHBondContact O-N 3.46Å; N220-Q223 VanDerWaalsContact O-N 3.16Å
224D50.6Low60.4Low142 Ų142126.3 Ų126.376%0.75961%0.607SS**  trans-88.46.2179.3-75.2-25.2000114.3N220N220-D224 PolarHBondContact O-N 3.4Å
225F44.9Very low59.2Low233 Ų233135 Ų135100%1.02263%0.634SS**  trans-120.50170.8-77.2-82.6000111.1I221I221-F225 HydrophobicContact CG2-CE2 4.36Å; I221-F225 VanDerWaalsContact O-CD2 3.3Å; I221-F225 WeakPolarHBondContact O-CD2 3.35Å

Retrieved 225 of 225 residues in 1426.9 ms (Link to these results)