A0A060XNJ1_ONCMY Loading...

TAF6-like RNA polymerase II p300/CBP-associated factor-associated factor 65 kDa subunit 6L

Functions as a component of the PCAF complex. The PCAF complex is capable of efficiently acetylating histones in a nucleosomal context. The PCAF complex could be considered as the human version of the yeast SAGA complex. With TAF5L, acts as an epigenetic regulator essential for somatic reprogramming. Regulates target genes through H3K9ac deposition and MYC recruitment which trigger MYC regulatory network to orchestrate gene expression programs to control embryonic stem cell state. Functions with MYC to activate target gene expression through RNA polymerase II pause release.

AlphaFold DB , UniProt , Accession A0A060XNJ1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene taf6l, Length 637 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
1M38.2Very low67.4Low206 Ų206150.3 Ų150.3100%1.01570%0.703SS**  0104.70-78.1-172.2-158.700105.6E3M1-E3 PolarHBondContact O-N 3.14Å
2E43.5Very low69.3Low191 Ų191145.8 Ų145.889%0.89368%0.682SS**  trans-63.2118.6166.6-74.8171151.600107R4E2-R4 PolarHBondContact O-N 3.23Å
3E45.9Very low70.9Confident179 Ų179138.4 Ų138.484%0.83666%0.656SS**  trans-54.8115.2165.6-80.7-180149.400106.7M1 R5M1-E3 PolarHBondContact O-N 3.14Å; E3-R5 PolarHBondContact O-N 3.12Å
4R50.5Low72.4Confident232 Ų232129.4 Ų129.488%0.87562%0.615SS**  trans-65.490.8171.9-71.9-177.9178-178.6-1.6106.6E2 F6E2-R4 PolarHBondContact O-N 3.23Å; R4-F6 PolarHBondContact O-N 3.11Å
5R64.3Low73.7Confident231 Ų231123.7 Ų123.787%0.87259%0.587SS**PPolyproline II helixtrans-53.7122.8166.8-84.7-175.2173.3-178.6-3.3106.8E3E3-R5 PolarHBondContact O-N 3.12Å
6F68.7Low74.7Confident146 Ų146121.6 Ų121.664%0.6458%0.579SS**PPolyproline II helixtrans-63.8148.1170.8-65-78.2000107.8R4 E8R4-F6 PolarHBondContact O-N 3.11Å; F6-E8 PolarHBondContact O-N 3.08Å
7A75.3Confident75.7Confident97 Ų97122.6 Ų122.680%0.80259%0.585SS**PPolyproline II helixtrans-63121.5167.900000107.4
8E85.3Confident76.7Confident145 Ų145116.6 Ų116.668%0.67856%0.56SS**  trans-113.4132.5179.7-73.4168.8-167.100107.8F6F6-E8 PolarHBondContact O-N 3.08Å
9V88.8Confident77.5Confident42 Ų42116.3 Ų116.326%0.25556%0.557SS.*  trans-69.6123.5170.7177.60000106.6V14 V37 C38 L41V9-V14 HydrophobicContact CG1-CG2 4.14Å; V9-V37 HydrophobicContact CG2-CG1 4.21Å; V9-C38 PolarHBondContact N-SG 3.06Å; V9-L41 HydrophobicContact CG2-CD1 3.94Å
10P89.8Confident78.2Confident64 Ų64115.7 Ų115.742%0.41657%0.566SS.*  trans-69.1142-178.428.1-32.8000109.9E12 S13 V14P10-E12 WeakPolarHBondContact CB-OE2 3.48Å; P10-E12 PolarHBondContact O-N 3.44Å; P10-S13 WeakPolarHBondContact CG-OG 3.41Å; P10-S13 WeakPolarHBondContact O-CB 3.44Å; P10-S13 PolarHBondContact O-N 3.28Å; P10-V14 PolarHBondContact O-N 3.4Å
11R90.9Very high78.9Confident120 Ų120113.9 Ų113.945%0.45357%0.57SS.*Hα-helixtrans-57.3-30.5176.861.6-175.3177.91780111.9S13 V14 K15 A30R11-S13 VanDerWaalsContact C-N 3.33Å; R11-S13 PolarHBondContact O-N 3.44Å; R11-V14 PolarHBondContact O-N 3.06Å; R11-K15 PolarHBondContact O-N 2.95Å; R11-A30 HydrophobicContact CB-CB 4.35Å
12E90.2Very high81.5Confident96 Ų96107.6 Ų107.645%0.44956%0.557SS.*Hα-helixtrans-62.8-38.4175.9-62.475-160.600111.2P10 K15 L16P10-E12 WeakPolarHBondContact CB-OE2 3.48Å; P10-E12 PolarHBondContact O-N 3.44Å; E12-K15 PolarHBondContact O-N 3.18Å; E12-L16 VanDerWaalsContact O-CG 3.31Å; E12-L16 WeakPolarHBondContact O-CG 3.42Å; E12-L16 PolarHBondContact O-N 3.38Å
13S90.1Very high84Confident50 Ų50102 Ų10235%0.3554%0.536SS..Hα-helixtrans-66.3-38.3174.5-70.90000112.5P10 R11 L16 M17P10-S13 WeakPolarHBondContact CG-OG 3.41Å; P10-S13 WeakPolarHBondContact O-CB 3.44Å; P10-S13 PolarHBondContact O-N 3.28Å; R11-S13 VanDerWaalsContact C-N 3.33Å; R11-S13 PolarHBondContact O-N 3.44Å; S13-L16 PolarHBondContact O-N 2.97Å; S13-M17 WeakPolarHBondContact O-CG 3.41Å; S13-M17 PolarHBondContact O-N 3.23Å
14V92.2Very high86.2Confident12 Ų12102.2 Ų102.27%0.07354%0.537CS..Hα-helixtrans-66.3-40.7177.1178.90000111.1V9 P10 R11 M17 A18 L25 L33 A34V9-V14 HydrophobicContact CG1-CG2 4.14Å; P10-V14 PolarHBondContact O-N 3.4Å; R11-V14 PolarHBondContact O-N 3.06Å; V14-M17 PolarHBondContact O-N 2.93Å; V14-A18 PolarHBondContact O-N 3.27Å; V14-L25 HydrophobicContact CG1-CD1 4.29Å; V14-L33 HydrophobicContact CG1-CB 4.09Å; V14-L33 HydrophobicContact CG1-CD2 3.59Å; V14-L33 HydrophobicContact CG1-CG 3.97Å; V14-A34 HydrophobicContact CG2-CB 3.87Å
15K92.5Very high88.2Confident45 Ų4593.4 Ų93.420%0.19651%0.507CS..Hα-helixtrans-61.3-48.7173.7-74.9-179.5169.6-172.60112.3R11 E12 M17 A18 E19 D27 A30R11-K15 PolarHBondContact O-N 2.95Å; E12-K15 PolarHBondContact O-N 3.18Å; K15-M17 VanDerWaalsContact C-N 3.27Å; K15-M17 PolarHBondContact O-N 3.33Å; K15-A18 WeakPolarHBondContact O-CB 3.45Å; K15-A18 PolarHBondContact O-N 3.23Å; K15-E19 WeakPolarHBondContact O-CG 3.38Å; K15-E19 PolarHBondContact O-N 3.33Å; K15-D27 WeakPolarHBondContact CE-OD1 3.44Å; K15-D27 VanDerWaalsContact NZ-CG 3.26Å; K15-D27 IonicContact NZ-OD1 2.62Å; K15-D27 PolarHBondContact NZ-OD1 3.11Å; K15-D27 IonicContact NZ-OD2 3.9Å; K15-A30 HydrophobicContact CD-CB 4.41Å; K15-A30 HydrophobicContact CG-CB 3.72Å
16L90Very high89.6Confident89 Ų8985.5 Ų85.547%0.46649%0.487SS..Hα-helixtrans-59-38.3177.5-71.5171000112.2E12 S13 S20E12-L16 VanDerWaalsContact O-CG 3.31Å; E12-L16 WeakPolarHBondContact O-CG 3.42Å; E12-L16 PolarHBondContact O-N 3.38Å; S13-L16 PolarHBondContact O-N 2.97Å; L16-S20 PolarHBondContact O-N 3.06Å
17M91Very high90.8Very high139 Ų13982.3 Ų82.369%0.68548%0.477SS*.Hα-helixtrans-65.7-38.7174-71.9-17779.400112.2S13 V14 K15 S20 A21S13-M17 WeakPolarHBondContact O-CG 3.41Å; S13-M17 PolarHBondContact O-N 3.23Å; V14-M17 PolarHBondContact O-N 2.93Å; K15-M17 VanDerWaalsContact C-N 3.27Å; K15-M17 PolarHBondContact O-N 3.33Å; M17-S20 PolarHBondContact O-N 3.5Å; M17-S20 PolarHBondContact O-OG 3.38Å; M17-A21 PolarHBondContact O-N 2.95Å
18A93.3Very high91.6Very high15 Ų1583.9 Ų83.912%0.12447%0.472CS..Hα-helixtrans-68.5-41.5176.100000112.4V14 K15 S20 A21 G22 V23 L25V14-A18 PolarHBondContact O-N 3.27Å; K15-A18 WeakPolarHBondContact O-CB 3.45Å; K15-A18 PolarHBondContact O-N 3.23Å; A18-S20 VanDerWaalsContact C-N 3.27Å; A18-S20 PolarHBondContact O-N 2.88Å; A18-A21 CarbonylContact O-C 3.57Å; A18-A21 WeakPolarHBondContact O-CA 3.24Å; A18-A21 WeakPolarHBondContact O-CB 3.24Å; A18-A21 PolarHBondContact O-N 3Å; A18-G22 PolarHBondContact O-N 3.42Å; A18-V23 CarbonylContact C-O 3.44Å; A18-V23 WeakPolarHBondContact CB-O 3.46Å; A18-V23 PolarHBondContact O-N 3.27Å; A18-V23 VanDerWaalsContact O-O 3.11Å; A18-L25 HydrophobicContact CB-CD1 3.39Å; A18-L25 HydrophobicContact CB-CG 3.57Å
19E92.8Very high92Very high110 Ų11080.3 Ų80.351%0.51446%0.46SS..Hα-helixtrans-59.7-39.4173.9-72.8170.8-16400111.1K15 A21 G22 V23K15-E19 WeakPolarHBondContact O-CG 3.38Å; K15-E19 PolarHBondContact O-N 3.33Å; E19-A21 PolarHBondContact O-N 3Å; E19-G22 WeakPolarHBondContact O-CA 3.47Å; E19-G22 PolarHBondContact O-N 2.98Å; E19-V23 PolarHBondContact N-O 3.25Å
20S91.3Very high92.3Very high105 Ų10578.3 Ų78.373%0.73445%0.448SS*.Hα-helixtrans-63-24.2174.582.30000113.5L16 M17 A18L16-S20 PolarHBondContact O-N 3.06Å; M17-S20 PolarHBondContact O-N 3.5Å; M17-S20 PolarHBondContact O-OG 3.38Å; A18-S20 VanDerWaalsContact C-N 3.27Å; A18-S20 PolarHBondContact O-N 2.88Å
21A93.2Very high92.3Very high78 Ų7877.4 Ų77.465%0.64545%0.446SS*.THydrogen-bonded Turntrans-91.11.8172.900000113.1M17 A18 E19M17-A21 PolarHBondContact O-N 2.95Å; A18-A21 CarbonylContact O-C 3.57Å; A18-A21 WeakPolarHBondContact O-CA 3.24Å; A18-A21 WeakPolarHBondContact O-CB 3.24Å; A18-A21 PolarHBondContact O-N 3Å; E19-A21 PolarHBondContact O-N 3Å
22G93.1Very high92.4Very high73 Ų7377.5 Ų77.575%0.75345%0.454SS*.THydrogen-bonded Turntrans80.422.4-179.400000114.7A18 E19A18-G22 PolarHBondContact O-N 3.42Å; E19-G22 WeakPolarHBondContact O-CA 3.47Å; E19-G22 PolarHBondContact O-N 2.98Å
23V94.3Very high92.6Very high74 Ų7476.7 Ų76.745%0.44845%0.453SS..  trans-122.3130.2-177.2-177.70000110.9A18 E19 L25A18-V23 CarbonylContact C-O 3.44Å; A18-V23 WeakPolarHBondContact CB-O 3.46Å; A18-V23 PolarHBondContact O-N 3.27Å; A18-V23 VanDerWaalsContact O-O 3.11Å; E19-V23 PolarHBondContact N-O 3.25Å; V23-L25 HydrophobicContact CG1-CD2 4.33Å
24E92.9Very high92.7Very high183 Ų18374.6 Ų74.686%0.85544%0.439SS*.  trans-90.5131.7171.4-67.5-178.4178.100110.8
25L92.5Very high92.6Very high47 Ų4780.2 Ų80.225%0.24646%0.464CS..  trans-111.3138.4179.3-67.4179.9000111.4V14 A18 V23 V29V14-L25 HydrophobicContact CG1-CD1 4.29Å; A18-L25 HydrophobicContact CB-CD1 3.39Å; A18-L25 HydrophobicContact CB-CG 3.57Å; V23-L25 HydrophobicContact CG1-CD2 4.33Å; L25-V29 HydrophobicContact CD2-CG1 4.15Å
26S94.7Very high92.6Very high65 Ų6581.8 Ų81.846%0.45548%0.475SS..  trans-69.1155167.967.10000111.5D28 V29 A30S26-D28 VanDerWaalsContact C-N 3.26Å; S26-D28 PolarHBondContact O-N 3.31Å; S26-V29 PolarHBondContact O-N 3.38Å; S26-V29 WeakPolarHBondContact OG-CG2 3.37Å; S26-A30 PolarHBondContact O-N 2.86Å
27D92.1Very high92.7Very high80 Ų8080.2 Ų80.243%0.42847%0.469SS..Hα-helixtrans-55.2-40.9-178.9-74.141000112.9K15 A30 A31K15-D27 WeakPolarHBondContact CE-OD1 3.44Å; K15-D27 VanDerWaalsContact NZ-CG 3.26Å; K15-D27 IonicContact NZ-OD1 2.62Å; K15-D27 PolarHBondContact NZ-OD1 3.11Å; K15-D27 IonicContact NZ-OD2 3.9Å; D27-A30 PolarHBondContact O-N 3.02Å; D27-A31 WeakPolarHBondContact O-CB 3.49Å; D27-A31 PolarHBondContact O-N 3.31Å
28D93.4Very high92.7Very high129 Ų12973.9 Ų73.969%0.6944%0.438SS*.Hα-helixtrans-66.9-41.5-178.2-60.8-30.1000111.9S26 A31 L32S26-D28 VanDerWaalsContact C-N 3.26Å; S26-D28 PolarHBondContact O-N 3.31Å; D28-A31 PolarHBondContact O-N 3.33Å; D28-L32 WeakPolarHBondContact O-CG 3.38Å; D28-L32 PolarHBondContact O-N 3.28Å; D28-L32 VanDerWaalsContact O-N 3.15Å
29V93.8Very high92.6Very high71 Ų7178.8 Ų78.843%0.4345%0.454SS..Hα-helixtrans-70.8-40.9179.1177.10000110.6L25 S26 A31 L32 L33L25-V29 HydrophobicContact CD2-CG1 4.15Å; S26-V29 PolarHBondContact O-N 3.38Å; S26-V29 WeakPolarHBondContact OG-CG2 3.37Å; V29-A31 VanDerWaalsContact C-N 3.31Å; V29-A31 PolarHBondContact O-N 3.04Å; V29-L32 PolarHBondContact O-N 3.43Å; V29-L33 WeakPolarHBondContact O-CB 3.36Å; V29-L33 PolarHBondContact O-N 2.65Å
30A93.3Very high92.5Very high0 Ų078.5 Ų78.50%045%0.449CS..Hα-helixtrans-62.5-38.4176.100000112R11 K15 S26 D27 A34R11-A30 HydrophobicContact CB-CB 4.35Å; K15-A30 HydrophobicContact CD-CB 4.41Å; K15-A30 HydrophobicContact CG-CB 3.72Å; S26-A30 PolarHBondContact O-N 2.86Å; D27-A30 PolarHBondContact O-N 3.02Å; A30-A34 VanDerWaalsContact O-CB 3.29Å; A30-A34 WeakPolarHBondContact O-CB 3.39Å; A30-A34 PolarHBondContact O-N 3.33Å
31A91Very high92.5Very high45 Ų4577.4 Ų77.437%0.37243%0.434SS..Hα-helixtrans-65.4-46.4176.800000112.3D27 D28 V29 L33 A34 E35D27-A31 WeakPolarHBondContact O-CB 3.49Å; D27-A31 PolarHBondContact O-N 3.31Å; D28-A31 PolarHBondContact O-N 3.33Å; V29-A31 VanDerWaalsContact C-N 3.31Å; V29-A31 PolarHBondContact O-N 3.04Å; A31-L33 PolarHBondContact O-N 3.32Å; A31-A34 PolarHBondContact O-N 3.04Å; A31-E35 PolarHBondContact O-N 3.15Å; A31-E35 VanDerWaalsContact O-N 3.14Å
32L92.9Very high92.4Very high121 Ų12178.2 Ų78.263%0.63442%0.42SS*.Hα-helixtrans-63.6-41.9177.6-71172.5000112.1D28 V29 E35 D36D28-L32 WeakPolarHBondContact O-CG 3.38Å; D28-L32 PolarHBondContact O-N 3.28Å; D28-L32 VanDerWaalsContact O-N 3.15Å; V29-L32 PolarHBondContact O-N 3.43Å; L32-E35 PolarHBondContact O-N 3.07Å; L32-D36 PolarHBondContact O-N 2.85Å; L32-D36 VanDerWaalsContact O-N 3.15Å
33L93.9Very high92.3Very high79 Ų7977.7 Ų77.741%0.41440%0.398SS..Hα-helixtrans-68.1-37.4179-172.162.4000111.6V14 V29 A31 E35 D36 V37V14-L33 HydrophobicContact CG1-CB 4.09Å; V14-L33 HydrophobicContact CG1-CD2 3.59Å; V14-L33 HydrophobicContact CG1-CG 3.97Å; V29-L33 WeakPolarHBondContact O-CB 3.36Å; V29-L33 PolarHBondContact O-N 2.65Å; A31-L33 PolarHBondContact O-N 3.32Å; L33-E35 VanDerWaalsContact C-N 3.33Å; L33-E35 PolarHBondContact O-N 3.37Å; L33-D36 PolarHBondContact O-N 3.47Å; L33-V37 VanDerWaalsContact O-CG2 3.28Å; L33-V37 WeakPolarHBondContact O-CG2 3.49Å; L33-V37 PolarHBondContact O-N 3.23Å
34A92.2Very high92.2Very high7 Ų774.7 Ų74.76%0.05838%0.381CS..Hα-helixtrans-59.9-42.2173.500000112V14 A30 A31 V37 C38V14-A34 HydrophobicContact CG2-CB 3.87Å; A30-A34 VanDerWaalsContact O-CB 3.29Å; A30-A34 WeakPolarHBondContact O-CB 3.39Å; A30-A34 PolarHBondContact O-N 3.33Å; A31-A34 PolarHBondContact O-N 3.04Å; A34-V37 PolarHBondContact O-N 3.13Å; A34-C38 WeakPolarHBondContact O-CB 3.32Å; A34-C38 PolarHBondContact O-N 3.37Å; A34-C38 PolarHBondContact O-SG 3.05Å
35E90.6Very high92.2Very high129 Ų12969.5 Ų69.560%0.60336%0.362SS*.Hα-helixtrans-63.3-44.4177.2-170.4179-179.900112.2A31 L32 L33 C38 Y39A31-E35 PolarHBondContact O-N 3.15Å; A31-E35 VanDerWaalsContact O-N 3.14Å; L32-E35 PolarHBondContact O-N 3.07Å; L33-E35 VanDerWaalsContact C-N 3.33Å; L33-E35 PolarHBondContact O-N 3.37Å; E35-C38 WeakPolarHBondContact O-CB 3.37Å; E35-C38 PolarHBondContact O-N 3.28Å; E35-Y39 PolarHBondContact O-N 3.38Å
36D92.1Very high92.3Very high79 Ų7973.1 Ų73.142%0.42238%0.378SS..Hα-helixtrans-64.3-44.1178-170.856.8000111.7L32 L33 C38 Y39 R40L32-D36 PolarHBondContact O-N 2.85Å; L32-D36 VanDerWaalsContact O-N 3.15Å; L33-D36 PolarHBondContact O-N 3.47Å; D36-C38 VanDerWaalsContact C-N 3.3Å; D36-C38 PolarHBondContact O-N 3.41Å; D36-Y39 WeakPolarHBondContact O-CB 3.31Å; D36-Y39 PolarHBondContact O-N 3.45Å; D36-Y39 VanDerWaalsContact O-N 3.11Å; D36-R40 WeakPolarHBondContact O-CG 3.49Å; D36-R40 PolarHBondContact O-N 3Å
37V92.6Very high92.3Very high56 Ų5671.1 Ų71.134%0.33936%0.364SS..Hα-helixtrans-59.3-43.3174.71720000110.9V9 L33 A34 Y39 R40 L41V9-V37 HydrophobicContact CG2-CG1 4.21Å; L33-V37 VanDerWaalsContact O-CG2 3.28Å; L33-V37 WeakPolarHBondContact O-CG2 3.49Å; L33-V37 PolarHBondContact O-N 3.23Å; A34-V37 PolarHBondContact O-N 3.13Å; V37-Y39 VanDerWaalsContact C-N 3.33Å; V37-Y39 PolarHBondContact O-N 3.48Å; V37-R40 PolarHBondContact O-N 3.27Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.44Å; V37-L41 WeakPolarHBondContact O-CB 3.48Å; V37-L41 WeakPolarHBondContact O-CG 3.36Å; V37-L41 PolarHBondContact O-N 3Å
38C90.8Very high92.5Very high6 Ų667.3 Ų67.34%0.04134%0.344CS..Hα-helixtrans-61.2-41.3175.5-70.30000112.3V9 A34 E35 D36 L41 R42V9-C38 PolarHBondContact N-SG 3.06Å; A34-C38 WeakPolarHBondContact O-CB 3.32Å; A34-C38 PolarHBondContact O-N 3.37Å; A34-C38 PolarHBondContact O-SG 3.05Å; E35-C38 WeakPolarHBondContact O-CB 3.37Å; E35-C38 PolarHBondContact O-N 3.28Å; D36-C38 VanDerWaalsContact C-N 3.3Å; D36-C38 PolarHBondContact O-N 3.41Å; C38-L41 PolarHBondContact O-N 3.41Å; C38-R42 WeakPolarHBondContact O-CG 3.45Å; C38-R42 PolarHBondContact O-N 3.24Å; C38-R42 VanDerWaalsContact O-N 3.08Å; C38-R42 PolarHBondContact O-NE 3.1Å
39Y90.1Very high92.6Very high117 Ų11762.9 Ų62.946%0.45932%0.322SS..Hα-helixtrans-60.4-49.1175.9175.8-92.9000111.2E35 D36 V37 L41 R42 E43E35-Y39 PolarHBondContact O-N 3.38Å; D36-Y39 WeakPolarHBondContact O-CB 3.31Å; D36-Y39 PolarHBondContact O-N 3.45Å; D36-Y39 VanDerWaalsContact O-N 3.11Å; V37-Y39 VanDerWaalsContact C-N 3.33Å; V37-Y39 PolarHBondContact O-N 3.48Å; Y39-L41 PolarHBondContact O-N 3Å; Y39-R42 PolarHBondContact O-N 3.48Å; Y39-E43 PolarHBondContact O-N 3.01Å
40R91.1Very high92.7Very high105 Ų10564.2 Ų64.240%0.39632%0.324SS..Hα-helixtrans-62-40.4178.5-66.7-61-173.9178.42.9112.9D36 V37 R42 E43 A44D36-R40 WeakPolarHBondContact O-CG 3.49Å; D36-R40 PolarHBondContact O-N 3Å; V37-R40 PolarHBondContact O-N 3.27Å; R40-R42 PolarHBondContact O-N 3.13Å; R40-E43 IonicContact CZ-OE2 3.94Å; R40-E43 IonicContact NH1-OE2 2.63Å; R40-E43 PolarHBondContact NH1-OE2 3.46Å; R40-E43 PolarHBondContact O-N 2.63Å; R40-A44 WeakPolarHBondContact O-CB 3.3Å; R40-A44 PolarHBondContact O-N 3.37Å
41L91.1Very high92.9Very high82 Ų8266.7 Ų66.743%0.42934%0.335SS..Hα-helixtrans-62.8-41.4175.4-76.1172.2000112V9 V37 C38 Y39 T45V9-L41 HydrophobicContact CG2-CD1 3.94Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.44Å; V37-L41 WeakPolarHBondContact O-CB 3.48Å; V37-L41 WeakPolarHBondContact O-CG 3.36Å; V37-L41 PolarHBondContact O-N 3Å; C38-L41 PolarHBondContact O-N 3.41Å; Y39-L41 PolarHBondContact O-N 3Å; L41-T45 VanDerWaalsContact O-CB 3.27Å; L41-T45 WeakPolarHBondContact O-CB 3.47Å; L41-T45 PolarHBondContact O-N 3.02Å; L41-T45 PolarHBondContact O-OG1 3.42Å
42R90.9Very high93.2Very high94 Ų9465.6 Ų65.636%0.35532%0.323SS..Hα-helixtrans-64.9-44175.6-73.1-177.5-69.2-109.94.8111.6C38 Y39 R40 T45 Q46C38-R42 WeakPolarHBondContact O-CG 3.45Å; C38-R42 PolarHBondContact O-N 3.24Å; C38-R42 VanDerWaalsContact O-N 3.08Å; C38-R42 PolarHBondContact O-NE 3.1Å; Y39-R42 PolarHBondContact O-N 3.48Å; R40-R42 PolarHBondContact O-N 3.13Å; R42-T45 PolarHBondContact O-N 3.31Å; R42-Q46 WeakPolarHBondContact O-CB 3.48Å; R42-Q46 PolarHBondContact O-N 3.32Å
43E91.4Very high93.3Very high63 Ų6368.6 Ų68.629%0.29433%0.325SS..Hα-helixtrans-58.7-48176.5-176.1-179.5-155.600111.9Y39 R40 Q46 S47Y39-E43 PolarHBondContact O-N 3.01Å; R40-E43 IonicContact CZ-OE2 3.94Å; R40-E43 IonicContact NH1-OE2 2.63Å; R40-E43 PolarHBondContact NH1-OE2 3.46Å; R40-E43 PolarHBondContact O-N 2.63Å; E43-Q46 PolarHBondContact O-N 2.64Å; E43-S47 WeakPolarHBondContact O-CB 3.39Å; E43-S47 PolarHBondContact O-N 2.94Å; E43-S47 PolarHBondContact O-OG 3.15Å
44A92.7Very high93.4Very high11 Ų1172.3 Ų72.39%0.09134%0.34CS..Hα-helixtrans-65.9-39.9177.500000112.5R40 S47 S48 F65R40-A44 WeakPolarHBondContact O-CB 3.3Å; R40-A44 PolarHBondContact O-N 3.37Å; A44-S47 PolarHBondContact O-N 2.86Å; A44-S48 WeakPolarHBondContact O-CB 3.46Å; A44-S48 PolarHBondContact O-N 3Å; A44-S48 PolarHBondContact O-OG 3.01Å; A44-F65 HydrophobicContact CB-CE1 4.41Å; A44-F65 HydrophobicContact CB-CE2 4.15Å; A44-F65 HydrophobicContact CB-CZ 3.78Å
45T93.4Very high93.5Very high74 Ų7474 Ų7445%0.45435%0.354SS..Hα-helixtrans-65.6-40176.9-580000111.6L41 R42 S48 S49L41-T45 VanDerWaalsContact O-CB 3.27Å; L41-T45 WeakPolarHBondContact O-CB 3.47Å; L41-T45 PolarHBondContact O-N 3.02Å; L41-T45 PolarHBondContact O-OG1 3.42Å; R42-T45 PolarHBondContact O-N 3.31Å; T45-S48 WeakPolarHBondContact CA-OG 3.28Å; T45-S48 PolarHBondContact O-OG 3.28Å; T45-S49 WeakPolarHBondContact O-CB 3.38Å; T45-S49 PolarHBondContact O-N 3.44Å
46Q93.4Very high93.7Very high123 Ų12377.4 Ų77.458%0.57537%0.367SS*.Hα-helixtrans-64.7-46.5175.9178.9173.1-10.600111.3R42 E43 S49 Q50R42-Q46 WeakPolarHBondContact O-CB 3.48Å; R42-Q46 PolarHBondContact O-N 3.32Å; E43-Q46 PolarHBondContact O-N 2.64Å; Q46-S49 WeakPolarHBondContact O-CB 3.4Å; Q46-S49 PolarHBondContact O-N 3.06Å; Q46-Q50 PolarHBondContact O-N 3.39Å
47S95.1Very high93.8Very high23 Ų2377.3 Ų77.316%0.16136%0.361CS..Hα-helixtrans-65.2-42.5-179.4-59.70000112E43 A44 S49 Q50 F51E43-S47 WeakPolarHBondContact O-CB 3.39Å; E43-S47 PolarHBondContact O-N 2.94Å; E43-S47 PolarHBondContact O-OG 3.15Å; A44-S47 PolarHBondContact O-N 2.86Å; S47-S49 VanDerWaalsContact C-N 3.34Å; S47-S49 PolarHBondContact O-N 3.28Å; S47-Q50 WeakPolarHBondContact O-CB 3.45Å; S47-Q50 PolarHBondContact O-N 3.03Å; S47-Q50 VanDerWaalsContact O-N 3.11Å; S47-F51 VanDerWaalsContact O-CD2 3.24Å; S47-F51 WeakPolarHBondContact O-CD2 3.29Å; S47-F51 PolarHBondContact O-N 3.33Å
48S96.6Very high93.9Very high0 Ų086.4 Ų86.40%039%0.389CS..Hα-helixtrans-64.4-36175.254.70000113A44 T45 Q50 F51 M52 D64A44-S48 WeakPolarHBondContact O-CB 3.46Å; A44-S48 PolarHBondContact O-N 3Å; A44-S48 PolarHBondContact O-OG 3.01Å; T45-S48 WeakPolarHBondContact CA-OG 3.28Å; T45-S48 PolarHBondContact O-OG 3.28Å; S48-Q50 VanDerWaalsContact C-N 3.27Å; S48-Q50 PolarHBondContact O-N 3.08Å; S48-F51 PolarHBondContact O-N 3.26Å; S48-M52 PolarHBondContact O-N 3.45Å; S48-D64 WeakPolarHBondContact CB-O 3.41Å
49S96.3Very high94Very high35 Ų3594.2 Ų94.225%0.24542%0.422CS..Hα-helixtrans-61.6-34172.2-170.50000112.7T45 Q46 S47 R53T45-S49 WeakPolarHBondContact O-CB 3.38Å; T45-S49 PolarHBondContact O-N 3.44Å; Q46-S49 WeakPolarHBondContact O-CB 3.4Å; Q46-S49 PolarHBondContact O-N 3.06Å; S47-S49 VanDerWaalsContact C-N 3.34Å; S47-S49 PolarHBondContact O-N 3.28Å; S49-R53 WeakPolarHBondContact O-CG 3.34Å; S49-R53 PolarHBondContact O-N 3.48Å
50Q95.9Very high94.1Very high100 Ų10092.2 Ų92.247%0.46742%0.419SS..Hα-helixtrans-65.6-48.7173.1-63.8177.47.900110.9Q46 S47 S48 M52 R53 H54Q46-Q50 PolarHBondContact O-N 3.39Å; S47-Q50 WeakPolarHBondContact O-CB 3.45Å; S47-Q50 PolarHBondContact O-N 3.03Å; S47-Q50 VanDerWaalsContact O-N 3.11Å; S48-Q50 VanDerWaalsContact C-N 3.27Å; S48-Q50 PolarHBondContact O-N 3.08Å; Q50-M52 VanDerWaalsContact C-N 3.3Å; Q50-M52 PolarHBondContact O-N 3.35Å; Q50-R53 PolarHBondContact O-N 2.89Å; Q50-R53 VanDerWaalsContact O-N 3.12Å; Q50-H54 PolarHBondContact O-CD2 3.11Å; Q50-H54 PolarHBondContact O-N 3.49Å
51F96.2Very high94.2Very high52 Ų5289.4 Ų89.423%0.22841%0.414CS..Hα-helixtrans-56.5-43176.2-72.5-65.7000112.5S47 S48 R53 H54 A55 D64 R67 A68 W71S47-F51 VanDerWaalsContact O-CD2 3.24Å; S47-F51 WeakPolarHBondContact O-CD2 3.29Å; S47-F51 PolarHBondContact O-N 3.33Å; S48-F51 PolarHBondContact O-N 3.26Å; F51-R53 PolarHBondContact O-N 2.94Å; F51-H54 PolarHBondContact O-N 2.93Å; F51-A55 WeakPolarHBondContact O-CB 3.45Å; F51-A55 PolarHBondContact O-N 2.89Å; F51-D64 HydrophobicContact CB-CB 4.28Å; F51-R67 HydrophobicContact CD1-CB 4.24Å; F51-R67 HydrophobicContact CD2-CB 3.94Å; F51-R67 HydrophobicContact CE1-CB 4.33Å; F51-R67 HydrophobicContact CE2-CB 4.05Å; F51-R67 HydrophobicContact CG-CB 4.06Å; F51-R67 HydrophobicContact CZ-CB 4.24Å; F51-A68 HydrophobicContact CD2-CB 4.24Å; F51-A68 HydrophobicContact CE2-CB 4.2Å; F51-W71 HydrophobicContact CE2-CB 4.4Å; F51-W71 HydrophobicContact CZ-CB 4.3Å; F51-W71 HydrophobicContact CZ-CD2 4.3Å; F51-W71 HydrophobicContact CZ-CE3 4.02Å; F51-W71 HydrophobicContact CZ-CG 4.44Å
52M97.1Very high94.3Very high22 Ų2288.2 Ų88.211%0.10841%0.409CS..Hα-helixtrans-58.6-47175.1179.3-163.265.900112.1S48 Q50 A55 K56 R57 R58 L60S48-M52 PolarHBondContact O-N 3.45Å; Q50-M52 VanDerWaalsContact C-N 3.3Å; Q50-M52 PolarHBondContact O-N 3.35Å; M52-A55 CarbonylContact O-C 3.57Å; M52-A55 PolarHBondContact O-N 3.38Å; M52-K56 PolarHBondContact O-N 3.37Å; M52-R57 HydrophobicContact CG-CB 4.13Å; M52-R57 PolarHBondContact O-N 3.15Å; M52-R58 VanDerWaalsContact SD-C 3.59Å; M52-L60 HydrophobicContact SD-CB 3.86Å; M52-L60 PolarHBondContact SD-N 3.14Å
53R95.6Very high94.4Very high183 Ų18389.4 Ų89.469%0.69142%0.419SS*.Hα-helixtrans-66.9-41.7179.8-73.5178.5-177.9-157.70.6112.1S49 Q50 F51 A55 K56S49-R53 WeakPolarHBondContact O-CG 3.34Å; S49-R53 PolarHBondContact O-N 3.48Å; Q50-R53 PolarHBondContact O-N 2.89Å; Q50-R53 VanDerWaalsContact O-N 3.12Å; F51-R53 PolarHBondContact O-N 2.94Å; R53-A55 PolarHBondContact O-N 2.94Å; R53-K56 WeakPolarHBondContact O-CA 3.4Å; R53-K56 PolarHBondContact O-N 3.07Å
54H95.7Very high94.6Very high157 Ų15786.4 Ų86.473%0.72741%0.405SS*.Hα-helixtrans-65.1-30.2175.4-76-67.1000112.1Q50 F51 K56Q50-H54 PolarHBondContact O-CD2 3.11Å; Q50-H54 PolarHBondContact O-N 3.49Å; F51-H54 PolarHBondContact O-N 2.93Å; H54-K56 PolarHBondContact O-N 2.98Å
55A94.8Very high94.7Very high42 Ų4288.3 Ų88.335%0.34741%0.411SS..THydrogen-bonded Turntrans-77.45.8170.600000114F51 M52 R53 R57F51-A55 WeakPolarHBondContact O-CB 3.45Å; F51-A55 PolarHBondContact O-N 2.89Å; M52-A55 CarbonylContact O-C 3.57Å; M52-A55 PolarHBondContact O-N 3.38Å; R53-A55 PolarHBondContact O-N 2.94Å; A55-R57 PolarHBondContact O-N 3.46Å; A55-R57 VanDerWaalsContact O-N 3.16Å
56K94.8Very high94.8Very high201 Ų20185.7 Ų85.787%0.87440%0.395SS*.THydrogen-bonded Turntrans55.127.8-176.9-58179.2-179.8177.90113.6M52 R53 H54M52-K56 PolarHBondContact O-N 3.37Å; R53-K56 WeakPolarHBondContact O-CA 3.4Å; R53-K56 PolarHBondContact O-N 3.07Å; H54-K56 PolarHBondContact O-N 2.98Å
57R94.8Very high94.8Very high78 Ų7885 Ų8529%0.29439%0.387SS..  trans-101.3156.2177.3-73.2-175.6-75.3101.7-1.9111M52 A55 K59 T61 D64M52-R57 HydrophobicContact CG-CB 4.13Å; M52-R57 PolarHBondContact O-N 3.15Å; A55-R57 PolarHBondContact O-N 3.46Å; A55-R57 VanDerWaalsContact O-N 3.16Å; R57-K59 PolarHBondContact NH1-O 3.5Å; R57-K59 VanDerWaalsContact NH1-O 3.17Å; R57-T61 PolarHBondContact NH1-OG1 3.37Å; R57-D64 IonicContact CZ-OD1 3.32Å; R57-D64 IonicContact CZ-OD2 3.31Å; R57-D64 IonicContact NH1-OD1 3.31Å; R57-D64 IonicContact NH1-OD2 3.09Å; R57-D64 PolarHBondContact NH1-OD2 2.99Å; R57-D64 IonicContact NH2-OD1 2.64Å; R57-D64 PolarHBondContact NH2-OD1 3.32Å; R57-D64 IonicContact NH2-OD2 3.14Å; R57-D64 PolarHBondContact NH2-OD2 3.15Å
58R93.6Very high94.9Very high247 Ų24783.9 Ų83.993%0.93238%0.379SS*.SBendtrans-106.7-12.3174-61.6-179.173.5170.72.6113.2M52M52-R58 VanDerWaalsContact SD-C 3.59Å
59K93.8Very high94.7Very high169 Ų16984.8 Ų84.874%0.73538%0.384SS*.SBendtrans-108.6123.6178.8-172.1178.1-179-177.70108.8R57R57-K59 PolarHBondContact NH1-O 3.5Å; R57-K59 VanDerWaalsContact NH1-O 3.17Å
60L92.6Very high94.6Very high75 Ų7590 Ų9039%0.39340%0.398SS..  trans-75.1127.5176.5-170.5132.2000108.7M52 D64M52-L60 HydrophobicContact SD-CB 3.86Å; M52-L60 PolarHBondContact SD-N 3.14Å; L60-D64 HydrophobicContact CG-CB 4.38Å
61T92.8Very high94.5Very high47 Ų4794.7 Ų94.729%0.28841%0.412SS..  trans-108.6163.3-179.563.10000111R57 E63 D64 F65R57-T61 PolarHBondContact NH1-OG1 3.37Å; T61-E63 PolarHBondContact O-N 3.44Å; T61-D64 PolarHBondContact N-OD2 2.98Å; T61-D64 WeakPolarHBondContact O-CB 3.42Å; T61-D64 PolarHBondContact O-N 2.97Å; T61-D64 PolarHBondContact OG1-OD2 3.46Å; T61-F65 PolarHBondContact O-N 3.14Å
62V93.4Very high94.3Very high56 Ų5694.5 Ų94.534%0.33942%0.417SS..Hα-helixtrans-56.8-35.5173.9-1780000110.9D64 F65 N66V62-D64 VanDerWaalsContact C-N 3.33Å; V62-D64 PolarHBondContact O-N 3.42Å; V62-F65 PolarHBondContact O-N 3.23Å; V62-N66 WeakPolarHBondContact O-CB 3.36Å; V62-N66 PolarHBondContact O-N 2.85Å
63E93.4Very high94.1Very high119 Ų119101.1 Ų101.156%0.55645%0.453SS*.Hα-helixtrans-61.9-37.6175.7-67-173.7-170.400113.4T61 F65 N66 R67T61-E63 PolarHBondContact O-N 3.44Å; E63-F65 VanDerWaalsContact C-N 3.3Å; E63-N66 PolarHBondContact O-N 3.5Å; E63-R67 WeakPolarHBondContact O-CB 3.22Å; E63-R67 VanDerWaalsContact O-CG 3.22Å; E63-R67 WeakPolarHBondContact O-CG 3.45Å; E63-R67 PolarHBondContact O-N 3.32Å; E63-R67 IonicContact OE2-NH2 3.55Å; E63-R67 PolarHBondContact OE2-NH2 3.42Å
64D95.1Very high94Very high0 Ų096.1 Ų96.10%044%0.442CS..Hα-helixtrans-64.4-40.4177-63.3-40.2000110.9S48 F51 R57 L60 T61 V62 R67 A68S48-D64 WeakPolarHBondContact CB-O 3.41Å; F51-D64 HydrophobicContact CB-CB 4.28Å; R57-D64 IonicContact CZ-OD1 3.32Å; R57-D64 IonicContact CZ-OD2 3.31Å; R57-D64 IonicContact NH1-OD1 3.31Å; R57-D64 IonicContact NH1-OD2 3.09Å; R57-D64 PolarHBondContact NH1-OD2 2.99Å; R57-D64 IonicContact NH2-OD1 2.64Å; R57-D64 PolarHBondContact NH2-OD1 3.32Å; R57-D64 IonicContact NH2-OD2 3.14Å; R57-D64 PolarHBondContact NH2-OD2 3.15Å; L60-D64 HydrophobicContact CG-CB 4.38Å; T61-D64 PolarHBondContact N-OD2 2.98Å; T61-D64 WeakPolarHBondContact O-CB 3.42Å; T61-D64 PolarHBondContact O-N 2.97Å; T61-D64 PolarHBondContact OG1-OD2 3.46Å; V62-D64 VanDerWaalsContact C-N 3.33Å; V62-D64 PolarHBondContact O-N 3.42Å; D64-R67 PolarHBondContact O-N 3.31Å; D64-A68 PolarHBondContact O-N 3.07Å
65F94.6Very high93.8Very high51 Ų5197.1 Ų97.122%0.22445%0.448CS..Hα-helixtrans-68.3-44.6176.8-153.3-89000111.6A44 T61 V62 E63 R67 A68 L69A44-F65 HydrophobicContact CB-CE1 4.41Å; A44-F65 HydrophobicContact CB-CE2 4.15Å; A44-F65 HydrophobicContact CB-CZ 3.78Å; T61-F65 PolarHBondContact O-N 3.14Å; V62-F65 PolarHBondContact O-N 3.23Å; E63-F65 VanDerWaalsContact C-N 3.3Å; F65-R67 VanDerWaalsContact C-N 3.29Å; F65-R67 PolarHBondContact O-N 3.38Å; F65-A68 WeakPolarHBondContact O-CA 3.08Å; F65-A68 WeakPolarHBondContact O-CB 3.4Å; F65-A68 PolarHBondContact O-N 3.18Å; F65-L69 HydrophobicContact CD1-CD1 3.88Å; F65-L69 HydrophobicContact CD1-CG 4Å; F65-L69 HydrophobicContact CE1-CD1 4.03Å; F65-L69 HydrophobicContact CE1-CD2 4.07Å; F65-L69 HydrophobicContact CE1-CG 4.05Å; F65-L69 WeakPolarHBondContact O-CG 3.36Å; F65-L69 PolarHBondContact O-N 2.93Å
66N95.1Very high93.6Very high20 Ų2096.9 Ų96.911%0.10745%0.446CS..Hα-helixtrans-64.7-30.7175.5-82-18.6000112.8V62 E63 R70 A76 I77V62-N66 WeakPolarHBondContact O-CB 3.36Å; V62-N66 PolarHBondContact O-N 2.85Å; E63-N66 PolarHBondContact O-N 3.5Å; N66-R70 VanDerWaalsContact O-CG 3.3Å; N66-R70 WeakPolarHBondContact O-CG 3.44Å; N66-R70 PolarHBondContact O-N 3.41Å; N66-R70 VanDerWaalsContact O-N 3.14Å; N66-A76 HydrophobicContact CB-CB 4.15Å; N66-I77 PolarHBondContact ND2-O 3.41Å; N66-I77 VanDerWaalsContact ND2-O 3.1Å; N66-I77 PolarHBondContact OD1-N 2.93Å
67R94.6Very high93.3Very high107 Ų10791.4 Ų91.440%0.40443%0.425SS..Hα-helixtrans-67.5-41.4170-73.6172-161.6-167.16.6111.6F51 E63 D64 F65 R70 W71F51-R67 HydrophobicContact CD1-CB 4.24Å; F51-R67 HydrophobicContact CD2-CB 3.94Å; F51-R67 HydrophobicContact CE1-CB 4.33Å; F51-R67 HydrophobicContact CE2-CB 4.05Å; F51-R67 HydrophobicContact CG-CB 4.06Å; F51-R67 HydrophobicContact CZ-CB 4.24Å; E63-R67 WeakPolarHBondContact O-CB 3.22Å; E63-R67 VanDerWaalsContact O-CG 3.22Å; E63-R67 WeakPolarHBondContact O-CG 3.45Å; E63-R67 PolarHBondContact O-N 3.32Å; E63-R67 IonicContact OE2-NH2 3.55Å; E63-R67 PolarHBondContact OE2-NH2 3.42Å; D64-R67 PolarHBondContact O-N 3.31Å; F65-R67 VanDerWaalsContact C-N 3.29Å; F65-R67 PolarHBondContact O-N 3.38Å; R67-R70 PolarHBondContact O-N 2.91Å; R67-W71 WeakPolarHBondContact O-CB 3.37Å; R67-W71 PolarHBondContact O-N 2.82Å
68A95.7Very high92.9Very high0 Ų091.9 Ų91.90%045%0.445CS..Hα-helixtrans-63-43.1175.200000112.7F51 D64 F65 W71 S72F51-A68 HydrophobicContact CD2-CB 4.24Å; F51-A68 HydrophobicContact CE2-CB 4.2Å; D64-A68 PolarHBondContact O-N 3.07Å; F65-A68 WeakPolarHBondContact O-CA 3.08Å; F65-A68 WeakPolarHBondContact O-CB 3.4Å; F65-A68 PolarHBondContact O-N 3.18Å; A68-W71 WeakPolarHBondContact O-CB 3.37Å; A68-W71 PolarHBondContact O-N 2.93Å; A68-S72 PolarHBondContact O-N 3.2Å; A68-S72 VanDerWaalsContact O-N 3.08Å; A68-S72 PolarHBondContact O-OG 3.35Å
69L93.3Very high92.5Very high20 Ų2083.8 Ų83.811%0.10544%0.439CS..Hα-helixtrans-61.2-48.9176.2-68.3177000111.5F65 W71 S72 N73 V74 I77F65-L69 HydrophobicContact CD1-CD1 3.88Å; F65-L69 HydrophobicContact CD1-CG 4Å; F65-L69 HydrophobicContact CE1-CD1 4.03Å; F65-L69 HydrophobicContact CE1-CD2 4.07Å; F65-L69 HydrophobicContact CE1-CG 4.05Å; F65-L69 WeakPolarHBondContact O-CG 3.36Å; F65-L69 PolarHBondContact O-N 2.93Å; L69-W71 VanDerWaalsContact C-N 3.27Å; L69-W71 PolarHBondContact O-N 3.49Å; L69-S72 CarbonylContact O-C 3.27Å; L69-S72 WeakPolarHBondContact O-CA 3.24Å; L69-S72 PolarHBondContact O-N 3.08Å; L69-N73 PolarHBondContact O-N 3.49Å; L69-V74 CarbonylContact C-O 3.03Å; L69-V74 VanDerWaalsContact C-O 3.27Å; L69-V74 HydrophobicContact CB-CB 4.17Å; L69-V74 HydrophobicContact CB-CG1 4.49Å; L69-V74 HydrophobicContact CD2-CB 4.2Å; L69-V74 HydrophobicContact CD2-CG1 4.07Å; L69-V74 WeakPolarHBondContact O-CA 3.5Å; L69-V74 WeakPolarHBondContact O-CB 3.46Å; L69-V74 PolarHBondContact O-N 3.32Å; L69-I77 HydrophobicContact CD1-CD1 3.94Å; L69-I77 HydrophobicContact CD1-CG1 3.78Å
70R94.4Very high91.9Very high144 Ų14482.3 Ų82.354%0.54343%0.43SS..Hα-helixtrans-60.4-37.9176.3-70.1-178.5-160.9115-2.1112.4N66 R67 S72 N73 V74 A76N66-R70 VanDerWaalsContact O-CG 3.3Å; N66-R70 WeakPolarHBondContact O-CG 3.44Å; N66-R70 PolarHBondContact O-N 3.41Å; N66-R70 VanDerWaalsContact O-N 3.14Å; R67-R70 PolarHBondContact O-N 2.91Å; R70-S72 PolarHBondContact O-N 3.44Å; R70-N73 PolarHBondContact O-N 2.93Å; R70-V74 PolarHBondContact N-O 3.44Å; R70-A76 HydrophobicContact CG-CB 4.36Å
71W92.9Very high91.2Very high198 Ų19881.7 Ų81.775%0.7544%0.442SS*.Hα-helixtrans-61.4-35175.8-173.4-84.5000112.2F51 R67 A68 L69 N73F51-W71 HydrophobicContact CE2-CB 4.4Å; F51-W71 HydrophobicContact CZ-CB 4.3Å; F51-W71 HydrophobicContact CZ-CD2 4.3Å; F51-W71 HydrophobicContact CZ-CE3 4.02Å; F51-W71 HydrophobicContact CZ-CG 4.44Å; R67-W71 WeakPolarHBondContact O-CB 3.37Å; R67-W71 PolarHBondContact O-N 2.82Å; A68-W71 WeakPolarHBondContact O-CB 3.37Å; A68-W71 PolarHBondContact O-N 2.93Å; L69-W71 VanDerWaalsContact C-N 3.27Å; L69-W71 PolarHBondContact O-N 3.49Å; W71-N73 VanDerWaalsContact C-N 3.26Å; W71-N73 PolarHBondContact O-N 3.34Å
72S91.7Very high90.5Very high49 Ų4983.1 Ų83.134%0.34346%0.458SS..THydrogen-bonded Turntrans-86.613.8175.1-590000113.7A68 L69 R70 V74A68-S72 PolarHBondContact O-N 3.2Å; A68-S72 VanDerWaalsContact O-N 3.08Å; A68-S72 PolarHBondContact O-OG 3.35Å; L69-S72 CarbonylContact O-C 3.27Å; L69-S72 WeakPolarHBondContact O-CA 3.24Å; L69-S72 PolarHBondContact O-N 3.08Å; R70-S72 PolarHBondContact O-N 3.44Å; S72-V74 PolarHBondContact O-N 2.94Å
73N93.3Very high89.5Confident161 Ų16190.2 Ų90.286%0.86149%0.488SS*.THydrogen-bonded Turntrans55.531.4-174.3-62.2-42.4000114L69 R70 W71L69-N73 PolarHBondContact O-N 3.49Å; R70-N73 PolarHBondContact O-N 2.93Å; W71-N73 VanDerWaalsContact C-N 3.26Å; W71-N73 PolarHBondContact O-N 3.34Å
74V93.3Very high88.8Confident77 Ų7790.9 Ų90.947%0.46750%0.495SS..PPolyproline II helixtrans-101.7141.7173-1770000109.1L69 R70 S72L69-V74 CarbonylContact C-O 3.03Å; L69-V74 VanDerWaalsContact C-O 3.27Å; L69-V74 HydrophobicContact CB-CB 4.17Å; L69-V74 HydrophobicContact CB-CG1 4.49Å; L69-V74 HydrophobicContact CD2-CB 4.2Å; L69-V74 HydrophobicContact CD2-CG1 4.07Å; L69-V74 WeakPolarHBondContact O-CA 3.5Å; L69-V74 WeakPolarHBondContact O-CB 3.46Å; L69-V74 PolarHBondContact O-N 3.32Å; R70-V74 PolarHBondContact N-O 3.44Å; S72-V74 PolarHBondContact O-N 2.94Å
75E92.1Very high87.9Confident179 Ų17995.1 Ų95.184%0.83653%0.53SS*.PPolyproline II helixtrans-60141176.3-65.6-173166.400111.3
76A89.8Confident87.2Confident37 Ų3797 Ų9731%0.30654%0.542SS..PPolyproline II helixtrans-73.9140.8178.200000110.3N66 R70 A78N66-A76 HydrophobicContact CB-CB 4.15Å; R70-A76 HydrophobicContact CG-CB 4.36Å; A76-A78 PolarHBondContact O-N 3.28Å
77I89.1Confident86.4Confident85 Ų8598.7 Ų98.744%0.43655%0.554SS.*PPolyproline II helixtrans-80.8118179.4-52.7174.3000108.1N66 L69 Y80N66-I77 PolarHBondContact ND2-O 3.41Å; N66-I77 VanDerWaalsContact ND2-O 3.1Å; N66-I77 PolarHBondContact OD1-N 2.93Å; L69-I77 HydrophobicContact CD1-CD1 3.94Å; L69-I77 HydrophobicContact CD1-CG1 3.78Å; I77-Y80 HydrophobicContact CG2-CD2 3.54Å; I77-Y80 HydrophobicContact CG2-CE2 3.49Å; I77-Y80 VanDerWaalsContact CG2-CE2 3.49Å
78A87.1Confident85.9Confident88 Ų88100.6 Ų100.673%0.72757%0.566SS**PPolyproline II helixtrans-86.1162.2175.100000111.3A76 Y80A76-A78 PolarHBondContact O-N 3.28Å; A78-Y80 WeakPolarHBondContact O-CD2 3.42Å
79G83.9Confident85.4Confident78 Ų78105.4 Ų105.480%0.80458%0.584SS**SBendtrans87.22.3176.700000115.5
80Y82.4Confident85Confident137 Ų137108.6 Ų108.654%0.53761%0.606SS.*  trans-117.6144.5177.3-63.9-89.7000111.5I77 A78 L86I77-Y80 HydrophobicContact CG2-CD2 3.54Å; I77-Y80 HydrophobicContact CG2-CE2 3.49Å; I77-Y80 VanDerWaalsContact CG2-CE2 3.49Å; A78-Y80 WeakPolarHBondContact O-CD2 3.42Å; Y80-L86 HydrophobicContact CD1-CD1 3.7Å; Y80-L86 HydrophobicContact CE1-CD1 3.62Å
81G76.8Confident84.5Confident62 Ų62105.5 Ų105.564%0.63960%0.599SS**  trans119.9-0.2-179.900000115
82A78.4Confident83.6Confident77 Ų77106.2 Ų106.264%0.63661%0.608SS**  trans-61.6153.7167.100000111D84A82-D84 PolarHBondContact O-N 3.05Å
83Q72Confident82.4Confident205 Ų205112.9 Ų112.996%0.95863%0.633SS**SBendtrans-72.7-20.9173.5-66-170.116.800112.1
84D78.4Confident81Confident134 Ų134107.3 Ų107.372%0.71761%0.614SS**SBendtrans-67.9136.2179.5-59.6-45.8000110.9A82A82-D84 PolarHBondContact O-N 3.05Å
85A77.1Confident80Confident89 Ų89112.8 Ų112.874%0.73663%0.634SS**  trans-69.1141.3175.200000109.8P87A85-P87 WeakPolarHBondContact O-CD 3.41Å
86L79.3Confident79.4Confident89 Ų89108.8 Ų108.847%0.46662%0.618SS.*  trans-96.993.1170.6-65.9173.4000108.7Y80 F88 V99Y80-L86 HydrophobicContact CD1-CD1 3.7Å; Y80-L86 HydrophobicContact CE1-CD1 3.62Å; L86-F88 PolarHBondContact O-N 3.26Å; L86-V99 HydrophobicContact CB-CG1 4.26Å; L86-V99 HydrophobicContact CD2-CG1 4.25Å
87P79.7Confident79.1Confident57 Ų57113.6 Ų113.637%0.3763%0.632SS.*  trans-72.4120.1-176.929-34.6000110.9A85 D100A85-P87 WeakPolarHBondContact O-CD 3.41Å; P87-D100 HydrophobicContact CG-CB 4.27Å; P87-D100 PolarHBondContact O-N 3.1Å
88F83Confident78.9Confident147 Ų147113.8 Ų113.865%0.64563%0.63SS**EExtended strand (participates in β ladder)trans-77.1122.7166.9-71.4-89.1000109.5L86 F98 V99L86-F88 PolarHBondContact O-N 3.26Å; F88-F98 WeakPolarHBondContact CA-O 3.34Å; F88-V99 HydrophobicContact CD1-CG2 3.97Å; F88-V99 HydrophobicContact CE1-CG2 3.61Å; F88-V99 HydrophobicContact CZ-CG2 4.04Å
89R85Confident78.8Confident100 Ų100112.4 Ų112.438%0.37761%0.612SS.*EExtended strand (participates in β ladder)trans-112.2134179.1-64.1-167.8-175.5-164.19.4111F97 F98 D100R89-F97 WeakPolarHBondContact O-CA 3.46Å; R89-F98 HydrophobicContact CB-CD1 4.31Å; R89-F98 HydrophobicContact CB-CE1 3.78Å; R89-F98 HydrophobicContact CB-CE2 4.41Å; R89-F98 HydrophobicContact CB-CZ 3.84Å; R89-F98 PolarHBondContact N-O 3.11Å; R89-F98 WeakPolarHBondContact O-CD1 3.36Å; R89-F98 PolarHBondContact O-N 2.7Å; R89-D100 HydrophobicContact CG-CB 4.2Å; R89-D100 IonicContact CZ-OD1 3.59Å; R89-D100 IonicContact CZ-OD2 3.62Å; R89-D100 IonicContact NE-OD1 2.7Å; R89-D100 IonicContact NE-OD2 3.63Å; R89-D100 PolarHBondContact NE-OD2 2.98Å; R89-D100 IonicContact NH2-OD1 2.68Å; R89-D100 IonicContact NH2-OD2 3.58Å; R89-D100 PolarHBondContact NH2-OD2 2.94Å
90P86.4Confident78.7Confident87 Ų87110.4 Ų110.457%0.56558%0.584SS**EExtended strand (participates in β ladder)trans-77.7145.6173.731.3-33.2000111.2L96 F97P90-L96 WeakPolarHBondContact CA-O 3.27Å; P90-F97 HydrophobicContact CB-CD1 4.09Å; P90-F97 HydrophobicContact CB-CE1 3.85Å
91I82.7Confident78.6Confident80 Ų80111 Ų11141%0.4160%0.596SS.*  trans-83.8138.4169.1-62.1175.1000108.5E93 L96 F98I91-E93 PolarHBondContact O-N 3.16Å; I91-E93 VanDerWaalsContact O-N 3.15Å; I91-L96 HydrophobicContact CB-CB 4.49Å; I91-L96 HydrophobicContact CD1-CB 4.04Å; I91-L96 PolarHBondContact N-O 3.34Å; I91-F98 HydrophobicContact CD1-CD1 4.18Å; I91-F98 HydrophobicContact CG1-CD1 3.73Å; I91-F98 HydrophobicContact CG1-CE1 3.99Å
92K75.3Confident78.8Confident212 Ų212116.3 Ų116.392%0.92260%0.597SS**THydrogen-bonded Turntrans-67.2-14.7-171.9-66.4-177.8-179.8176.30114.5
93E66.3Low79.1Confident190 Ų190120.8 Ų120.889%0.88861%0.61SS**THydrogen-bonded Turntrans-126.347.2-176-67.9-179.8170.500111.8I91I91-E93 PolarHBondContact O-N 3.16Å; I91-E93 VanDerWaalsContact O-N 3.15Å
94G62.3Low79.7Confident43 Ų43115.6 Ų115.644%0.44359%0.592SS.*SBendtrans165168.5170.900000114.1L96G94-L96 PolarHBondContact O-N 3.46Å
95E73.3Confident80.2Confident193 Ų193112.8 Ų112.890%0.90258%0.577SS**SBendtrans-7835.6172.2-61.9-171.3162.700112.4
96L79.4Confident80.7Confident95 Ų95114.9 Ų114.950%0.49758%0.575SS.*  trans-102.4136.8-176.8-68.2169.5000110.6P90 I91 G94P90-L96 WeakPolarHBondContact CA-O 3.27Å; I91-L96 HydrophobicContact CB-CB 4.49Å; I91-L96 HydrophobicContact CD1-CB 4.04Å; I91-L96 PolarHBondContact N-O 3.34Å; G94-L96 PolarHBondContact O-N 3.46Å
97F82.7Confident81.3Confident138 Ų138115.3 Ų115.361%0.60558%0.581SS**EExtended strand (participates in β ladder)trans-119.5140.6176.8-62.7-92.7000109.7R89 P90R89-F97 WeakPolarHBondContact O-CA 3.46Å; P90-F97 HydrophobicContact CB-CD1 4.09Å; P90-F97 HydrophobicContact CB-CE1 3.85Å
98F85.1Confident81.7Confident88 Ų88118.9 Ų118.939%0.38659%0.593SS.*EExtended strand (participates in β ladder)trans-128156171.870.9-81.3000110.5F88 R89 I91 D100F88-F98 WeakPolarHBondContact CA-O 3.34Å; R89-F98 HydrophobicContact CB-CD1 4.31Å; R89-F98 HydrophobicContact CB-CE1 3.78Å; R89-F98 HydrophobicContact CB-CE2 4.41Å; R89-F98 HydrophobicContact CB-CZ 3.84Å; R89-F98 PolarHBondContact N-O 3.11Å; R89-F98 WeakPolarHBondContact O-CD1 3.36Å; R89-F98 PolarHBondContact O-N 2.7Å; I91-F98 HydrophobicContact CD1-CD1 4.18Å; I91-F98 HydrophobicContact CG1-CD1 3.73Å; I91-F98 HydrophobicContact CG1-CE1 3.99Å; F98-D100 HydrophobicContact CE2-CB 4.28Å
99V85.3Confident81.8Confident59 Ų59117.1 Ų117.136%0.35859%0.59SS.*EExtended strand (participates in β ladder)trans-85.4120.3170.4179.80000107.2L86 F88 D101L86-V99 HydrophobicContact CB-CG1 4.26Å; L86-V99 HydrophobicContact CD2-CG1 4.25Å; F88-V99 HydrophobicContact CD1-CG2 3.97Å; F88-V99 HydrophobicContact CE1-CG2 3.61Å; F88-V99 HydrophobicContact CZ-CG2 4.04Å; V99-D101 PolarHBondContact O-N 2.95Å; V99-D101 VanDerWaalsContact O-N 3.15Å
100D82.5Confident81.7Confident37 Ų37116.5 Ų116.520%0.19861%0.606CS.*  trans-70105.4176.6-177.857.6000109.4P87 R89 F98 R102P87-D100 HydrophobicContact CG-CB 4.27Å; P87-D100 PolarHBondContact O-N 3.1Å; R89-D100 HydrophobicContact CG-CB 4.2Å; R89-D100 IonicContact CZ-OD1 3.59Å; R89-D100 IonicContact CZ-OD2 3.62Å; R89-D100 IonicContact NE-OD1 2.7Å; R89-D100 IonicContact NE-OD2 3.63Å; R89-D100 PolarHBondContact NE-OD2 2.98Å; R89-D100 IonicContact NH2-OD1 2.68Å; R89-D100 IonicContact NH2-OD2 3.58Å; R89-D100 PolarHBondContact NH2-OD2 2.94Å; F98-D100 HydrophobicContact CE2-CB 4.28Å; D100-R102 IonicContact OD2-NE 3.82Å; D100-R102 PolarHBondContact OD2-NE 3.33Å
101D80.3Confident81.8Confident150 Ų150118.7 Ų118.780%0.80261%0.612SS**PPolyproline II helixtrans-94.8119.2174.4-154.2-2.8000109V99V99-D101 PolarHBondContact O-N 2.95Å; V99-D101 VanDerWaalsContact O-N 3.15Å
102R81.1Confident81.8Confident172 Ų172117.2 Ų117.265%0.64961%0.612SS**PPolyproline II helixtrans-100.9128.3-176.9-65.5-173.7-176.6-173.63.5109.1D100 V104D100-R102 IonicContact OD2-NE 3.82Å; D100-R102 PolarHBondContact OD2-NE 3.33Å; R102-V104 PolarHBondContact O-N 2.97Å
103D84.4Confident81.7Confident171 Ų171113.1 Ų113.191%0.91461%0.605SS**PPolyproline II helixtrans-58.9129.1173.4-65.1-34.7000110.7
104V83.4Confident82.1Confident97 Ų97111 Ų11159%0.58860%0.599SS**PPolyproline II helixtrans-102121.8178.6-178.60000109R102 L106 L109R102-V104 PolarHBondContact O-N 2.97Å; V104-L106 PolarHBondContact O-N 2.94Å; V104-L106 VanDerWaalsContact O-N 3.11Å; V104-L109 HydrophobicContact CG1-CB 4.4Å; V104-L109 HydrophobicContact CG1-CD2 4.07Å
105N89.1Confident82.8Confident75 Ų75115.9 Ų115.940%0.40161%0.614SS.*  trans-72.9104.2171.9-173.9-15.6000109.9V107 E108 L109N105-V107 PolarHBondContact O-N 3.22Å; N105-V107 WeakPolarHBondContact OD1-CB 3.47Å; N105-V107 PolarHBondContact OD1-N 3.48Å; N105-E108 HydrophobicContact CB-CB 4.15Å; N105-E108 HydrophobicContact CB-CG 4.24Å; N105-E108 VanDerWaalsContact ND2-CD 3.34Å; N105-E108 PolarHBondContact ND2-OE1 3.41Å; N105-E108 PolarHBondContact O-N 3.19Å; N105-L109 PolarHBondContact O-N 3.11Å
106L88.8Confident82.8Confident133 Ų133112.3 Ų112.370%0.69661%0.607SS**Hα-helixtrans-60.6-31.2-178-64.9176.3000113.1V104 A110V104-L106 PolarHBondContact O-N 2.94Å; V104-L106 VanDerWaalsContact O-N 3.11Å; L106-A110 VanDerWaalsContact O-CB 3.24Å; L106-A110 WeakPolarHBondContact O-CB 3.42Å; L106-A110 PolarHBondContact O-N 3.21Å
107V91.6Very high82.7Confident97 Ų97117.4 Ų117.459%0.58863%0.626SS**Hα-helixtrans-69.2-46.7179.7-178.70000109.9N105 A110 L111N105-V107 PolarHBondContact O-N 3.22Å; N105-V107 WeakPolarHBondContact OD1-CB 3.47Å; N105-V107 PolarHBondContact OD1-N 3.48Å; V107-A110 PolarHBondContact O-N 3.44Å; V107-L111 HydrophobicContact CG1-CD1 3.97Å; V107-L111 WeakPolarHBondContact O-CB 3.36Å; V107-L111 VanDerWaalsContact O-CG 3.24Å; V107-L111 WeakPolarHBondContact O-CG 3.34Å; V107-L111 PolarHBondContact O-N 3.31Å
108E87.6Confident82Confident133 Ų133114.4 Ų114.462%0.62163%0.634SS**Hα-helixtrans-64.3-41.3176.5-72.8173.3-154.700111.8N105 A110 L111 A112N105-E108 HydrophobicContact CB-CB 4.15Å; N105-E108 HydrophobicContact CB-CG 4.24Å; N105-E108 VanDerWaalsContact ND2-CD 3.34Å; N105-E108 PolarHBondContact ND2-OE1 3.41Å; N105-E108 PolarHBondContact O-N 3.19Å; E108-A110 PolarHBondContact O-N 3.07Å; E108-L111 PolarHBondContact O-N 3.02Å; E108-A112 PolarHBondContact O-N 3.36Å
109L84.7Confident81.6Confident110 Ų110116.5 Ų116.558%0.57666%0.658SS**Hα-helixtrans-63.6-41.3177.1-175.366.7000112V104 N105 L111 A112V104-L109 HydrophobicContact CG1-CB 4.4Å; V104-L109 HydrophobicContact CG1-CD2 4.07Å; N105-L109 PolarHBondContact O-N 3.11Å; L109-L111 VanDerWaalsContact C-N 3.32Å; L109-A112 WeakPolarHBondContact O-CB 3.4Å; L109-A112 PolarHBondContact O-N 3.4Å
110A84.3Confident81Confident86 Ų86117.8 Ų117.871%0.71168%0.675SS**Hα-helixtrans-69-30.7178.800000112.8L106 V107 E108L106-A110 VanDerWaalsContact O-CB 3.24Å; L106-A110 WeakPolarHBondContact O-CB 3.42Å; L106-A110 PolarHBondContact O-N 3.21Å; V107-A110 PolarHBondContact O-N 3.44Å; E108-A110 PolarHBondContact O-N 3.07Å
111L88.2Confident81Confident133 Ų133125 Ų12570%0.69671%0.707SS**Hα-helixtrans-84.4-13.1176.4-65.6174.3000113V107 E108 L109 T113V107-L111 HydrophobicContact CG1-CD1 3.97Å; V107-L111 WeakPolarHBondContact O-CB 3.36Å; V107-L111 VanDerWaalsContact O-CG 3.24Å; V107-L111 WeakPolarHBondContact O-CG 3.34Å; V107-L111 PolarHBondContact O-N 3.31Å; E108-L111 PolarHBondContact O-N 3.02Å; L109-L111 VanDerWaalsContact C-N 3.32Å; L111-T113 PolarHBondContact O-N 3.36Å
112A83.2Confident81.1Confident49 Ų49125 Ų12541%0.40571%0.712SS.*  trans-64122.7177.700000110.6E108 L109 N114E108-A112 PolarHBondContact O-N 3.36Å; L109-A112 WeakPolarHBondContact O-CB 3.4Å; L109-A112 PolarHBondContact O-N 3.4Å; A112-N114 PolarHBondContact O-N 2.87Å
113T72.9Confident81Confident126 Ų126122.5 Ų122.577%0.77371%0.71SS**  trans-79.215.5-17754.90000113.9L111 I115L111-T113 PolarHBondContact O-N 3.36Å; T113-I115 VanDerWaalsContact C-N 3.32Å; T113-I115 PolarHBondContact O-N 2.67Å
114N73.8Confident81Confident145 Ų145120.7 Ų120.778%0.77570%0.704SS**  trans-84.474.4-177.3-68.3-38.7000110.5A112A112-N114 PolarHBondContact O-N 2.87Å
115I77.1Confident80.5Confident146 Ų146125.3 Ų125.375%0.74971%0.711SS**PPolyproline II helixtrans-69.6126.4172.6-57.5168.8000108T113 K117T113-I115 VanDerWaalsContact C-N 3.32Å; T113-I115 PolarHBondContact O-N 2.67Å; I115-K117 PolarHBondContact O-N 2.7Å; I115-K117 VanDerWaalsContact O-N 3.13Å
116P72.9Confident79.9Confident118 Ų118128 Ų12877%0.76673%0.73SS**PPolyproline II helixtrans-55.5122.2175.1-23.332.4000110G118P116-G118 PolarHBondContact O-N 3.01Å
117K77.9Confident79.1Confident202 Ų202128.3 Ų128.388%0.87873%0.733SS**PPolyproline II helixtrans-65.4127.2173.6-65.1-179.9-178.5178.20107.7I115I115-K117 PolarHBondContact O-N 2.7Å; I115-K117 VanDerWaalsContact O-N 3.13Å
118G68.7Low78Confident75 Ų75129 Ų12977%0.77374%0.737SS**PPolyproline II helixtrans-55.7144.9175.400000111P116P116-G118 PolarHBondContact O-N 3.01Å
119C76.5Confident76.7Confident133 Ų133127.3 Ų127.390%0.89974%0.74SS**PPolyproline II helixtrans-72.7141.8172-158.40000109
120A73Confident75.4Confident86 Ų86130.7 Ų130.771%0.71175%0.746SS**PPolyproline II helixtrans-60.9149.2173.100000110.5
121E80.9Confident74.2Confident189 Ų189131.6 Ų131.688%0.88374%0.738SS**PPolyproline II helixtrans-60.8143.7174.6-68.2-172.4165.600110.7M123E121-M123 PolarHBondContact O-N 3.17Å
122T82.3Confident72.6Confident148 Ų148129.7 Ų129.791%0.90873%0.729SS**PPolyproline II helixtrans-72.7116.6-179-52.50000109.3
123M80.5Confident71Confident121 Ų121131.3 Ų131.360%0.59675%0.751SS**  trans-110.7145.1175.569.2171.5-58.100111.7E121 R125E121-M123 PolarHBondContact O-N 3.17Å; M123-R125 HydrophobicContact CE-CG 3.57Å; M123-R125 HydrophobicContact CG-CG 4.44Å; M123-R125 HydrophobicContact SD-CG 4.21Å; M123-R125 PolarHBondContact SD-NE 2.97Å
124V84.3Confident69.8Low132 Ų132131.2 Ų131.280%0.874%0.74SS**  trans-91.9124.2171.7-179.30000108.4V126V124-V126 HydrophobicContact CG1-CG2 4.38Å
125R72.1Confident68.3Low194 Ų194127.1 Ų127.173%0.73273%0.731SS**  trans-109.5130.1170.8-67.9-176.2179.9-176.4-2.7109.1M123M123-R125 HydrophobicContact CE-CG 3.57Å; M123-R125 HydrophobicContact CG-CG 4.44Å; M123-R125 HydrophobicContact SD-CG 4.21Å; M123-R125 PolarHBondContact SD-NE 2.97Å
126V76.3Confident66.5Low131 Ų131125.4 Ų125.479%0.79472%0.724SS**  trans-106.8120.7179.6-177.90000108.7V124V124-V126 HydrophobicContact CG1-CG2 4.38Å
127N71.7Confident65.1Low140 Ų140127.3 Ų127.375%0.74973%0.727SS**  trans-124.1145.2174.4-65.5-1000108.8S129N127-S129 PolarHBondContact O-N 3.25Å
128V69.5Low63.4Low113 Ų113124.4 Ų124.469%0.68572%0.716SS**  trans-76.8115.2174.7-177.80000109L131V128-L131 HydrophobicContact CG1-CD1 4.38Å; V128-L131 HydrophobicContact CG1-CD2 4.23Å; V128-L131 HydrophobicContact CG1-CG 3.82Å
129S59.2Low62.1Low97 Ų97126.2 Ų126.268%0.67871%0.714SS**  trans-88.1-29-178.845.50000114N127N127-S129 PolarHBondContact O-N 3.25Å
130Y58.2Low60.5Low180 Ų180125 Ų12571%0.70670%0.695SS**  trans-149.6129.9-179.3-57.7-79.7000110.3
131L57.9Low59.2Low105 Ų105123.9 Ų123.955%0.5569%0.693SS.*SBendtrans-105.5-27.1177.3-84.3153.7000112.9V128 L137 Y227V128-L131 HydrophobicContact CG1-CD1 4.38Å; V128-L131 HydrophobicContact CG1-CD2 4.23Å; V128-L131 HydrophobicContact CG1-CG 3.82Å; L131-L137 HydrophobicContact CD1-CD2 4.27Å; L131-Y227 HydrophobicContact CD2-CE1 4.04Å
132D56.1Low57.5Low93 Ų93120.7 Ų120.750%0.49769%0.686SS.*SBendtrans-143.4153.9172.5-1758.7000107.3K134D132-K134 CarbonylContact O-C 3.18Å; D132-K134 PolarHBondContact O-N 3.18Å
133G48.3Very low56.1Low84 Ų84115.3 Ų115.387%0.86665%0.653SS**SBendtrans-58.7-9.1-178.800000114.2
134K48.7Very low54.7Low124 Ų124113.8 Ų113.854%0.53965%0.652SS.*SBendtrans-107106.5160.5-60.4177.2-176.11740106.2D132 N136D132-K134 CarbonylContact O-C 3.18Å; D132-K134 PolarHBondContact O-N 3.18Å; K134-N136 PolarHBondContact O-N 2.97Å
135G41.1Very low52.8Low58 Ų58111.8 Ų111.860%0.59864%0.644SS**  trans-64.355.6-177.700000115.2
136N40.4Very low51.8Low111 Ų111103.6 Ų103.659%0.59462%0.618SS**  trans-101.8117.7176.4-89.6-9.9000109.4K134K134-N136 PolarHBondContact O-N 2.97Å
137L44.5Very low50.7Low157 Ų15799.7 Ų99.782%0.82259%0.594SS**  trans-76.6-2.4162.3-70.8161.7000111.8L131L131-L137 HydrophobicContact CD1-CD2 4.27Å
138E41.1Very low49.9Very low142 Ų142101.2 Ų101.266%0.66460%0.597SS**SBendtrans-81.9135.6-178.4-69.7-64.6115.600111.3Q140E138-Q140 PolarHBondContact O-N 3.43Å
139P41Very low49.7Very low113 Ų113100.6 Ų100.673%0.73459%0.593SS**  trans-60.2112.1172.424.4-30.2000108.4G141P139-G141 PolarHBondContact O-N 3.43Å
140Q44.1Very low50.6Low107 Ų10797.4 Ų97.450%0.557%0.568SS.*  trans-55.2118.1169.4-78.7-176.44.300107.2E138E138-Q140 PolarHBondContact O-N 3.43Å
141G44.4Very low51.8Low63 Ų6391.7 Ų91.765%0.64956%0.555SS**  trans-56.1177.9175.700000112.1P139 V143P139-G141 PolarHBondContact O-N 3.43Å; G141-V143 PolarHBondContact O-N 2.91Å
142T45.2Very low53.2Low121 Ų12193 Ų9374%0.74256%0.558SS**  trans-39.8131-171.745.50000113.5P144 S145T142-P144 VanDerWaalsContact C-N 3.27Å; T142-P144 WeakPolarHBondContact O-CD 3.32Å; T142-S145 PolarHBondContact O-N 3.29Å
143V53.5Low54.8Low35 Ų3594.3 Ų94.321%0.21257%0.565CS.*G310 helixtrans-46.7-26.6-174-176.10000116.4G141 S145 A146 V147 Y192 Y195G141-V143 PolarHBondContact O-N 2.91Å; V143-S145 VanDerWaalsContact C-N 3.27Å; V143-S145 PolarHBondContact O-N 3.09Å; V143-S145 VanDerWaalsContact O-N 3.16Å; V143-A146 PolarHBondContact O-N 3.4Å; V143-V147 HydrophobicContact CG1-CG2 4.48Å; V143-V147 PolarHBondContact O-N 3.3Å; V143-Y192 HydrophobicContact CG1-CD1 3.71Å; V143-Y192 HydrophobicContact CG1-CE1 4.07Å; V143-Y195 HydrophobicContact CB-CD2 3.97Å; V143-Y195 HydrophobicContact CB-CE2 4.22Å; V143-Y195 HydrophobicContact CB-CG 4.11Å; V143-Y195 HydrophobicContact CG1-CD1 4.25Å; V143-Y195 HydrophobicContact CG1-CD2 4.44Å; V143-Y195 HydrophobicContact CG1-CG 4.07Å; V143-Y195 HydrophobicContact CG2-CD2 3.4Å; V143-Y195 VanDerWaalsContact CG2-CD2 3.4Å; V143-Y195 HydrophobicContact CG2-CE2 4Å; V143-Y195 HydrophobicContact CG2-CG 3.75Å
144P50.3Low56.7Low89 Ų8992.7 Ų92.758%0.57854%0.536SS*.G310 helixtrans-58.3-32.1-178.3-26.935.8000115.1T142T142-P144 VanDerWaalsContact C-N 3.27Å; T142-P144 WeakPolarHBondContact O-CD 3.32Å
145S45.9Very low58.7Low90 Ų9089.1 Ų89.163%0.62952%0.523SS*.G310 helixtrans-79.6-28-178.8-168.20000112.9T142 V143T142-S145 PolarHBondContact O-N 3.29Å; V143-S145 VanDerWaalsContact C-N 3.27Å; V143-S145 PolarHBondContact O-N 3.09Å; V143-S145 VanDerWaalsContact O-N 3.16Å
146A50.5Low61.1Low22 Ų2291 Ų9118%0.18251%0.514CS..G310 helixtrans-72-31.7178.900000112.5V143 Q148 T149 Y192V143-A146 PolarHBondContact O-N 3.4Å; A146-Q148 PolarHBondContact O-N 2.95Å; A146-Q148 VanDerWaalsContact O-N 3.15Å; A146-T149 PolarHBondContact O-N 3.12Å; A146-T149 PolarHBondContact O-OG1 3.07Å; A146-Y192 HydrophobicContact CB-CE1 4.29Å; A146-Y192 PolarHBondContact O-OH 3.5Å
147V53.2Low63.7Low50 Ų5087.9 Ų87.930%0.30350%0.495SS..G310 helixtrans-57.6-30.5-179.7-176.10000111.8V143 T149 L150 L155 Y192V143-V147 HydrophobicContact CG1-CG2 4.48Å; V143-V147 PolarHBondContact O-N 3.3Å; V147-T149 PolarHBondContact O-N 2.88Å; V147-L150 PolarHBondContact O-N 3.16Å; V147-L155 HydrophobicContact CG1-CD1 3.86Å; V147-Y192 HydrophobicContact CB-CE1 4.04Å; V147-Y192 HydrophobicContact CG2-CD1 3.76Å; V147-Y192 HydrophobicContact CG2-CE1 3.37Å; V147-Y192 PolarHBondContact N-OH 3.45Å
148Q53.8Low66Low172 Ų17282.2 Ų82.280%0.80446%0.463SS*.G310 helixtrans-71.1-7.3179.7-63.8-175.55.600114.2A146A146-Q148 PolarHBondContact O-N 2.95Å; A146-Q148 VanDerWaalsContact O-N 3.15Å
149T65.9Low68.4Low99 Ų9978.8 Ų78.861%0.60745%0.447SS*.G310 helixtrans-99.2-0.2178.358.20000114.1A146 V147A146-T149 PolarHBondContact O-N 3.12Å; A146-T149 PolarHBondContact O-OG1 3.07Å; V147-T149 PolarHBondContact O-N 2.88Å
150L77.8Confident71Confident31 Ų3179.5 Ų79.516%0.16244%0.44CS..SBendtrans-86.8146.1-178.3-140.369.7000111.1V147 L154 L155 L189 Y192V147-L150 PolarHBondContact O-N 3.16Å; L150-L154 HydrophobicContact CD1-CD1 4.36Å; L150-L154 HydrophobicContact CD2-CB 3.9Å; L150-L154 HydrophobicContact CG-CB 3.77Å; L150-L154 HydrophobicContact CG-CD1 4.29Å; L150-L155 HydrophobicContact CD2-CB 4.34Å; L150-L189 HydrophobicContact CD1-CD2 4.08Å; L150-L189 HydrophobicContact CD2-CD2 3.25Å; L150-L189 HydrophobicContact CG-CD2 4.08Å; L150-Y192 HydrophobicContact CD1-CE2 3.8Å; L150-Y192 HydrophobicContact CD2-CE2 4.24Å
151S84.8Confident73.5Confident59 Ų5975.1 Ų75.141%0.41342%0.42SS..  trans-66.4152.8171.7670000110.8D153 L154 L155S151-D153 PolarHBondContact O-N 3.06Å; S151-L154 PolarHBondContact O-N 3.19Å; S151-L154 VanDerWaalsContact O-N 3.16Å; S151-L154 WeakPolarHBondContact OG-CB 3.46Å; S151-L154 WeakPolarHBondContact OG-CD1 3.19Å; S151-L154 VanDerWaalsContact OG-CG 3.27Å; S151-L154 WeakPolarHBondContact OG-CG 3.44Å; S151-L154 PolarHBondContact OG-N 2.76Å; S151-L155 PolarHBondContact O-N 3.39Å
152E87Confident75.8Confident132 Ų13273.1 Ų73.162%0.61740%0.395SS*.Hα-helixtrans-57.3-38.8-179.8-164.4-173.3153.100111.9L155 K156E152-L155 PolarHBondContact O-N 3.41Å; E152-K156 HydrophobicContact CG-CD 4.5Å; E152-K156 WeakPolarHBondContact O-CB 3.47Å; E152-K156 WeakPolarHBondContact O-CG 3.39Å; E152-K156 PolarHBondContact O-N 3.15Å; E152-K156 WeakPolarHBondContact OE1-CE 3.31Å; E152-K156 IonicContact OE1-NZ 2.67Å; E152-K156 PolarHBondContact OE1-NZ 3.16Å
153D89.5Confident78.2Confident121 Ų12175.1 Ų75.165%0.64739%0.389SS*.Hα-helixtrans-66.6-42178.1-61.1-32.5000112.6S151 L155 K156 Y157S151-D153 PolarHBondContact O-N 3.06Å; D153-L155 VanDerWaalsContact C-N 3.33Å; D153-K156 PolarHBondContact O-N 3.3Å; D153-Y157 WeakPolarHBondContact O-CB 3.38Å; D153-Y157 PolarHBondContact O-N 3.46Å
154L88.6Confident80.2Confident50 Ų5073.9 Ų73.926%0.26238%0.382SS..Hα-helixtrans-66.6-38.3176.9-77.7175.7000111.1L150 S151 Y157 Y158 A188 L189L150-L154 HydrophobicContact CD1-CD1 4.36Å; L150-L154 HydrophobicContact CD2-CB 3.9Å; L150-L154 HydrophobicContact CG-CB 3.77Å; L150-L154 HydrophobicContact CG-CD1 4.29Å; S151-L154 PolarHBondContact O-N 3.19Å; S151-L154 VanDerWaalsContact O-N 3.16Å; S151-L154 WeakPolarHBondContact OG-CB 3.46Å; S151-L154 WeakPolarHBondContact OG-CD1 3.19Å; S151-L154 VanDerWaalsContact OG-CG 3.27Å; S151-L154 WeakPolarHBondContact OG-CG 3.44Å; S151-L154 PolarHBondContact OG-N 2.76Å; L154-Y157 PolarHBondContact O-N 3.05Å; L154-Y158 WeakPolarHBondContact O-CB 3.24Å; L154-Y158 PolarHBondContact O-N 3.28Å; L154-A188 HydrophobicContact CD1-CB 4.47Å; L154-L189 HydrophobicContact CB-CD2 4.11Å; L154-L189 HydrophobicContact CD2-CD1 4.16Å; L154-L189 HydrophobicContact CD2-CG 4.29Å
155L89Confident82.4Confident50 Ų5069.6 Ų69.626%0.26236%0.355SS..Hα-helixtrans-66-44.3175.7-176.962.4000111.5V147 L150 S151 E152 D153 Y158 Q159V147-L155 HydrophobicContact CG1-CD1 3.86Å; L150-L155 HydrophobicContact CD2-CB 4.34Å; S151-L155 PolarHBondContact O-N 3.39Å; E152-L155 PolarHBondContact O-N 3.41Å; D153-L155 VanDerWaalsContact C-N 3.33Å; L155-Y158 HydrophobicContact CD1-CD1 4.36Å; L155-Y158 PolarHBondContact O-N 2.92Å; L155-Q159 VanDerWaalsContact O-CG 3.3Å; L155-Q159 WeakPolarHBondContact O-CG 3.46Å; L155-Q159 PolarHBondContact O-N 3.15Å
156K92Very high84.6Confident96 Ų9667.9 Ų67.942%0.41734%0.338SS..Hα-helixtrans-59.2-47.1175-76.9171.6-176163.30111.3E152 D153 Q159 Q160E152-K156 HydrophobicContact CG-CD 4.5Å; E152-K156 WeakPolarHBondContact O-CB 3.47Å; E152-K156 WeakPolarHBondContact O-CG 3.39Å; E152-K156 PolarHBondContact O-N 3.15Å; E152-K156 WeakPolarHBondContact OE1-CE 3.31Å; E152-K156 IonicContact OE1-NZ 2.67Å; E152-K156 PolarHBondContact OE1-NZ 3.16Å; D153-K156 PolarHBondContact O-N 3.3Å; K156-Q159 PolarHBondContact O-N 3.2Å; K156-Q160 WeakPolarHBondContact O-CB 3.22Å; K156-Q160 WeakPolarHBondContact O-CG 3.33Å; K156-Q160 PolarHBondContact O-N 2.96Å
157Y94.4Very high86.6Confident46 Ų4667.9 Ų67.918%0.1834%0.341CS..Hα-helixtrans-59-49.8176171.6-88.1000111.4D153 L154 Q159 Q160 I161 D179 N183 I186 L189 F193D153-Y157 WeakPolarHBondContact O-CB 3.38Å; D153-Y157 PolarHBondContact O-N 3.46Å; L154-Y157 PolarHBondContact O-N 3.05Å; Y157-Q159 VanDerWaalsContact C-N 3.31Å; Y157-Q159 PolarHBondContact O-N 3.21Å; Y157-Q160 PolarHBondContact O-N 2.83Å; Y157-Q160 VanDerWaalsContact O-N 3.17Å; Y157-I161 HydrophobicContact CD1-CG1 4.17Å; Y157-I161 HydrophobicContact CD2-CG1 4.09Å; Y157-I161 HydrophobicContact CE1-CG1 3.76Å; Y157-I161 HydrophobicContact CE2-CD1 3.93Å; Y157-I161 HydrophobicContact CE2-CG1 3.67Å; Y157-I161 HydrophobicContact CG-CG1 4.33Å; Y157-I161 VanDerWaalsContact CZ-CG1 3.49Å; Y157-I161 WeakPolarHBondContact O-CG1 3.04Å; Y157-I161 PolarHBondContact O-N 2.78Å; Y157-D179 VanDerWaalsContact CE2-OD2 3.26Å; Y157-D179 WeakPolarHBondContact CE2-OD2 3.39Å; Y157-D179 VanDerWaalsContact CZ-OD2 3.26Å; Y157-D179 PolarHBondContact OH-OD2 3.26Å; Y157-N183 PolarHBondContact OH-ND2 3.14Å; Y157-I186 HydrophobicContact CE1-CG2 3.66Å; Y157-I186 WeakPolarHBondContact OH-CG2 3.29Å; Y157-L189 HydrophobicContact CD1-CD1 3.32Å; Y157-L189 HydrophobicContact CE1-CD1 3.61Å; Y157-F193 HydrophobicContact CE1-CZ 4.42Å
158Y93.3Very high88.4Confident38 Ų3874.4 Ų74.415%0.14937%0.368CS..Hα-helixtrans-55.8-45.4177.6165.9-101.9000112.2L154 L155 T162 F193 V196L154-Y158 WeakPolarHBondContact O-CB 3.24Å; L154-Y158 PolarHBondContact O-N 3.28Å; L155-Y158 HydrophobicContact CD1-CD1 4.36Å; L155-Y158 PolarHBondContact O-N 2.92Å; Y158-T162 VanDerWaalsContact O-CB 3.31Å; Y158-T162 WeakPolarHBondContact O-CB 3.35Å; Y158-T162 PolarHBondContact O-N 3.26Å; Y158-T162 PolarHBondContact O-OG1 3.33Å; Y158-F193 AromaticContact CD2-CD1 3.99Å; Y158-F193 HydrophobicContact CD2-CD1 3.99Å; Y158-F193 AromaticContact CD2-CE1 3.58Å; Y158-F193 HydrophobicContact CD2-CE1 3.58Å; Y158-F193 HydrophobicContact CD2-CE2 4.46Å; Y158-F193 AromaticContact CD2-CZ 3.85Å; Y158-F193 HydrophobicContact CD2-CZ 3.85Å; Y158-F193 AromaticContact CE2-CD1 3.91Å; Y158-F193 HydrophobicContact CE2-CD1 3.91Å; Y158-F193 AromaticContact CE2-CE1 3.94Å; Y158-F193 HydrophobicContact CE2-CE1 3.94Å; Y158-V196 HydrophobicContact CE2-CG2 4.39Å; Y158-V196 WeakPolarHBondContact OH-CG2 3.32Å
159Q92.9Very high90.4Very high71 Ų7170 Ų7033%0.33235%0.35SS..Hα-helixtrans-64-43.3177.8-71.61777.300112.3L155 K156 Y157 R163L155-Q159 VanDerWaalsContact O-CG 3.3Å; L155-Q159 WeakPolarHBondContact O-CG 3.46Å; L155-Q159 PolarHBondContact O-N 3.15Å; K156-Q159 PolarHBondContact O-N 3.2Å; Y157-Q159 VanDerWaalsContact C-N 3.31Å; Y157-Q159 PolarHBondContact O-N 3.21Å; Q159-R163 WeakPolarHBondContact O-CB 2.9Å; Q159-R163 VanDerWaalsContact O-CG 3.23Å; Q159-R163 WeakPolarHBondContact O-CG 3.31Å; Q159-R163 PolarHBondContact O-N 3.23Å
160Q94.7Very high91.7Very high128 Ų12869.4 Ų69.460%0.59835%0.348SS*.Hα-helixtrans-65.3-46.6179.5-74.8176.2-9.800111.8K156 Y157 R163 A164K156-Q160 WeakPolarHBondContact O-CB 3.22Å; K156-Q160 WeakPolarHBondContact O-CG 3.33Å; K156-Q160 PolarHBondContact O-N 2.96Å; Y157-Q160 PolarHBondContact O-N 2.83Å; Y157-Q160 VanDerWaalsContact O-N 3.17Å; Q160-R163 PolarHBondContact O-N 2.87Å; Q160-A164 VanDerWaalsContact O-CB 3.27Å; Q160-A164 WeakPolarHBondContact O-CB 3.34Å; Q160-A164 PolarHBondContact O-N 3.47Å
161I95.9Very high92.5Very high15 Ų1574.4 Ų74.48%0.07737%0.37CS..Hα-helixtrans-63.5-44.6178-67.3-65.3000111.2Y157 R163 A164 I165 A176 L180 F193Y157-I161 HydrophobicContact CD1-CG1 4.17Å; Y157-I161 HydrophobicContact CD2-CG1 4.09Å; Y157-I161 HydrophobicContact CE1-CG1 3.76Å; Y157-I161 HydrophobicContact CE2-CD1 3.93Å; Y157-I161 HydrophobicContact CE2-CG1 3.67Å; Y157-I161 HydrophobicContact CG-CG1 4.33Å; Y157-I161 VanDerWaalsContact CZ-CG1 3.49Å; Y157-I161 WeakPolarHBondContact O-CG1 3.04Å; Y157-I161 PolarHBondContact O-N 2.78Å; I161-R163 PolarHBondContact O-N 3.18Å; I161-A164 PolarHBondContact O-N 3.28Å; I161-I165 HydrophobicContact CG2-CD1 3.63Å; I161-I165 HydrophobicContact CG2-CG1 4.46Å; I161-I165 WeakPolarHBondContact O-CG1 3.39Å; I161-I165 PolarHBondContact O-N 3.08Å; I161-A176 HydrophobicContact CD1-CB 3.94Å; I161-A176 HydrophobicContact CG2-CB 4.48Å; I161-L180 HydrophobicContact CG2-CD1 3.85Å; I161-L180 HydrophobicContact CG2-CD2 3.92Å; I161-L180 HydrophobicContact CG2-CG 3.81Å; I161-F193 HydrophobicContact CB-CE1 4.47Å; I161-F193 HydrophobicContact CB-CZ 4.44Å; I161-F193 HydrophobicContact CG2-CE1 3.92Å; I161-F193 HydrophobicContact CG2-CZ 4.05Å
162T93.9Very high93Very high21 Ų2175.9 Ų75.913%0.12937%0.372CS..Hα-helixtrans-63.4-42.5179.3-540000111.3Y158 I165 L166 V196Y158-T162 VanDerWaalsContact O-CB 3.31Å; Y158-T162 WeakPolarHBondContact O-CB 3.35Å; Y158-T162 PolarHBondContact O-N 3.26Å; Y158-T162 PolarHBondContact O-OG1 3.33Å; T162-I165 PolarHBondContact O-N 3.03Å; T162-L166 HydrophobicContact CG2-CD1 3.92Å; T162-L166 WeakPolarHBondContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CG 3.31Å; T162-L166 PolarHBondContact O-N 3.15Å; T162-V196 HydrophobicContact CG2-CG1 4.42Å; T162-V196 HydrophobicContact CG2-CG2 4.42Å
163R94.7Very high93.4Very high163 Ų16371 Ų7162%0.61535%0.35SS*.Hα-helixtrans-65.6-39174.9-73.8175.6-171.3139.45112.6Q159 Q160 I161 G167Q159-R163 WeakPolarHBondContact O-CB 2.9Å; Q159-R163 VanDerWaalsContact O-CG 3.23Å; Q159-R163 WeakPolarHBondContact O-CG 3.31Å; Q159-R163 PolarHBondContact O-N 3.23Å; Q160-R163 PolarHBondContact O-N 2.87Å; I161-R163 PolarHBondContact O-N 3.18Å; R163-G167 VanDerWaalsContact O-CA 3.26Å; R163-G167 WeakPolarHBondContact O-CA 3.2Å; R163-G167 PolarHBondContact O-N 2.7Å
164A96Very high93.7Very high8 Ų871.7 Ų71.77%0.06635%0.347CS..Hα-helixtrans-64.3-40.8177.500000112.1Q160 I161 L172 M173 A176Q160-A164 VanDerWaalsContact O-CB 3.27Å; Q160-A164 WeakPolarHBondContact O-CB 3.34Å; Q160-A164 PolarHBondContact O-N 3.47Å; I161-A164 PolarHBondContact O-N 3.28Å; A164-L172 HydrophobicContact CB-CD2 3.88Å; A164-L172 HydrophobicContact CB-CG 3.71Å; A164-M173 WeakPolarHBondContact O-CA 3.38Å; A164-A176 HydrophobicContact CB-CB 3.66Å
165I95.4Very high94.1Very high0 Ų073 Ų730%036%0.357CS..Hα-helixtrans-74.7-43.5-177.8-66.2167000111.6I161 T162 G167 A176 L177 L180 R212 M216I161-I165 HydrophobicContact CG2-CD1 3.63Å; I161-I165 HydrophobicContact CG2-CG1 4.46Å; I161-I165 WeakPolarHBondContact O-CG1 3.39Å; I161-I165 PolarHBondContact O-N 3.08Å; T162-I165 PolarHBondContact O-N 3.03Å; I165-G167 VanDerWaalsContact C-N 3.35Å; I165-A176 HydrophobicContact CD1-CB 4.29Å; I165-A176 HydrophobicContact CG1-CB 3.77Å; I165-L177 HydrophobicContact CD1-CD2 3.93Å; I165-L177 HydrophobicContact CG1-CD2 4.09Å; I165-L177 HydrophobicContact CG1-CG 4.3Å; I165-L177 HydrophobicContact CG2-CD2 4.27Å; I165-L180 HydrophobicContact CD1-CD1 3.4Å; I165-L180 VanDerWaalsContact CD1-CD1 3.4Å; I165-L180 HydrophobicContact CD1-CG 4.4Å; I165-R212 HydrophobicContact CG2-CB 4.35Å; I165-R212 WeakPolarHBondContact O-CD 3.19Å; I165-R212 PolarHBondContact O-NH1 3.45Å; I165-M216 HydrophobicContact CB-CE 3.93Å; I165-M216 HydrophobicContact CD1-CE 3.74Å; I165-M216 HydrophobicContact CD1-CG 4.22Å; I165-M216 HydrophobicContact CG1-CE 4.44Å; I165-M216 HydrophobicContact CG2-CB 4.48Å; I165-M216 HydrophobicContact CG2-CE 3.56Å
166L93.4Very high94.5Very high53 Ų5370.8 Ų70.828%0.27735%0.347SS..Hα-helixtrans-88.4-0.2-179-55.9179.4000113.4T162 V196 Q209 R212 L213T162-L166 HydrophobicContact CG2-CD1 3.92Å; T162-L166 WeakPolarHBondContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CG 3.31Å; T162-L166 PolarHBondContact O-N 3.15Å; L166-V196 HydrophobicContact CD1-CG1 4.35Å; L166-Q209 VanDerWaalsContact CD2-OE1 3.25Å; L166-Q209 PolarHBondContact O-NE2 2.79Å; L166-Q209 PolarHBondContact O-OE1 3.42Å; L166-R212 HydrophobicContact CD2-CB 4.45Å; L166-L213 HydrophobicContact CD2-CD2 3.9Å; L166-L213 HydrophobicContact CD2-CG 4.24Å
167G92.6Very high94.8Very high23 Ų2367.1 Ų67.124%0.23733%0.331CS..SBendtrans-85.7174.6179.900000113.3R163 I165 R212R163-G167 VanDerWaalsContact O-CA 3.26Å; R163-G167 WeakPolarHBondContact O-CA 3.2Å; R163-G167 PolarHBondContact O-N 2.7Å; I165-G167 VanDerWaalsContact C-N 3.35Å; G167-R212 PolarHBondContact O-NH1 2.97Å; G167-R212 PolarHBondContact O-NH2 3.22Å
168E91.7Very high94.9Very high187 Ų18769.2 Ų69.287%0.87435%0.345SS*.SBendtrans-75.9-27.5-174-62.6-179.6174.500113.5P170E168-P170 VanDerWaalsContact O-CD 3.24Å; E168-P170 WeakPolarHBondContact O-CD 3.5Å
169D94.5Very high95Very high80 Ų8070 Ų7043%0.42835%0.352SS..  trans-74.7112.5-175-177.8-0.8000112.7H171 L172 M173D169-H171 VanDerWaalsContact C-N 3.32Å; D169-H171 PolarHBondContact O-N 3.03Å; D169-H171 WeakPolarHBondContact OD1-CB 3.23Å; D169-H171 PolarHBondContact OD1-N 3.41Å; D169-L172 HydrophobicContact CB-CB 3.97Å; D169-L172 PolarHBondContact OD1-N 3.33Å; D169-L172 WeakPolarHBondContact OD2-CB 3.35Å; D169-M173 PolarHBondContact O-N 3.46Å; D169-M173 VanDerWaalsContact O-N 3.08Å
170P93.1Very high95.2Very high86 Ų8666.6 Ų66.656%0.55834%0.336SS*.Hα-helixtrans-70.4-26.7-179.430.2-35.7000113.1E168 K174E168-P170 VanDerWaalsContact O-CD 3.24Å; E168-P170 WeakPolarHBondContact O-CD 3.5Å; P170-K174 PolarHBondContact O-N 2.96Å; P170-K174 VanDerWaalsContact O-N 3.1Å
171H94.9Very high95.3Very high136 Ų13663.5 Ų63.563%0.6332%0.321SS*.Hα-helixtrans-71.3-47.8178.5-17468.3000110.3D169 M173 K174 V175D169-H171 VanDerWaalsContact C-N 3.32Å; D169-H171 PolarHBondContact O-N 3.03Å; D169-H171 WeakPolarHBondContact OD1-CB 3.23Å; D169-H171 PolarHBondContact OD1-N 3.41Å; H171-M173 VanDerWaalsContact C-N 3.32Å; H171-M173 PolarHBondContact O-N 3.44Å; H171-K174 PolarHBondContact O-N 3.45Å; H171-K174 VanDerWaalsContact O-N 3.14Å; H171-V175 WeakPolarHBondContact O-CG2 3.47Å; H171-V175 PolarHBondContact O-N 3Å
172L95.1Very high95.2Very high89 Ų8966.3 Ų66.347%0.46634%0.343SS..Hα-helixtrans-62-40.6176.9-167.967.4000111.7A164 D169 K174 V175 A176A164-L172 HydrophobicContact CB-CD2 3.88Å; A164-L172 HydrophobicContact CB-CG 3.71Å; D169-L172 HydrophobicContact CB-CB 3.97Å; D169-L172 PolarHBondContact OD1-N 3.33Å; D169-L172 WeakPolarHBondContact OD2-CB 3.35Å; L172-K174 PolarHBondContact O-N 2.95Å; L172-V175 PolarHBondContact O-N 2.68Å; L172-A176 WeakPolarHBondContact O-CB 3.43Å; L172-A176 PolarHBondContact O-N 3.36Å
173M96Very high95.3Very high31 Ų3167 Ų6715%0.15335%0.346CS..Hα-helixtrans-55.5-50171.8176-171.867.800111.3A164 D169 H171 V175 A176 L177 R212A164-M173 WeakPolarHBondContact O-CA 3.38Å; D169-M173 PolarHBondContact O-N 3.46Å; D169-M173 VanDerWaalsContact O-N 3.08Å; H171-M173 VanDerWaalsContact C-N 3.32Å; H171-M173 PolarHBondContact O-N 3.44Å; M173-V175 VanDerWaalsContact C-N 3.33Å; M173-V175 PolarHBondContact O-N 2.75Å; M173-A176 PolarHBondContact O-N 3.42Å; M173-L177 HydrophobicContact CG-CD1 3.79Å; M173-L177 HydrophobicContact CG-CG 4.28Å; M173-L177 VanDerWaalsContact O-CG 3.28Å; M173-L177 WeakPolarHBondContact O-CG 3.3Å; M173-L177 PolarHBondContact O-N 3Å; M173-L177 HydrophobicContact SD-CD1 4.34Å; M173-R212 HydrophobicContact SD-CG 3.69Å; M173-R212 PolarHBondContact SD-NH1 3.3Å
174K96.3Very high95.1Very high134 Ų13462.5 Ų62.558%0.58334%0.339SS*.Hα-helixtrans-61.3-42.1-178-172.5177.6-178.9179.50111.9P170 H171 L172 L177 L178P170-K174 PolarHBondContact O-N 2.96Å; P170-K174 VanDerWaalsContact O-N 3.1Å; H171-K174 PolarHBondContact O-N 3.45Å; H171-K174 VanDerWaalsContact O-N 3.14Å; L172-K174 PolarHBondContact O-N 2.95Å; K174-L177 PolarHBondContact O-N 3.02Å; K174-L178 HydrophobicContact CG-CD1 4.35Å; K174-L178 WeakPolarHBondContact O-CG 3.45Å; K174-L178 PolarHBondContact O-N 3.12Å; K174-L178 VanDerWaalsContact O-N 3.08Å
175V97Very high94.8Very high77 Ų7770.2 Ų70.247%0.46737%0.371SS..Hα-helixtrans-62.7-45.9176.2174.50000110.7H171 L172 M173 L177 L178 D179H171-V175 WeakPolarHBondContact O-CG2 3.47Å; H171-V175 PolarHBondContact O-N 3Å; L172-V175 PolarHBondContact O-N 2.68Å; M173-V175 VanDerWaalsContact C-N 3.33Å; M173-V175 PolarHBondContact O-N 2.75Å; V175-L177 PolarHBondContact O-N 3.14Å; V175-L178 PolarHBondContact O-N 3.17Å; V175-D179 PolarHBondContact O-N 3.24Å
176A97.3Very high94.5Very high5 Ų570.3 Ų70.34%0.04137%0.371CS..Hα-helixtrans-63.3-39.4179.100000112.9I161 A164 I165 L172 M173 D179 L180I161-A176 HydrophobicContact CD1-CB 3.94Å; I161-A176 HydrophobicContact CG2-CB 4.48Å; A164-A176 HydrophobicContact CB-CB 3.66Å; I165-A176 HydrophobicContact CD1-CB 4.29Å; I165-A176 HydrophobicContact CG1-CB 3.77Å; L172-A176 WeakPolarHBondContact O-CB 3.43Å; L172-A176 PolarHBondContact O-N 3.36Å; M173-A176 PolarHBondContact O-N 3.42Å; A176-D179 PolarHBondContact O-N 2.97Å; A176-L180 WeakPolarHBondContact O-CG 3.47Å; A176-L180 PolarHBondContact O-N 3.5Å
177L96.9Very high94.2Very high18 Ų1870.4 Ų70.49%0.09438%0.38CS..Hα-helixtrans-66.1-41.6176.1-69.1171.3000112.3I165 M173 K174 V175 D179 L180 Q181 H215 M216 S219I165-L177 HydrophobicContact CD1-CD2 3.93Å; I165-L177 HydrophobicContact CG1-CD2 4.09Å; I165-L177 HydrophobicContact CG1-CG 4.3Å; I165-L177 HydrophobicContact CG2-CD2 4.27Å; M173-L177 HydrophobicContact CG-CD1 3.79Å; M173-L177 HydrophobicContact CG-CG 4.28Å; M173-L177 VanDerWaalsContact O-CG 3.28Å; M173-L177 WeakPolarHBondContact O-CG 3.3Å; M173-L177 PolarHBondContact O-N 3Å; M173-L177 HydrophobicContact SD-CD1 4.34Å; K174-L177 PolarHBondContact O-N 3.02Å; V175-L177 PolarHBondContact O-N 3.14Å; L177-D179 VanDerWaalsContact C-N 3.33Å; L177-L180 PolarHBondContact O-N 3.08Å; L177-Q181 PolarHBondContact O-N 3.1Å; L177-H215 HydrophobicContact CD1-CB 3.76Å; L177-H215 HydrophobicContact CD2-CB 4.17Å; L177-M216 HydrophobicContact CD2-CB 4.37Å; L177-S219 WeakPolarHBondContact CD2-OG 3.46Å; L177-S219 WeakPolarHBondContact O-CB 3.19Å
178L97Very high93.9Very high91 Ų9172 Ų7248%0.47639%0.39SS..Hα-helixtrans-65.3-37175.9-72.8172.4000112.2K174 V175 Q181 S182K174-L178 HydrophobicContact CG-CD1 4.35Å; K174-L178 WeakPolarHBondContact O-CG 3.45Å; K174-L178 PolarHBondContact O-N 3.12Å; K174-L178 VanDerWaalsContact O-N 3.08Å; V175-L178 PolarHBondContact O-N 3.17Å; L178-Q181 PolarHBondContact O-N 3.39Å; L178-S182 PolarHBondContact O-N 3.41Å; L178-S182 PolarHBondContact O-OG 3.26Å
179D96.6Very high93.7Very high54 Ų5463 Ų6329%0.28935%0.349SS..Hα-helixtrans-64.7-47.9173.5-169.271.1000110.6Y157 V175 A176 L177 Q181 S182 N183Y157-D179 VanDerWaalsContact CE2-OD2 3.26Å; Y157-D179 WeakPolarHBondContact CE2-OD2 3.39Å; Y157-D179 VanDerWaalsContact CZ-OD2 3.26Å; Y157-D179 PolarHBondContact OH-OD2 3.26Å; V175-D179 PolarHBondContact O-N 3.24Å; A176-D179 PolarHBondContact O-N 2.97Å; L177-D179 VanDerWaalsContact C-N 3.33Å; D179-Q181 PolarHBondContact O-N 2.93Å; D179-Q181 VanDerWaalsContact O-N 3.15Å; D179-S182 PolarHBondContact O-N 2.96Å; D179-S182 VanDerWaalsContact O-N 3.08Å; D179-N183 WeakPolarHBondContact O-CB 3.13Å; D179-N183 PolarHBondContact O-N 3.31Å; D179-N183 PolarHBondContact OD2-ND2 2.93Å; D179-N183 VanDerWaalsContact OD2-ND2 3.12Å
180L96.3Very high93.5Very high0 Ų059.6 Ų59.60%033%0.33CS..Hα-helixtrans-56.7-32.7175.2-77.6-176.2000113.5I161 I165 A176 L177 I186 F193 M216 L220 N223I161-L180 HydrophobicContact CG2-CD1 3.85Å; I161-L180 HydrophobicContact CG2-CD2 3.92Å; I161-L180 HydrophobicContact CG2-CG 3.81Å; I165-L180 HydrophobicContact CD1-CD1 3.4Å; I165-L180 VanDerWaalsContact CD1-CD1 3.4Å; I165-L180 HydrophobicContact CD1-CG 4.4Å; A176-L180 WeakPolarHBondContact O-CG 3.47Å; A176-L180 PolarHBondContact O-N 3.5Å; L177-L180 PolarHBondContact O-N 3.08Å; L180-I186 HydrophobicContact CD2-CD1 3.73Å; L180-I186 WeakPolarHBondContact O-CD1 3.28Å; L180-F193 HydrophobicContact CD2-CD2 4.31Å; L180-F193 HydrophobicContact CD2-CE1 4.23Å; L180-F193 HydrophobicContact CD2-CE2 3.69Å; L180-F193 HydrophobicContact CD2-CZ 3.65Å; L180-M216 HydrophobicContact CD1-CG 3.91Å; L180-L220 HydrophobicContact CD2-CD2 4.45Å; L180-N223 PolarHBondContact O-ND2 3.21Å
181Q96.6Very high93.3Very high62 Ų6257.2 Ų57.229%0.2932%0.315SS..Hα-helixtrans-74-30.1179.2-175.4174.713.300113.4L177 L178 D179 S219 Q222 N223L177-Q181 PolarHBondContact O-N 3.1Å; L178-Q181 PolarHBondContact O-N 3.39Å; D179-Q181 PolarHBondContact O-N 2.93Å; D179-Q181 VanDerWaalsContact O-N 3.15Å; Q181-S219 WeakPolarHBondContact CA-O 3.39Å; Q181-Q222 HydrophobicContact CG-CB 4.04Å; Q181-N223 VanDerWaalsContact O-CA 3.31Å; Q181-N223 WeakPolarHBondContact O-CA 3.46Å; Q181-N223 WeakPolarHBondContact O-CB 3.34Å; Q181-N223 VanDerWaalsContact O-CG 3.32Å
182S95.2Very high93Very high75 Ų7551.3 Ų51.352%0.52429%0.287SS..Hα-helixtrans-114-17-169.7590000114.4L178 D179 S184 Y225L178-S182 PolarHBondContact O-N 3.41Å; L178-S182 PolarHBondContact O-OG 3.26Å; D179-S182 PolarHBondContact O-N 2.96Å; D179-S182 VanDerWaalsContact O-N 3.08Å; S182-S184 PolarHBondContact O-N 3.44Å; S182-Y225 WeakPolarHBondContact O-CE2 3.34Å
183N94.1Very high92.9Very high36 Ų3647.1 Ų47.119%0.19327%0.265CS..  trans-75.2122.3-174.2-168.7-28.5000111.4Y157 D179 K185 I186 N223Y157-N183 PolarHBondContact OH-ND2 3.14Å; D179-N183 WeakPolarHBondContact O-CB 3.13Å; D179-N183 PolarHBondContact O-N 3.31Å; D179-N183 PolarHBondContact OD2-ND2 2.93Å; D179-N183 VanDerWaalsContact OD2-ND2 3.12Å; N183-K185 PolarHBondContact OD1-N 2.9Å; N183-I186 HydrophobicContact CB-CG2 3.91Å; N183-N223 PolarHBondContact O-ND2 3.38Å
184S92Very high92.7Very high67 Ų6745.9 Ų45.947%0.46926%0.259SS..THydrogen-bonded Turntrans-82.6-10.5-177.969.10000114.3S182S182-S184 PolarHBondContact O-N 3.44Å
185K88.3Confident92.4Very high170 Ų17045.7 Ų45.774%0.73926%0.256SS*.THydrogen-bonded Turntrans-101.46.3-170.7-62-175.7-178.5176.90114.1N183N183-K185 PolarHBondContact OD1-N 2.9Å
186I89.5Confident92.1Very high2 Ų243.3 Ų43.31%0.0124%0.242CC..  trans-93.54.4-173.969.5178.2000114.1Y157 L180 N183 A188 L189 L190 L220 L226Y157-I186 HydrophobicContact CE1-CG2 3.66Å; Y157-I186 WeakPolarHBondContact OH-CG2 3.29Å; L180-I186 HydrophobicContact CD2-CD1 3.73Å; L180-I186 WeakPolarHBondContact O-CD1 3.28Å; N183-I186 HydrophobicContact CB-CG2 3.91Å; I186-A188 VanDerWaalsContact C-N 3.28Å; I186-A188 PolarHBondContact O-N 3.41Å; I186-L189 HydrophobicContact CB-CD1 4.44Å; I186-L189 HydrophobicContact CG2-CD1 4.45Å; I186-L189 WeakPolarHBondContact O-CA 3.35Å; I186-L189 WeakPolarHBondContact O-CB 3.38Å; I186-L189 PolarHBondContact O-N 2.97Å; I186-L190 PolarHBondContact O-N 3.01Å; I186-L220 HydrophobicContact CD1-CD2 4.48Å; I186-L226 HydrophobicContact CD1-CD1 4.09Å; I186-L226 HydrophobicContact CG1-CD1 4.23Å; I186-L226 HydrophobicContact CG1-CD2 3.83Å; I186-L226 HydrophobicContact CG1-CG 4.45Å
187A87.4Confident91.9Very high56 Ų5643.1 Ų43.146%0.46324%0.24SC..G310 helixtrans-56.1-40.3-177.900000113.1L189 L190 L226A187-L189 PolarHBondContact O-N 3.3Å; A187-L190 WeakPolarHBondContact O-CB 3.22Å; A187-L190 PolarHBondContact O-N 2.87Å; A187-L226 HydrophobicContact CB-CD2 4.09Å
188A85.8Confident91.6Very high55 Ų5544.5 Ų44.546%0.45525%0.251SS..G310 helixtrans-65.7-20.5175.900000113.4L154 I186 Y192L154-A188 HydrophobicContact CD1-CB 4.47Å; I186-A188 VanDerWaalsContact C-N 3.28Å; I186-A188 PolarHBondContact O-N 3.41Å; A188-Y192 WeakPolarHBondContact O-CE2 3.41Å
189L88.7Confident91.1Very high0 Ų041.4 Ų41.40%024%0.241CC..G310 helixtrans-91.5-15.4-179.5-60.9178.8000113.3L150 L154 Y157 I186 A187 Y192 F193L150-L189 HydrophobicContact CD1-CD2 4.08Å; L150-L189 HydrophobicContact CD2-CD2 3.25Å; L150-L189 HydrophobicContact CG-CD2 4.08Å; L154-L189 HydrophobicContact CB-CD2 4.11Å; L154-L189 HydrophobicContact CD2-CD1 4.16Å; L154-L189 HydrophobicContact CD2-CG 4.29Å; Y157-L189 HydrophobicContact CD1-CD1 3.32Å; Y157-L189 HydrophobicContact CE1-CD1 3.61Å; I186-L189 HydrophobicContact CB-CD1 4.44Å; I186-L189 HydrophobicContact CG2-CD1 4.45Å; I186-L189 WeakPolarHBondContact O-CA 3.35Å; I186-L189 WeakPolarHBondContact O-CB 3.38Å; I186-L189 PolarHBondContact O-N 2.97Å; A187-L189 PolarHBondContact O-N 3.3Å; L189-Y192 HydrophobicContact CD2-CD2 4.47Å; L189-Y192 WeakPolarHBondContact O-CD2 3.34Å; L189-Y192 PolarHBondContact O-N 3.46Å; L189-F193 HydrophobicContact CB-CD2 3.94Å; L189-F193 HydrophobicContact CB-CE2 3.54Å; L189-F193 HydrophobicContact CB-CZ 4.42Å; L189-F193 HydrophobicContact CD1-CE2 4.17Å; L189-F193 HydrophobicContact CD1-CZ 4.47Å; L189-F193 WeakPolarHBondContact O-CD2 3.23Å; L189-F193 PolarHBondContact O-N 3.03Å; L189-F193 VanDerWaalsContact O-N 3.17Å
190L89.9Confident90.8Very high7 Ų739 Ų394%0.03723%0.228CC..Hα-helixtrans-50.5-45.7-176.8177.562.1000113.4I186 A187 Y192 F193 V194 L220 L226 L228 Y231I186-L190 PolarHBondContact O-N 3.01Å; A187-L190 WeakPolarHBondContact O-CB 3.22Å; A187-L190 PolarHBondContact O-N 2.87Å; L190-Y192 PolarHBondContact O-N 2.94Å; L190-F193 PolarHBondContact O-N 3.3Å; L190-V194 HydrophobicContact CD1-CG2 3.84Å; L190-V194 HydrophobicContact CG-CG2 4.29Å; L190-V194 VanDerWaalsContact O-CG2 3.32Å; L190-V194 WeakPolarHBondContact O-CG2 3.44Å; L190-V194 PolarHBondContact O-N 3.03Å; L190-L220 HydrophobicContact CD1-CD1 4.45Å; L190-L220 HydrophobicContact CD1-CD2 4.47Å; L190-L226 HydrophobicContact CD1-CD1 4.38Å; L190-L228 HydrophobicContact CD1-CD2 3.74Å; L190-L228 HydrophobicContact CD2-CD2 3.92Å; L190-L228 HydrophobicContact CG-CD2 4.44Å; L190-Y231 HydrophobicContact CD2-CD2 3.73Å; L190-Y231 HydrophobicContact CD2-CE2 3.91Å; L190-Y231 HydrophobicContact CG-CD2 4.13Å; L190-Y231 HydrophobicContact CG-CE2 4.26Å
191P88.6Confident90.5Very high36 Ų3645.9 Ų45.923%0.23426%0.258CS..Hα-helixtrans-59.5-34.3-180-2031000113.1Y195 Y231P191-Y195 WeakPolarHBondContact O-CB 3.43Å; P191-Y195 PolarHBondContact O-N 3.32Å; P191-Y231 HydrophobicContact CB-CE1 4.35Å; P191-Y231 WeakPolarHBondContact CG-OH 3.43Å
192Y88.6Confident90.1Very high13 Ų1347.1 Ų47.15%0.05127%0.274CS..Hα-helixtrans-75.8-40.7-179.7-50.5-84.3000111.6V143 A146 V147 L150 A188 L189 L190 V194 Y195 V196V143-Y192 HydrophobicContact CG1-CD1 3.71Å; V143-Y192 HydrophobicContact CG1-CE1 4.07Å; A146-Y192 HydrophobicContact CB-CE1 4.29Å; A146-Y192 PolarHBondContact O-OH 3.5Å; V147-Y192 HydrophobicContact CB-CE1 4.04Å; V147-Y192 HydrophobicContact CG2-CD1 3.76Å; V147-Y192 HydrophobicContact CG2-CE1 3.37Å; V147-Y192 PolarHBondContact N-OH 3.45Å; L150-Y192 HydrophobicContact CD1-CE2 3.8Å; L150-Y192 HydrophobicContact CD2-CE2 4.24Å; A188-Y192 WeakPolarHBondContact O-CE2 3.41Å; L189-Y192 HydrophobicContact CD2-CD2 4.47Å; L189-Y192 WeakPolarHBondContact O-CD2 3.34Å; L189-Y192 PolarHBondContact O-N 3.46Å; L190-Y192 PolarHBondContact O-N 2.94Å; Y192-V194 VanDerWaalsContact C-N 3.34Å; Y192-V194 PolarHBondContact O-N 2.53Å; Y192-Y195 WeakPolarHBondContact O-CB 3.36Å; Y192-Y195 PolarHBondContact O-N 3.01Å; Y192-V196 WeakPolarHBondContact O-CG2 3.49Å; Y192-V196 PolarHBondContact O-N 3.36Å
193F92.8Very high89.9Confident0 Ų045.2 Ų45.20%026%0.259CS..Hα-helixtrans-63.1-41.9173.2-68-57.8000111.5Y157 Y158 I161 L180 L189 L190 Y195 V196 I197 M216 L220Y157-F193 HydrophobicContact CE1-CZ 4.42Å; Y158-F193 AromaticContact CD2-CD1 3.99Å; Y158-F193 HydrophobicContact CD2-CD1 3.99Å; Y158-F193 AromaticContact CD2-CE1 3.58Å; Y158-F193 HydrophobicContact CD2-CE1 3.58Å; Y158-F193 HydrophobicContact CD2-CE2 4.46Å; Y158-F193 AromaticContact CD2-CZ 3.85Å; Y158-F193 HydrophobicContact CD2-CZ 3.85Å; Y158-F193 AromaticContact CE2-CD1 3.91Å; Y158-F193 HydrophobicContact CE2-CD1 3.91Å; Y158-F193 AromaticContact CE2-CE1 3.94Å; Y158-F193 HydrophobicContact CE2-CE1 3.94Å; I161-F193 HydrophobicContact CB-CE1 4.47Å; I161-F193 HydrophobicContact CB-CZ 4.44Å; I161-F193 HydrophobicContact CG2-CE1 3.92Å; I161-F193 HydrophobicContact CG2-CZ 4.05Å; L180-F193 HydrophobicContact CD2-CD2 4.31Å; L180-F193 HydrophobicContact CD2-CE1 4.23Å; L180-F193 HydrophobicContact CD2-CE2 3.69Å; L180-F193 HydrophobicContact CD2-CZ 3.65Å; L189-F193 HydrophobicContact CB-CD2 3.94Å; L189-F193 HydrophobicContact CB-CE2 3.54Å; L189-F193 HydrophobicContact CB-CZ 4.42Å; L189-F193 HydrophobicContact CD1-CE2 4.17Å; L189-F193 HydrophobicContact CD1-CZ 4.47Å; L189-F193 WeakPolarHBondContact O-CD2 3.23Å; L189-F193 PolarHBondContact O-N 3.03Å; L189-F193 VanDerWaalsContact O-N 3.17Å; L190-F193 PolarHBondContact O-N 3.3Å; F193-Y195 VanDerWaalsContact C-N 3.28Å; F193-Y195 PolarHBondContact O-N 3.47Å; F193-V196 PolarHBondContact O-N 2.81Å; F193-I197 WeakPolarHBondContact O-CD1 3.46Å; F193-I197 VanDerWaalsContact O-CG1 3.28Å; F193-I197 WeakPolarHBondContact O-CG1 3.32Å; F193-I197 PolarHBondContact O-N 3.07Å; F193-M216 HydrophobicContact CD1-SD 4.16Å; F193-L220 HydrophobicContact CB-CD1 3.9Å; F193-L220 HydrophobicContact CD2-CD2 4.42Å
194V91.6Very high89.7Confident5 Ų544.5 Ų44.53%0.0326%0.257CS..Hα-helixtrans-63.5-35.6174.7178.10000111.3L190 Y192 I197 S198 Y231 L235L190-V194 HydrophobicContact CD1-CG2 3.84Å; L190-V194 HydrophobicContact CG-CG2 4.29Å; L190-V194 VanDerWaalsContact O-CG2 3.32Å; L190-V194 WeakPolarHBondContact O-CG2 3.44Å; L190-V194 PolarHBondContact O-N 3.03Å; Y192-V194 VanDerWaalsContact C-N 3.34Å; Y192-V194 PolarHBondContact O-N 2.53Å; V194-I197 PolarHBondContact O-N 3.38Å; V194-S198 WeakPolarHBondContact O-CB 3.46Å; V194-S198 PolarHBondContact O-N 3.35Å; V194-S198 PolarHBondContact O-OG 3.24Å; V194-Y231 HydrophobicContact CB-CD1 4.27Å; V194-Y231 HydrophobicContact CG1-CD1 4.07Å; V194-Y231 HydrophobicContact CG2-CD1 4.17Å; V194-Y231 HydrophobicContact CG2-CG 4.13Å; V194-L235 HydrophobicContact CG1-CD2 4.33Å; V194-L235 HydrophobicContact CG2-CD2 4.15Å
195Y89.8Confident89.6Confident131 Ų13147.2 Ų47.251%0.51426%0.262SS..Hα-helixtrans-63.2-46.3173.4177.9-101.6000112.5V143 P191 Y192 F193 I197 S198 G199V143-Y195 HydrophobicContact CB-CD2 3.97Å; V143-Y195 HydrophobicContact CB-CE2 4.22Å; V143-Y195 HydrophobicContact CB-CG 4.11Å; V143-Y195 HydrophobicContact CG1-CD1 4.25Å; V143-Y195 HydrophobicContact CG1-CD2 4.44Å; V143-Y195 HydrophobicContact CG1-CG 4.07Å; V143-Y195 HydrophobicContact CG2-CD2 3.4Å; V143-Y195 VanDerWaalsContact CG2-CD2 3.4Å; V143-Y195 HydrophobicContact CG2-CE2 4Å; V143-Y195 HydrophobicContact CG2-CG 3.75Å; P191-Y195 WeakPolarHBondContact O-CB 3.43Å; P191-Y195 PolarHBondContact O-N 3.32Å; Y192-Y195 WeakPolarHBondContact O-CB 3.36Å; Y192-Y195 PolarHBondContact O-N 3.01Å; F193-Y195 VanDerWaalsContact C-N 3.28Å; F193-Y195 PolarHBondContact O-N 3.47Å; Y195-I197 VanDerWaalsContact C-N 3.31Å; Y195-I197 PolarHBondContact O-N 3.11Å; Y195-S198 WeakPolarHBondContact O-CB 3.44Å; Y195-S198 PolarHBondContact O-N 3.39Å; Y195-G199 PolarHBondContact O-N 2.62Å; Y195-G199 VanDerWaalsContact O-N 3.17Å
196V91.6Very high89.8Confident27 Ų2741.8 Ų41.816%0.16424%0.241CC..Hα-helixtrans-57.8-45.6174.7173.20000110.8Y158 T162 L166 Y192 F193 S198 G199 L213 M216Y158-V196 HydrophobicContact CE2-CG2 4.39Å; Y158-V196 WeakPolarHBondContact OH-CG2 3.32Å; T162-V196 HydrophobicContact CG2-CG1 4.42Å; T162-V196 HydrophobicContact CG2-CG2 4.42Å; L166-V196 HydrophobicContact CD1-CG1 4.35Å; Y192-V196 WeakPolarHBondContact O-CG2 3.49Å; Y192-V196 PolarHBondContact O-N 3.36Å; F193-V196 PolarHBondContact O-N 2.81Å; V196-S198 VanDerWaalsContact C-N 3.29Å; V196-S198 PolarHBondContact O-N 3.44Å; V196-G199 WeakPolarHBondContact O-CA 3.3Å; V196-G199 PolarHBondContact O-N 2.82Å; V196-L213 HydrophobicContact CG1-CD2 3.9Å; V196-M216 HydrophobicContact CG1-CE 4.49Å
197I93.9Very high89.9Confident1 Ų143.4 Ų43.41%0.00525%0.249CC..Hα-helixtrans-64.5-32.1175.9-68.2161.2000112F193 V194 Y195 G199 V200 M216 V217 L220 L235 S238F193-I197 WeakPolarHBondContact O-CD1 3.46Å; F193-I197 VanDerWaalsContact O-CG1 3.28Å; F193-I197 WeakPolarHBondContact O-CG1 3.32Å; F193-I197 PolarHBondContact O-N 3.07Å; V194-I197 PolarHBondContact O-N 3.38Å; Y195-I197 VanDerWaalsContact C-N 3.31Å; Y195-I197 PolarHBondContact O-N 3.11Å; I197-G199 PolarHBondContact O-N 2.9Å; I197-V200 VanDerWaalsContact O-CG1 3.23Å; I197-V200 WeakPolarHBondContact O-CG1 3.35Å; I197-V200 PolarHBondContact O-N 2.93Å; I197-M216 HydrophobicContact CD1-CG 4.18Å; I197-M216 HydrophobicContact CD1-SD 4.07Å; I197-M216 HydrophobicContact CG1-SD 3.98Å; I197-V217 HydrophobicContact CB-CG2 4.39Å; I197-V217 HydrophobicContact CD1-CG2 3.78Å; I197-V217 HydrophobicContact CG1-CG2 4.02Å; I197-V217 HydrophobicContact CG2-CG2 3.46Å; I197-V217 VanDerWaalsContact CG2-CG2 3.46Å; I197-L220 HydrophobicContact CD1-CD1 3.53Å; I197-L235 HydrophobicContact CB-CD2 4.49Å; I197-L235 HydrophobicContact CD1-CD2 4.01Å; I197-L235 HydrophobicContact CG2-CD2 3.9Å; I197-S238 PolarHBondContact O-OG 3.49Å
198S89.4Confident90.2Very high46 Ų4646 Ų4632%0.32225%0.252SS..Hα-helixtrans-70.9-17.5175.9-57.70000112V194 Y195 V196 V200 S234 S238V194-S198 WeakPolarHBondContact O-CB 3.46Å; V194-S198 PolarHBondContact O-N 3.35Å; V194-S198 PolarHBondContact O-OG 3.24Å; Y195-S198 WeakPolarHBondContact O-CB 3.44Å; Y195-S198 PolarHBondContact O-N 3.39Å; V196-S198 VanDerWaalsContact C-N 3.29Å; V196-S198 PolarHBondContact O-N 3.44Å; S198-V200 PolarHBondContact O-N 2.85Å; S198-S234 PolarHBondContact OG-OG 2.86Å; S198-S238 WeakPolarHBondContact CA-OG 3.5Å
199G86.9Confident90.5Very high26 Ų2645.2 Ų45.227%0.26824%0.239SC..G310 helixtrans-72.65.4172.200000115.6Y195 V196 I197 K201 S202Y195-G199 PolarHBondContact O-N 2.62Å; Y195-G199 VanDerWaalsContact O-N 3.17Å; V196-G199 WeakPolarHBondContact O-CA 3.3Å; V196-G199 PolarHBondContact O-N 2.82Å; I197-G199 PolarHBondContact O-N 2.9Å; G199-K201 PolarHBondContact O-N 3.39Å; G199-S202 PolarHBondContact O-N 2.98Å; G199-S202 PolarHBondContact O-OG 3.21Å
200V90.6Very high90.8Very high4 Ų445.2 Ų45.22%0.02424%0.239CC..G310 helixtrans-50-30.4179.3-78.20000114.3I197 S198 S202 V203 S204 L210 L213 Y241I197-V200 VanDerWaalsContact O-CG1 3.23Å; I197-V200 WeakPolarHBondContact O-CG1 3.35Å; I197-V200 PolarHBondContact O-N 2.93Å; S198-V200 PolarHBondContact O-N 2.85Å; V200-S202 PolarHBondContact O-N 3.48Å; V200-V203 PolarHBondContact O-N 2.92Å; V200-S204 PolarHBondContact O-N 3.29Å; V200-L210 HydrophobicContact CB-CD2 4.15Å; V200-L210 HydrophobicContact CG1-CD2 4.22Å; V200-L213 HydrophobicContact CG1-CB 4.44Å; V200-L213 HydrophobicContact CG1-CD1 3.76Å; V200-Y241 HydrophobicContact CB-CD1 4.15Å; V200-Y241 HydrophobicContact CG2-CD1 3.85Å; V200-Y241 HydrophobicContact CG2-CG 4.24Å
201K89.2Confident91Very high144 Ų14447.5 Ų47.563%0.62625%0.251SS*.G310 helixtrans-62.8-38.7178.8-62.4-171.2176.4-179.10113.1G199 V203 S204 Y241G199-K201 PolarHBondContact O-N 3.39Å; K201-V203 VanDerWaalsContact C-N 3.25Å; K201-V203 PolarHBondContact O-N 3.44Å; K201-S204 WeakPolarHBondContact O-CB 3.36Å; K201-S204 PolarHBondContact O-OG 3.39Å; K201-S204 VanDerWaalsContact O-OG 3.1Å; K201-Y241 HydrophobicContact CD-CE2 4.28Å; K201-Y241 HydrophobicContact CG-CD2 4.01Å; K201-Y241 HydrophobicContact CG-CE1 4.23Å; K201-Y241 HydrophobicContact CG-CE2 3.7Å; K201-Y241 HydrophobicContact CG-CG 4.46Å
202S89.6Confident91.4Very high89 Ų8946.2 Ų46.262%0.62224%0.241SC*.G310 helixtrans-73.3-20.9-178.458.60000112.7G199 V200 H205G199-S202 PolarHBondContact O-N 2.98Å; G199-S202 PolarHBondContact O-OG 3.21Å; V200-S202 PolarHBondContact O-N 3.48Å; S202-H205 PolarHBondContact O-CE1 3.43Å; S202-H205 PolarHBondContact O-ND1 3.44Å
203V89.8Confident91.7Very high34 Ų3445.8 Ų45.821%0.20624%0.24CC..G310 helixtrans-105.616.5-176.7-159.10000111.7V200 K201 H205 D206 Q209V200-V203 PolarHBondContact O-N 2.92Å; K201-V203 VanDerWaalsContact C-N 3.25Å; K201-V203 PolarHBondContact O-N 3.44Å; V203-H205 PolarHBondContact O-N 3.45Å; V203-D206 HydrophobicContact CG1-CB 4.03Å; V203-D206 PolarHBondContact O-N 3.11Å; V203-Q209 HydrophobicContact CG1-CB 3.35Å; V203-Q209 HydrophobicContact CG1-CG 4.1Å
204S89.9Confident91.9Very high22 Ų2245.9 Ų45.915%0.15424%0.241CC..THydrogen-bonded Turntrans-61.3-13.4-177.357.40000115.4V200 K201 A248 A249V200-S204 PolarHBondContact O-N 3.29Å; K201-S204 WeakPolarHBondContact O-CB 3.36Å; K201-S204 PolarHBondContact O-OG 3.39Å; K201-S204 VanDerWaalsContact O-OG 3.1Å; S204-A248 PolarHBondContact O-N 3.36Å; S204-A248 VanDerWaalsContact O-N 3.11Å; S204-A249 PolarHBondContact O-N 3.1Å; S204-A249 VanDerWaalsContact O-N 3.08Å
205H90.6Very high92.2Very high124 Ų12448 Ų4857%0.57425%0.25SS*.THydrogen-bonded Turntrans-89.2-18.4178.260.4-83.2000113.5S202 V203 A248S202-H205 PolarHBondContact O-CE1 3.43Å; S202-H205 PolarHBondContact O-ND1 3.44Å; V203-H205 PolarHBondContact O-N 3.45Å; H205-A248 HydrophobicContact CB-CB 4.03Å
206D92.4Very high92.5Very high55 Ų5541.8 Ų41.829%0.29423%0.226SC..  trans-113.9106.5-176.3-174.4-23.3000110.3V203 E208 Q209 L210V203-D206 HydrophobicContact CG1-CB 4.03Å; V203-D206 PolarHBondContact O-N 3.11Å; D206-E208 VanDerWaalsContact C-N 3.31Å; D206-E208 PolarHBondContact O-N 2.89Å; D206-E208 WeakPolarHBondContact OD1-CB 3.44Å; D206-E208 PolarHBondContact OD1-N 3.14Å; D206-Q209 HydrophobicContact CB-CB 4.15Å; D206-Q209 HydrophobicContact CB-CG 4.14Å; D206-Q209 VanDerWaalsContact CG-CG 3.42Å; D206-Q209 PolarHBondContact OD1-N 2.82Å; D206-Q209 VanDerWaalsContact OD1-N 3.15Å; D206-Q209 WeakPolarHBondContact OD2-CG 3.27Å; D206-L210 WeakPolarHBondContact O-CG 3.41Å; D206-L210 PolarHBondContact O-N 3.49Å; D206-L210 VanDerWaalsContact O-N 3.17Å
207L92.3Very high92.8Very high36 Ų3640.6 Ų40.619%0.18822%0.218CC..Hα-helixtrans-66.8-34-177.2-171.966.2000112.4N211 A249 N255 D256 H257 L260L207-N211 PolarHBondContact O-N 2.96Å; L207-A249 HydrophobicContact CB-CB 4.3Å; L207-N255 HydrophobicContact CD2-CB 4.48Å; L207-D256 WeakPolarHBondContact CD2-O 3.42Å; L207-H257 HydrophobicContact CD1-CB 4.2Å; L207-L260 HydrophobicContact CD1-CB 3.83Å; L207-L260 HydrophobicContact CD1-CD1 4.01Å; L207-L260 HydrophobicContact CD1-CD2 3.82Å; L207-L260 HydrophobicContact CD1-CG 4.08Å
208E92.1Very high92.9Very high111 Ų11144.3 Ų44.352%0.51923%0.234SC..Hα-helixtrans-69.7-44.8-177.2-166.2-176155.300110.2D206 L210 N211 R212D206-E208 VanDerWaalsContact C-N 3.31Å; D206-E208 PolarHBondContact O-N 2.89Å; D206-E208 WeakPolarHBondContact OD1-CB 3.44Å; D206-E208 PolarHBondContact OD1-N 3.14Å; E208-L210 PolarHBondContact O-N 3.39Å; E208-N211 WeakPolarHBondContact O-CB 3.46Å; E208-N211 PolarHBondContact O-N 3.33Å; E208-R212 VanDerWaalsContact O-CG 3.25Å; E208-R212 WeakPolarHBondContact O-CG 3.25Å; E208-R212 PolarHBondContact O-N 3.31Å; E208-R212 IonicContact OE1-CZ 3.57Å; E208-R212 VanDerWaalsContact OE1-CZ 3.31Å; E208-R212 IonicContact OE1-NE 3.48Å; E208-R212 PolarHBondContact OE1-NE 2.86Å; E208-R212 VanDerWaalsContact OE1-NE 3.09Å; E208-R212 IonicContact OE1-NH2 3.36Å; E208-R212 PolarHBondContact OE1-NH2 2.9Å
209Q93.2Very high93.3Very high39 Ų3942.5 Ų42.518%0.18222%0.222CC..Hα-helixtrans-65.5-38.6176.9-65.7-68.2-19.900112.4L166 V203 D206 N211 R212 L213L166-Q209 VanDerWaalsContact CD2-OE1 3.25Å; L166-Q209 PolarHBondContact O-NE2 2.79Å; L166-Q209 PolarHBondContact O-OE1 3.42Å; V203-Q209 HydrophobicContact CG1-CB 3.35Å; V203-Q209 HydrophobicContact CG1-CG 4.1Å; D206-Q209 HydrophobicContact CB-CB 4.15Å; D206-Q209 HydrophobicContact CB-CG 4.14Å; D206-Q209 VanDerWaalsContact CG-CG 3.42Å; D206-Q209 PolarHBondContact OD1-N 2.82Å; D206-Q209 VanDerWaalsContact OD1-N 3.15Å; D206-Q209 WeakPolarHBondContact OD2-CG 3.27Å; Q209-N211 VanDerWaalsContact C-N 3.31Å; Q209-N211 PolarHBondContact O-N 3.44Å; Q209-R212 WeakPolarHBondContact O-CB 3.22Å; Q209-R212 PolarHBondContact O-N 3.2Å; Q209-L213 WeakPolarHBondContact O-CG 3.48Å; Q209-L213 PolarHBondContact O-N 3.12Å
210L94.5Very high93.7Very high0 Ų041.3 Ų41.30%021%0.209CC..Hα-helixtrans-58.9-44.1171.3-73.2173.5000111.5V200 D206 E208 R212 L213 L214 L247 L260V200-L210 HydrophobicContact CB-CD2 4.15Å; V200-L210 HydrophobicContact CG1-CD2 4.22Å; D206-L210 WeakPolarHBondContact O-CG 3.41Å; D206-L210 PolarHBondContact O-N 3.49Å; D206-L210 VanDerWaalsContact O-N 3.17Å; E208-L210 PolarHBondContact O-N 3.39Å; L210-R212 PolarHBondContact O-N 3.41Å; L210-L213 PolarHBondContact O-N 3.22Å; L210-L214 WeakPolarHBondContact O-CG 3.31Å; L210-L214 PolarHBondContact O-N 3.11Å; L210-L247 HydrophobicContact CD1-CD1 3.84Å; L210-L247 HydrophobicContact CD1-CD2 4.01Å; L210-L247 HydrophobicContact CD1-CG 4.44Å; L210-L260 HydrophobicContact CB-CD1 4.01Å; L210-L260 HydrophobicContact CB-CD2 4.33Å; L210-L260 HydrophobicContact CD1-CD2 4.28Å
211N94.8Very high94Very high54 Ų5441.5 Ų41.529%0.28921%0.211SC..Hα-helixtrans-63.7-41.1177.8-168.745.4000111.9L207 E208 Q209 L213 L214 H215 L260L207-N211 PolarHBondContact O-N 2.96Å; E208-N211 WeakPolarHBondContact O-CB 3.46Å; E208-N211 PolarHBondContact O-N 3.33Å; Q209-N211 VanDerWaalsContact C-N 3.31Å; Q209-N211 PolarHBondContact O-N 3.44Å; N211-L213 VanDerWaalsContact C-N 3.34Å; N211-L213 PolarHBondContact O-N 3.39Å; N211-L214 PolarHBondContact O-N 3.12Å; N211-H215 PolarHBondContact ND2-NE2 3.27Å; N211-H215 PolarHBondContact O-CD2 2.93Å; N211-H215 PolarHBondContact O-N 2.97Å; N211-L260 HydrophobicContact CB-CD1 3.78Å
212R95.4Very high94.3Very high10 Ų1037.9 Ų37.94%0.03820%0.196CC..Hα-helixtrans-59.8-41.9174.2-69.1166.7175.9-92.98.3112I165 L166 G167 M173 E208 Q209 L210 H215 M216I165-R212 HydrophobicContact CG2-CB 4.35Å; I165-R212 WeakPolarHBondContact O-CD 3.19Å; I165-R212 PolarHBondContact O-NH1 3.45Å; L166-R212 HydrophobicContact CD2-CB 4.45Å; G167-R212 PolarHBondContact O-NH1 2.97Å; G167-R212 PolarHBondContact O-NH2 3.22Å; M173-R212 HydrophobicContact SD-CG 3.69Å; M173-R212 PolarHBondContact SD-NH1 3.3Å; E208-R212 VanDerWaalsContact O-CG 3.25Å; E208-R212 WeakPolarHBondContact O-CG 3.25Å; E208-R212 PolarHBondContact O-N 3.31Å; E208-R212 IonicContact OE1-CZ 3.57Å; E208-R212 VanDerWaalsContact OE1-CZ 3.31Å; E208-R212 IonicContact OE1-NE 3.48Å; E208-R212 PolarHBondContact OE1-NE 2.86Å; E208-R212 VanDerWaalsContact OE1-NE 3.09Å; E208-R212 IonicContact OE1-NH2 3.36Å; E208-R212 PolarHBondContact OE1-NH2 2.9Å; Q209-R212 WeakPolarHBondContact O-CB 3.22Å; Q209-R212 PolarHBondContact O-N 3.2Å; L210-R212 PolarHBondContact O-N 3.41Å; R212-H215 PolarHBondContact O-N 2.97Å; R212-M216 PolarHBondContact O-N 2.97Å
213L96.3Very high94.6Very high4 Ų433.9 Ų33.92%0.02117%0.167CC..Hα-helixtrans-64-41.1174.2-69.5174.2000112.3L166 V196 V200 Q209 L210 N211 H215 M216 V217L166-L213 HydrophobicContact CD2-CD2 3.9Å; L166-L213 HydrophobicContact CD2-CG 4.24Å; V196-L213 HydrophobicContact CG1-CD2 3.9Å; V200-L213 HydrophobicContact CG1-CB 4.44Å; V200-L213 HydrophobicContact CG1-CD1 3.76Å; Q209-L213 WeakPolarHBondContact O-CG 3.48Å; Q209-L213 PolarHBondContact O-N 3.12Å; L210-L213 PolarHBondContact O-N 3.22Å; N211-L213 VanDerWaalsContact C-N 3.34Å; N211-L213 PolarHBondContact O-N 3.39Å; L213-H215 VanDerWaalsContact C-N 3.33Å; L213-H215 PolarHBondContact O-N 3.47Å; L213-M216 HydrophobicContact CD2-CE 4.41Å; L213-M216 WeakPolarHBondContact O-CB 3.48Å; L213-M216 PolarHBondContact O-N 3.3Å; L213-M216 VanDerWaalsContact O-N 3.16Å; L213-V217 WeakPolarHBondContact O-CG2 3.37Å; L213-V217 PolarHBondContact O-N 3.47Å
214L96.7Very high94.7Very high2 Ų237.1 Ų37.11%0.0119%0.189CC..Hα-helixtrans-65.8-34.3175.4-64.9175.9000112.2L210 N211 V217 K218 V239 C242 L260 Y263 A264 L267L210-L214 WeakPolarHBondContact O-CG 3.31Å; L210-L214 PolarHBondContact O-N 3.11Å; N211-L214 PolarHBondContact O-N 3.12Å; L214-V217 PolarHBondContact O-N 3.08Å; L214-K218 PolarHBondContact O-N 2.61Å; L214-V239 HydrophobicContact CD2-CG2 4.06Å; L214-C242 HydrophobicContact CD1-CB 4.42Å; L214-C242 HydrophobicContact CD2-CB 4.4Å; L214-L260 HydrophobicContact CD1-CD1 3.82Å; L214-L260 HydrophobicContact CD1-CG 3.99Å; L214-Y263 HydrophobicContact CB-CD1 3.93Å; L214-Y263 HydrophobicContact CB-CE1 3.59Å; L214-Y263 HydrophobicContact CD1-CD1 3.99Å; L214-Y263 HydrophobicContact CD1-CE1 4.5Å; L214-A264 HydrophobicContact CD1-CB 3.85Å; L214-A264 HydrophobicContact CD2-CB 4.41Å; L214-L267 HydrophobicContact CB-CD2 4.15Å; L214-L267 HydrophobicContact CD2-CD2 4.19Å; L214-L267 VanDerWaalsContact O-CD2 3.32Å; L214-L267 WeakPolarHBondContact O-CD2 3.36Å
215H96.8Very high94.8Very high50 Ų5042.9 Ų42.923%0.23121%0.209CC..Hα-helixtrans-66.7-36170.8-72.7-53.1000112.7L177 N211 R212 L213 K218 S219 Y263L177-H215 HydrophobicContact CD1-CB 3.76Å; L177-H215 HydrophobicContact CD2-CB 4.17Å; N211-H215 PolarHBondContact ND2-NE2 3.27Å; N211-H215 PolarHBondContact O-CD2 2.93Å; N211-H215 PolarHBondContact O-N 2.97Å; R212-H215 PolarHBondContact O-N 2.97Å; L213-H215 VanDerWaalsContact C-N 3.33Å; L213-H215 PolarHBondContact O-N 3.47Å; H215-K218 PolarHBondContact O-N 3.05Å; H215-S219 PolarHBondContact O-N 3.31Å; H215-S219 PolarHBondContact O-OG 3.16Å; H215-Y263 AromaticContact CE1-CE1 3.98Å; H215-Y263 AromaticContact CE1-CZ 3.67Å; H215-Y263 AromaticContact ND1-CE1 3.93Å; H215-Y263 AromaticContact ND1-CZ 3.56Å; H215-Y263 PolarHBondContact ND1-OH 3.05Å
216M96.8Very high94.8Very high0 Ų037.6 Ų37.60%019%0.185CC..Hα-helixtrans-62.1-46.4172-167.1-173.3-63.300111.1I165 L177 L180 F193 V196 I197 R212 L213 K218 S219 L220I165-M216 HydrophobicContact CB-CE 3.93Å; I165-M216 HydrophobicContact CD1-CE 3.74Å; I165-M216 HydrophobicContact CD1-CG 4.22Å; I165-M216 HydrophobicContact CG1-CE 4.44Å; I165-M216 HydrophobicContact CG2-CB 4.48Å; I165-M216 HydrophobicContact CG2-CE 3.56Å; L177-M216 HydrophobicContact CD2-CB 4.37Å; L180-M216 HydrophobicContact CD1-CG 3.91Å; F193-M216 HydrophobicContact CD1-SD 4.16Å; V196-M216 HydrophobicContact CG1-CE 4.49Å; I197-M216 HydrophobicContact CD1-CG 4.18Å; I197-M216 HydrophobicContact CD1-SD 4.07Å; I197-M216 HydrophobicContact CG1-SD 3.98Å; R212-M216 PolarHBondContact O-N 2.97Å; L213-M216 HydrophobicContact CD2-CE 4.41Å; L213-M216 WeakPolarHBondContact O-CB 3.48Å; L213-M216 PolarHBondContact O-N 3.3Å; L213-M216 VanDerWaalsContact O-N 3.16Å; M216-K218 PolarHBondContact O-N 3.37Å; M216-S219 PolarHBondContact O-N 3.48Å; M216-L220 HydrophobicContact CG-CD1 4.49Å; M216-L220 WeakPolarHBondContact O-CG 3.33Å; M216-L220 PolarHBondContact O-N 3.17Å
217V97.7Very high94.6Very high1 Ų141.2 Ų41.21%0.00620%0.195CC..Hα-helixtrans-55.7-49.6174.4174.40000110.8I197 L213 L214 S219 L220 V221 L235 V239 L267 I271I197-V217 HydrophobicContact CB-CG2 4.39Å; I197-V217 HydrophobicContact CD1-CG2 3.78Å; I197-V217 HydrophobicContact CG1-CG2 4.02Å; I197-V217 HydrophobicContact CG2-CG2 3.46Å; I197-V217 VanDerWaalsContact CG2-CG2 3.46Å; L213-V217 WeakPolarHBondContact O-CG2 3.37Å; L213-V217 PolarHBondContact O-N 3.47Å; L214-V217 PolarHBondContact O-N 3.08Å; V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 3.31Å; V217-L220 PolarHBondContact O-N 3.01Å; V217-V221 HydrophobicContact CG1-CG2 4.13Å; V217-V221 WeakPolarHBondContact O-CB 3.24Å; V217-V221 WeakPolarHBondContact O-CG2 3.15Å; V217-V221 PolarHBondContact O-N 3.43Å; V217-L235 HydrophobicContact CG2-CD2 4.28Å; V217-V239 HydrophobicContact CG1-CG2 4.09Å; V217-L267 HydrophobicContact CB-CD2 3.97Å; V217-L267 HydrophobicContact CG1-CD1 4.46Å; V217-L267 HydrophobicContact CG1-CD2 3.83Å; V217-L267 HydrophobicContact CG1-CG 4.3Å; V217-I271 HydrophobicContact CG1-CD1 3.82Å
218K97.3Very high94.3Very high79 Ų7939.5 Ų39.534%0.34319%0.186SC..Hα-helixtrans-56-45.2177.8179.9178.6172.6-176.50111.9L214 H215 M216 V221 Q222 Y263 L267L214-K218 PolarHBondContact O-N 2.61Å; H215-K218 PolarHBondContact O-N 3.05Å; M216-K218 PolarHBondContact O-N 3.37Å; K218-V221 PolarHBondContact O-N 3.22Å; K218-Q222 HydrophobicContact CG-CG 4.47Å; K218-Q222 WeakPolarHBondContact O-CB 3.3Å; K218-Q222 VanDerWaalsContact O-CG 3.27Å; K218-Q222 WeakPolarHBondContact O-CG 3.41Å; K218-Q222 PolarHBondContact O-N 3.26Å; K218-Y263 WeakPolarHBondContact CD-OH 3.45Å; K218-L267 HydrophobicContact CB-CD1 3.84Å; K218-L267 HydrophobicContact CG-CD1 4.33Å
219S97.1Very high93.9Very high9 Ų934.6 Ų34.66%0.06317%0.165CC..Hα-helixtrans-65.2-41.5-177.8-53.70000111.7L177 Q181 H215 M216 V217 Q222 N223L177-S219 WeakPolarHBondContact CD2-OG 3.46Å; L177-S219 WeakPolarHBondContact O-CB 3.19Å; Q181-S219 WeakPolarHBondContact CA-O 3.39Å; H215-S219 PolarHBondContact O-N 3.31Å; H215-S219 PolarHBondContact O-OG 3.16Å; M216-S219 PolarHBondContact O-N 3.48Å; V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 3.31Å; S219-Q222 PolarHBondContact O-N 2.94Å; S219-N223 PolarHBondContact O-N 3.4Å
220L96Very high93.5Very high1 Ų136.7 Ų36.71%0.00518%0.184CC..Hα-helixtrans-66.4-41.2175.9-66.4174.1000112.5L180 I186 L190 F193 I197 M216 V217 Q222 N223 L226L180-L220 HydrophobicContact CD2-CD2 4.45Å; I186-L220 HydrophobicContact CD1-CD2 4.48Å; L190-L220 HydrophobicContact CD1-CD1 4.45Å; L190-L220 HydrophobicContact CD1-CD2 4.47Å; F193-L220 HydrophobicContact CB-CD1 3.9Å; F193-L220 HydrophobicContact CD2-CD2 4.42Å; I197-L220 HydrophobicContact CD1-CD1 3.53Å; M216-L220 HydrophobicContact CG-CD1 4.49Å; M216-L220 WeakPolarHBondContact O-CG 3.33Å; M216-L220 PolarHBondContact O-N 3.17Å; V217-L220 PolarHBondContact O-N 3.01Å; L220-Q222 VanDerWaalsContact C-N 3.28Å; L220-Q222 PolarHBondContact O-N 3.22Å; L220-N223 PolarHBondContact O-N 2.95Å; L220-L226 HydrophobicContact CD2-CD1 3.9Å
221V95.4Very high93.2Very high8 Ų839.8 Ų39.85%0.04820%0.197CC..Hα-helixtrans-66.2-32.3179.9169.20000112.2V217 K218 N223 L228 L235 I271 H275V217-V221 HydrophobicContact CG1-CG2 4.13Å; V217-V221 WeakPolarHBondContact O-CB 3.24Å; V217-V221 WeakPolarHBondContact O-CG2 3.15Å; V217-V221 PolarHBondContact O-N 3.43Å; K218-V221 PolarHBondContact O-N 3.22Å; V221-N223 VanDerWaalsContact C-N 3.35Å; V221-L228 HydrophobicContact CB-CD1 4.38Å; V221-L228 HydrophobicContact CG2-CD1 3.86Å; V221-L235 HydrophobicContact CG2-CD1 4.43Å; V221-I271 HydrophobicContact CG1-CG1 4.14Å; V221-I271 HydrophobicContact CG2-CD1 4.34Å; V221-I271 HydrophobicContact CG2-CG1 3.8Å; V221-H275 PolarHBondContact O-NE2 2.94Å
222Q95.6Very high93.1Very high67 Ų6737.3 Ų37.331%0.31318%0.183SC..THydrogen-bonded Turntrans-85-5.3179-69.2-176.7-18.100113.8Q181 K218 S219 L220 P224 H270Q181-Q222 HydrophobicContact CG-CB 4.04Å; K218-Q222 HydrophobicContact CG-CG 4.47Å; K218-Q222 WeakPolarHBondContact O-CB 3.3Å; K218-Q222 VanDerWaalsContact O-CG 3.27Å; K218-Q222 WeakPolarHBondContact O-CG 3.41Å; K218-Q222 PolarHBondContact O-N 3.26Å; S219-Q222 PolarHBondContact O-N 2.94Å; L220-Q222 VanDerWaalsContact C-N 3.28Å; L220-Q222 PolarHBondContact O-N 3.22Å; Q222-P224 WeakPolarHBondContact O-CD 3.46Å; Q222-H270 PolarHBondContact NE2-NE2 3.37Å
223N95.4Very high92.9Very high5 Ų542.5 Ų42.53%0.02720%0.203CC..  trans-80.8115.1-179.6-173.2-29.7000110.8L180 Q181 N183 S219 L220 V221 Y225 L226L180-N223 PolarHBondContact O-ND2 3.21Å; Q181-N223 VanDerWaalsContact O-CA 3.31Å; Q181-N223 WeakPolarHBondContact O-CA 3.46Å; Q181-N223 WeakPolarHBondContact O-CB 3.34Å; Q181-N223 VanDerWaalsContact O-CG 3.32Å; N183-N223 PolarHBondContact O-ND2 3.38Å; S219-N223 PolarHBondContact O-N 3.4Å; L220-N223 PolarHBondContact O-N 2.95Å; V221-N223 VanDerWaalsContact C-N 3.35Å; N223-Y225 PolarHBondContact O-N 3.24Å; N223-Y225 WeakPolarHBondContact OD1-CB 3.47Å; N223-Y225 WeakPolarHBondContact OD1-CD2 3.49Å; N223-Y225 PolarHBondContact OD1-N 3.26Å; N223-L226 HydrophobicContact CB-CD1 3.83Å; N223-L226 HydrophobicContact CB-CG 4.01Å; N223-L226 PolarHBondContact O-N 3.5Å
224P92.6Very high92.7Very high103 Ų10344.4 Ų44.467%0.66922%0.216SC*.THydrogen-bonded Turntrans-72.1-13.8-176.631.2-36.6000113.6Q222Q222-P224 WeakPolarHBondContact O-CD 3.46Å
225Y91.6Very high92.7Very high142 Ų14244.3 Ų44.356%0.55722%0.216SC*.THydrogen-bonded Turntrans-91.5-0.4-178.6-52.6-68.3000112.9S182 N223S182-Y225 WeakPolarHBondContact O-CE2 3.34Å; N223-Y225 PolarHBondContact O-N 3.24Å; N223-Y225 WeakPolarHBondContact OD1-CB 3.47Å; N223-Y225 WeakPolarHBondContact OD1-CD2 3.49Å; N223-Y225 PolarHBondContact OD1-N 3.26Å
226L90.2Very high92.6Very high14 Ų1442.3 Ų42.37%0.07321%0.207CC..  trans-107.2134.2179.8-59.6179.2000111.8I186 A187 L190 L220 N223I186-L226 HydrophobicContact CD1-CD1 4.09Å; I186-L226 HydrophobicContact CG1-CD1 4.23Å; I186-L226 HydrophobicContact CG1-CD2 3.83Å; I186-L226 HydrophobicContact CG1-CG 4.45Å; A187-L226 HydrophobicContact CB-CD2 4.09Å; L190-L226 HydrophobicContact CD1-CD1 4.38Å; L220-L226 HydrophobicContact CD2-CD1 3.9Å; N223-L226 HydrophobicContact CB-CD1 3.83Å; N223-L226 HydrophobicContact CB-CG 4.01Å; N223-L226 PolarHBondContact O-N 3.5Å
227Y88.4Confident92.5Very high130 Ų13045.4 Ų45.451%0.5123%0.229SC..  trans-98.6108.9168.8-178.8-103.9000109.7L131 L278L131-Y227 HydrophobicContact CD2-CE1 4.04Å; Y227-L278 HydrophobicContact CE2-CD1 4.4Å; Y227-L278 HydrophobicContact CE2-CD2 4.15Å
228L87.4Confident92.5Very high1 Ų145.7 Ų45.71%0.00523%0.231CC..  trans-86.3-8.6-175.6-66.5-177.4000114.5L190 V221 S230 Y231 V232 L235L190-L228 HydrophobicContact CD1-CD2 3.74Å; L190-L228 HydrophobicContact CD2-CD2 3.92Å; L190-L228 HydrophobicContact CG-CD2 4.44Å; V221-L228 HydrophobicContact CB-CD1 4.38Å; V221-L228 HydrophobicContact CG2-CD1 3.86Å; L228-S230 PolarHBondContact O-N 2.88Å; L228-Y231 CarbonylContact O-C 3.43Å; L228-Y231 WeakPolarHBondContact O-CA 3.43Å; L228-Y231 WeakPolarHBondContact O-CB 3.37Å; L228-Y231 PolarHBondContact O-N 3.19Å; L228-V232 HydrophobicContact CB-CG2 3.86Å; L228-V232 PolarHBondContact O-N 3.31Å; L228-V232 VanDerWaalsContact O-N 3.08Å; L228-L235 HydrophobicContact CD1-CD1 4.06Å; L228-L235 HydrophobicContact CD2-CD1 4.23Å
229G83.6Confident92.5Very high8 Ų842 Ų428%0.08222%0.215CC..THydrogen-bonded Turntrans-34.3-60-161.200000117.1Y231G229-Y231 VanDerWaalsContact C-N 3.33Å; G229-Y231 PolarHBondContact O-N 3.12Å
230S83.2Confident92.4Very high83 Ų8342.4 Ų42.458%0.5822%0.216SC*.THydrogen-bonded Turntrans-72.4-23.5-179.652.50000114.3L228L228-S230 PolarHBondContact O-N 2.88Å
231Y89.8Confident92.4Very high65 Ų6544.2 Ų44.226%0.25522%0.223SC..THydrogen-bonded Turntrans-88.4-17.1-177.3-55.8-70.3000113.6L190 P191 V194 L228 G229 R233 S234 L235L190-Y231 HydrophobicContact CD2-CD2 3.73Å; L190-Y231 HydrophobicContact CD2-CE2 3.91Å; L190-Y231 HydrophobicContact CG-CD2 4.13Å; L190-Y231 HydrophobicContact CG-CE2 4.26Å; P191-Y231 HydrophobicContact CB-CE1 4.35Å; P191-Y231 WeakPolarHBondContact CG-OH 3.43Å; V194-Y231 HydrophobicContact CB-CD1 4.27Å; V194-Y231 HydrophobicContact CG1-CD1 4.07Å; V194-Y231 HydrophobicContact CG2-CD1 4.17Å; V194-Y231 HydrophobicContact CG2-CG 4.13Å; L228-Y231 CarbonylContact O-C 3.43Å; L228-Y231 WeakPolarHBondContact O-CA 3.43Å; L228-Y231 WeakPolarHBondContact O-CB 3.37Å; L228-Y231 PolarHBondContact O-N 3.19Å; G229-Y231 VanDerWaalsContact C-N 3.33Å; G229-Y231 PolarHBondContact O-N 3.12Å; Y231-R233 VanDerWaalsContact C-N 3.29Å; Y231-R233 PolarHBondContact O-N 3.22Å; Y231-S234 WeakPolarHBondContact O-CA 3.02Å; Y231-S234 WeakPolarHBondContact O-CB 3.36Å; Y231-S234 PolarHBondContact O-N 3.02Å; Y231-L235 PolarHBondContact O-N 3.47Å
232V92.1Very high92.5Very high1 Ų143.8 Ų43.81%0.00622%0.221CC..Hα-helixtrans-52.6-46.3-179176.70000111.2L228 S234 L235 V236 I271 H275 L278 V279 L282L228-V232 HydrophobicContact CB-CG2 3.86Å; L228-V232 PolarHBondContact O-N 3.31Å; L228-V232 VanDerWaalsContact O-N 3.08Å; V232-S234 VanDerWaalsContact C-N 3.3Å; V232-S234 PolarHBondContact O-N 3.4Å; V232-L235 PolarHBondContact O-N 2.99Å; V232-V236 HydrophobicContact CG1-CG2 4.15Å; V232-V236 WeakPolarHBondContact O-CB 3.29Å; V232-V236 VanDerWaalsContact O-CG2 3.29Å; V232-V236 WeakPolarHBondContact O-CG2 3.4Å; V232-V236 PolarHBondContact O-N 2.89Å; V232-I271 HydrophobicContact CG1-CG2 4.16Å; V232-H275 HydrophobicContact CG2-CB 3.93Å; V232-L278 HydrophobicContact CG2-CD1 4.33Å; V232-V279 HydrophobicContact CB-CG2 3.94Å; V232-V279 HydrophobicContact CG1-CG2 4.15Å; V232-L282 HydrophobicContact CG1-CD2 3.94Å
233R91.1Very high92.5Very high120 Ų12040.6 Ų40.645%0.45321%0.206SC..Hα-helixtrans-61.6-37.2179-171.4-178-70.8110.4-3.4112.5Y231 S237Y231-R233 VanDerWaalsContact C-N 3.29Å; Y231-R233 PolarHBondContact O-N 3.22Å; R233-S237 WeakPolarHBondContact O-CB 3.33Å; R233-S237 PolarHBondContact O-N 3.35Å; R233-S237 PolarHBondContact O-OG 3.44Å
234S92.8Very high92.5Very high44 Ų4441 Ų4131%0.30821%0.207SC..Hα-helixtrans-68.2-46.3177.2-158.80000111S198 Y231 V232 S237 S238S198-S234 PolarHBondContact OG-OG 2.86Å; Y231-S234 WeakPolarHBondContact O-CA 3.02Å; Y231-S234 WeakPolarHBondContact O-CB 3.36Å; Y231-S234 PolarHBondContact O-N 3.02Å; V232-S234 VanDerWaalsContact C-N 3.3Å; V232-S234 PolarHBondContact O-N 3.4Å; S234-S237 WeakPolarHBondContact O-CB 3.34Å; S234-S237 PolarHBondContact O-N 2.92Å; S234-S238 PolarHBondContact O-N 3.17Å; S234-S238 PolarHBondContact O-OG 3.19Å
235L95.2Very high92.5Very high0 Ų039.4 Ų39.40%019%0.191CC..Hα-helixtrans-61.8-46.7177.3-67.4176.5000111.6V194 I197 V217 V221 L228 Y231 V232 S237 S238 V239V194-L235 HydrophobicContact CG1-CD2 4.33Å; V194-L235 HydrophobicContact CG2-CD2 4.15Å; I197-L235 HydrophobicContact CB-CD2 4.49Å; I197-L235 HydrophobicContact CD1-CD2 4.01Å; I197-L235 HydrophobicContact CG2-CD2 3.9Å; V217-L235 HydrophobicContact CG2-CD2 4.28Å; V221-L235 HydrophobicContact CG2-CD1 4.43Å; L228-L235 HydrophobicContact CD1-CD1 4.06Å; L228-L235 HydrophobicContact CD2-CD1 4.23Å; Y231-L235 PolarHBondContact O-N 3.47Å; V232-L235 PolarHBondContact O-N 2.99Å; L235-S237 VanDerWaalsContact C-N 3.27Å; L235-S237 PolarHBondContact O-N 3.12Å; L235-S238 PolarHBondContact O-N 2.68Å; L235-V239 WeakPolarHBondContact O-CG2 3.31Å; L235-V239 PolarHBondContact O-N 3.39Å
236V95.8Very high92.4Very high8 Ų835.7 Ų35.75%0.04819%0.185CC..Hα-helixtrans-58.5-41.61751690000110.6V232 S238 V239 M240 L268 I271 L282 I286V232-V236 HydrophobicContact CG1-CG2 4.15Å; V232-V236 WeakPolarHBondContact O-CB 3.29Å; V232-V236 VanDerWaalsContact O-CG2 3.29Å; V232-V236 WeakPolarHBondContact O-CG2 3.4Å; V232-V236 PolarHBondContact O-N 2.89Å; V236-S238 PolarHBondContact O-N 3.44Å; V236-V239 PolarHBondContact O-N 3.38Å; V236-M240 HydrophobicContact CG1-CG 4.02Å; V236-M240 VanDerWaalsContact O-CB 3.24Å; V236-M240 WeakPolarHBondContact O-CB 3.33Å; V236-M240 WeakPolarHBondContact O-CG 3.48Å; V236-M240 PolarHBondContact O-N 3.32Å; V236-L268 HydrophobicContact CG1-CD1 3.83Å; V236-L268 HydrophobicContact CG2-CD1 4.4Å; V236-I271 HydrophobicContact CG2-CG2 3.76Å; V236-L282 HydrophobicContact CB-CD1 4.5Å; V236-L282 HydrophobicContact CG1-CD1 4.24Å; V236-L282 HydrophobicContact CG2-CD1 4.31Å; V236-L282 HydrophobicContact CG2-CD2 4.35Å; V236-I286 HydrophobicContact CG1-CD1 4.06Å; V236-I286 HydrophobicContact CG1-CG1 4.01Å
237S95.1Very high92.4Very high65 Ų6535.1 Ų35.146%0.45518%0.182SC..Hα-helixtrans-63.1-41.4177.5-60.60000112.4R233 S234 L235 Y241R233-S237 WeakPolarHBondContact O-CB 3.33Å; R233-S237 PolarHBondContact O-N 3.35Å; R233-S237 PolarHBondContact O-OG 3.44Å; S234-S237 WeakPolarHBondContact O-CB 3.34Å; S234-S237 PolarHBondContact O-N 2.92Å; L235-S237 VanDerWaalsContact C-N 3.27Å; L235-S237 PolarHBondContact O-N 3.12Å; S237-Y241 WeakPolarHBondContact O-CB 3.29Å; S237-Y241 PolarHBondContact O-N 3.33Å
238S96.1Very high92.2Very high7 Ų731.1 Ų31.15%0.04918%0.176CC..Hα-helixtrans-65.9-40.3175.5-68.50000113I197 S198 S234 L235 V236 Y241 C242I197-S238 PolarHBondContact O-OG 3.49Å; S198-S238 WeakPolarHBondContact CA-OG 3.5Å; S234-S238 PolarHBondContact O-N 3.17Å; S234-S238 PolarHBondContact O-OG 3.19Å; L235-S238 PolarHBondContact O-N 2.68Å; V236-S238 PolarHBondContact O-N 3.44Å; S238-Y241 WeakPolarHBondContact O-CB 3.13Å; S238-Y241 PolarHBondContact O-N 3.5Å; S238-C242 PolarHBondContact O-N 2.62Å; S238-C242 PolarHBondContact O-SG 3.32Å; S238-C242 VanDerWaalsContact O-SG 3.36Å
239V97.4Very high91.9Very high0 Ų031.2 Ų31.20%018%0.176CC..Hα-helixtrans-69-43.8176.9176.40000110.5L214 V217 L235 V236 Y241 C242 I243 A264 L267 L268 I271L214-V239 HydrophobicContact CD2-CG2 4.06Å; V217-V239 HydrophobicContact CG1-CG2 4.09Å; L235-V239 WeakPolarHBondContact O-CG2 3.31Å; L235-V239 PolarHBondContact O-N 3.39Å; V236-V239 PolarHBondContact O-N 3.38Å; V239-Y241 VanDerWaalsContact C-N 3.27Å; V239-Y241 PolarHBondContact O-N 3.03Å; V239-C242 WeakPolarHBondContact O-CB 3.35Å; V239-C242 PolarHBondContact O-N 3.47Å; V239-C242 VanDerWaalsContact O-N 3.07Å; V239-I243 HydrophobicContact CG1-CD1 3.93Å; V239-I243 WeakPolarHBondContact O-CG1 3.31Å; V239-I243 PolarHBondContact O-N 2.88Å; V239-A264 HydrophobicContact CG1-CB 4.18Å; V239-A264 WeakPolarHBondContact CG1-O 3.41Å; V239-L267 HydrophobicContact CG2-CD2 4.22Å; V239-L268 HydrophobicContact CG1-CB 3.9Å; V239-I271 HydrophobicContact CG2-CD1 3.99Å
240M96.1Very high92Very high18 Ų1832 Ų329%0.08918%0.18CC..Hα-helixtrans-60.9-34.8175.3-74.9-68.2-77.800112.5V236 I243 L244 L268 I286 L290V236-M240 HydrophobicContact CG1-CG 4.02Å; V236-M240 VanDerWaalsContact O-CB 3.24Å; V236-M240 WeakPolarHBondContact O-CB 3.33Å; V236-M240 WeakPolarHBondContact O-CG 3.48Å; V236-M240 PolarHBondContact O-N 3.32Å; M240-I243 PolarHBondContact O-N 2.79Å; M240-I243 HydrophobicContact SD-CD1 4.24Å; M240-L244 HydrophobicContact CE-CD1 3.49Å; M240-L244 VanDerWaalsContact CE-CD1 3.49Å; M240-L244 HydrophobicContact CE-CG 4.29Å; M240-L244 WeakPolarHBondContact O-CB 3.38Å; M240-L244 PolarHBondContact O-N 3.18Å; M240-L268 HydrophobicContact CG-CD1 4.15Å; M240-L268 HydrophobicContact CG-CD2 4.48Å; M240-L268 HydrophobicContact SD-CD1 4.16Å; M240-L268 HydrophobicContact SD-CD2 3.45Å; M240-L268 WeakPolarHBondContact SD-CD2 3.24Å; M240-L268 HydrophobicContact SD-CG 4.45Å; M240-I286 HydrophobicContact CE-CG2 4.32Å; M240-I286 HydrophobicContact SD-CG2 4.32Å; M240-L290 HydrophobicContact CE-CD2 3.89Å; M240-L290 HydrophobicContact CE-CG 4.09Å; M240-L290 HydrophobicContact SD-CD2 4.37Å
241Y96.1Very high92Very high39 Ų3934.6 Ų34.615%0.15319%0.186CC..Hα-helixtrans-58.4-46.4171.9-179.5-93.4000111.4V200 K201 S237 S238 V239 I243 L244 E245 L247V200-Y241 HydrophobicContact CB-CD1 4.15Å; V200-Y241 HydrophobicContact CG2-CD1 3.85Å; V200-Y241 HydrophobicContact CG2-CG 4.24Å; K201-Y241 HydrophobicContact CD-CE2 4.28Å; K201-Y241 HydrophobicContact CG-CD2 4.01Å; K201-Y241 HydrophobicContact CG-CE1 4.23Å; K201-Y241 HydrophobicContact CG-CE2 3.7Å; K201-Y241 HydrophobicContact CG-CG 4.46Å; S237-Y241 WeakPolarHBondContact O-CB 3.29Å; S237-Y241 PolarHBondContact O-N 3.33Å; S238-Y241 WeakPolarHBondContact O-CB 3.13Å; S238-Y241 PolarHBondContact O-N 3.5Å; V239-Y241 VanDerWaalsContact C-N 3.27Å; V239-Y241 PolarHBondContact O-N 3.03Å; Y241-I243 VanDerWaalsContact C-N 3.28Å; Y241-I243 PolarHBondContact O-N 3.34Å; Y241-L244 PolarHBondContact O-N 3.4Å; Y241-E245 HydrophobicContact CD2-CB 3.89Å; Y241-E245 HydrophobicContact CD2-CG 3.43Å; Y241-E245 VanDerWaalsContact CD2-CG 3.43Å; Y241-E245 HydrophobicContact CE2-CB 3.74Å; Y241-E245 HydrophobicContact CE2-CG 3.6Å; Y241-E245 HydrophobicContact CG-CB 4.39Å; Y241-E245 HydrophobicContact CG-CG 4.18Å; Y241-E245 WeakPolarHBondContact O-CB 3.36Å; Y241-E245 PolarHBondContact O-N 2.89Å; Y241-L247 HydrophobicContact CD1-CD2 4.41Å; Y241-L247 HydrophobicContact CE1-CD2 3.89Å
242C96.1Very high91.7Very high0 Ų034.8 Ų34.80%019%0.192CC..Hα-helixtrans-66.1-30177.5-58.10000112.7L214 S238 V239 L260 A264L214-C242 HydrophobicContact CD1-CB 4.42Å; L214-C242 HydrophobicContact CD2-CB 4.4Å; S238-C242 PolarHBondContact O-N 2.62Å; S238-C242 PolarHBondContact O-SG 3.32Å; S238-C242 VanDerWaalsContact O-SG 3.36Å; V239-C242 WeakPolarHBondContact O-CB 3.35Å; V239-C242 PolarHBondContact O-N 3.47Å; V239-C242 VanDerWaalsContact O-N 3.07Å; C242-L260 HydrophobicContact CB-CD2 4.31Å; C242-A264 HydrophobicContact CB-CB 4.2Å
243I96.5Very high91.2Very high0 Ų038.8 Ų38.80%022%0.218CC..Hα-helixtrans-78.7-41.8178.9-64166.4000111.8V239 M240 Y241 R261 A264 A265 L268 G306V239-I243 HydrophobicContact CG1-CD1 3.93Å; V239-I243 WeakPolarHBondContact O-CG1 3.31Å; V239-I243 PolarHBondContact O-N 2.88Å; M240-I243 PolarHBondContact O-N 2.79Å; M240-I243 HydrophobicContact SD-CD1 4.24Å; Y241-I243 VanDerWaalsContact C-N 3.28Å; Y241-I243 PolarHBondContact O-N 3.34Å; I243-R261 VanDerWaalsContact C-NH1 3.27Å; I243-R261 PolarHBondContact O-NH1 3.02Å; I243-A264 HydrophobicContact CD1-CB 4.21Å; I243-A264 HydrophobicContact CG1-CB 3.51Å; I243-A265 HydrophobicContact CD1-CB 4.39Å; I243-L268 HydrophobicContact CD1-CB 3.89Å; I243-L268 HydrophobicContact CD1-CD2 3.71Å; I243-L268 HydrophobicContact CD1-CG 4.37Å; I243-G306 WeakPolarHBondContact CG2-O 3.37Å; I243-G306 WeakPolarHBondContact O-CA 3.49Å
244L95.3Very high90.9Very high12 Ų1240.5 Ų40.56%0.06324%0.235CC..Hα-helixtrans-108.6-30-164.5-67.9-175.9000114.8M240 Y241 L290 V293 S303 A307M240-L244 HydrophobicContact CE-CD1 3.49Å; M240-L244 VanDerWaalsContact CE-CD1 3.49Å; M240-L244 HydrophobicContact CE-CG 4.29Å; M240-L244 WeakPolarHBondContact O-CB 3.38Å; M240-L244 PolarHBondContact O-N 3.18Å; Y241-L244 PolarHBondContact O-N 3.4Å; L244-L290 HydrophobicContact CD1-CD2 4.32Å; L244-L290 HydrophobicContact CD2-CD2 3.97Å; L244-L290 HydrophobicContact CG-CD2 4.44Å; L244-V293 HydrophobicContact CD1-CG2 4.09Å; L244-V293 HydrophobicContact CD2-CB 4.44Å; L244-V293 HydrophobicContact CD2-CG2 4.05Å; L244-V293 HydrophobicContact CG-CG2 4.47Å; L244-S303 WeakPolarHBondContact O-CB 3.41Å; L244-S303 PolarHBondContact O-OG 2.84Å; L244-A307 HydrophobicContact CD2-CB 3.92Å
245E93.2Very high90.7Very high70 Ų7040.9 Ų40.933%0.32723%0.234SC..SBendtrans-82.2149.1-172.2-65.9-64.4134.900111.6Y241 L247 R261 R299Y241-E245 HydrophobicContact CD2-CB 3.89Å; Y241-E245 HydrophobicContact CD2-CG 3.43Å; Y241-E245 VanDerWaalsContact CD2-CG 3.43Å; Y241-E245 HydrophobicContact CE2-CB 3.74Å; Y241-E245 HydrophobicContact CE2-CG 3.6Å; Y241-E245 HydrophobicContact CG-CB 4.39Å; Y241-E245 HydrophobicContact CG-CG 4.18Å; Y241-E245 WeakPolarHBondContact O-CB 3.36Å; Y241-E245 PolarHBondContact O-N 2.89Å; E245-L247 PolarHBondContact O-N 3.32Å; E245-L247 VanDerWaalsContact O-N 3.14Å; E245-R261 PolarHBondContact O-NH1 2.84Å; E245-R261 PolarHBondContact O-NH2 2.93Å; E245-R299 IonicContact OE1-NH1 3.42Å
246P88.9Confident90.4Very high65 Ų6544.6 Ų44.642%0.42225%0.253SS..  trans-71.7103.9170.228-30.4000108.9P300P246-P300 HydrophobicContact CB-CG 3.89Å; P246-P300 HydrophobicContact CG-CG 4.34Å
247L89.3Confident90.2Very high2 Ų244.6 Ų44.61%0.0125%0.253CS..  trans-72.5142.1179.9-59172.6000109.2L210 Y241 E245 A249 S250 L260L210-L247 HydrophobicContact CD1-CD1 3.84Å; L210-L247 HydrophobicContact CD1-CD2 4.01Å; L210-L247 HydrophobicContact CD1-CG 4.44Å; Y241-L247 HydrophobicContact CD1-CD2 4.41Å; Y241-L247 HydrophobicContact CE1-CD2 3.89Å; E245-L247 PolarHBondContact O-N 3.32Å; E245-L247 VanDerWaalsContact O-N 3.14Å; L247-A249 HydrophobicContact CB-CB 4.49Å; L247-A249 PolarHBondContact O-N 3.49Å; L247-A249 VanDerWaalsContact O-N 3.16Å; L247-S250 PolarHBondContact N-OG 2.72Å; L247-S250 WeakPolarHBondContact O-CB 3.35Å; L247-S250 PolarHBondContact O-N 2.99Å; L247-S250 PolarHBondContact O-OG 3.04Å; L247-L260 HydrophobicContact CD1-CD2 3.64Å
248A84.4Confident90.2Very high46 Ų4642.6 Ų42.638%0.3824%0.236SC..G310 helixtrans-57.3-32.6173.700000111.4S204 H205 S250 I251S204-A248 PolarHBondContact O-N 3.36Å; S204-A248 VanDerWaalsContact O-N 3.11Å; H205-A248 HydrophobicContact CB-CB 4.03Å; A248-S250 PolarHBondContact O-N 2.94Å; A248-I251 WeakPolarHBondContact O-CB 3.27Å; A248-I251 WeakPolarHBondContact O-CG1 3.42Å; A248-I251 PolarHBondContact O-N 2.95Å
249A82.9Confident90.1Very high3 Ų345.9 Ų45.93%0.02526%0.255CS..G310 helixtrans-59.7-27.6172.400000114S204 L207 L247 I251 N252 N255S204-A249 PolarHBondContact O-N 3.1Å; S204-A249 VanDerWaalsContact O-N 3.08Å; L207-A249 HydrophobicContact CB-CB 4.3Å; L247-A249 HydrophobicContact CB-CB 4.49Å; L247-A249 PolarHBondContact O-N 3.49Å; L247-A249 VanDerWaalsContact O-N 3.16Å; A249-I251 VanDerWaalsContact C-N 3.27Å; A249-I251 PolarHBondContact O-N 3.1Å; A249-N252 PolarHBondContact O-N 3.29Å; A249-N255 VanDerWaalsContact O-CB 3.31Å; A249-N255 WeakPolarHBondContact O-CB 3.39Å; A249-N255 PolarHBondContact O-ND2 3.32Å
250S83.8Confident90.1Very high23 Ų2346.2 Ų46.216%0.16126%0.257CS..G310 helixtrans-76.2-10.6-179.865.50000114.3L247 A248 N252L247-S250 PolarHBondContact N-OG 2.72Å; L247-S250 WeakPolarHBondContact O-CB 3.35Å; L247-S250 PolarHBondContact O-N 2.99Å; L247-S250 PolarHBondContact O-OG 3.04Å; A248-S250 PolarHBondContact O-N 2.94Å; S250-N252 PolarHBondContact O-N 3.08Å
251I83.3Confident90.1Very high139 Ų13945.3 Ų45.371%0.71325%0.253SS*.G310 helixtrans-68.3-29.6175.1-60.3172.2000110.5A248 A249 P253A248-I251 WeakPolarHBondContact O-CB 3.27Å; A248-I251 WeakPolarHBondContact O-CG1 3.42Å; A248-I251 PolarHBondContact O-N 2.95Å; A249-I251 VanDerWaalsContact C-N 3.27Å; A249-I251 PolarHBondContact O-N 3.1Å; I251-P253 WeakPolarHBondContact O-CD 3.23Å
252N85.2Confident90.1Very high69 Ų6946 Ų4637%0.36926%0.259SS..SBendtrans-88.8115.2177.7-176-0.6000110.4A249 S250 L254 N255A249-N252 PolarHBondContact O-N 3.29Å; S250-N252 PolarHBondContact O-N 3.08Å; N252-L254 PolarHBondContact O-N 3.3Å; N252-L254 VanDerWaalsContact O-N 3.11Å; N252-L254 WeakPolarHBondContact OD1-CB 3.31Å; N252-L254 PolarHBondContact OD1-N 3.32Å; N252-L254 VanDerWaalsContact OD1-N 3.14Å; N252-N255 WeakPolarHBondContact O-CB 3.48Å; N252-N255 PolarHBondContact O-N 2.99Å
253P81.1Confident90.2Very high85 Ų8548.2 Ų48.255%0.55227%0.267SS*.THydrogen-bonded Turntrans-61.8-20.4-179.7-23.134.5000114.4I251 N255I251-P253 WeakPolarHBondContact O-CD 3.23Å; P253-N255 VanDerWaalsContact C-N 3.27Å
254L83.6Confident90.2Very high156 Ų15648.2 Ų48.282%0.81727%0.267SS*.THydrogen-bonded Turntrans-73.8-19.6176.9-60.7177.1000112.9N252 D256N252-L254 PolarHBondContact O-N 3.3Å; N252-L254 VanDerWaalsContact O-N 3.11Å; N252-L254 WeakPolarHBondContact OD1-CB 3.31Å; N252-L254 PolarHBondContact OD1-N 3.32Å; N252-L254 VanDerWaalsContact OD1-N 3.14Å; L254-D256 PolarHBondContact O-N 3.45Å
255N88.6Confident90.4Very high51 Ų5147.6 Ų47.627%0.27327%0.265SS..SBendtrans-82.5118.9179.8-72.4-14.9000110.4L207 A249 N252 P253 H257L207-N255 HydrophobicContact CD2-CB 4.48Å; A249-N255 VanDerWaalsContact O-CB 3.31Å; A249-N255 WeakPolarHBondContact O-CB 3.39Å; A249-N255 PolarHBondContact O-ND2 3.32Å; N252-N255 WeakPolarHBondContact O-CB 3.48Å; N252-N255 PolarHBondContact O-N 2.99Å; P253-N255 VanDerWaalsContact C-N 3.27Å; N255-H257 PolarHBondContact O-N 2.65Å; N255-H257 PolarHBondContact O-ND1 2.9Å
256D90.1Very high90.6Very high78 Ų7849.7 Ų49.742%0.41728%0.277SS..  trans-78.267176.4-175.830.1000112.3L207 L254 W258 T259L207-D256 WeakPolarHBondContact CD2-O 3.42Å; L254-D256 PolarHBondContact O-N 3.45Å; D256-W258 PolarHBondContact O-N 3.39Å; D256-T259 PolarHBondContact O-OG1 3.44Å; D256-T259 VanDerWaalsContact O-OG1 3.04Å; D256-T259 WeakPolarHBondContact OD2-CB 3.48Å; D256-T259 WeakPolarHBondContact OD2-CG2 3.18Å; D256-T259 PolarHBondContact OD2-OG1 3.45Å
257H92Very high91Very high9 Ų946.9 Ų46.94%0.04226%0.259CS..Hα-helixtrans-71.5-10177.464-77000113.3L207 N255 R261L207-H257 HydrophobicContact CD1-CB 4.2Å; N255-H257 PolarHBondContact O-N 2.65Å; N255-H257 PolarHBondContact O-ND1 2.9Å; H257-R261 WeakPolarHBondContact O-CG 3.36Å; H257-R261 PolarHBondContact O-N 3.28Å
258W94.1Very high91.4Very high23 Ų2346.8 Ų46.89%0.08726%0.258CS..Hα-helixtrans-68.4-46178.7-52.8101.3000111.5D256 L260 R261 D262 C302 Y305 D351 K354D256-W258 PolarHBondContact O-N 3.39Å; W258-L260 VanDerWaalsContact C-N 3.29Å; W258-L260 PolarHBondContact O-N 2.76Å; W258-R261 WeakPolarHBondContact O-CB 3.31Å; W258-R261 PolarHBondContact O-N 3.03Å; W258-R261 VanDerWaalsContact O-N 3.08Å; W258-D262 PolarHBondContact O-N 3.41Å; W258-C302 HydrophobicContact CH2-CB 4.15Å; W258-C302 HydrophobicContact CZ3-CB 4.28Å; W258-Y305 AromaticContact CE3-CD1 3.59Å; W258-Y305 HydrophobicContact CE3-CD1 3.59Å; W258-Y305 AromaticContact CE3-CD2 3.94Å; W258-Y305 HydrophobicContact CE3-CD2 3.94Å; W258-Y305 AromaticContact CE3-CE1 3.9Å; W258-Y305 HydrophobicContact CE3-CE1 3.9Å; W258-Y305 HydrophobicContact CE3-CE2 4.2Å; W258-Y305 AromaticContact CE3-CG 3.62Å; W258-Y305 HydrophobicContact CE3-CG 3.62Å; W258-Y305 AromaticContact CZ3-CD1 3.95Å; W258-Y305 HydrophobicContact CZ3-CD1 3.95Å; W258-Y305 AromaticContact CZ3-CD2 3.94Å; W258-Y305 HydrophobicContact CZ3-CD2 3.94Å; W258-Y305 AromaticContact CZ3-CG 3.56Å; W258-Y305 HydrophobicContact CZ3-CG 3.56Å; W258-D351 HydrophobicContact CH2-CB 4.05Å; W258-D351 HydrophobicContact CZ2-CB 4.25Å; W258-D351 WeakPolarHBondContact CZ2-OD1 3.35Å; W258-K354 HydrophobicContact CD2-CG 4.43Å; W258-K354 HydrophobicContact CE3-CB 4.33Å; W258-K354 HydrophobicContact CH2-CB 4.2Å; W258-K354 HydrophobicContact CH2-CG 4.39Å; W258-K354 HydrophobicContact CZ2-CG 4.25Å; W258-K354 HydrophobicContact CZ3-CB 4.08Å
259T95.1Very high91.9Very high76 Ų7645.3 Ų45.347%0.46625%0.245SC..Hα-helixtrans-64.1-33.8178.449.40000112.7D256 D262 Y263D256-T259 PolarHBondContact O-OG1 3.44Å; D256-T259 VanDerWaalsContact O-OG1 3.04Å; D256-T259 WeakPolarHBondContact OD2-CB 3.48Å; D256-T259 WeakPolarHBondContact OD2-CG2 3.18Å; D256-T259 PolarHBondContact OD2-OG1 3.45Å; T259-D262 PolarHBondContact O-N 3.28Å; T259-Y263 WeakPolarHBondContact O-CB 3.34Å; T259-Y263 PolarHBondContact O-N 3.16Å
260L95.6Very high92.5Very high6 Ų648.3 Ų48.33%0.03126%0.258CS..Hα-helixtrans-61.1-45.3171.3-174.298.6000111.4L207 L210 N211 L214 C242 L247 W258 Y263 A264L207-L260 HydrophobicContact CD1-CB 3.83Å; L207-L260 HydrophobicContact CD1-CD1 4.01Å; L207-L260 HydrophobicContact CD1-CD2 3.82Å; L207-L260 HydrophobicContact CD1-CG 4.08Å; L210-L260 HydrophobicContact CB-CD1 4.01Å; L210-L260 HydrophobicContact CB-CD2 4.33Å; L210-L260 HydrophobicContact CD1-CD2 4.28Å; N211-L260 HydrophobicContact CB-CD1 3.78Å; L214-L260 HydrophobicContact CD1-CD1 3.82Å; L214-L260 HydrophobicContact CD1-CG 3.99Å; C242-L260 HydrophobicContact CB-CD2 4.31Å; L247-L260 HydrophobicContact CD1-CD2 3.64Å; W258-L260 VanDerWaalsContact C-N 3.29Å; W258-L260 PolarHBondContact O-N 2.76Å; L260-Y263 PolarHBondContact O-N 3.04Å; L260-A264 VanDerWaalsContact O-CB 3.26Å; L260-A264 WeakPolarHBondContact O-CB 3.41Å; L260-A264 PolarHBondContact O-N 3.41Å
261R96.4Very high93.1Very high0 Ų047.3 Ų47.30%025%0.251CS..Hα-helixtrans-64.6-40178.7-68.9-178.4-167.1-87.2-3.6111.5I243 E245 H257 W258 A264 A265 C302 Y305I243-R261 VanDerWaalsContact C-NH1 3.27Å; I243-R261 PolarHBondContact O-NH1 3.02Å; E245-R261 PolarHBondContact O-NH1 2.84Å; E245-R261 PolarHBondContact O-NH2 2.93Å; H257-R261 WeakPolarHBondContact O-CG 3.36Å; H257-R261 PolarHBondContact O-N 3.28Å; W258-R261 WeakPolarHBondContact O-CB 3.31Å; W258-R261 PolarHBondContact O-N 3.03Å; W258-R261 VanDerWaalsContact O-N 3.08Å; R261-A264 PolarHBondContact O-N 3.05Å; R261-A265 WeakPolarHBondContact O-CB 3.22Å; R261-A265 PolarHBondContact O-N 3.44Å; R261-C302 WeakPolarHBondContact CD-O 3.41Å; R261-C302 PolarHBondContact NE-O 3.5Å; R261-C302 PolarHBondContact NH1-O 3Å; R261-Y305 HydrophobicContact CB-CD1 4.36Å; R261-Y305 HydrophobicContact CB-CE1 4.29Å
262D96.8Very high93.6Very high52 Ų5241.6 Ų41.628%0.27822%0.221SC..Hα-helixtrans-61.7-48.4175.4-66.6-16.6000111.4W258 T259 A264 A265 L266 Y305W258-D262 PolarHBondContact O-N 3.41Å; T259-D262 PolarHBondContact O-N 3.28Å; D262-A264 PolarHBondContact O-N 3.38Å; D262-A265 PolarHBondContact O-N 3.15Å; D262-L266 WeakPolarHBondContact O-CG 3.38Å; D262-L266 PolarHBondContact O-N 3.48Å; D262-Y305 WeakPolarHBondContact OD1-CE1 3.13Å; D262-Y305 PolarHBondContact OD1-OH 3.39Å; D262-Y305 PolarHBondContact OD2-OH 3.36Å
263Y97.8Very high93.9Very high47 Ų4743.2 Ų43.218%0.18422%0.222CC..Hα-helixtrans-63.2-42.9177.4179.8-111000111.9L214 H215 K218 T259 L260 A265 L266 L267L214-Y263 HydrophobicContact CB-CD1 3.93Å; L214-Y263 HydrophobicContact CB-CE1 3.59Å; L214-Y263 HydrophobicContact CD1-CD1 3.99Å; L214-Y263 HydrophobicContact CD1-CE1 4.5Å; H215-Y263 AromaticContact CE1-CE1 3.98Å; H215-Y263 AromaticContact CE1-CZ 3.67Å; H215-Y263 AromaticContact ND1-CE1 3.93Å; H215-Y263 AromaticContact ND1-CZ 3.56Å; H215-Y263 PolarHBondContact ND1-OH 3.05Å; K218-Y263 WeakPolarHBondContact CD-OH 3.45Å; T259-Y263 WeakPolarHBondContact O-CB 3.34Å; T259-Y263 PolarHBondContact O-N 3.16Å; L260-Y263 PolarHBondContact O-N 3.04Å; Y263-A265 PolarHBondContact O-N 2.83Å; Y263-L266 PolarHBondContact O-N 3.37Å; Y263-L267 HydrophobicContact CE1-CD2 4.5Å; Y263-L267 WeakPolarHBondContact O-CB 3.47Å; Y263-L267 PolarHBondContact O-N 3.35Å
264A97.9Very high94.4Very high0 Ų042.3 Ų42.30%022%0.215CC..Hα-helixtrans-63-41177.400000111.9L214 V239 C242 I243 L260 R261 D262 L267 L268L214-A264 HydrophobicContact CD1-CB 3.85Å; L214-A264 HydrophobicContact CD2-CB 4.41Å; V239-A264 HydrophobicContact CG1-CB 4.18Å; V239-A264 WeakPolarHBondContact CG1-O 3.41Å; C242-A264 HydrophobicContact CB-CB 4.2Å; I243-A264 HydrophobicContact CD1-CB 4.21Å; I243-A264 HydrophobicContact CG1-CB 3.51Å; L260-A264 VanDerWaalsContact O-CB 3.26Å; L260-A264 WeakPolarHBondContact O-CB 3.41Å; L260-A264 PolarHBondContact O-N 3.41Å; R261-A264 PolarHBondContact O-N 3.05Å; D262-A264 PolarHBondContact O-N 3.38Å; A264-L267 PolarHBondContact O-N 3.28Å; A264-L268 WeakPolarHBondContact O-CB 3.17Å; A264-L268 PolarHBondContact O-N 3Å
265A97.8Very high94.7Very high0 Ų036.5 Ų36.50%018%0.184CC..Hα-helixtrans-64.6-42.2176.600000112.4I243 R261 D262 Y263 L267 L268 S269 V309 A313I243-A265 HydrophobicContact CD1-CB 4.39Å; R261-A265 WeakPolarHBondContact O-CB 3.22Å; R261-A265 PolarHBondContact O-N 3.44Å; D262-A265 PolarHBondContact O-N 3.15Å; Y263-A265 PolarHBondContact O-N 2.83Å; A265-L267 VanDerWaalsContact C-N 3.33Å; A265-L268 WeakPolarHBondContact O-CB 3.33Å; A265-L268 PolarHBondContact O-N 2.8Å; A265-S269 PolarHBondContact O-N 2.96Å; A265-V309 HydrophobicContact CB-CB 4.4Å; A265-V309 HydrophobicContact CB-CG1 3.7Å; A265-A313 HydrophobicContact CB-CB 4.06Å; A265-A313 VanDerWaalsContact O-CB 3.31Å; A265-A313 WeakPolarHBondContact O-CB 3.28Å
266L97.4Very high94.6Very high113 Ų11334.4 Ų34.459%0.59218%0.175SC*.Hα-helixtrans-63.9-40.1173.4-69.5175.8000111.8D262 Y263 S269 H270 A313D262-L266 WeakPolarHBondContact O-CG 3.38Å; D262-L266 PolarHBondContact O-N 3.48Å; Y263-L266 PolarHBondContact O-N 3.37Å; L266-S269 WeakPolarHBondContact O-CB 3.29Å; L266-S269 PolarHBondContact O-N 3.13Å; L266-H270 PolarHBondContact O-N 3.38Å; L266-A313 HydrophobicContact CD2-CB 4.47Å
267L97.8Very high94.3Very high6 Ų638.3 Ų38.33%0.03120%0.196CC..Hα-helixtrans-66.3-40.5176.2-178.358.7000112L214 V217 K218 V239 Y263 A264 A265 S269 H270 I271L214-L267 HydrophobicContact CB-CD2 4.15Å; L214-L267 HydrophobicContact CD2-CD2 4.19Å; L214-L267 VanDerWaalsContact O-CD2 3.32Å; L214-L267 WeakPolarHBondContact O-CD2 3.36Å; V217-L267 HydrophobicContact CB-CD2 3.97Å; V217-L267 HydrophobicContact CG1-CD1 4.46Å; V217-L267 HydrophobicContact CG1-CD2 3.83Å; V217-L267 HydrophobicContact CG1-CG 4.3Å; K218-L267 HydrophobicContact CB-CD1 3.84Å; K218-L267 HydrophobicContact CG-CD1 4.33Å; V239-L267 HydrophobicContact CG2-CD2 4.22Å; Y263-L267 HydrophobicContact CE1-CD2 4.5Å; Y263-L267 WeakPolarHBondContact O-CB 3.47Å; Y263-L267 PolarHBondContact O-N 3.35Å; A264-L267 PolarHBondContact O-N 3.28Å; A265-L267 VanDerWaalsContact C-N 3.33Å; L267-S269 VanDerWaalsContact C-N 3.32Å; L267-S269 PolarHBondContact O-N 3.09Å; L267-H270 WeakPolarHBondContact O-CB 3.42Å; L267-H270 PolarHBondContact O-N 3.38Å; L267-I271 HydrophobicContact CD1-CD1 4.46Å; L267-I271 HydrophobicContact CD1-CG1 4.46Å; L267-I271 HydrophobicContact CG-CD1 4.14Å; L267-I271 VanDerWaalsContact O-CG1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.39Å; L267-I271 PolarHBondContact O-N 3.06Å
268L97.4Very high93.9Very high0 Ų041.3 Ų41.30%021%0.212CC..Hα-helixtrans-57.4-47.4173.3176.969000110.8V236 V239 M240 I243 A264 A265 H270 I271 F272 I286V236-L268 HydrophobicContact CG1-CD1 3.83Å; V236-L268 HydrophobicContact CG2-CD1 4.4Å; V239-L268 HydrophobicContact CG1-CB 3.9Å; M240-L268 HydrophobicContact CG-CD1 4.15Å; M240-L268 HydrophobicContact CG-CD2 4.48Å; M240-L268 HydrophobicContact SD-CD1 4.16Å; M240-L268 HydrophobicContact SD-CD2 3.45Å; M240-L268 WeakPolarHBondContact SD-CD2 3.24Å; M240-L268 HydrophobicContact SD-CG 4.45Å; I243-L268 HydrophobicContact CD1-CB 3.89Å; I243-L268 HydrophobicContact CD1-CD2 3.71Å; I243-L268 HydrophobicContact CD1-CG 4.37Å; A264-L268 WeakPolarHBondContact O-CB 3.17Å; A264-L268 PolarHBondContact O-N 3Å; A265-L268 WeakPolarHBondContact O-CB 3.33Å; A265-L268 PolarHBondContact O-N 2.8Å; L268-H270 VanDerWaalsContact C-N 3.34Å; L268-H270 PolarHBondContact O-N 2.8Å; L268-I271 PolarHBondContact O-N 2.96Å; L268-F272 WeakPolarHBondContact O-CB 3.25Å; L268-F272 PolarHBondContact O-N 2.97Å; L268-I286 HydrophobicContact CD1-CD1 4.09Å; L268-I286 HydrophobicContact CD2-CG2 4.05Å
269S96.1Very high93.5Very high16 Ų1641 Ų4111%0.11221%0.212CC..Hα-helixtrans-58.8-46.7174.9-175.90000110.9A265 L266 L267 I271 F272 W273 A313A265-S269 PolarHBondContact O-N 2.96Å; L266-S269 WeakPolarHBondContact O-CB 3.29Å; L266-S269 PolarHBondContact O-N 3.13Å; L267-S269 VanDerWaalsContact C-N 3.32Å; L267-S269 PolarHBondContact O-N 3.09Å; S269-I271 PolarHBondContact O-N 3.39Å; S269-F272 PolarHBondContact O-N 3.38Å; S269-W273 PolarHBondContact O-N 3.46Å; S269-W273 VanDerWaalsContact OG-CD1 3.3Å; S269-W273 PolarHBondContact OG-NE1 3.03Å; S269-A313 VanDerWaalsContact CB-O 3.25Å; S269-A313 WeakPolarHBondContact CB-O 3.33Å; S269-A313 PolarHBondContact OG-O 3.1Å
270H95.8Very high93Very high65 Ų6542.7 Ų42.730%0.30123%0.227SC..Hα-helixtrans-58.7-45.3177.6-172.355.4000112.7Q222 L266 L267 L268 F272 W273 T274Q222-H270 PolarHBondContact NE2-NE2 3.37Å; L266-H270 PolarHBondContact O-N 3.38Å; L267-H270 WeakPolarHBondContact O-CB 3.42Å; L267-H270 PolarHBondContact O-N 3.38Å; L268-H270 VanDerWaalsContact C-N 3.34Å; L268-H270 PolarHBondContact O-N 2.8Å; H270-F272 VanDerWaalsContact C-N 3.35Å; H270-F272 PolarHBondContact O-N 2.9Å; H270-W273 PolarHBondContact O-N 2.95Å; H270-T274 WeakPolarHBondContact O-CB 3.38Å; H270-T274 WeakPolarHBondContact O-CG2 3.49Å; H270-T274 PolarHBondContact O-N 3.38Å; H270-T274 VanDerWaalsContact O-N 3.1Å; H270-T274 PolarHBondContact O-OG1 3.28Å
271I95.3Very high92.7Very high2 Ų243.6 Ų43.61%0.0124%0.238CC..Hα-helixtrans-60.8-45.7176.5-66.5164.4000110.5V217 V221 V232 V236 V239 L267 L268 S269 W273 T274 H275V217-I271 HydrophobicContact CG1-CD1 3.82Å; V221-I271 HydrophobicContact CG1-CG1 4.14Å; V221-I271 HydrophobicContact CG2-CD1 4.34Å; V221-I271 HydrophobicContact CG2-CG1 3.8Å; V232-I271 HydrophobicContact CG1-CG2 4.16Å; V236-I271 HydrophobicContact CG2-CG2 3.76Å; V239-I271 HydrophobicContact CG2-CD1 3.99Å; L267-I271 HydrophobicContact CD1-CD1 4.46Å; L267-I271 HydrophobicContact CD1-CG1 4.46Å; L267-I271 HydrophobicContact CG-CD1 4.14Å; L267-I271 VanDerWaalsContact O-CG1 3.31Å; L267-I271 WeakPolarHBondContact O-CG1 3.39Å; L267-I271 PolarHBondContact O-N 3.06Å; L268-I271 PolarHBondContact O-N 2.96Å; S269-I271 PolarHBondContact O-N 3.39Å; I271-W273 PolarHBondContact O-N 3.15Å; I271-T274 PolarHBondContact O-N 2.92Å; I271-T274 PolarHBondContact O-OG1 2.85Å; I271-H275 PolarHBondContact O-N 3.48Å
272F93.9Very high92.4Very high19 Ų1943.7 Ų43.78%0.08324%0.239CC..Hα-helixtrans-59.8-47179.6173.6-105.9000112L268 S269 H270 T274 G276 Y283 L314 P403L268-F272 WeakPolarHBondContact O-CB 3.25Å; L268-F272 PolarHBondContact O-N 2.97Å; S269-F272 PolarHBondContact O-N 3.38Å; H270-F272 VanDerWaalsContact C-N 3.35Å; H270-F272 PolarHBondContact O-N 2.9Å; F272-T274 VanDerWaalsContact C-N 3.33Å; F272-T274 PolarHBondContact O-N 3.47Å; F272-G276 WeakPolarHBondContact O-CA 3.4Å; F272-G276 PolarHBondContact O-N 3.3Å; F272-Y283 HydrophobicContact CD2-CD2 4.39Å; F272-Y283 AromaticContact CE1-CD2 3.87Å; F272-Y283 HydrophobicContact CE1-CD2 3.87Å; F272-Y283 HydrophobicContact CE1-CE2 4.27Å; F272-Y283 AromaticContact CE2-CD2 3.65Å; F272-Y283 HydrophobicContact CE2-CD2 3.65Å; F272-Y283 HydrophobicContact CE2-CG 4.02Å; F272-Y283 AromaticContact CZ-CD2 3.33Å; F272-Y283 HydrophobicContact CZ-CD2 3.33Å; F272-Y283 HydrophobicContact CZ-CE2 4.12Å; F272-Y283 AromaticContact CZ-CG 3.87Å; F272-Y283 HydrophobicContact CZ-CG 3.87Å; F272-L314 HydrophobicContact CB-CD2 4.33Å; F272-L314 HydrophobicContact CD1-CD2 4.21Å; F272-L314 HydrophobicContact CG-CD2 4.25Å; F272-P403 HydrophobicContact CE1-CB 4.25Å; F272-P403 HydrophobicContact CE1-CG 4.09Å; F272-P403 HydrophobicContact CZ-CB 4.1Å; F272-P403 HydrophobicContact CZ-CG 3.99Å
273W91.8Very high92.2Very high104 Ų10442.8 Ų42.839%0.39423%0.232SC..Hα-helixtrans-74.5-21.4-177.7-69.8116.3000114.8S269 H270 I271 L401 P403S269-W273 PolarHBondContact O-N 3.46Å; S269-W273 VanDerWaalsContact OG-CD1 3.3Å; S269-W273 PolarHBondContact OG-NE1 3.03Å; H270-W273 PolarHBondContact O-N 2.95Å; I271-W273 PolarHBondContact O-N 3.15Å; W273-L401 WeakPolarHBondContact CH2-O 3.5Å; W273-L401 WeakPolarHBondContact CZ2-O 3.37Å; W273-P403 HydrophobicContact CH2-CB 3.99Å; W273-P403 HydrophobicContact CH2-CG 4.05Å; W273-P403 HydrophobicContact CZ3-CB 3.76Å; W273-P403 HydrophobicContact CZ3-CG 4.33Å
274T91.6Very high91.9Very high66 Ų6644.2 Ų44.241%0.40524%0.24SC..Hα-helixtrans-96.8-37-177.949.90000112.7H270 I271 F272H270-T274 WeakPolarHBondContact O-CB 3.38Å; H270-T274 WeakPolarHBondContact O-CG2 3.49Å; H270-T274 PolarHBondContact O-N 3.38Å; H270-T274 VanDerWaalsContact O-N 3.1Å; H270-T274 PolarHBondContact O-OG1 3.28Å; I271-T274 PolarHBondContact O-N 2.92Å; I271-T274 PolarHBondContact O-OG1 2.85Å; F272-T274 VanDerWaalsContact C-N 3.33Å; F272-T274 PolarHBondContact O-N 3.47Å
275H89.4Confident91.7Very high33 Ų3348.4 Ų48.415%0.15326%0.259CS..Hα-helixtrans-1296.7-172-63.7-80.3000113.4V221 V232 I271 D277 L278V221-H275 PolarHBondContact O-NE2 2.94Å; V232-H275 HydrophobicContact CG2-CB 3.93Å; I271-H275 PolarHBondContact O-N 3.48Å; H275-D277 VanDerWaalsContact C-N 3.32Å; H275-D277 PolarHBondContact O-N 3.27Å; H275-L278 HydrophobicContact CB-CD1 4.02Å; H275-L278 WeakPolarHBondContact O-CB 3.34Å; H275-L278 PolarHBondContact O-N 3.16Å
276G85.8Confident91.6Very high8 Ų848.6 Ų48.68%0.08226%0.26CS..G310 helixtrans-62.2-35.7-177.400000114F272 L278 V279F272-G276 WeakPolarHBondContact O-CA 3.4Å; F272-G276 PolarHBondContact O-N 3.3Å; G276-L278 PolarHBondContact O-N 2.95Å; G276-L278 VanDerWaalsContact O-N 3.12Å; G276-V279 PolarHBondContact O-N 2.9Å; G276-V279 VanDerWaalsContact O-N 3.11Å
277D85Confident91.4Very high160 Ų16043.4 Ų43.486%0.85623%0.233SC*.G310 helixtrans-64.6-17.1179.7-60.9-27.3000113.1H275 V279H275-D277 VanDerWaalsContact C-N 3.32Å; H275-D277 PolarHBondContact O-N 3.27Å; D277-V279 VanDerWaalsContact C-N 3.27Å; D277-V279 PolarHBondContact O-N 2.99Å
278L83.4Confident91.3Very high72 Ų7246.5 Ų46.538%0.37725%0.249SC..G310 helixtrans-74.9-18177.9-56.8178.7000112.7Y227 V232 H275 G276Y227-L278 HydrophobicContact CE2-CD1 4.4Å; Y227-L278 HydrophobicContact CE2-CD2 4.15Å; V232-L278 HydrophobicContact CG2-CD1 4.33Å; H275-L278 HydrophobicContact CB-CD1 4.02Å; H275-L278 WeakPolarHBondContact O-CB 3.34Å; H275-L278 PolarHBondContact O-N 3.16Å; G276-L278 PolarHBondContact O-N 2.95Å; G276-L278 VanDerWaalsContact O-N 3.12Å
279V84.9Confident91.2Very high15 Ų1548.7 Ų48.79%0.09127%0.265CS..SBendtrans-130.5106.8-175.4-176.20000109.7V232 G276 D277 G281 L282V232-V279 HydrophobicContact CB-CG2 3.94Å; V232-V279 HydrophobicContact CG1-CG2 4.15Å; G276-V279 PolarHBondContact O-N 2.9Å; G276-V279 VanDerWaalsContact O-N 3.11Å; D277-V279 VanDerWaalsContact C-N 3.27Å; D277-V279 PolarHBondContact O-N 2.99Å; V279-G281 PolarHBondContact O-N 3.2Å; V279-L282 HydrophobicContact CB-CB 4.05Å; V279-L282 HydrophobicContact CB-CD2 4.43Å; V279-L282 HydrophobicContact CG1-CB 4.06Å; V279-L282 HydrophobicContact CG1-CD1 4.47Å; V279-L282 WeakPolarHBondContact O-CB 3.32Å; V279-L282 PolarHBondContact O-N 3Å
280S86.1Confident91.2Very high112 Ų11248 Ų4878%0.78326%0.259SS*.THydrogen-bonded Turntrans-58.6137.1175.153.80000111.7L282S280-L282 PolarHBondContact O-N 3.48Å
281G87.6Confident91.2Very high26 Ų2647 Ų4727%0.26826%0.255SS..THydrogen-bonded Turntrans708.217800000115.4V279 Y283 H284 Q285 E406V279-G281 PolarHBondContact O-N 3.2Å; G281-Y283 VanDerWaalsContact C-N 3.3Å; G281-Y283 PolarHBondContact O-N 2.95Å; G281-H284 PolarHBondContact O-N 3.25Å; G281-Q285 PolarHBondContact O-N 3.2Å; G281-E406 PolarHBondContact N-OE1 3.14Å
282L91.1Very high91.2Very high2 Ų253.9 Ų53.91%0.0129%0.285CS..Hα-helixtrans-58.8-42.9179.1-178.166000111.7V232 V236 V279 S280 H284 Q285 I286V232-L282 HydrophobicContact CG1-CD2 3.94Å; V236-L282 HydrophobicContact CB-CD1 4.5Å; V236-L282 HydrophobicContact CG1-CD1 4.24Å; V236-L282 HydrophobicContact CG2-CD1 4.31Å; V236-L282 HydrophobicContact CG2-CD2 4.35Å; V279-L282 HydrophobicContact CB-CB 4.05Å; V279-L282 HydrophobicContact CB-CD2 4.43Å; V279-L282 HydrophobicContact CG1-CB 4.06Å; V279-L282 HydrophobicContact CG1-CD1 4.47Å; V279-L282 WeakPolarHBondContact O-CB 3.32Å; V279-L282 PolarHBondContact O-N 3Å; S280-L282 PolarHBondContact O-N 3.48Å; L282-H284 VanDerWaalsContact C-N 3.35Å; L282-H284 PolarHBondContact O-N 2.81Å; L282-Q285 PolarHBondContact O-N 2.85Å; L282-I286 HydrophobicContact CD1-CD1 4.21Å; L282-I286 HydrophobicContact CD1-CG1 4.43Å; L282-I286 HydrophobicContact CD2-CD1 4.47Å; L282-I286 HydrophobicContact CG-CD1 3.88Å; L282-I286 HydrophobicContact CG-CG1 4.49Å; L282-I286 VanDerWaalsContact O-CG1 3.29Å; L282-I286 WeakPolarHBondContact O-CG1 3.49Å; L282-I286 PolarHBondContact O-N 3.26Å
283Y91.4Very high91.2Very high33 Ų3353.1 Ų53.113%0.12928%0.282CS..Hα-helixtrans-57.6-48.8177.9-174.5-115.3000111.5F272 G281 Q285 I286 L287F272-Y283 HydrophobicContact CD2-CD2 4.39Å; F272-Y283 AromaticContact CE1-CD2 3.87Å; F272-Y283 HydrophobicContact CE1-CD2 3.87Å; F272-Y283 HydrophobicContact CE1-CE2 4.27Å; F272-Y283 AromaticContact CE2-CD2 3.65Å; F272-Y283 HydrophobicContact CE2-CD2 3.65Å; F272-Y283 HydrophobicContact CE2-CG 4.02Å; F272-Y283 AromaticContact CZ-CD2 3.33Å; F272-Y283 HydrophobicContact CZ-CD2 3.33Å; F272-Y283 HydrophobicContact CZ-CE2 4.12Å; F272-Y283 AromaticContact CZ-CG 3.87Å; F272-Y283 HydrophobicContact CZ-CG 3.87Å; G281-Y283 VanDerWaalsContact C-N 3.3Å; G281-Y283 PolarHBondContact O-N 2.95Å; Y283-Q285 PolarHBondContact O-N 3.34Å; Y283-I286 PolarHBondContact O-N 2.98Å; Y283-L287 HydrophobicContact CD1-CD1 3.94Å; Y283-L287 HydrophobicContact CD1-CG 4.44Å; Y283-L287 HydrophobicContact CE1-CD1 3.36Å; Y283-L287 HydrophobicContact CE1-CG 4.12Å; Y283-L287 HydrophobicContact CE2-CD1 4.33Å; Y283-L287 HydrophobicContact CE2-CD2 4.36Å; Y283-L287 HydrophobicContact CE2-CG 4.3Å; Y283-L287 WeakPolarHBondContact O-CG 3.35Å; Y283-L287 PolarHBondContact O-N 2.75Å
284H91.5Very high91.3Very high77 Ų7748.5 Ų48.536%0.35627%0.265SS..Hα-helixtrans-62.6-43.5-180-17568.3000111.6G281 L282 I286 L287 L288 W429G281-H284 PolarHBondContact O-N 3.25Å; L282-H284 VanDerWaalsContact C-N 3.35Å; L282-H284 PolarHBondContact O-N 2.81Å; H284-I286 VanDerWaalsContact C-N 3.35Å; H284-I286 PolarHBondContact O-N 3.44Å; H284-L287 PolarHBondContact O-N 3.02Å; H284-L288 VanDerWaalsContact NE2-CD1 3.3Å; H284-L288 WeakPolarHBondContact NE2-CD1 3.33Å; H284-L288 WeakPolarHBondContact O-CB 3.48Å; H284-L288 WeakPolarHBondContact O-CG 3.07Å; H284-L288 PolarHBondContact O-N 2.79Å; H284-W429 AromaticContact CE1-CD2 3.83Å; H284-W429 AromaticContact CE1-CE2 3.61Å; H284-W429 AromaticContact CE1-NE1 3.71Å
285Q94Very high91.3Very high88 Ų8848.5 Ų48.541%0.41127%0.268SS..Hα-helixtrans-61.5-41177-172.8-179.5-5.900112.6G281 L282 Y283 S289G281-Q285 PolarHBondContact O-N 3.2Å; L282-Q285 PolarHBondContact O-N 2.85Å; Y283-Q285 PolarHBondContact O-N 3.34Å; Q285-S289 PolarHBondContact O-N 3.43Å; Q285-S289 VanDerWaalsContact O-N 3.16Å; Q285-S289 PolarHBondContact O-OG 3.28Å
286I95.4Very high91.5Very high4 Ų449.6 Ų49.62%0.02127%0.274CS..Hα-helixtrans-64.6-49.7176.2-67.1166.4000109.9V236 M240 L268 L282 Y283 H284 L288 S289 L290 L314V236-I286 HydrophobicContact CG1-CD1 4.06Å; V236-I286 HydrophobicContact CG1-CG1 4.01Å; M240-I286 HydrophobicContact CE-CG2 4.32Å; M240-I286 HydrophobicContact SD-CG2 4.32Å; L268-I286 HydrophobicContact CD1-CD1 4.09Å; L268-I286 HydrophobicContact CD2-CG2 4.05Å; L282-I286 HydrophobicContact CD1-CD1 4.21Å; L282-I286 HydrophobicContact CD1-CG1 4.43Å; L282-I286 HydrophobicContact CD2-CD1 4.47Å; L282-I286 HydrophobicContact CG-CD1 3.88Å; L282-I286 HydrophobicContact CG-CG1 4.49Å; L282-I286 VanDerWaalsContact O-CG1 3.29Å; L282-I286 WeakPolarHBondContact O-CG1 3.49Å; L282-I286 PolarHBondContact O-N 3.26Å; Y283-I286 PolarHBondContact O-N 2.98Å; H284-I286 VanDerWaalsContact C-N 3.35Å; H284-I286 PolarHBondContact O-N 3.44Å; I286-L288 PolarHBondContact O-N 3.26Å; I286-S289 WeakPolarHBondContact O-CB 3.13Å; I286-S289 PolarHBondContact O-N 3Å; I286-S289 VanDerWaalsContact O-N 3.15Å; I286-L290 HydrophobicContact CG2-CD1 3.87Å; I286-L290 HydrophobicContact CG2-CG 4.37Å; I286-L290 WeakPolarHBondContact O-CG 3.47Å; I286-L290 PolarHBondContact O-N 3.21Å; I286-L314 HydrophobicContact CG2-CD1 3.66Å
287L94.8Very high91.5Very high4 Ų453 Ų532%0.02130%0.295CS..Hα-helixtrans-59-45.2180-71.2-173000112.5Y283 H284 S289 L290 Q291 L311 L314 A318 V322Y283-L287 HydrophobicContact CD1-CD1 3.94Å; Y283-L287 HydrophobicContact CD1-CG 4.44Å; Y283-L287 HydrophobicContact CE1-CD1 3.36Å; Y283-L287 HydrophobicContact CE1-CG 4.12Å; Y283-L287 HydrophobicContact CE2-CD1 4.33Å; Y283-L287 HydrophobicContact CE2-CD2 4.36Å; Y283-L287 HydrophobicContact CE2-CG 4.3Å; Y283-L287 WeakPolarHBondContact O-CG 3.35Å; Y283-L287 PolarHBondContact O-N 2.75Å; H284-L287 PolarHBondContact O-N 3.02Å; L287-S289 VanDerWaalsContact C-N 3.28Å; L287-S289 PolarHBondContact O-N 3Å; L287-L290 PolarHBondContact O-N 3.3Å; L287-Q291 VanDerWaalsContact O-CB 3.31Å; L287-Q291 WeakPolarHBondContact O-CB 3.26Å; L287-Q291 PolarHBondContact O-N 3.01Å; L287-L311 HydrophobicContact CD2-CD2 3.75Å; L287-L314 HydrophobicContact CD2-CD1 4.07Å; L287-A318 HydrophobicContact CD2-CB 3.74Å; L287-V322 HydrophobicContact CB-CG2 4.3Å; L287-V322 HydrophobicContact CD1-CG2 4.4Å; L287-V322 HydrophobicContact CD2-CG2 4.14Å
288L95.1Very high91.8Very high71 Ų7151.6 Ų51.637%0.37229%0.292SS..Hα-helixtrans-58.2-41.5176.1-81.4172.1000112.2H284 I286 Q291 K292 W429H284-L288 VanDerWaalsContact NE2-CD1 3.3Å; H284-L288 WeakPolarHBondContact NE2-CD1 3.33Å; H284-L288 WeakPolarHBondContact O-CB 3.48Å; H284-L288 WeakPolarHBondContact O-CG 3.07Å; H284-L288 PolarHBondContact O-N 2.79Å; I286-L288 PolarHBondContact O-N 3.26Å; L288-Q291 PolarHBondContact O-N 3.22Å; L288-K292 WeakPolarHBondContact O-CB 3.49Å; L288-K292 PolarHBondContact O-N 3.38Å; L288-W429 HydrophobicContact CD2-CH2 4.33Å; L288-W429 HydrophobicContact CD2-CZ2 3.43Å; L288-W429 VanDerWaalsContact CD2-CZ2 3.43Å; L288-W429 HydrophobicContact CG-CZ2 4.04Å
289S95.4Very high92.3Very high46 Ų4651.3 Ų51.332%0.32229%0.286SS..Hα-helixtrans-66.2-42.2179.5-58.60000111.7Q285 I286 L287Q285-S289 PolarHBondContact O-N 3.43Å; Q285-S289 VanDerWaalsContact O-N 3.16Å; Q285-S289 PolarHBondContact O-OG 3.28Å; I286-S289 WeakPolarHBondContact O-CB 3.13Å; I286-S289 PolarHBondContact O-N 3Å; I286-S289 VanDerWaalsContact O-N 3.15Å; L287-S289 VanDerWaalsContact C-N 3.28Å; L287-S289 PolarHBondContact O-N 3Å
290L95.9Very high92.6Very high0 Ų053.2 Ų53.20%030%0.299CS..Hα-helixtrans-67.2-44.1176.3-61.5170.3000111.3M240 L244 I286 L287 K292 V293 L294 A307 L311 L314M240-L290 HydrophobicContact CE-CD2 3.89Å; M240-L290 HydrophobicContact CE-CG 4.09Å; M240-L290 HydrophobicContact SD-CD2 4.37Å; L244-L290 HydrophobicContact CD1-CD2 4.32Å; L244-L290 HydrophobicContact CD2-CD2 3.97Å; L244-L290 HydrophobicContact CG-CD2 4.44Å; I286-L290 HydrophobicContact CG2-CD1 3.87Å; I286-L290 HydrophobicContact CG2-CG 4.37Å; I286-L290 WeakPolarHBondContact O-CG 3.47Å; I286-L290 PolarHBondContact O-N 3.21Å; L287-L290 PolarHBondContact O-N 3.3Å; L290-K292 PolarHBondContact O-N 3.01Å; L290-V293 PolarHBondContact O-N 3.23Å; L290-L294 PolarHBondContact O-N 2.87Å; L290-A307 HydrophobicContact CD2-CB 4.48Å; L290-L311 HydrophobicContact CB-CD2 4.04Å; L290-L311 HydrophobicContact CB-CG 4.11Å; L290-L311 HydrophobicContact CD1-CD2 3.64Å; L290-L311 HydrophobicContact CD1-CG 3.89Å; L290-L311 HydrophobicContact CG-CD2 4.48Å; L290-L314 HydrophobicContact CD1-CD1 3.6Å
291Q95.4Very high93Very high44 Ų4449.1 Ų49.121%0.20627%0.268CS..Hα-helixtrans-59.1-46176.7-178.3-178.4-14.800111.7L287 L288 V293 L294 S295 V322 H326L287-Q291 VanDerWaalsContact O-CB 3.31Å; L287-Q291 WeakPolarHBondContact O-CB 3.26Å; L287-Q291 PolarHBondContact O-N 3.01Å; L288-Q291 PolarHBondContact O-N 3.22Å; Q291-V293 PolarHBondContact O-N 3.17Å; Q291-L294 PolarHBondContact O-N 3.02Å; Q291-S295 PolarHBondContact O-N 3.29Å; Q291-S295 PolarHBondContact O-OG 3.47Å; Q291-V322 HydrophobicContact CB-CG1 3.64Å; Q291-V322 HydrophobicContact CG-CG1 4.01Å; Q291-H326 PolarHBondContact NE2-NE2 3.32Å
292K95.3Very high93.2Very high147 Ų14748.4 Ų48.464%0.63926%0.258SS*.Hα-helixtrans-56.1-35.3-179.2-176.9176.9179.9177.80112.4L288 L290L288-K292 WeakPolarHBondContact O-CB 3.49Å; L288-K292 PolarHBondContact O-N 3.38Å; L290-K292 PolarHBondContact O-N 3.01Å
293V94.9Very high93.4Very high3 Ų348.3 Ų48.32%0.01826%0.258CS..Hα-helixtrans-72.3-39.9176.9175.60000111.3L244 L290 Q291 S295 D296 H304 A307L244-V293 HydrophobicContact CD1-CG2 4.09Å; L244-V293 HydrophobicContact CD2-CB 4.44Å; L244-V293 HydrophobicContact CD2-CG2 4.05Å; L244-V293 HydrophobicContact CG-CG2 4.47Å; L290-V293 PolarHBondContact O-N 3.23Å; Q291-V293 PolarHBondContact O-N 3.17Å; V293-S295 VanDerWaalsContact C-N 3.3Å; V293-S295 PolarHBondContact O-N 3.08Å; V293-D296 PolarHBondContact O-N 2.99Å; V293-H304 PolarHBondContact O-CE1 3.36Å; V293-H304 PolarHBondContact O-ND1 3.42Å; V293-A307 HydrophobicContact CB-CB 4.13Å; V293-A307 HydrophobicContact CG1-CB 4.05Å
294L92.9Very high93.6Very high8 Ų846.9 Ų46.94%0.04225%0.253CS..Hα-helixtrans-66-31.9177.1-65.5177.5000113.1L290 Q291 D296 A307 V308 L311 V322 L323L290-L294 PolarHBondContact O-N 2.87Å; Q291-L294 PolarHBondContact O-N 3.02Å; L294-D296 VanDerWaalsContact C-N 3.33Å; L294-A307 HydrophobicContact CD2-CB 3.96Å; L294-A307 HydrophobicContact CG-CB 4.07Å; L294-V308 HydrophobicContact CD2-CG2 4Å; L294-L311 HydrophobicContact CD1-CD1 3.65Å; L294-V322 HydrophobicContact CD1-CG1 4.33Å; L294-L323 HydrophobicContact CD1-CD1 3.86Å
295S92.7Very high93.9Very high66 Ų6644.4 Ų44.446%0.46224%0.24SC..THydrogen-bonded Turntrans-79.4-10.8179.8-54.70000114.5Q291 V293 P297Q291-S295 PolarHBondContact O-N 3.29Å; Q291-S295 PolarHBondContact O-OG 3.47Å; V293-S295 VanDerWaalsContact C-N 3.3Å; V293-S295 PolarHBondContact O-N 3.08Å; S295-P297 WeakPolarHBondContact O-CD 3.32Å
296D92.2Very high94Very high55 Ų5540.2 Ų40.229%0.29422%0.221SC..  trans-105.797.4-176.9-178.8-1.2000110.6V293 L294 V298 R299 H304V293-D296 PolarHBondContact O-N 2.99Å; L294-D296 VanDerWaalsContact C-N 3.33Å; D296-V298 PolarHBondContact O-N 3.12Å; D296-V298 WeakPolarHBondContact OD1-CB 3.41Å; D296-V298 PolarHBondContact OD1-N 3.43Å; D296-V298 VanDerWaalsContact OD1-N 3.15Å; D296-R299 HydrophobicContact CB-CG 3.83Å; D296-R299 WeakPolarHBondContact O-CB 3.4Å; D296-R299 PolarHBondContact O-N 3.34Å; D296-R299 VanDerWaalsContact OD2-CG 3.31Å; D296-R299 WeakPolarHBondContact OD2-CG 3.33Å; D296-R299 IonicContact OD2-NE 2.67Å; D296-H304 PolarHBondContact O-CE1 3.3Å; D296-H304 PolarHBondContact O-NE2 3.01Å
297P87.6Confident94.1Very high81 Ų8140 Ų4053%0.52622%0.22SC..THydrogen-bonded Turntrans-71-9-175.730.9-36.8000113.8S295 R299S295-P297 WeakPolarHBondContact O-CD 3.32Å; P297-R299 VanDerWaalsContact C-N 3.35Å
298V90.9Very high94.2Very high130 Ų13039.9 Ų39.979%0.78822%0.219SC*.THydrogen-bonded Turntrans-84.1-16.8179.4-1740000111.1D296D296-V298 PolarHBondContact O-N 3.12Å; D296-V298 WeakPolarHBondContact OD1-CB 3.41Å; D296-V298 PolarHBondContact OD1-N 3.43Å; D296-V298 VanDerWaalsContact OD1-N 3.15Å
299R92.4Very high94.3Very high66 Ų6637.3 Ų37.325%0.24921%0.206CC..SBendtrans-64.4148.7176.6-72.1-91.5-174.8146.9-6.2110.7E245 D296 P297 H304E245-R299 IonicContact OE1-NH1 3.42Å; D296-R299 HydrophobicContact CB-CG 3.83Å; D296-R299 WeakPolarHBondContact O-CB 3.4Å; D296-R299 PolarHBondContact O-N 3.34Å; D296-R299 VanDerWaalsContact OD2-CG 3.31Å; D296-R299 WeakPolarHBondContact OD2-CG 3.33Å; D296-R299 IonicContact OD2-NE 2.67Å; P297-R299 VanDerWaalsContact C-N 3.35Å; R299-H304 PolarHBondContact O-CD2 3.18Å; R299-H304 PolarHBondContact O-NE2 2.99Å
300P92.7Very high94.4Very high55 Ų5535.1 Ų35.136%0.35719%0.191SC..  trans-68.3150.2177.326-30.7000111.7P246 C302 S303 H304P246-P300 HydrophobicContact CB-CG 3.89Å; P246-P300 HydrophobicContact CG-CG 4.34Å; P300-C302 PolarHBondContact O-N 3.15Å; P300-C302 VanDerWaalsContact O-N 3.13Å; P300-S303 VanDerWaalsContact O-CB 3.31Å; P300-S303 WeakPolarHBondContact O-CB 3.45Å; P300-S303 PolarHBondContact O-N 2.83Å; P300-H304 PolarHBondContact O-CD2 3.39Å; P300-H304 VanDerWaalsContact O-CD2 3.31Å; P300-H304 PolarHBondContact O-N 3Å
301L93.3Very high94.5Very high26 Ų2635.1 Ų35.114%0.13619%0.191CC..Hα-helixtrans-58.3-29.3-177.3-68.4170.4000113.5S303 H304 Y305 V337 V348 D351 V355L301-S303 VanDerWaalsContact C-N 3.31Å; L301-S303 PolarHBondContact O-N 2.84Å; L301-H304 PolarHBondContact O-N 3.35Å; L301-Y305 WeakPolarHBondContact O-CB 3.41Å; L301-Y305 PolarHBondContact O-N 3.29Å; L301-V337 HydrophobicContact CD1-CG1 4.16Å; L301-V348 HydrophobicContact CD1-CG1 3.7Å; L301-V348 WeakPolarHBondContact CD1-O 3.49Å; L301-D351 HydrophobicContact CB-CB 4.05Å; L301-D351 HydrophobicContact CD1-CB 3.96Å; L301-V355 HydrophobicContact CB-CG2 4.14Å; L301-V355 HydrophobicContact CD2-CG2 4.36Å; L301-V355 WeakPolarHBondContact O-CG2 3.28Å
302C93.2Very high94.5Very high10 Ų1034.8 Ų34.87%0.06819%0.189CC..Hα-helixtrans-64.3-33.6174.766.30000112.9W258 R261 P300 G306W258-C302 HydrophobicContact CH2-CB 4.15Å; W258-C302 HydrophobicContact CZ3-CB 4.28Å; R261-C302 WeakPolarHBondContact CD-O 3.41Å; R261-C302 PolarHBondContact NE-O 3.5Å; R261-C302 PolarHBondContact NH1-O 3Å; P300-C302 PolarHBondContact O-N 3.15Å; P300-C302 VanDerWaalsContact O-N 3.13Å; C302-G306 PolarHBondContact O-N 3.5Å; C302-G306 VanDerWaalsContact O-N 3.11Å
303S95.3Very high94.5Very high0 Ų028.5 Ų28.50%016%0.164CC..Hα-helixtrans-69.1-42.4172.9-65.30000111.3L244 P300 L301 G306 A307L244-S303 WeakPolarHBondContact O-CB 3.41Å; L244-S303 PolarHBondContact O-OG 2.84Å; P300-S303 VanDerWaalsContact O-CB 3.31Å; P300-S303 WeakPolarHBondContact O-CB 3.45Å; P300-S303 PolarHBondContact O-N 2.83Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-S303 PolarHBondContact O-N 2.84Å; S303-G306 PolarHBondContact O-N 3.43Å; S303-A307 PolarHBondContact O-N 2.85Å
304H95.9Very high94.5Very high4 Ų428.6 Ų28.62%0.01917%0.165CC..Hα-helixtrans-63.5-43.6175.7-67.2-76.4000112V293 D296 R299 P300 L301 G306 A307 V308 Y330V293-H304 PolarHBondContact O-CE1 3.36Å; V293-H304 PolarHBondContact O-ND1 3.42Å; D296-H304 PolarHBondContact O-CE1 3.3Å; D296-H304 PolarHBondContact O-NE2 3.01Å; R299-H304 PolarHBondContact O-CD2 3.18Å; R299-H304 PolarHBondContact O-NE2 2.99Å; P300-H304 PolarHBondContact O-CD2 3.39Å; P300-H304 VanDerWaalsContact O-CD2 3.31Å; P300-H304 PolarHBondContact O-N 3Å; L301-H304 PolarHBondContact O-N 3.35Å; H304-G306 VanDerWaalsContact C-N 3.33Å; H304-G306 PolarHBondContact O-N 3.01Å; H304-A307 WeakPolarHBondContact O-CB 3.45Å; H304-A307 PolarHBondContact O-N 3.41Å; H304-A307 VanDerWaalsContact O-N 3.16Å; H304-V308 WeakPolarHBondContact O-CG2 3.37Å; H304-V308 PolarHBondContact O-N 3.49Å; H304-Y330 HydrophobicContact CB-CE2 4.48Å; H304-Y330 WeakPolarHBondContact CB-OH 3.5Å; H304-Y330 AromaticContact CE1-CE2 3.74Å; H304-Y330 AromaticContact CG-CE2 3.93Å; H304-Y330 AromaticContact ND1-CE2 3.4Å; H304-Y330 WeakPolarHBondContact ND1-CE2 2.96Å; H304-Y330 AromaticContact ND1-CZ 3.9Å
305Y96.9Very high94.5Very high24 Ų2429.2 Ų29.29%0.09417%0.173CC..Hα-helixtrans-54.2-50.8172.8177.9-90.6000111.1W258 R261 D262 L301 A307 V308 V309 K354 A358W258-Y305 AromaticContact CE3-CD1 3.59Å; W258-Y305 HydrophobicContact CE3-CD1 3.59Å; W258-Y305 AromaticContact CE3-CD2 3.94Å; W258-Y305 HydrophobicContact CE3-CD2 3.94Å; W258-Y305 AromaticContact CE3-CE1 3.9Å; W258-Y305 HydrophobicContact CE3-CE1 3.9Å; W258-Y305 HydrophobicContact CE3-CE2 4.2Å; W258-Y305 AromaticContact CE3-CG 3.62Å; W258-Y305 HydrophobicContact CE3-CG 3.62Å; W258-Y305 AromaticContact CZ3-CD1 3.95Å; W258-Y305 HydrophobicContact CZ3-CD1 3.95Å; W258-Y305 AromaticContact CZ3-CD2 3.94Å; W258-Y305 HydrophobicContact CZ3-CD2 3.94Å; W258-Y305 AromaticContact CZ3-CG 3.56Å; W258-Y305 HydrophobicContact CZ3-CG 3.56Å; R261-Y305 HydrophobicContact CB-CD1 4.36Å; R261-Y305 HydrophobicContact CB-CE1 4.29Å; D262-Y305 WeakPolarHBondContact OD1-CE1 3.13Å; D262-Y305 PolarHBondContact OD1-OH 3.39Å; D262-Y305 PolarHBondContact OD2-OH 3.36Å; L301-Y305 WeakPolarHBondContact O-CB 3.41Å; L301-Y305 PolarHBondContact O-N 3.29Å; Y305-A307 VanDerWaalsContact C-N 3.3Å; Y305-A307 PolarHBondContact O-N 2.69Å; Y305-V308 PolarHBondContact O-N 2.98Å; Y305-V309 HydrophobicContact CD1-CG2 4.05Å; Y305-V309 HydrophobicContact CD2-CG2 4.44Å; Y305-V309 HydrophobicContact CE1-CG2 3.62Å; Y305-V309 HydrophobicContact CE2-CG2 4.07Å; Y305-V309 HydrophobicContact CG-CG2 4.44Å; Y305-V309 WeakPolarHBondContact O-CG2 3.41Å; Y305-V309 PolarHBondContact O-N 3.41Å; Y305-K354 HydrophobicContact CD2-CB 4.16Å; Y305-K354 HydrophobicContact CE2-CB 4.34Å; Y305-A358 HydrophobicContact CD2-CB 3.87Å; Y305-A358 HydrophobicContact CE2-CB 3.74Å
306G96.6Very high94.5Very high0 Ų027.5 Ų27.50%016%0.157CC..Hα-helixtrans-59.2-39.5177.600000113.2I243 C302 S303 H304 G310I243-G306 WeakPolarHBondContact CG2-O 3.37Å; I243-G306 WeakPolarHBondContact O-CA 3.49Å; C302-G306 PolarHBondContact O-N 3.5Å; C302-G306 VanDerWaalsContact O-N 3.11Å; S303-G306 PolarHBondContact O-N 3.43Å; H304-G306 VanDerWaalsContact C-N 3.33Å; H304-G306 PolarHBondContact O-N 3.01Å; G306-G310 PolarHBondContact O-N 3.43Å
307A97.2Very high94.5Very high0 Ų028.1 Ų28.10%016%0.157CC..Hα-helixtrans-62.3-44.9175.600000112.1L244 L290 V293 L294 S303 H304 Y305 G310 L311L244-A307 HydrophobicContact CD2-CB 3.92Å; L290-A307 HydrophobicContact CD2-CB 4.48Å; V293-A307 HydrophobicContact CB-CB 4.13Å; V293-A307 HydrophobicContact CG1-CB 4.05Å; L294-A307 HydrophobicContact CD2-CB 3.96Å; L294-A307 HydrophobicContact CG-CB 4.07Å; S303-A307 PolarHBondContact O-N 2.85Å; H304-A307 WeakPolarHBondContact O-CB 3.45Å; H304-A307 PolarHBondContact O-N 3.41Å; H304-A307 VanDerWaalsContact O-N 3.16Å; Y305-A307 VanDerWaalsContact C-N 3.3Å; Y305-A307 PolarHBondContact O-N 2.69Å; A307-G310 PolarHBondContact O-N 2.94Å; A307-L311 WeakPolarHBondContact O-CG 3.48Å; A307-L311 PolarHBondContact O-N 3.23Å
308V97.4Very high94.8Very high1 Ų124.3 Ų24.31%0.00613%0.132CC..Hα-helixtrans-65-47.9178.3175.70000111.5L294 H304 Y305 G310 L311 H312 L323 A358 I359 A362L294-V308 HydrophobicContact CD2-CG2 4Å; H304-V308 WeakPolarHBondContact O-CG2 3.37Å; H304-V308 PolarHBondContact O-N 3.49Å; Y305-V308 PolarHBondContact O-N 2.98Å; V308-G310 VanDerWaalsContact C-N 3.32Å; V308-G310 PolarHBondContact O-N 2.99Å; V308-L311 PolarHBondContact O-N 2.86Å; V308-H312 WeakPolarHBondContact O-CB 3.49Å; V308-H312 PolarHBondContact O-N 3.24Å; V308-L323 HydrophobicContact CG1-CD2 4.29Å; V308-L323 HydrophobicContact CG2-CD1 4.14Å; V308-A358 HydrophobicContact CB-CB 4.46Å; V308-A358 HydrophobicContact CG1-CB 3.92Å; V308-I359 HydrophobicContact CB-CG1 4.44Å; V308-I359 HydrophobicContact CG1-CB 4.5Å; V308-I359 HydrophobicContact CG1-CG1 3.83Å; V308-I359 HydrophobicContact CG2-CD1 4.38Å; V308-I359 HydrophobicContact CG2-CG1 3.77Å; V308-A362 HydrophobicContact CG1-CB 4.31Å
309V97.4Very high95Very high18 Ų1818.2 Ų18.211%0.10910%0.095CC..Hα-helixtrans-67-36.1179.4-178.90000111.2A265 Y305 H312 A313 A358A265-V309 HydrophobicContact CB-CB 4.4Å; A265-V309 HydrophobicContact CB-CG1 3.7Å; Y305-V309 HydrophobicContact CD1-CG2 4.05Å; Y305-V309 HydrophobicContact CD2-CG2 4.44Å; Y305-V309 HydrophobicContact CE1-CG2 3.62Å; Y305-V309 HydrophobicContact CE2-CG2 4.07Å; Y305-V309 HydrophobicContact CG-CG2 4.44Å; Y305-V309 WeakPolarHBondContact O-CG2 3.41Å; Y305-V309 PolarHBondContact O-N 3.41Å; V309-H312 WeakPolarHBondContact O-CB 3.42Å; V309-H312 PolarHBondContact O-N 3.24Å; V309-A313 WeakPolarHBondContact O-CB 3.4Å; V309-A313 PolarHBondContact O-N 2.88Å; V309-A358 HydrophobicContact CG2-CB 4.04Å
310G97.1Very high95Very high0 Ų016 Ų160%09%0.088CC..Hα-helixtrans-58.2-49.1171.200000112.5G306 A307 V308 H312 A313 L314G306-G310 PolarHBondContact O-N 3.43Å; A307-G310 PolarHBondContact O-N 2.94Å; V308-G310 VanDerWaalsContact C-N 3.32Å; V308-G310 PolarHBondContact O-N 2.99Å; G310-H312 PolarHBondContact O-N 2.97Å; G310-A313 PolarHBondContact O-N 3.4Å; G310-L314 WeakPolarHBondContact O-CG 3.32Å; G310-L314 PolarHBondContact O-N 3.18Å; G310-L314 VanDerWaalsContact O-N 3.1Å
311L96.8Very high95Very high0 Ų018.9 Ų18.90%09%0.091CC..Hα-helixtrans-62.2-42.4175.4-71171.5000111.9L287 L290 L294 A307 V308 A313 L314 G315 A318 V319 V322 L323L287-L311 HydrophobicContact CD2-CD2 3.75Å; L290-L311 HydrophobicContact CB-CD2 4.04Å; L290-L311 HydrophobicContact CB-CG 4.11Å; L290-L311 HydrophobicContact CD1-CD2 3.64Å; L290-L311 HydrophobicContact CD1-CG 3.89Å; L290-L311 HydrophobicContact CG-CD2 4.48Å; L294-L311 HydrophobicContact CD1-CD1 3.65Å; A307-L311 WeakPolarHBondContact O-CG 3.48Å; A307-L311 PolarHBondContact O-N 3.23Å; V308-L311 PolarHBondContact O-N 2.86Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 3.26Å; L311-L314 PolarHBondContact O-N 3.35Å; L311-G315 PolarHBondContact O-N 3.06Å; L311-A318 HydrophobicContact CD2-CB 4.15Å; L311-V319 HydrophobicContact CB-CG2 4.33Å; L311-V322 HydrophobicContact CD1-CB 4.05Å; L311-V322 HydrophobicContact CD1-CG1 3.83Å; L311-V322 HydrophobicContact CD2-CB 3.92Å; L311-V322 HydrophobicContact CD2-CG1 4.16Å; L311-V322 HydrophobicContact CD2-CG2 4.19Å; L311-L323 HydrophobicContact CD1-CB 4.11Å
312H96.4Very high95Very high37 Ų3717.6 Ų17.617%0.1719%0.085CC..Hα-helixtrans-58.9-44176.2179.879.9000112.1V308 V309 G310 G315 A362 R365V308-H312 WeakPolarHBondContact O-CB 3.49Å; V308-H312 PolarHBondContact O-N 3.24Å; V309-H312 WeakPolarHBondContact O-CB 3.42Å; V309-H312 PolarHBondContact O-N 3.24Å; G310-H312 PolarHBondContact O-N 2.97Å; H312-G315 PolarHBondContact O-N 3.37Å; H312-A362 HydrophobicContact CB-CB 4.21Å; H312-A362 WeakPolarHBondContact ND1-CA 3.22Å; H312-R365 WeakPolarHBondContact CE1-CD 3.41Å; H312-R365 PolarHBondContact NE2-NH1 2.93Å
313A95.9Very high95Very high14 Ų1417.3 Ų17.312%0.1168%0.082CC..Hα-helixtrans-69.2-33.6-178.900000112.8A265 L266 S269 V309 G310 L311 G315A265-A313 HydrophobicContact CB-CB 4.06Å; A265-A313 VanDerWaalsContact O-CB 3.31Å; A265-A313 WeakPolarHBondContact O-CB 3.28Å; L266-A313 HydrophobicContact CD2-CB 4.47Å; S269-A313 VanDerWaalsContact CB-O 3.25Å; S269-A313 WeakPolarHBondContact CB-O 3.33Å; S269-A313 PolarHBondContact OG-O 3.1Å; V309-A313 WeakPolarHBondContact O-CB 3.4Å; V309-A313 PolarHBondContact O-N 2.88Å; G310-A313 PolarHBondContact O-N 3.4Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 3.26Å; A313-G315 VanDerWaalsContact C-N 3.33Å
314L94.5Very high95Very high6 Ų617.8 Ų17.83%0.0319%0.085CC..Hα-helixtrans-68.5-32.1175.2-69.9169000112.4F272 I286 L287 L290 G310 L311 A318F272-L314 HydrophobicContact CB-CD2 4.33Å; F272-L314 HydrophobicContact CD1-CD2 4.21Å; F272-L314 HydrophobicContact CG-CD2 4.25Å; I286-L314 HydrophobicContact CG2-CD1 3.66Å; L287-L314 HydrophobicContact CD2-CD1 4.07Å; L290-L314 HydrophobicContact CD1-CD1 3.6Å; G310-L314 WeakPolarHBondContact O-CG 3.32Å; G310-L314 PolarHBondContact O-N 3.18Å; G310-L314 VanDerWaalsContact O-N 3.1Å; L311-L314 PolarHBondContact O-N 3.35Å; L314-A318 HydrophobicContact CB-CB 3.97Å
315G92.6Very high94.8Very high21 Ų2120 Ų2022%0.21610%0.099CC..  trans131.1170.417000000114.2L311 H312 A313 K317 A318 V319L311-G315 PolarHBondContact O-N 3.06Å; H312-G315 PolarHBondContact O-N 3.37Å; A313-G315 VanDerWaalsContact C-N 3.33Å; G315-K317 VanDerWaalsContact C-N 3.28Å; G315-K317 PolarHBondContact O-N 3.34Å; G315-A318 WeakPolarHBondContact O-CB 3.46Å; G315-A318 PolarHBondContact O-N 3.07Å; G315-V319 PolarHBondContact O-N 3.2Å
316W92.6Very high94.5Very high29 Ų2921.3 Ų21.311%0.1111%0.106CC..Hα-helixtrans-60.5-32.4-171.967.8-88.8000114.1A318 V319 E320 L366 M369 K370W316-A318 VanDerWaalsContact C-N 3.31Å; W316-A318 PolarHBondContact O-N 3.35Å; W316-V319 WeakPolarHBondContact O-CB 3.21Å; W316-V319 PolarHBondContact O-N 3.38Å; W316-E320 VanDerWaalsContact CZ3-OE2 3.25Å; W316-E320 WeakPolarHBondContact CZ3-OE2 3.48Å; W316-E320 WeakPolarHBondContact O-CB 3.34Å; W316-E320 PolarHBondContact O-N 2.97Å; W316-L366 HydrophobicContact CB-CD1 4.37Å; W316-L366 HydrophobicContact CE3-CD1 3.9Å; W316-M369 HydrophobicContact CB-CB 3.93Å; W316-M369 HydrophobicContact CB-CG 4.3Å; W316-M369 HydrophobicContact CD2-CB 3.98Å; W316-M369 HydrophobicContact CG-CB 3.55Å; W316-M369 HydrophobicContact CG-CG 4.18Å; W316-K370 HydrophobicContact CE3-CB 4.41Å; W316-K370 HydrophobicContact CZ3-CB 4.15Å; W316-K370 HydrophobicContact CZ3-CG 4.23Å
317K91.3Very high94.3Very high68 Ų6821.4 Ų21.430%0.29611%0.106SC..Hα-helixtrans-67.4-30175-69.2-171.3179.6164.60113.1G315 R321 S402G315-K317 VanDerWaalsContact C-N 3.28Å; G315-K317 PolarHBondContact O-N 3.34Å; K317-R321 WeakPolarHBondContact O-CB 3.45Å; K317-R321 WeakPolarHBondContact O-CD 3.37Å; K317-R321 WeakPolarHBondContact O-CG 3.46Å; K317-R321 PolarHBondContact O-N 2.94Å; K317-S402 VanDerWaalsContact CD-OG 3.22Å; K317-S402 WeakPolarHBondContact CD-OG 3.45Å; K317-S402 WeakPolarHBondContact CE-OG 3.46Å; K317-S402 PolarHBondContact NZ-OG 3.04Å
318A94Very high94Very high1 Ų123.9 Ų23.91%0.00812%0.123CC..Hα-helixtrans-69.3-41.9173.700000110.4L287 L311 L314 G315 W316 R321 V322L287-A318 HydrophobicContact CD2-CB 3.74Å; L311-A318 HydrophobicContact CD2-CB 4.15Å; L314-A318 HydrophobicContact CB-CB 3.97Å; G315-A318 WeakPolarHBondContact O-CB 3.46Å; G315-A318 PolarHBondContact O-N 3.07Å; W316-A318 VanDerWaalsContact C-N 3.31Å; W316-A318 PolarHBondContact O-N 3.35Å; A318-R321 PolarHBondContact O-N 3.21Å; A318-V322 WeakPolarHBondContact O-CB 3.41Å; A318-V322 PolarHBondContact O-N 3.02Å
319V95.4Very high93.7Very high2 Ų227.2 Ų27.21%0.01215%0.15CC..Iπ-helixtrans-62.2-45.8174.3-177.50000111.1L311 G315 W316 L323 Y324 A362 L366L311-V319 HydrophobicContact CB-CG2 4.33Å; G315-V319 PolarHBondContact O-N 3.2Å; W316-V319 WeakPolarHBondContact O-CB 3.21Å; W316-V319 PolarHBondContact O-N 3.38Å; V319-L323 HydrophobicContact CG1-CB 3.9Å; V319-L323 HydrophobicContact CG1-CD2 3.77Å; V319-L323 HydrophobicContact CG1-CG 4.39Å; V319-L323 WeakPolarHBondContact O-CA 3.34Å; V319-L323 WeakPolarHBondContact O-CB 3.39Å; V319-L323 PolarHBondContact O-N 3.5Å; V319-Y324 PolarHBondContact O-N 3.01Å; V319-A362 HydrophobicContact CG1-CB 4.16Å; V319-A362 HydrophobicContact CG2-CB 4.3Å; V319-L366 HydrophobicContact CG1-CB 4.25Å; V319-L366 HydrophobicContact CG1-CD2 4.15Å
320E93.3Very high93.5Very high20 Ų2027 Ų279%0.09315%0.148CC..Iπ-helixtrans-61.3-44.8177.9-170.8175.4-157.600112.5W316 P325 L366 K370 W432 M440W316-E320 VanDerWaalsContact CZ3-OE2 3.25Å; W316-E320 WeakPolarHBondContact CZ3-OE2 3.48Å; W316-E320 WeakPolarHBondContact O-CB 3.34Å; W316-E320 PolarHBondContact O-N 2.97Å; E320-P325 VanDerWaalsContact O-CD 3.22Å; E320-P325 WeakPolarHBondContact O-CD 3.44Å; E320-L366 HydrophobicContact CB-CD1 3.7Å; E320-L366 HydrophobicContact CG-CD1 4.23Å; E320-K370 WeakPolarHBondContact OE1-CE 3.5Å; E320-K370 IonicContact OE1-NZ 3.9Å; E320-K370 PolarHBondContact OE1-NZ 3.46Å; E320-W432 HydrophobicContact CG-CH2 3.91Å; E320-W432 HydrophobicContact CG-CZ3 3.78Å; E320-W432 VanDerWaalsContact O-CH2 3.31Å; E320-W432 WeakPolarHBondContact O-CH2 3.31Å; E320-M440 HydrophobicContact CG-CE 4.38Å
321R91.3Very high93.3Very high115 Ų11528.4 Ų28.443%0.43415%0.153SC..Iπ-helixtrans-78.3-32-175.5-70.3173.5-173.3163-0.8113.8K317 A318 P325K317-R321 WeakPolarHBondContact O-CB 3.45Å; K317-R321 WeakPolarHBondContact O-CD 3.37Å; K317-R321 WeakPolarHBondContact O-CG 3.46Å; K317-R321 PolarHBondContact O-N 2.94Å; A318-R321 PolarHBondContact O-N 3.21Å; R321-P325 VanDerWaalsContact O-CG 3.23Å; R321-P325 WeakPolarHBondContact O-CG 3.31Å
322V94Very high93Very high0 Ų031.3 Ų31.30%018%0.177CC..Iπ-helixtrans-110.5-59.7-174-177.70000111L287 Q291 L294 L311 A318 H326L287-V322 HydrophobicContact CB-CG2 4.3Å; L287-V322 HydrophobicContact CD1-CG2 4.4Å; L287-V322 HydrophobicContact CD2-CG2 4.14Å; Q291-V322 HydrophobicContact CB-CG1 3.64Å; Q291-V322 HydrophobicContact CG-CG1 4.01Å; L294-V322 HydrophobicContact CD1-CG1 4.33Å; L311-V322 HydrophobicContact CD1-CB 4.05Å; L311-V322 HydrophobicContact CD1-CG1 3.83Å; L311-V322 HydrophobicContact CD2-CB 3.92Å; L311-V322 HydrophobicContact CD2-CG1 4.16Å; L311-V322 HydrophobicContact CD2-CG2 4.19Å; A318-V322 WeakPolarHBondContact O-CB 3.41Å; A318-V322 PolarHBondContact O-N 3.02Å; V322-H326 PolarHBondContact O-CD2 3.25Å
323L94.1Very high92.7Very high3 Ų333.5 Ų33.52%0.01619%0.19CC..Iπ-helixtrans-65.6-48.4-172.3-174.963.3000111.9L294 V308 L311 V319 H326 L327 I359 A362L294-L323 HydrophobicContact CD1-CD1 3.86Å; V308-L323 HydrophobicContact CG1-CD2 4.29Å; V308-L323 HydrophobicContact CG2-CD1 4.14Å; L311-L323 HydrophobicContact CD1-CB 4.11Å; V319-L323 HydrophobicContact CG1-CB 3.9Å; V319-L323 HydrophobicContact CG1-CD2 3.77Å; V319-L323 HydrophobicContact CG1-CG 4.39Å; V319-L323 WeakPolarHBondContact O-CA 3.34Å; V319-L323 WeakPolarHBondContact O-CB 3.39Å; V319-L323 PolarHBondContact O-N 3.5Å; L323-H326 PolarHBondContact O-N 3.17Å; L323-L327 WeakPolarHBondContact O-CB 3.46Å; L323-L327 PolarHBondContact O-N 3.43Å; L323-I359 HydrophobicContact CD2-CG2 4.3Å; L323-A362 HydrophobicContact CD2-CB 4.04Å
324Y93.4Very high92.6Very high11 Ų1133 Ų334%0.04319%0.185CC..Hα-helixtrans-59.2-51.5-174.1175.7-104.1000113.9V319 H326 L327 P328 W432 V435 M440 E443 L444V319-Y324 PolarHBondContact O-N 3.01Å; Y324-H326 VanDerWaalsContact C-N 3.29Å; Y324-H326 PolarHBondContact O-N 3.46Å; Y324-L327 VanDerWaalsContact O-CB 3.29Å; Y324-L327 WeakPolarHBondContact O-CB 3.31Å; Y324-L327 PolarHBondContact O-N 3.14Å; Y324-L327 VanDerWaalsContact O-N 3.16Å; Y324-P328 WeakPolarHBondContact O-CD 3.26Å; Y324-W432 AromaticContact CD1-CH2 3.57Å; Y324-W432 HydrophobicContact CD1-CH2 3.57Å; Y324-W432 AromaticContact CD1-CZ2 3.63Å; Y324-W432 HydrophobicContact CD1-CZ2 3.63Å; Y324-W432 AromaticContact CE1-CH2 3.99Å; Y324-W432 HydrophobicContact CE1-CH2 3.99Å; Y324-W432 HydrophobicContact CE1-CZ2 4.13Å; Y324-V435 HydrophobicContact CE1-CB 4.42Å; Y324-V435 HydrophobicContact CE1-CG2 4.03Å; Y324-M440 HydrophobicContact CD1-CE 4.2Å; Y324-M440 HydrophobicContact CD2-CG 4.29Å; Y324-M440 HydrophobicContact CE1-CE 3.88Å; Y324-M440 HydrophobicContact CE2-CB 4.46Å; Y324-M440 HydrophobicContact CE2-CE 4.4Å; Y324-M440 HydrophobicContact CE2-CG 3.7Å; Y324-E443 VanDerWaalsContact CZ-OE2 3.25Å; Y324-E443 PolarHBondContact OH-OE2 2.86Å; Y324-L444 HydrophobicContact CD2-CD1 4.45Å; Y324-L444 HydrophobicContact CD2-CD2 4.05Å; Y324-L444 HydrophobicContact CD2-CG 4.32Å; Y324-L444 HydrophobicContact CE2-CD1 4.39Å; Y324-L444 HydrophobicContact CE2-CD2 4.26Å; Y324-L444 HydrophobicContact CE2-CG 4.12Å
325P92.1Very high92.5Very high50 Ų5036.5 Ų36.533%0.32520%0.202SC..Hα-helixtrans-67.8-24.1179.221.2-29.4000114.4E320 R321 W432E320-P325 VanDerWaalsContact O-CD 3.22Å; E320-P325 WeakPolarHBondContact O-CD 3.44Å; R321-P325 VanDerWaalsContact O-CG 3.23Å; R321-P325 WeakPolarHBondContact O-CG 3.31Å; P325-W432 HydrophobicContact CB-CZ2 4.07Å; P325-W432 HydrophobicContact CG-CZ2 3.85Å
326H91.1Very high92.4Very high52 Ų5238.7 Ų38.724%0.24122%0.217CC..Hα-helixtrans-87.2-12.9175.4-74.3-71000113.1Q291 V322 L323 Y324 A329 Y330Q291-H326 PolarHBondContact NE2-NE2 3.32Å; V322-H326 PolarHBondContact O-CD2 3.25Å; L323-H326 PolarHBondContact O-N 3.17Å; Y324-H326 VanDerWaalsContact C-N 3.29Å; Y324-H326 PolarHBondContact O-N 3.46Å; H326-A329 PolarHBondContact O-N 3.25Å; H326-Y330 WeakPolarHBondContact O-CB 3.16Å; H326-Y330 PolarHBondContact O-N 3.43Å
327L92.1Very high92.3Very high1 Ų139 Ų391%0.00522%0.223CC..Hα-helixtrans-61.1-42.6-173.4-168.567.4000113.5L323 Y324 A329 Y330 W331 I359 L444 F447 F448L323-L327 WeakPolarHBondContact O-CB 3.46Å; L323-L327 PolarHBondContact O-N 3.43Å; Y324-L327 VanDerWaalsContact O-CB 3.29Å; Y324-L327 WeakPolarHBondContact O-CB 3.31Å; Y324-L327 PolarHBondContact O-N 3.14Å; Y324-L327 VanDerWaalsContact O-N 3.16Å; L327-A329 PolarHBondContact O-N 3.37Å; L327-Y330 PolarHBondContact O-N 3.11Å; L327-W331 WeakPolarHBondContact O-CA 3.47Å; L327-W331 WeakPolarHBondContact O-CB 3.28Å; L327-W331 PolarHBondContact O-N 2.86Å; L327-I359 HydrophobicContact CD1-CD1 4.46Å; L327-I359 HydrophobicContact CD1-CG2 3.86Å; L327-L444 HydrophobicContact CD2-CD2 3.5Å; L327-F447 HydrophobicContact CD2-CD2 3.91Å; L327-F447 HydrophobicContact CD2-CE2 4.24Å; L327-F447 HydrophobicContact CG-CD2 4.4Å; L327-F448 HydrophobicContact CD1-CZ 4.39Å; L327-F448 HydrophobicContact CD2-CE2 3.88Å; L327-F448 HydrophobicContact CD2-CZ 4.06Å
328P91.2Very high92.3Very high53 Ų5336.8 Ų36.834%0.34421%0.214SC..Hα-helixtrans-60.6-43-178.8-24.634.6000113.2Y324 F447Y324-P328 WeakPolarHBondContact O-CD 3.26Å; P328-F447 HydrophobicContact CB-CZ 4.01Å; P328-F447 HydrophobicContact CG-CE2 4.43Å; P328-F447 HydrophobicContact CG-CZ 3.95Å
329A91.4Very high92.2Very high71 Ų7140.7 Ų40.759%0.58724%0.235SC*.Hα-helixtrans-71-39.817800000111.8H326 L327H326-A329 PolarHBondContact O-N 3.25Å; L327-A329 PolarHBondContact O-N 3.37Å
330Y92.7Very high91.9Very high14 Ų1443.1 Ų43.16%0.05525%0.247CC..Hα-helixtrans-69.2-37.1178.5-173.1-103.4000112.5H304 H326 L327 A332 N333 L334 V355 I359H304-Y330 HydrophobicContact CB-CE2 4.48Å; H304-Y330 WeakPolarHBondContact CB-OH 3.5Å; H304-Y330 AromaticContact CE1-CE2 3.74Å; H304-Y330 AromaticContact CG-CE2 3.93Å; H304-Y330 AromaticContact ND1-CE2 3.4Å; H304-Y330 WeakPolarHBondContact ND1-CE2 2.96Å; H304-Y330 AromaticContact ND1-CZ 3.9Å; H326-Y330 WeakPolarHBondContact O-CB 3.16Å; H326-Y330 PolarHBondContact O-N 3.43Å; L327-Y330 PolarHBondContact O-N 3.11Å; Y330-A332 PolarHBondContact O-N 2.66Å; Y330-N333 PolarHBondContact O-N 3.22Å; Y330-L334 HydrophobicContact CE1-CB 4.24Å; Y330-L334 HydrophobicContact CE1-CD2 4.15Å; Y330-L334 PolarHBondContact O-N 3.48Å; Y330-V355 HydrophobicContact CE1-CG1 4.13Å; Y330-I359 HydrophobicContact CD1-CD1 4.08Å; Y330-I359 HydrophobicContact CE1-CD1 3.76Å
331W92.8Very high91.4Very high29 Ų2951.4 Ų51.411%0.1128%0.279CS..Hα-helixtrans-60.7-43.4-177.1178.7-100.7000112.3L327 N333 L334 Q335 Y356 F447 F448L327-W331 WeakPolarHBondContact O-CA 3.47Å; L327-W331 WeakPolarHBondContact O-CB 3.28Å; L327-W331 PolarHBondContact O-N 2.86Å; W331-N333 VanDerWaalsContact C-N 3.26Å; W331-N333 PolarHBondContact O-N 3.42Å; W331-L334 HydrophobicContact CE3-CD2 4.44Å; W331-L334 HydrophobicContact CZ3-CD2 4.32Å; W331-L334 PolarHBondContact O-N 3.49Å; W331-Q335 VanDerWaalsContact O-CB 3.25Å; W331-Q335 WeakPolarHBondContact O-CB 3.41Å; W331-Q335 PolarHBondContact O-N 2.86Å; W331-Y356 AromaticContact CH2-CD2 3.92Å; W331-Y356 HydrophobicContact CH2-CD2 3.92Å; W331-Y356 AromaticContact CH2-CE2 3.62Å; W331-Y356 HydrophobicContact CH2-CE2 3.62Å; W331-Y356 AromaticContact CZ3-CD2 3.74Å; W331-Y356 HydrophobicContact CZ3-CD2 3.74Å; W331-Y356 AromaticContact CZ3-CE2 3.79Å; W331-Y356 HydrophobicContact CZ3-CE2 3.79Å; W331-F447 HydrophobicContact CB-CD1 4.13Å; W331-F447 HydrophobicContact CB-CE1 4.37Å; W331-F447 AromaticContact CD1-CD1 3.44Å; W331-F447 VanDerWaalsContact CD1-CD1 3.44Å; W331-F447 HydrophobicContact CD2-CB 3.97Å; W331-F447 HydrophobicContact CD2-CD1 4.12Å; W331-F447 HydrophobicContact CD2-CG 4.33Å; W331-F447 HydrophobicContact CE3-CB 4.29Å; W331-F447 HydrophobicContact CG-CB 4.33Å; W331-F447 AromaticContact CG-CD1 3.59Å; W331-F447 HydrophobicContact CG-CD1 3.59Å; W331-F447 HydrophobicContact CG-CE1 4.22Å; W331-F447 HydrophobicContact CG-CG 4.17Å; W331-F447 WeakPolarHBondContact CH2-O 3.41Å; W331-F447 HydrophobicContact CZ2-CB 4.49Å; W331-F447 WeakPolarHBondContact CZ2-O 3.19Å; W331-F447 AromaticContact NE1-CD1 3.88Å; W331-F448 HydrophobicContact CE3-CE1 4.22Å; W331-F448 HydrophobicContact CE3-CZ 4.49Å; W331-F448 HydrophobicContact CH2-CD1 4.43Å; W331-F448 HydrophobicContact CH2-CE1 4.41Å; W331-F448 HydrophobicContact CZ3-CD1 4.12Å; W331-F448 AromaticContact CZ3-CE1 3.67Å; W331-F448 HydrophobicContact CZ3-CE1 3.67Å; W331-F448 HydrophobicContact CZ3-CZ 4.37Å
332A90.6Very high91.2Very high61 Ų6147.9 Ų47.950%0.50427%0.272SS..Hα-helixtrans-56.6-41177.500000112.4Y330 A336Y330-A332 PolarHBondContact O-N 2.66Å; A332-A336 PolarHBondContact O-N 3.5Å
333N91.3Very high90.5Very high83 Ų8354.4 Ų54.444%0.44431%0.312SS..Hα-helixtrans-71.6-43.2178-62.6-34.8000111.7Y330 W331 A336 V337Y330-N333 PolarHBondContact O-N 3.22Å; W331-N333 VanDerWaalsContact C-N 3.26Å; W331-N333 PolarHBondContact O-N 3.42Å; N333-A336 PolarHBondContact O-N 2.95Å; N333-V337 PolarHBondContact O-N 3.38Å
334L92.3Very high89.9Confident2 Ų259.2 Ų59.21%0.0135%0.346CS..Hα-helixtrans-65.6-41.3178.7-177.363.4000111.5Y330 W331 A336 V337 L338 V355 I359Y330-L334 HydrophobicContact CE1-CB 4.24Å; Y330-L334 HydrophobicContact CE1-CD2 4.15Å; Y330-L334 PolarHBondContact O-N 3.48Å; W331-L334 HydrophobicContact CE3-CD2 4.44Å; W331-L334 HydrophobicContact CZ3-CD2 4.32Å; W331-L334 PolarHBondContact O-N 3.49Å; L334-A336 VanDerWaalsContact C-N 3.34Å; L334-A336 PolarHBondContact O-N 3.35Å; L334-V337 WeakPolarHBondContact O-CB 3.39Å; L334-V337 PolarHBondContact O-N 3.45Å; L334-V337 VanDerWaalsContact O-N 3.14Å; L334-L338 HydrophobicContact CG-CD1 4.07Å; L334-L338 HydrophobicContact CG-CG 4.42Å; L334-L338 WeakPolarHBondContact O-CG 3.5Å; L334-L338 PolarHBondContact O-N 2.95Å; L334-V355 HydrophobicContact CD1-CB 4.42Å; L334-V355 HydrophobicContact CD1-CG1 4.47Å; L334-V355 HydrophobicContact CD2-CG1 4.44Å; L334-I359 HydrophobicContact CD2-CD1 4Å
335Q92.1Very high89.6Confident81 Ų8161.8 Ų61.838%0.37936%0.36SS..Hα-helixtrans-61.2-42.9178.2-177.5171.2-6.700111.3W331 V337 L338 D339W331-Q335 VanDerWaalsContact O-CB 3.25Å; W331-Q335 WeakPolarHBondContact O-CB 3.41Å; W331-Q335 PolarHBondContact O-N 2.86Å; Q335-V337 PolarHBondContact O-N 3.01Å; Q335-L338 PolarHBondContact O-N 3.18Å; Q335-L338 VanDerWaalsContact O-N 3.08Å; Q335-D339 VanDerWaalsContact CG-OD2 3.28Å; Q335-D339 WeakPolarHBondContact CG-OD2 3.33Å; Q335-D339 PolarHBondContact NE2-OD2 2.97Å; Q335-D339 WeakPolarHBondContact O-CB 3.42Å; Q335-D339 PolarHBondContact O-N 2.71Å
336A91.2Very high89.5Confident66 Ų6662.1 Ų62.155%0.54537%0.367SS..Hα-helixtrans-58.1-35.5174.900000113A332 N333 L334 D340A332-A336 PolarHBondContact O-N 3.5Å; N333-A336 PolarHBondContact O-N 2.95Å; L334-A336 VanDerWaalsContact C-N 3.34Å; L334-A336 PolarHBondContact O-N 3.35Å; A336-D340 PolarHBondContact O-N 3.26Å
337V90.8Very high89.3Confident37 Ų3764 Ų6422%0.22438%0.376CS..Hα-helixtrans-72.2-38.6175.3174.30000111.9L301 N333 L334 Q335 V348L301-V337 HydrophobicContact CD1-CG1 4.16Å; N333-V337 PolarHBondContact O-N 3.38Å; L334-V337 WeakPolarHBondContact O-CB 3.39Å; L334-V337 PolarHBondContact O-N 3.45Å; L334-V337 VanDerWaalsContact O-N 3.14Å; Q335-V337 PolarHBondContact O-N 3.01Å; V337-V348 HydrophobicContact CG1-CG1 3.9Å
338L91.1Very high89.3Confident20 Ų2067 Ų6711%0.10539%0.394CS..Hα-helixtrans-71.2-34.8179.8-66.5173.3000112.1L334 Q335 D340 K349 Y356L334-L338 HydrophobicContact CG-CD1 4.07Å; L334-L338 HydrophobicContact CG-CG 4.42Å; L334-L338 WeakPolarHBondContact O-CG 3.5Å; L334-L338 PolarHBondContact O-N 2.95Å; Q335-L338 PolarHBondContact O-N 3.18Å; Q335-L338 VanDerWaalsContact O-N 3.08Å; L338-D340 VanDerWaalsContact C-N 3.3Å; L338-K349 WeakPolarHBondContact O-CE 3.49Å; L338-K349 PolarHBondContact O-NZ 3.41Å; L338-Y356 HydrophobicContact CD1-CD2 4.16Å; L338-Y356 HydrophobicContact CD1-CG 4.43Å
339D91.4Very high89.3Confident84 Ų8466.4 Ų66.445%0.44939%0.386SS..SBendtrans-82.7-5.5179.9-67.3-20000112.8Q335 Y341Q335-D339 VanDerWaalsContact CG-OD2 3.28Å; Q335-D339 WeakPolarHBondContact CG-OD2 3.33Å; Q335-D339 PolarHBondContact NE2-OD2 2.97Å; Q335-D339 WeakPolarHBondContact O-CB 3.42Å; Q335-D339 PolarHBondContact O-N 2.71Å; D339-Y341 WeakPolarHBondContact O-CD2 3.41Å; D339-Y341 VanDerWaalsContact O-CE2 3.22Å; D339-Y341 WeakPolarHBondContact O-CE2 3.37Å; D339-Y341 PolarHBondContact O-N 2.82Å
340D89.4Confident89.3Confident53 Ų5365.3 Ų65.328%0.28338%0.377SS..  trans-71.6118.6172.9-168.2-9000110.4A336 L338 S342 N345 K349A336-D340 PolarHBondContact O-N 3.26Å; L338-D340 VanDerWaalsContact C-N 3.3Å; D340-S342 VanDerWaalsContact CG-OG 3.25Å; D340-S342 WeakPolarHBondContact OD1-CB 3.27Å; D340-S342 PolarHBondContact OD1-N 3.44Å; D340-S342 PolarHBondContact OD1-OG 3.37Å; D340-S342 PolarHBondContact OD2-OG 3.19Å; D340-N345 PolarHBondContact OD2-ND2 3.45Å; D340-K349 WeakPolarHBondContact O-CD 3.4Å; D340-K349 PolarHBondContact O-NZ 3.05Å
341Y82.8Confident89.2Confident193 Ų19366.2 Ų66.276%0.75738%0.383SS*.  trans-102.28.7177.9-66.7-83.1000112.9D339D339-Y341 WeakPolarHBondContact O-CD2 3.41Å; D339-Y341 VanDerWaalsContact O-CE2 3.22Å; D339-Y341 WeakPolarHBondContact O-CE2 3.37Å; D339-Y341 PolarHBondContact O-N 2.82Å
342S87.6Confident89.3Confident42 Ų4264.8 Ų64.829%0.29438%0.378SS..  trans-67.7133.5176.8660000111.7D340 S344 N345D340-S342 VanDerWaalsContact CG-OG 3.25Å; D340-S342 WeakPolarHBondContact OD1-CB 3.27Å; D340-S342 PolarHBondContact OD1-N 3.44Å; D340-S342 PolarHBondContact OD1-OG 3.37Å; D340-S342 PolarHBondContact OD2-OG 3.19Å; S342-S344 PolarHBondContact O-N 3.14Å; S342-N345 PolarHBondContact O-N 3.26Å; S342-N345 WeakPolarHBondContact OG-CB 3.41Å; S342-N345 PolarHBondContact OG-ND2 3.31Å
343V78.9Confident89.5Confident136 Ų13666.6 Ų66.682%0.82438%0.375SS*.G310 helixtrans-65-30.2179.7-179.10000111.4N345 A346V343-N345 VanDerWaalsContact C-N 3.26Å; V343-N345 PolarHBondContact O-N 3.32Å; V343-A346 WeakPolarHBondContact O-CB 3.32Å; V343-A346 PolarHBondContact O-N 2.63Å
344S82.1Confident89.7Confident104 Ų10467.6 Ų67.673%0.72738%0.376SS*.G310 helixtrans-64.3-26.6176.547.60000113.7S342S342-S344 PolarHBondContact O-N 3.14Å
345N87.4Confident89.8Confident65 Ų6567.5 Ų67.535%0.34838%0.375SS..G310 helixtrans-105.415.2-177.5-65.7-21000113.3D340 S342 V343 Q347 V348 K349D340-N345 PolarHBondContact OD2-ND2 3.45Å; S342-N345 PolarHBondContact O-N 3.26Å; S342-N345 WeakPolarHBondContact OG-CB 3.41Å; S342-N345 PolarHBondContact OG-ND2 3.31Å; V343-N345 VanDerWaalsContact C-N 3.26Å; V343-N345 PolarHBondContact O-N 3.32Å; N345-Q347 VanDerWaalsContact C-N 3.27Å; N345-Q347 PolarHBondContact O-N 3.36Å; N345-V348 PolarHBondContact O-N 3Å; N345-V348 VanDerWaalsContact O-N 3.09Å; N345-K349 PolarHBondContact O-N 3.15Å
346A88.5Confident90Very high57 Ų5765.5 Ų65.547%0.47136%0.364SS..Hα-helixtrans-55.6-38.3-178.500000113.5V343 A350V343-A346 WeakPolarHBondContact O-CB 3.32Å; V343-A346 PolarHBondContact O-N 2.63Å; A346-A350 PolarHBondContact O-N 3.36Å
347Q88.3Confident90.2Very high91 Ų9163.6 Ų63.643%0.42535%0.351SS..Hα-helixtrans-67.1-45.6176.4-176.562.735.400111.9N345 K349 A350 D351N345-Q347 VanDerWaalsContact C-N 3.27Å; N345-Q347 PolarHBondContact O-N 3.36Å; Q347-K349 VanDerWaalsContact C-N 3.26Å; Q347-K349 PolarHBondContact O-N 3.18Å; Q347-A350 WeakPolarHBondContact O-CB 3.49Å; Q347-A350 PolarHBondContact O-N 3.08Å; Q347-A350 VanDerWaalsContact O-N 3.12Å; Q347-D351 PolarHBondContact NE2-OD1 3.32Å; Q347-D351 PolarHBondContact O-N 3.48Å
348V90.5Very high90.5Very high64 Ų6462.5 Ų62.539%0.38835%0.346SS..Hα-helixtrans-62.2-38.4179.3-176.70000110.4L301 V337 N345 D351 G352L301-V348 HydrophobicContact CD1-CG1 3.7Å; L301-V348 WeakPolarHBondContact CD1-O 3.49Å; V337-V348 HydrophobicContact CG1-CG1 3.9Å; N345-V348 PolarHBondContact O-N 3Å; N345-V348 VanDerWaalsContact O-N 3.09Å; V348-D351 PolarHBondContact O-N 2.93Å; V348-G352 PolarHBondContact O-N 3.45Å
349K91.3Very high90.7Very high42 Ų4261.6 Ų61.618%0.18334%0.341CS..Hα-helixtrans-64.5-43.3173-177.4177.8-174.5125.60112.6L338 D340 N345 Q347 D351 G352 H353L338-K349 WeakPolarHBondContact O-CE 3.49Å; L338-K349 PolarHBondContact O-NZ 3.41Å; D340-K349 WeakPolarHBondContact O-CD 3.4Å; D340-K349 PolarHBondContact O-NZ 3.05Å; N345-K349 PolarHBondContact O-N 3.15Å; Q347-K349 VanDerWaalsContact C-N 3.26Å; Q347-K349 PolarHBondContact O-N 3.18Å; K349-D351 VanDerWaalsContact C-N 3.33Å; K349-D351 PolarHBondContact O-N 3.23Å; K349-G352 WeakPolarHBondContact O-CA 3.33Å; K349-G352 PolarHBondContact O-N 3.28Å; K349-G352 VanDerWaalsContact O-N 3.16Å; K349-H353 PolarHBondContact O-CD2 3.08Å; K349-H353 VanDerWaalsContact O-CD2 3.25Å; K349-H353 PolarHBondContact O-N 3.3Å
350A91.3Very high90.9Very high48 Ų4858 Ų5840%0.39732%0.322SS..Hα-helixtrans-60.4-43.2175.500000111.6A346 Q347 G352 H353 K354A346-A350 PolarHBondContact O-N 3.36Å; Q347-A350 WeakPolarHBondContact O-CB 3.49Å; Q347-A350 PolarHBondContact O-N 3.08Å; Q347-A350 VanDerWaalsContact O-N 3.12Å; A350-G352 VanDerWaalsContact C-N 3.33Å; A350-H353 PolarHBondContact O-N 3.21Å; A350-K354 PolarHBondContact O-N 3.3Å
351D92.3Very high91.1Very high32 Ų3258.5 Ų58.517%0.17133%0.327CS..Hα-helixtrans-64.8-37.8174.2-63.6-9.2000111.2W258 L301 Q347 V348 K349 H353 K354 V355W258-D351 HydrophobicContact CH2-CB 4.05Å; W258-D351 HydrophobicContact CZ2-CB 4.25Å; W258-D351 WeakPolarHBondContact CZ2-OD1 3.35Å; L301-D351 HydrophobicContact CB-CB 4.05Å; L301-D351 HydrophobicContact CD1-CB 3.96Å; Q347-D351 PolarHBondContact NE2-OD1 3.32Å; Q347-D351 PolarHBondContact O-N 3.48Å; V348-D351 PolarHBondContact O-N 2.93Å; K349-D351 VanDerWaalsContact C-N 3.33Å; K349-D351 PolarHBondContact O-N 3.23Å; D351-H353 VanDerWaalsContact C-N 3.34Å; D351-H353 PolarHBondContact O-N 3.29Å; D351-K354 WeakPolarHBondContact O-CB 3.23Å; D351-K354 PolarHBondContact O-N 3.37Å; D351-K354 VanDerWaalsContact O-N 3.11Å; D351-V355 PolarHBondContact O-N 3.04Å; D351-V355 VanDerWaalsContact O-N 3.1Å
352G94.1Very high91.7Very high0 Ų049.3 Ų49.30%029%0.291CS..Hα-helixtrans-59.9-42.3173.600000112.2V348 K349 A350 K354 V355 Y356V348-G352 PolarHBondContact O-N 3.45Å; K349-G352 WeakPolarHBondContact O-CA 3.33Å; K349-G352 PolarHBondContact O-N 3.28Å; K349-G352 VanDerWaalsContact O-N 3.16Å; A350-G352 VanDerWaalsContact C-N 3.33Å; G352-K354 VanDerWaalsContact C-N 3.3Å; G352-K354 PolarHBondContact O-N 2.95Å; G352-V355 PolarHBondContact O-N 2.5Å; G352-Y356 WeakPolarHBondContact O-CB 3.46Å; G352-Y356 PolarHBondContact O-N 3.46Å
353H94.4Very high92.1Very high98 Ų9847.4 Ų47.445%0.45428%0.277SS..Hα-helixtrans-64.4-32.1174.1-78.1-63.7000113K349 A350 D351 G357K349-H353 PolarHBondContact O-CD2 3.08Å; K349-H353 VanDerWaalsContact O-CD2 3.25Å; K349-H353 PolarHBondContact O-N 3.3Å; A350-H353 PolarHBondContact O-N 3.21Å; D351-H353 VanDerWaalsContact C-N 3.34Å; D351-H353 PolarHBondContact O-N 3.29Å; H353-G357 PolarHBondContact O-N 3.02Å
354K95Very high92.8Very high104 Ų10442.6 Ų42.645%0.45225%0.246SC..Hα-helixtrans-64.3-46.9172.8-67-74.2-172.5168.50111.2W258 Y305 A350 D351 G352 G357 A358W258-K354 HydrophobicContact CD2-CG 4.43Å; W258-K354 HydrophobicContact CE3-CB 4.33Å; W258-K354 HydrophobicContact CH2-CB 4.2Å; W258-K354 HydrophobicContact CH2-CG 4.39Å; W258-K354 HydrophobicContact CZ2-CG 4.25Å; W258-K354 HydrophobicContact CZ3-CB 4.08Å; Y305-K354 HydrophobicContact CD2-CB 4.16Å; Y305-K354 HydrophobicContact CE2-CB 4.34Å; A350-K354 PolarHBondContact O-N 3.3Å; D351-K354 WeakPolarHBondContact O-CB 3.23Å; D351-K354 PolarHBondContact O-N 3.37Å; D351-K354 VanDerWaalsContact O-N 3.11Å; G352-K354 VanDerWaalsContact C-N 3.3Å; G352-K354 PolarHBondContact O-N 2.95Å; K354-G357 PolarHBondContact O-N 3.45Å; K354-A358 PolarHBondContact O-N 2.94Å
355V96.1Very high93.3Very high0 Ų041.6 Ų41.60%023%0.226CC..Hα-helixtrans-61.8-47.4176.6179.80000110.7L301 Y330 L334 D351 G352 G357 A358 I359L301-V355 HydrophobicContact CB-CG2 4.14Å; L301-V355 HydrophobicContact CD2-CG2 4.36Å; L301-V355 WeakPolarHBondContact O-CG2 3.28Å; Y330-V355 HydrophobicContact CE1-CG1 4.13Å; L334-V355 HydrophobicContact CD1-CB 4.42Å; L334-V355 HydrophobicContact CD1-CG1 4.47Å; L334-V355 HydrophobicContact CD2-CG1 4.44Å; D351-V355 PolarHBondContact O-N 3.04Å; D351-V355 VanDerWaalsContact O-N 3.1Å; G352-V355 PolarHBondContact O-N 2.5Å; V355-G357 VanDerWaalsContact C-N 3.33Å; V355-G357 PolarHBondContact O-N 2.96Å; V355-A358 PolarHBondContact O-N 3.48Å; V355-A358 VanDerWaalsContact O-N 3.15Å; V355-I359 HydrophobicContact CG1-CD1 3.86Å; V355-I359 HydrophobicContact CG1-CG1 4.37Å; V355-I359 WeakPolarHBondContact O-CG1 3.44Å; V355-I359 PolarHBondContact O-N 3.16Å
356Y96Very high93.6Very high40 Ų4038.6 Ų38.616%0.15721%0.21CC..Hα-helixtrans-53.7-48.5175.8174.1-99.5000112.1W331 L338 G352 A358 I359 L360 F448 S451W331-Y356 AromaticContact CH2-CD2 3.92Å; W331-Y356 HydrophobicContact CH2-CD2 3.92Å; W331-Y356 AromaticContact CH2-CE2 3.62Å; W331-Y356 HydrophobicContact CH2-CE2 3.62Å; W331-Y356 AromaticContact CZ3-CD2 3.74Å; W331-Y356 HydrophobicContact CZ3-CD2 3.74Å; W331-Y356 AromaticContact CZ3-CE2 3.79Å; W331-Y356 HydrophobicContact CZ3-CE2 3.79Å; L338-Y356 HydrophobicContact CD1-CD2 4.16Å; L338-Y356 HydrophobicContact CD1-CG 4.43Å; G352-Y356 WeakPolarHBondContact O-CB 3.46Å; G352-Y356 PolarHBondContact O-N 3.46Å; Y356-A358 PolarHBondContact O-N 3.3Å; Y356-I359 PolarHBondContact O-N 3.2Å; Y356-L360 HydrophobicContact CD1-CD1 3.88Å; Y356-L360 HydrophobicContact CE1-CD1 3.24Å; Y356-L360 HydrophobicContact CE1-CG 4.08Å; Y356-L360 HydrophobicContact CE2-CD1 4.37Å; Y356-L360 HydrophobicContact CE2-CG 4.42Å; Y356-L360 PolarHBondContact O-N 2.98Å; Y356-F448 HydrophobicContact CD2-CD1 4.34Å; Y356-F448 HydrophobicContact CD2-CE1 4.22Å; Y356-F448 AromaticContact CE2-CD1 3.57Å; Y356-F448 HydrophobicContact CE2-CD1 3.57Å; Y356-F448 AromaticContact CE2-CE1 3.9Å; Y356-F448 HydrophobicContact CE2-CE1 3.9Å; Y356-S451 VanDerWaalsContact OH-CB 3.23Å; Y356-S451 WeakPolarHBondContact OH-CB 3.36Å; Y356-S451 PolarHBondContact OH-OG 3.12Å; Y356-S451 VanDerWaalsContact OH-OG 3.13Å
357G95.2Very high93.8Very high26 Ų2636.2 Ų36.227%0.26819%0.189SC..Hα-helixtrans-60.6-42.417700000113.1H353 K354 V355 L360 V361H353-G357 PolarHBondContact O-N 3.02Å; K354-G357 PolarHBondContact O-N 3.45Å; V355-G357 VanDerWaalsContact C-N 3.33Å; V355-G357 PolarHBondContact O-N 2.96Å; G357-L360 PolarHBondContact O-N 3.27Å; G357-V361 WeakPolarHBondContact O-CG2 3.38Å; G357-V361 PolarHBondContact O-N 3.26Å; G357-V361 VanDerWaalsContact O-N 3.09Å
358A96.3Very high93.9Very high14 Ų1436 Ų3612%0.11619%0.187CC..Hα-helixtrans-63.6-41.8176.900000112.2Y305 V308 V309 K354 V355 Y356 V361 A362Y305-A358 HydrophobicContact CD2-CB 3.87Å; Y305-A358 HydrophobicContact CE2-CB 3.74Å; V308-A358 HydrophobicContact CB-CB 4.46Å; V308-A358 HydrophobicContact CG1-CB 3.92Å; V309-A358 HydrophobicContact CG2-CB 4.04Å; K354-A358 PolarHBondContact O-N 2.94Å; V355-A358 PolarHBondContact O-N 3.48Å; V355-A358 VanDerWaalsContact O-N 3.15Å; Y356-A358 PolarHBondContact O-N 3.3Å; A358-V361 PolarHBondContact O-N 2.98Å; A358-A362 WeakPolarHBondContact O-CB 2.99Å; A358-A362 PolarHBondContact O-N 3.2Å
359I96Very high94Very high0 Ų035.1 Ų35.10%018%0.179CC..Hα-helixtrans-63.7-45.4176.8-65.4170.3000110.2V308 L323 L327 Y330 L334 V355 Y356 V361 A362 V363 F448V308-I359 HydrophobicContact CB-CG1 4.44Å; V308-I359 HydrophobicContact CG1-CB 4.5Å; V308-I359 HydrophobicContact CG1-CG1 3.83Å; V308-I359 HydrophobicContact CG2-CD1 4.38Å; V308-I359 HydrophobicContact CG2-CG1 3.77Å; L323-I359 HydrophobicContact CD2-CG2 4.3Å; L327-I359 HydrophobicContact CD1-CD1 4.46Å; L327-I359 HydrophobicContact CD1-CG2 3.86Å; Y330-I359 HydrophobicContact CD1-CD1 4.08Å; Y330-I359 HydrophobicContact CE1-CD1 3.76Å; L334-I359 HydrophobicContact CD2-CD1 4Å; V355-I359 HydrophobicContact CG1-CD1 3.86Å; V355-I359 HydrophobicContact CG1-CG1 4.37Å; V355-I359 WeakPolarHBondContact O-CG1 3.44Å; V355-I359 PolarHBondContact O-N 3.16Å; Y356-I359 PolarHBondContact O-N 3.2Å; I359-V361 VanDerWaalsContact C-N 3.33Å; I359-V361 PolarHBondContact O-N 3.25Å; I359-A362 PolarHBondContact O-N 3.11Å; I359-A362 VanDerWaalsContact O-N 3.12Å; I359-V363 HydrophobicContact CG2-CG2 4.03Å; I359-V363 WeakPolarHBondContact O-CB 3.37Å; I359-V363 VanDerWaalsContact O-CG2 3.3Å; I359-V363 WeakPolarHBondContact O-CG2 3.08Å; I359-V363 PolarHBondContact O-N 3.28Å; I359-F448 HydrophobicContact CB-CZ 4.49Å; I359-F448 HydrophobicContact CG2-CE1 3.98Å; I359-F448 HydrophobicContact CG2-CE2 4.38Å; I359-F448 HydrophobicContact CG2-CZ 3.43Å; I359-F448 VanDerWaalsContact CG2-CZ 3.43Å
360L95Very high93.9Very high9 Ų934 Ų345%0.04717%0.174CC..Hα-helixtrans-55.4-47176.4-84.2178.4000112.3Y356 G357 A362 V363 E364 F448Y356-L360 HydrophobicContact CD1-CD1 3.88Å; Y356-L360 HydrophobicContact CE1-CD1 3.24Å; Y356-L360 HydrophobicContact CE1-CG 4.08Å; Y356-L360 HydrophobicContact CE2-CD1 4.37Å; Y356-L360 HydrophobicContact CE2-CG 4.42Å; Y356-L360 PolarHBondContact O-N 2.98Å; G357-L360 PolarHBondContact O-N 3.27Å; L360-A362 VanDerWaalsContact C-N 3.32Å; L360-A362 PolarHBondContact O-N 2.91Å; L360-V363 PolarHBondContact O-N 3.38Å; L360-E364 VanDerWaalsContact O-CB 3.27Å; L360-E364 WeakPolarHBondContact O-CB 3.43Å; L360-E364 PolarHBondContact O-N 3.16Å; L360-F448 HydrophobicContact CD2-CB 3.73Å; L360-F448 HydrophobicContact CD2-CD1 3.3Å; L360-F448 HydrophobicContact CD2-CD2 4.25Å; L360-F448 HydrophobicContact CD2-CE1 4.02Å; L360-F448 HydrophobicContact CD2-CG 3.48Å; L360-F448 VanDerWaalsContact CD2-CG 3.48Å; L360-F448 HydrophobicContact CG-CD1 3.86Å; L360-F448 HydrophobicContact CG-CE1 4.22Å; L360-F448 HydrophobicContact CG-CG 4.49Å
361V95Very high93.7Very high63 Ų6334 Ų3438%0.38217%0.174SC..Hα-helixtrans-64.4-38.4178.1173.10000111.3G357 A358 I359 R365G357-V361 WeakPolarHBondContact O-CG2 3.38Å; G357-V361 PolarHBondContact O-N 3.26Å; G357-V361 VanDerWaalsContact O-N 3.09Å; A358-V361 PolarHBondContact O-N 2.98Å; I359-V361 VanDerWaalsContact C-N 3.33Å; I359-V361 PolarHBondContact O-N 3.25Å; V361-R365 WeakPolarHBondContact O-CB 3.46Å; V361-R365 PolarHBondContact O-N 2.92Å; V361-R365 VanDerWaalsContact O-N 3.11Å
362A95.2Very high93.6Very high0 Ų037 Ų370%019%0.19CC..Hα-helixtrans-65.7-44.7176.600000112.7V308 H312 V319 L323 A358 I359 L360 R365 L366V308-A362 HydrophobicContact CG1-CB 4.31Å; H312-A362 HydrophobicContact CB-CB 4.21Å; H312-A362 WeakPolarHBondContact ND1-CA 3.22Å; V319-A362 HydrophobicContact CG1-CB 4.16Å; V319-A362 HydrophobicContact CG2-CB 4.3Å; L323-A362 HydrophobicContact CD2-CB 4.04Å; A358-A362 WeakPolarHBondContact O-CB 2.99Å; A358-A362 PolarHBondContact O-N 3.2Å; I359-A362 PolarHBondContact O-N 3.11Å; I359-A362 VanDerWaalsContact O-N 3.12Å; L360-A362 VanDerWaalsContact C-N 3.32Å; L360-A362 PolarHBondContact O-N 2.91Å; A362-R365 PolarHBondContact O-N 3.45Å; A362-L366 WeakPolarHBondContact O-CB 3.22Å; A362-L366 PolarHBondContact O-N 3.42Å
363V94.8Very high93.3Very high3 Ų339.5 Ų39.52%0.01821%0.207CC..Hα-helixtrans-67.5-43178.5169.30000111.6I359 L360 R365 L366 L367 L444 F448 L452I359-V363 HydrophobicContact CG2-CG2 4.03Å; I359-V363 WeakPolarHBondContact O-CB 3.37Å; I359-V363 VanDerWaalsContact O-CG2 3.3Å; I359-V363 WeakPolarHBondContact O-CG2 3.08Å; I359-V363 PolarHBondContact O-N 3.28Å; L360-V363 PolarHBondContact O-N 3.38Å; V363-R365 VanDerWaalsContact C-N 3.33Å; V363-R365 PolarHBondContact O-N 3.48Å; V363-L366 WeakPolarHBondContact O-CB 3.45Å; V363-L366 PolarHBondContact O-N 3.16Å; V363-L367 HydrophobicContact CG1-CD1 4.13Å; V363-L367 WeakPolarHBondContact O-CG 3.46Å; V363-L367 PolarHBondContact O-N 3.36Å; V363-L444 HydrophobicContact CG1-CB 4.21Å; V363-L444 HydrophobicContact CG1-CD1 3.52Å; V363-L444 HydrophobicContact CG1-CD2 3.79Å; V363-L444 HydrophobicContact CG1-CG 4.04Å; V363-L444 HydrophobicContact CG2-CD2 3.99Å; V363-F448 HydrophobicContact CG1-CE2 4.42Å; V363-F448 HydrophobicContact CG2-CE2 4.05Å; V363-F448 HydrophobicContact CG2-CZ 4.44Å; V363-L452 HydrophobicContact CG1-CD1 3.99Å
364E93.8Very high92.7Very high34 Ų3440.6 Ų40.616%0.15922%0.216CC..Hα-helixtrans-56.8-49.1174.8-178.4-168.315300110.6L360 L366 L367 K368 R455 F456L360-E364 VanDerWaalsContact O-CB 3.27Å; L360-E364 WeakPolarHBondContact O-CB 3.43Å; L360-E364 PolarHBondContact O-N 3.16Å; E364-L366 VanDerWaalsContact C-N 3.34Å; E364-L366 PolarHBondContact O-N 3.37Å; E364-L367 PolarHBondContact O-N 3.42Å; E364-K368 HydrophobicContact CG-CD 4.19Å; E364-K368 WeakPolarHBondContact O-CG 3.25Å; E364-K368 PolarHBondContact O-N 3.41Å; E364-K368 WeakPolarHBondContact OE1-CE 3.36Å; E364-K368 IonicContact OE1-NZ 2.93Å; E364-K368 PolarHBondContact OE1-NZ 3.05Å; E364-R455 HydrophobicContact CG-CB 4.08Å; E364-R455 WeakPolarHBondContact OE2-CD 3.37Å; E364-R455 IonicContact OE2-NE 2.68Å; E364-F456 HydrophobicContact CG-CZ 4.29Å
365R92.3Very high91.6Very high84 Ų8439.6 Ų39.632%0.31722%0.222SC..Hα-helixtrans-65.1-37.8178-170.4170.2-174.2170.7-0.4111.9H312 V361 A362 V363 M369 P399H312-R365 WeakPolarHBondContact CE1-CD 3.41Å; H312-R365 PolarHBondContact NE2-NH1 2.93Å; V361-R365 WeakPolarHBondContact O-CB 3.46Å; V361-R365 PolarHBondContact O-N 2.92Å; V361-R365 VanDerWaalsContact O-N 3.11Å; A362-R365 PolarHBondContact O-N 3.45Å; V363-R365 VanDerWaalsContact C-N 3.33Å; V363-R365 PolarHBondContact O-N 3.48Å; R365-M369 HydrophobicContact CG-CG 4.05Å; R365-M369 VanDerWaalsContact O-CB 3.31Å; R365-M369 WeakPolarHBondContact O-CB 3.32Å; R365-M369 WeakPolarHBondContact O-CG 3.41Å; R365-M369 PolarHBondContact O-N 3.4Å; R365-P399 PolarHBondContact NH2-O 3.16Å
366L93.7Very high89.5Confident1 Ų146.7 Ų46.71%0.00526%0.255CS..Hα-helixtrans-56.1-54.4174.3167.161.2000111W316 V319 E320 A362 V363 E364 M369 K370 M440W316-L366 HydrophobicContact CB-CD1 4.37Å; W316-L366 HydrophobicContact CE3-CD1 3.9Å; V319-L366 HydrophobicContact CG1-CB 4.25Å; V319-L366 HydrophobicContact CG1-CD2 4.15Å; E320-L366 HydrophobicContact CB-CD1 3.7Å; E320-L366 HydrophobicContact CG-CD1 4.23Å; A362-L366 WeakPolarHBondContact O-CB 3.22Å; A362-L366 PolarHBondContact O-N 3.42Å; V363-L366 WeakPolarHBondContact O-CB 3.45Å; V363-L366 PolarHBondContact O-N 3.16Å; E364-L366 VanDerWaalsContact C-N 3.34Å; E364-L366 PolarHBondContact O-N 3.37Å; L366-M369 PolarHBondContact O-N 3.25Å; L366-K370 VanDerWaalsContact O-CB 3.24Å; L366-K370 WeakPolarHBondContact O-CB 3.27Å; L366-K370 PolarHBondContact O-N 2.97Å; L366-M440 HydrophobicContact CD2-SD 4.12Å; L366-M440 HydrophobicContact CG-SD 4.36Å
367L92.8Very high86.9Confident7 Ų750.2 Ų50.24%0.03728%0.283CS..Hα-helixtrans-63.2-44.9-178.2-70.9169.1000112V363 E364 K370 A371 M440 Y441 L444 L452 F456V363-L367 HydrophobicContact CG1-CD1 4.13Å; V363-L367 WeakPolarHBondContact O-CG 3.46Å; V363-L367 PolarHBondContact O-N 3.36Å; E364-L367 PolarHBondContact O-N 3.42Å; L367-K370 PolarHBondContact O-N 3.4Å; L367-A371 WeakPolarHBondContact O-CB 3.34Å; L367-A371 PolarHBondContact O-N 3.34Å; L367-M440 HydrophobicContact CD2-CG 4.19Å; L367-M440 HydrophobicContact CD2-SD 4.45Å; L367-Y441 HydrophobicContact CD1-CD2 3.89Å; L367-Y441 HydrophobicContact CD1-CE2 4.49Å; L367-L444 HydrophobicContact CD1-CD1 4.07Å; L367-L444 HydrophobicContact CD2-CD1 4.04Å; L367-L444 HydrophobicContact CG-CD1 4.12Å; L367-L452 HydrophobicContact CD1-CD1 4.28Å; L367-L452 HydrophobicContact CD1-CD2 4.26Å; L367-F456 HydrophobicContact CB-CE1 4.2Å; L367-F456 HydrophobicContact CB-CZ 3.73Å; L367-F456 HydrophobicContact CD1-CE2 3.92Å; L367-F456 HydrophobicContact CD1-CZ 3.66Å; L367-F456 HydrophobicContact CG-CZ 4.37Å
368K91.9Very high84.2Confident88 Ų8853.9 Ų53.938%0.38331%0.311SS..Hα-helixtrans-59.8-48.3177.1-73.1179.8176.8176.40111.7E364 A371 L372 F456E364-K368 HydrophobicContact CG-CD 4.19Å; E364-K368 WeakPolarHBondContact O-CG 3.25Å; E364-K368 PolarHBondContact O-N 3.41Å; E364-K368 WeakPolarHBondContact OE1-CE 3.36Å; E364-K368 IonicContact OE1-NZ 2.93Å; E364-K368 PolarHBondContact OE1-NZ 3.05Å; K368-A371 PolarHBondContact O-N 2.97Å; K368-L372 VanDerWaalsContact O-CG 3.31Å; K368-L372 WeakPolarHBondContact O-CG 3.49Å; K368-L372 PolarHBondContact O-N 2.75Å; K368-F456 HydrophobicContact CG-CE1 3.81Å
369M91Very high81.3Confident44 Ų4462.7 Ų62.722%0.21735%0.35CS..Hα-helixtrans-70.8-34.7-178-66.7-60.5-63.900112.6W316 R365 L366 L372 S373W316-M369 HydrophobicContact CB-CB 3.93Å; W316-M369 HydrophobicContact CB-CG 4.3Å; W316-M369 HydrophobicContact CD2-CB 3.98Å; W316-M369 HydrophobicContact CG-CB 3.55Å; W316-M369 HydrophobicContact CG-CG 4.18Å; R365-M369 HydrophobicContact CG-CG 4.05Å; R365-M369 VanDerWaalsContact O-CB 3.31Å; R365-M369 WeakPolarHBondContact O-CB 3.32Å; R365-M369 WeakPolarHBondContact O-CG 3.41Å; R365-M369 PolarHBondContact O-N 3.4Å; L366-M369 PolarHBondContact O-N 3.25Å; M369-L372 PolarHBondContact O-N 3.37Å; M369-L372 HydrophobicContact SD-CD1 4.15Å; M369-S373 PolarHBondContact O-N 2.87Å; M369-S373 PolarHBondContact O-OG 3.08Å
370K88.9Confident78.5Confident18 Ų1865.5 Ų65.58%0.07838%0.379CS..Hα-helixtrans-70.6-33.8175.4-168.5172.8178.3169.30112.2W316 E320 L366 L367 S373 L374 V435 L437 M440W316-K370 HydrophobicContact CE3-CB 4.41Å; W316-K370 HydrophobicContact CZ3-CB 4.15Å; W316-K370 HydrophobicContact CZ3-CG 4.23Å; E320-K370 WeakPolarHBondContact OE1-CE 3.5Å; E320-K370 IonicContact OE1-NZ 3.9Å; E320-K370 PolarHBondContact OE1-NZ 3.46Å; L366-K370 VanDerWaalsContact O-CB 3.24Å; L366-K370 WeakPolarHBondContact O-CB 3.27Å; L366-K370 PolarHBondContact O-N 2.97Å; L367-K370 PolarHBondContact O-N 3.4Å; K370-S373 PolarHBondContact O-OG 3.2Å; K370-L374 WeakPolarHBondContact O-CG 3.33Å; K370-L374 PolarHBondContact O-N 2.84Å; K370-V435 PolarHBondContact NZ-O 2.76Å; K370-L437 HydrophobicContact CB-CD1 3.93Å; K370-L437 HydrophobicContact CD-CD1 4.41Å; K370-L437 HydrophobicContact CG-CD1 3.94Å; K370-M440 HydrophobicContact CD-CE 4.33Å; K370-M440 HydrophobicContact CD-SD 3.91Å
371A88.5Confident75.5Confident48 Ų4871 Ų7140%0.39742%0.418SS..Hα-helixtrans-66-44.3170.800000111.6L367 K368 S373 L374 S375 L437L367-A371 WeakPolarHBondContact O-CB 3.34Å; L367-A371 PolarHBondContact O-N 3.34Å; K368-A371 PolarHBondContact O-N 2.97Å; A371-S373 PolarHBondContact O-N 3.19Å; A371-L374 PolarHBondContact O-N 2.88Å; A371-S375 PolarHBondContact O-N 2.93Å; A371-L437 HydrophobicContact CB-CD1 3.93Å
372L89.6Confident72.4Confident97 Ų9773.5 Ų73.551%0.50844%0.438SS..Hα-helixtrans-62.5-40.1177-71.7170.8000112.4K368 M369 L374 S375 Q376K368-L372 VanDerWaalsContact O-CG 3.31Å; K368-L372 WeakPolarHBondContact O-CG 3.49Å; K368-L372 PolarHBondContact O-N 2.75Å; M369-L372 PolarHBondContact O-N 3.37Å; M369-L372 HydrophobicContact SD-CD1 4.15Å; L372-L374 VanDerWaalsContact C-N 3.32Å; L372-L374 PolarHBondContact O-N 3.33Å; L372-S375 WeakPolarHBondContact CA-OG 3.47Å; L372-S375 PolarHBondContact O-N 3.13Å; L372-S375 VanDerWaalsContact O-N 3.16Å; L372-S375 PolarHBondContact O-OG 2.87Å; L372-Q376 PolarHBondContact O-N 3.18Å
373S87Confident69.1Low51 Ų5179 Ų7936%0.35748%0.476SS..Hα-helixtrans-67.5-31179.367.30000113.2M369 K370 A371 S375M369-S373 PolarHBondContact O-N 2.87Å; M369-S373 PolarHBondContact O-OG 3.08Å; K370-S373 PolarHBondContact O-OG 3.2Å; A371-S373 PolarHBondContact O-N 3.19Å; S373-S375 VanDerWaalsContact C-N 3.33Å
374L82.3Confident66Low122 Ų12283.6 Ų83.664%0.63952%0.515SS*.Hα-helixtrans-74.8-22.6173.4-68.6168.4000113K370 A371 L372 L437K370-L374 WeakPolarHBondContact O-CG 3.33Å; K370-L374 PolarHBondContact O-N 2.84Å; A371-L374 PolarHBondContact O-N 2.88Å; L372-L374 VanDerWaalsContact C-N 3.32Å; L372-L374 PolarHBondContact O-N 3.33Å; L374-L437 HydrophobicContact CD1-CB 4.09Å; L374-L437 HydrophobicContact CD1-CD1 4.21Å
375S71.4Confident62.9Low83 Ų8391 Ų9158%0.5855%0.55SS*.Hα-helixtrans-84.7-10.518071.30000114.6A371 L372 S373 P377A371-S375 PolarHBondContact O-N 2.93Å; L372-S375 WeakPolarHBondContact CA-OG 3.47Å; L372-S375 PolarHBondContact O-N 3.13Å; L372-S375 VanDerWaalsContact O-N 3.16Å; L372-S375 PolarHBondContact O-OG 2.87Å; S373-S375 VanDerWaalsContact C-N 3.33Å; S375-P377 WeakPolarHBondContact O-CD 3.49Å
376Q53.6Low60.2Low148 Ų14892.8 Ų92.869%0.69257%0.572SS**SBendtrans-80.6119173.6-70.8-171.3-0.600109.6L372 A378L372-Q376 PolarHBondContact O-N 3.18Å; Q376-A378 PolarHBondContact O-N 3.02Å
377P40Very low56.9Low114 Ų11496.3 Ų96.374%0.7461%0.608SS**  trans-64.9134.6174.626.2-31000109.5S375 E379S375-P377 WeakPolarHBondContact O-CD 3.49Å; P377-E379 PolarHBondContact O-N 3.14Å
378A39.6Very low53.7Low104 Ų104102.3 Ų102.386%0.8665%0.651SS**  trans-63.993.7169.800000109.2Q376 G380Q376-A378 PolarHBondContact O-N 3.02Å; A378-G380 VanDerWaalsContact C-N 3.28Å; A378-G380 PolarHBondContact O-N 3.26Å
379E35.5Very low50.6Low199 Ų199101.5 Ų101.593%0.9367%0.668SS**  trans-70.592164.7-78.3-162.6158.700108.8P377P377-E379 PolarHBondContact O-N 3.14Å
380G35.6Very low47.5Very low59 Ų59103.3 Ų103.361%0.60870%0.697SS**  trans-123.5123.1166.100000110.2A378A378-G380 VanDerWaalsContact C-N 3.28Å; A378-G380 PolarHBondContact O-N 3.26Å
381S32.1Very low44.5Very low125 Ų125109.1 Ų109.187%0.87473%0.734SS**  trans84.497.9158.974.30000119.7
382S30.7Very low41.6Very low114 Ų114113 Ų11380%0.79775%0.745SS**  -162128.912850.80000112.4
383S27.1Very low38.6Very low116 Ų116111.4 Ų111.481%0.81175%0.753SS**  trans38.9123.415557.30000121.8
384A29.6Very low35.6Very low100 Ų100118.4 Ų118.483%0.82678%0.777SS**  trans-60.7138.8164.300000114.2
385Q27.3Very low32.9Very low190 Ų190124.1 Ų124.189%0.88879%0.79SS**  -158.6152.5121.9-93.6-137.5-49.900112.1
386P36.2Very low30.7Very low121 Ų121126 Ų12679%0.78680%0.798SS**  trans-99.3143.4-170.636.9-28.8000112.8
387G24.5Very low29.6Very low74 Ų74124.4 Ų124.476%0.76380%0.803SS**  trans175.4105.8169.300000115.6
388S25.9Very low29.2Very low134 Ų134123.1 Ų123.194%0.93780%0.797SS**  trans75.6129.3145.3-152.60000120.9
389G25.3Very low28.9Very low71 Ų71123.4 Ų123.473%0.73279%0.79SS**  trans106.193.714400000116
390G27Very low29.1Very low81 Ų81115.2 Ų115.284%0.83576%0.759SS**  trans-66.8141.2173.500000113.6
391V25.8Very low29.2Very low141 Ų141119.2 Ų119.286%0.85577%0.765SS**  trans-135.1117150.91770000106.7G393V391-G393 PolarHBondContact O-N 3.37Å; V391-G393 VanDerWaalsContact O-N 3.15Å
392M28.6Very low30Very low128 Ų128115 Ų11563%0.63174%0.736SS**  trans-77.697.7-177.6-163.9162.5175.900109.8F394 L637M392-F394 PolarHBondContact O-N 3.33Å; M392-L637 HydrophobicContact CE-CB 3.86Å; M392-L637 HydrophobicContact CE-CD1 3.59Å; M392-L637 HydrophobicContact CE-CD2 3.27Å; M392-L637 HydrophobicContact CE-CG 3.67Å; M392-L637 HydrophobicContact SD-CB 3.75Å; M392-L637 HydrophobicContact SD-CD1 3.19Å; M392-L637 WeakPolarHBondContact SD-CD1 3.47Å; M392-L637 HydrophobicContact SD-CD2 4.08Å; M392-L637 HydrophobicContact SD-CG 3.77Å
393G25.3Very low30.4Very low65 Ų65111.4 Ų111.467%0.6771%0.71SS**  trans-79.8112.3174.200000111V391 R395V391-G393 PolarHBondContact O-N 3.37Å; V391-G393 VanDerWaalsContact O-N 3.15Å; G393-R395 PolarHBondContact O-N 3.17Å
394F24.1Very low30.9Very low197 Ų197110.8 Ų110.886%0.86470%0.703SS**  trans-47.3121.5163.1-91.5-102000110.2M392 V396M392-F394 PolarHBondContact O-N 3.33Å; F394-V396 PolarHBondContact O-N 3.06Å
395R26.5Very low31.2Very low242 Ų242111.8 Ų111.891%0.91370%0.701SS**  trans-66.898.6168.4-80.9-170.5176-160.50.5108.7G393 S397G393-R395 PolarHBondContact O-N 3.17Å; R395-S397 PolarHBondContact O-N 3.48Å
396V25.4Very low31.7Very low124 Ų124108.8 Ų108.875%0.75269%0.687SS**  trans-74.2105.7160.7176.80000107F394 S398F394-V396 PolarHBondContact O-N 3.06Å; V396-S398 PolarHBondContact O-N 3.18Å
397S30.6Very low31.4Very low113 Ų113108.8 Ų108.879%0.7969%0.687SS**  trans-58.598173.7-55.60000110.1R395R395-S397 PolarHBondContact O-N 3.48Å
398S30.6Very low31.6Very low87 Ų87113.1 Ų113.161%0.60869%0.692SS**  trans-85.4125.1169.3-660000109.2V396 G400V396-S398 PolarHBondContact O-N 3.18Å; S398-G400 VanDerWaalsContact C-N 3.31Å; S398-G400 PolarHBondContact O-N 2.74Å
399P33.5Very low32Very low111 Ų111112.5 Ų112.572%0.72169%0.688SS**THydrogen-bonded Turntrans-75.482.2178.830.2-32.1000109.7R365R365-P399 PolarHBondContact NH2-O 3.16Å
400G38.8Very low32Very low27 Ų27118.1 Ų118.128%0.27870%0.695SS.*THydrogen-bonded Turntrans-174.2-5.5-177.700000118.1S398S398-G400 VanDerWaalsContact C-N 3.31Å; S398-G400 PolarHBondContact O-N 2.74Å
401L39.1Very low32.1Very low142 Ų142118.3 Ų118.374%0.74369%0.689SS**PPolyproline II helixtrans-93144.7176.2-64.7176.7000110.5W273W273-L401 WeakPolarHBondContact CH2-O 3.5Å; W273-L401 WeakPolarHBondContact CZ2-O 3.37Å
402S48.3Very low32.3Very low38 Ų38116.2 Ų116.227%0.26669%0.686SS.*PPolyproline II helixtrans-76.5155179.1-44.30000111.2K317K317-S402 VanDerWaalsContact CD-OG 3.22Å; K317-S402 WeakPolarHBondContact CD-OG 3.45Å; K317-S402 WeakPolarHBondContact CE-OG 3.46Å; K317-S402 PolarHBondContact NZ-OG 3.04Å
403P40Very low32.8Very low38 Ų38118.7 Ų118.725%0.24770%0.701CS.*PPolyproline II helixtrans-68.3147.517128.5-27.9000107.9F272 W273F272-P403 HydrophobicContact CE1-CB 4.25Å; F272-P403 HydrophobicContact CE1-CG 4.09Å; F272-P403 HydrophobicContact CZ-CB 4.1Å; F272-P403 HydrophobicContact CZ-CG 3.99Å; W273-P403 HydrophobicContact CH2-CB 3.99Å; W273-P403 HydrophobicContact CH2-CG 4.05Å; W273-P403 HydrophobicContact CZ3-CB 3.76Å; W273-P403 HydrophobicContact CZ3-CG 4.33Å
404P36.1Very low33.2Very low102 Ų102118 Ų11866%0.66269%0.694SS**PPolyproline II helixtrans-57.8149.7172.724.8-31.4000109.8E406P404-E406 PolarHBondContact O-N 3.15Å
405P35.6Very low33.9Very low121 Ų121117.4 Ų117.479%0.78670%0.698SS**PPolyproline II helixtrans-56134.2173.224.2-31.4000109.3
406E39Very low34.2Very low127 Ų127109.3 Ų109.359%0.59368%0.683SS**PPolyproline II helixtrans-54133.2174.8-74.1-175.1152.700108.7G281 P404 L408G281-E406 PolarHBondContact N-OE1 3.14Å; P404-E406 PolarHBondContact O-N 3.15Å; E406-L408 PolarHBondContact O-N 3.45Å; E406-L408 VanDerWaalsContact O-N 3.08Å
407P29.3Very low34.6Very low121 Ų121109.2 Ų109.279%0.78669%0.688SS**PPolyproline II helixtrans-60.6120170.224.4-29.8000107.4S409P407-S409 PolarHBondContact O-N 3.1Å; P407-S409 VanDerWaalsContact O-N 3.1Å
408L30Very low34.9Very low166 Ų166111.3 Ų111.387%0.86969%0.685SS**  trans-42.5122.2167.6-72.4164.6000107.5E406 E410E406-L408 PolarHBondContact O-N 3.45Å; E406-L408 VanDerWaalsContact O-N 3.08Å; L408-E410 PolarHBondContact O-N 3.46Å
409S32.3Very low35.2Very low121 Ų121114.6 Ų114.685%0.84670%0.695SS**  trans-47.6113.6177.2-73.30000108.4P407 A411P407-S409 PolarHBondContact O-N 3.1Å; P407-S409 VanDerWaalsContact O-N 3.1Å; S409-A411 PolarHBondContact O-N 3.08Å; S409-A411 VanDerWaalsContact O-N 3.15Å
410E26.6Very low35.2Very low188 Ų188118.1 Ų118.188%0.87970%0.702SS**  trans-52.1125.5173.2-84-175.5146.100107.5L408 A412L408-E410 PolarHBondContact O-N 3.46Å; E410-A412 PolarHBondContact O-N 3.44Å
411A28.7Very low34.8Very low86 Ų86119.8 Ų119.871%0.71172%0.719SS**  trans-48.5114.3174.200000108.6S409 L413S409-A411 PolarHBondContact O-N 3.08Å; S409-A411 VanDerWaalsContact O-N 3.15Å; A411-L413 VanDerWaalsContact C-N 3.29Å; A411-L413 PolarHBondContact O-N 3.46Å
412A29.4Very low34.5Very low96 Ų96119.9 Ų119.979%0.79373%0.728SS**  trans-6099.8165.600000106.9E410 G414E410-A412 PolarHBondContact O-N 3.44Å; A412-G414 PolarHBondContact O-N 2.87Å
413L39.9Very low33.8Very low181 Ų181121.7 Ų121.795%0.94875%0.752SS**  trans-68.772.3163.3-74.3169.3000107.6A411A411-L413 VanDerWaalsContact C-N 3.29Å; A411-L413 PolarHBondContact O-N 3.46Å
414G33.9Very low33.2Very low51 Ų51123.7 Ų123.753%0.52678%0.78SS.*  trans-117.1133171.600000108.5A412 A416A412-G414 PolarHBondContact O-N 2.87Å; G414-A416 PolarHBondContact O-N 3.43Å
415I37.8Very low32.9Very low183 Ų183123.7 Ų123.794%0.93879%0.789SS**SBendtrans-65.789.8-171.8-57161.8000109.7
416A33.6Very low32.6Very low73 Ų73121.2 Ų121.260%0.60379%0.785SS**  trans-155.850.3169.800000111.4G414 H418G414-A416 PolarHBondContact O-N 3.43Å; A416-H418 VanDerWaalsContact C-N 3.29Å; A416-H418 PolarHBondContact O-N 2.81Å
417S33.8Very low32.4Very low121 Ų121119.5 Ų119.585%0.84678%0.783SS**THydrogen-bonded Turntrans-84.331.4-174.4-35.80000115.2
418H37.2Very low32.9Very low158 Ų158119.4 Ų119.473%0.73178%0.783SS**THydrogen-bonded Turntrans-137.115.4-174.370.9-86.5000117.1A416A416-H418 VanDerWaalsContact C-N 3.29Å; A416-H418 PolarHBondContact O-N 2.81Å
419L35.7Very low33.5Very low156 Ų156115.2 Ų115.282%0.81776%0.755SS**  trans-134.866.6168.8-72.9172.5000110.9
420Q34.4Very low33.9Very low185 Ų185116.2 Ų116.286%0.86475%0.751SS**  trans-122.3101.4160.9-125.410826.800107.9
421G29.8Very low34.6Very low62 Ų62114.6 Ų114.664%0.63975%0.749SS**  trans-73.6156.3162.400000110.4G423G421-G423 PolarHBondContact O-N 3.09Å
422P33.9Very low35.8Very low144 Ų144114.9 Ų114.994%0.93573%0.731SS**SBendtrans-77.5110.6-179.331.1-29.8000109.3
423G31.8Very low37.3Very low75 Ų75115.6 Ų115.677%0.77373%0.726SS**  trans163.652.617900000113.6G421 A425G421-G423 PolarHBondContact O-N 3.09Å; G423-A425 PolarHBondContact O-N 3.24Å
424G28.9Very low38.6Very low81 Ų81112.1 Ų112.184%0.83571%0.714SS**  trans-82.499.5165.800000109.3G426G424-G426 PolarHBondContact O-N 2.98Å
425A30.1Very low40.9Very low102 Ų102111.5 Ų111.584%0.84370%0.7SS**  trans-63.1112.7162.200000107.5G423G423-A425 PolarHBondContact O-N 3.24Å
426G28.1Very low43.2Very low69 Ų69107 Ų10771%0.71168%0.683SS**  trans-56.9138.9174.500000110.4G424G424-G426 PolarHBondContact O-N 2.98Å
427T35.8Very low45.7Very low91 Ų91105.7 Ų105.756%0.55867%0.665SS**  trans-55.4131.816530.80000109.1W429T427-W429 PolarHBondContact O-N 2.72Å
428P39.3Very low48.3Very low118 Ų118104.2 Ų104.277%0.76665%0.653SS**THydrogen-bonded Turntrans-7014.5-174.726.6-33.7000114.7
429W42.7Very low50.7Low78 Ų7899 Ų9930%0.29564%0.637SS.*THydrogen-bonded Turntrans-98.2-18.7-172.9-69.281000113.5H284 L288 T427 D431H284-W429 AromaticContact CE1-CD2 3.83Å; H284-W429 AromaticContact CE1-CE2 3.61Å; H284-W429 AromaticContact CE1-NE1 3.71Å; L288-W429 HydrophobicContact CD2-CH2 4.33Å; L288-W429 HydrophobicContact CD2-CZ2 3.43Å; L288-W429 VanDerWaalsContact CD2-CZ2 3.43Å; L288-W429 HydrophobicContact CG-CZ2 4.04Å; T427-W429 PolarHBondContact O-N 2.72Å; W429-D431 VanDerWaalsContact C-N 3.34Å
430D40.5Very low53.3Low143 Ų14391.6 Ų91.677%0.76560%0.598SS**SBendtrans-85.9-5.2-178.3-73.1-54.7000113.7
431D41.5Very low56.1Low154 Ų15486.5 Ų86.582%0.82457%0.572SS**  trans-106.427.9-172.9-118.50.2000113.3W429W429-D431 VanDerWaalsContact C-N 3.34Å
432W53.8Low59Low92 Ų9287.6 Ų87.635%0.34857%0.569SS.*  trans-92.8111.3177-143.975.5000111.4E320 Y324 P325E320-W432 HydrophobicContact CG-CH2 3.91Å; E320-W432 HydrophobicContact CG-CZ3 3.78Å; E320-W432 VanDerWaalsContact O-CH2 3.31Å; E320-W432 WeakPolarHBondContact O-CH2 3.31Å; Y324-W432 AromaticContact CD1-CH2 3.57Å; Y324-W432 HydrophobicContact CD1-CH2 3.57Å; Y324-W432 AromaticContact CD1-CZ2 3.63Å; Y324-W432 HydrophobicContact CD1-CZ2 3.63Å; Y324-W432 AromaticContact CE1-CH2 3.99Å; Y324-W432 HydrophobicContact CE1-CH2 3.99Å; Y324-W432 HydrophobicContact CE1-CZ2 4.13Å; P325-W432 HydrophobicContact CB-CZ2 4.07Å; P325-W432 HydrophobicContact CG-CZ2 3.85Å
433T60.7Low61.7Low111 Ų11184 Ų8468%0.68154%0.54SS*.  trans-83.9125.7177.552.40000110.5V435T433-V435 PolarHBondContact O-N 2.97Å; T433-V435 VanDerWaalsContact O-N 3.14Å
434P68Low64.6Low107 Ų10780.4 Ų80.470%0.69550%0.503SS*.  trans-67.8115.3-179.224-30.9000110.8
435V81.1Confident67.6Low39 Ų3980.9 Ų80.924%0.23648%0.48CS..  trans-71.3134.4177.9-178.50000110.4Y324 K370 T433 A439 M440Y324-V435 HydrophobicContact CE1-CB 4.42Å; Y324-V435 HydrophobicContact CE1-CG2 4.03Å; K370-V435 PolarHBondContact NZ-O 2.76Å; T433-V435 PolarHBondContact O-N 2.97Å; T433-V435 VanDerWaalsContact O-N 3.14Å; V435-A439 HydrophobicContact CG1-CB 3.83Å; V435-M440 HydrophobicContact CB-CE 4.05Å; V435-M440 HydrophobicContact CG1-CB 4.24Å
436P85.9Confident70.5Confident88 Ų8880.1 Ų80.157%0.57147%0.468SS*.  trans-56.2142.2173.5-24.933.8000112.3P438 A439 M440P436-P438 VanDerWaalsContact C-CD 3.49Å; P436-A439 HydrophobicContact CB-CB 4.5Å; P436-A439 PolarHBondContact O-N 2.86Å; P436-A439 VanDerWaalsContact O-N 3.12Å; P436-M440 PolarHBondContact O-N 3.46Å
437L87.7Confident73.4Confident45 Ų4578.4 Ų78.424%0.23644%0.442CS..Hα-helixtrans-55.6-40.2-177.4-176.3139.1000114.1K370 A371 L374 M440 Y441K370-L437 HydrophobicContact CB-CD1 3.93Å; K370-L437 HydrophobicContact CD-CD1 4.41Å; K370-L437 HydrophobicContact CG-CD1 3.94Å; A371-L437 HydrophobicContact CB-CD1 3.93Å; L374-L437 HydrophobicContact CD1-CB 4.09Å; L374-L437 HydrophobicContact CD1-CD1 4.21Å; L437-M440 PolarHBondContact O-N 3.26Å; L437-Y441 PolarHBondContact O-N 3.4Å
438P87.1Confident76.1Confident90 Ų9074.4 Ų74.458%0.58442%0.416SS*.Hα-helixtrans-63.7-42175.9-23.734.9000113.3P436 Y441 C442P436-P438 VanDerWaalsContact C-CD 3.49Å; P438-Y441 PolarHBondContact O-N 3.17Å; P438-C442 PolarHBondContact O-N 2.94Å; P438-C442 PolarHBondContact O-SG 3.4Å
439A88.8Confident78.5Confident49 Ų4969.9 Ų69.941%0.40539%0.391SS..Hα-helixtrans-65.3-42.9178.300000111.2V435 P436 Y441 C442 E443V435-A439 HydrophobicContact CG1-CB 3.83Å; P436-A439 HydrophobicContact CB-CB 4.5Å; P436-A439 PolarHBondContact O-N 2.86Å; P436-A439 VanDerWaalsContact O-N 3.12Å; A439-Y441 VanDerWaalsContact C-N 3.34Å; A439-Y441 PolarHBondContact O-N 2.95Å; A439-C442 PolarHBondContact O-N 3.34Å; A439-E443 PolarHBondContact O-N 3.49Å
440M90.1Very high80.6Confident0 Ų071.3 Ų71.30%040%0.404CS..Hα-helixtrans-59.6-43.4174.5-179.9173.6-65.700112E320 Y324 L366 L367 K370 V435 P436 L437 E443 L444E320-M440 HydrophobicContact CG-CE 4.38Å; Y324-M440 HydrophobicContact CD1-CE 4.2Å; Y324-M440 HydrophobicContact CD2-CG 4.29Å; Y324-M440 HydrophobicContact CE1-CE 3.88Å; Y324-M440 HydrophobicContact CE2-CB 4.46Å; Y324-M440 HydrophobicContact CE2-CE 4.4Å; Y324-M440 HydrophobicContact CE2-CG 3.7Å; L366-M440 HydrophobicContact CD2-SD 4.12Å; L366-M440 HydrophobicContact CG-SD 4.36Å; L367-M440 HydrophobicContact CD2-CG 4.19Å; L367-M440 HydrophobicContact CD2-SD 4.45Å; K370-M440 HydrophobicContact CD-CE 4.33Å; K370-M440 HydrophobicContact CD-SD 3.91Å; V435-M440 HydrophobicContact CB-CE 4.05Å; V435-M440 HydrophobicContact CG1-CB 4.24Å; P436-M440 PolarHBondContact O-N 3.46Å; L437-M440 PolarHBondContact O-N 3.26Å; M440-E443 PolarHBondContact O-N 3.46Å; M440-L444 HydrophobicContact CG-CD1 3.76Å; M440-L444 WeakPolarHBondContact O-CB 3.23Å; M440-L444 WeakPolarHBondContact O-CD1 3.44Å; M440-L444 WeakPolarHBondContact O-CG 3.3Å; M440-L444 PolarHBondContact O-N 2.91Å
441Y91.6Very high83Confident78 Ų7867.1 Ų67.131%0.30639%0.386SS..Hα-helixtrans-62.7-46.2176.1-178.7-94.1000112.1L367 L437 P438 A439 E443 L444 Y445 L452 F456L367-Y441 HydrophobicContact CD1-CD2 3.89Å; L367-Y441 HydrophobicContact CD1-CE2 4.49Å; L437-Y441 PolarHBondContact O-N 3.4Å; P438-Y441 PolarHBondContact O-N 3.17Å; A439-Y441 VanDerWaalsContact C-N 3.34Å; A439-Y441 PolarHBondContact O-N 2.95Å; Y441-E443 VanDerWaalsContact C-N 3.34Å; Y441-E443 PolarHBondContact O-N 3.33Å; Y441-L444 PolarHBondContact O-N 3.49Å; Y441-Y445 VanDerWaalsContact O-CB 3.28Å; Y441-Y445 WeakPolarHBondContact O-CB 3.44Å; Y441-Y445 PolarHBondContact O-N 3.03Å; Y441-L452 HydrophobicContact CE2-CD2 4.26Å; Y441-F456 HydrophobicContact CE2-CD2 4.19Å; Y441-F456 HydrophobicContact CE2-CE2 4.21Å
442C90.8Very high85.2Confident86 Ų8659.8 Ų59.858%0.58135%0.347SS*.Hα-helixtrans-60-43.9178.6-68.70000112.2P438 A439 Y445 S446P438-C442 PolarHBondContact O-N 2.94Å; P438-C442 PolarHBondContact O-SG 3.4Å; A439-C442 PolarHBondContact O-N 3.34Å; C442-Y445 PolarHBondContact O-N 3.28Å; C442-S446 PolarHBondContact O-N 3.15Å; C442-S446 VanDerWaalsContact O-N 3.08Å
443E91.9Very high86.8Confident68 Ų6856.3 Ų56.332%0.31834%0.338SS..Hα-helixtrans-63.6-47.1177.5-168.1-175.5168.800111.1Y324 A439 M440 Y441 Y445 S446 F447Y324-E443 VanDerWaalsContact CZ-OE2 3.25Å; Y324-E443 PolarHBondContact OH-OE2 2.86Å; A439-E443 PolarHBondContact O-N 3.49Å; M440-E443 PolarHBondContact O-N 3.46Å; Y441-E443 VanDerWaalsContact C-N 3.34Å; Y441-E443 PolarHBondContact O-N 3.33Å; E443-Y445 VanDerWaalsContact C-N 3.33Å; E443-Y445 PolarHBondContact O-N 2.92Å; E443-S446 WeakPolarHBondContact O-CB 3.49Å; E443-S446 PolarHBondContact O-N 3.5Å; E443-S446 VanDerWaalsContact O-N 3.12Å; E443-S446 PolarHBondContact O-OG 3.06Å; E443-F447 HydrophobicContact CG-CE2 3.88Å; E443-F447 HydrophobicContact CG-CZ 4.3Å; E443-F447 VanDerWaalsContact O-CD2 3.29Å; E443-F447 WeakPolarHBondContact O-CD2 3.38Å
444L91.8Very high88Confident0 Ų055.2 Ų55.20%033%0.331CS..Hα-helixtrans-65.3-36.3177.7-68.5165.3000112.5Y324 L327 V363 L367 M440 Y441 S446 F447 F448 L452Y324-L444 HydrophobicContact CD2-CD1 4.45Å; Y324-L444 HydrophobicContact CD2-CD2 4.05Å; Y324-L444 HydrophobicContact CD2-CG 4.32Å; Y324-L444 HydrophobicContact CE2-CD1 4.39Å; Y324-L444 HydrophobicContact CE2-CD2 4.26Å; Y324-L444 HydrophobicContact CE2-CG 4.12Å; L327-L444 HydrophobicContact CD2-CD2 3.5Å; V363-L444 HydrophobicContact CG1-CB 4.21Å; V363-L444 HydrophobicContact CG1-CD1 3.52Å; V363-L444 HydrophobicContact CG1-CD2 3.79Å; V363-L444 HydrophobicContact CG1-CG 4.04Å; V363-L444 HydrophobicContact CG2-CD2 3.99Å; L367-L444 HydrophobicContact CD1-CD1 4.07Å; L367-L444 HydrophobicContact CD2-CD1 4.04Å; L367-L444 HydrophobicContact CG-CD1 4.12Å; M440-L444 HydrophobicContact CG-CD1 3.76Å; M440-L444 WeakPolarHBondContact O-CB 3.23Å; M440-L444 WeakPolarHBondContact O-CD1 3.44Å; M440-L444 WeakPolarHBondContact O-CG 3.3Å; M440-L444 PolarHBondContact O-N 2.91Å; Y441-L444 PolarHBondContact O-N 3.49Å; L444-S446 VanDerWaalsContact C-N 3.25Å; L444-S446 PolarHBondContact O-N 2.95Å; L444-F447 PolarHBondContact O-N 3.46Å; L444-F448 HydrophobicContact CB-CD2 4.44Å; L444-F448 HydrophobicContact CD2-CE2 4.01Å; L444-F448 WeakPolarHBondContact O-CD2 3.08Å; L444-F448 PolarHBondContact O-N 3Å; L444-L452 HydrophobicContact CB-CD2 3.85Å
445Y91.6Very high88.7Confident90 Ų9055.4 Ų55.435%0.35332%0.318SS..Hα-helixtrans-63.8-32.5174.6-173.6-96.6000111.6Y441 C442 E443 F447 G449 D450 A453Y441-Y445 VanDerWaalsContact O-CB 3.28Å; Y441-Y445 WeakPolarHBondContact O-CB 3.44Å; Y441-Y445 PolarHBondContact O-N 3.03Å; C442-Y445 PolarHBondContact O-N 3.28Å; E443-Y445 VanDerWaalsContact C-N 3.33Å; E443-Y445 PolarHBondContact O-N 2.92Å; Y445-F447 VanDerWaalsContact C-N 3.26Å; Y445-F447 PolarHBondContact O-N 3.45Å; Y445-G449 WeakPolarHBondContact CD2-O 3.43Å; Y445-G449 VanDerWaalsContact CE2-C 3.47Å; Y445-G449 VanDerWaalsContact CE2-O 3.3Å; Y445-G449 WeakPolarHBondContact CE2-O 3.38Å; Y445-G449 VanDerWaalsContact O-CA 3.24Å; Y445-G449 WeakPolarHBondContact O-CA 3.24Å; Y445-G449 PolarHBondContact O-N 2.97Å; Y445-D450 PolarHBondContact OH-OD1 3.18Å; Y445-A453 HydrophobicContact CE2-CB 3.98Å
446S91.3Very high88.5Confident86 Ų8657.1 Ų57.160%0.60132%0.322SS*.Hα-helixtrans-63.8-29.917580.40000113.4C442 E443 L444C442-S446 PolarHBondContact O-N 3.15Å; C442-S446 VanDerWaalsContact O-N 3.08Å; E443-S446 WeakPolarHBondContact O-CB 3.49Å; E443-S446 PolarHBondContact O-N 3.5Å; E443-S446 VanDerWaalsContact O-N 3.12Å; E443-S446 PolarHBondContact O-OG 3.06Å; L444-S446 VanDerWaalsContact C-N 3.25Å; L444-S446 PolarHBondContact O-N 2.95Å
447F90.2Very high87.3Confident34 Ų3457.6 Ų57.615%0.14933%0.327CS..Hα-helixtrans-83.9-45.1176.3-56.9-54.1000112.4L327 P328 W331 E443 L444 Y445L327-F447 HydrophobicContact CD2-CD2 3.91Å; L327-F447 HydrophobicContact CD2-CE2 4.24Å; L327-F447 HydrophobicContact CG-CD2 4.4Å; P328-F447 HydrophobicContact CB-CZ 4.01Å; P328-F447 HydrophobicContact CG-CE2 4.43Å; P328-F447 HydrophobicContact CG-CZ 3.95Å; W331-F447 HydrophobicContact CB-CD1 4.13Å; W331-F447 HydrophobicContact CB-CE1 4.37Å; W331-F447 AromaticContact CD1-CD1 3.44Å; W331-F447 VanDerWaalsContact CD1-CD1 3.44Å; W331-F447 HydrophobicContact CD2-CB 3.97Å; W331-F447 HydrophobicContact CD2-CD1 4.12Å; W331-F447 HydrophobicContact CD2-CG 4.33Å; W331-F447 HydrophobicContact CE3-CB 4.29Å; W331-F447 HydrophobicContact CG-CB 4.33Å; W331-F447 AromaticContact CG-CD1 3.59Å; W331-F447 HydrophobicContact CG-CD1 3.59Å; W331-F447 HydrophobicContact CG-CE1 4.22Å; W331-F447 HydrophobicContact CG-CG 4.17Å; W331-F447 WeakPolarHBondContact CH2-O 3.41Å; W331-F447 HydrophobicContact CZ2-CB 4.49Å; W331-F447 WeakPolarHBondContact CZ2-O 3.19Å; W331-F447 AromaticContact NE1-CD1 3.88Å; E443-F447 HydrophobicContact CG-CE2 3.88Å; E443-F447 HydrophobicContact CG-CZ 4.3Å; E443-F447 VanDerWaalsContact O-CD2 3.29Å; E443-F447 WeakPolarHBondContact O-CD2 3.38Å; L444-F447 PolarHBondContact O-N 3.46Å; Y445-F447 VanDerWaalsContact C-N 3.26Å; Y445-F447 PolarHBondContact O-N 3.45Å
448F91.4Very high85.4Confident7 Ų760.7 Ų60.73%0.03135%0.348CS..Hα-helixtrans-102.2-16.8-167.7-62.2-65.7000114.6L327 W331 Y356 I359 L360 V363 L444 S451 L452L327-F448 HydrophobicContact CD1-CZ 4.39Å; L327-F448 HydrophobicContact CD2-CE2 3.88Å; L327-F448 HydrophobicContact CD2-CZ 4.06Å; W331-F448 HydrophobicContact CE3-CE1 4.22Å; W331-F448 HydrophobicContact CE3-CZ 4.49Å; W331-F448 HydrophobicContact CH2-CD1 4.43Å; W331-F448 HydrophobicContact CH2-CE1 4.41Å; W331-F448 HydrophobicContact CZ3-CD1 4.12Å; W331-F448 AromaticContact CZ3-CE1 3.67Å; W331-F448 HydrophobicContact CZ3-CE1 3.67Å; W331-F448 HydrophobicContact CZ3-CZ 4.37Å; Y356-F448 HydrophobicContact CD2-CD1 4.34Å; Y356-F448 HydrophobicContact CD2-CE1 4.22Å; Y356-F448 AromaticContact CE2-CD1 3.57Å; Y356-F448 HydrophobicContact CE2-CD1 3.57Å; Y356-F448 AromaticContact CE2-CE1 3.9Å; Y356-F448 HydrophobicContact CE2-CE1 3.9Å; I359-F448 HydrophobicContact CB-CZ 4.49Å; I359-F448 HydrophobicContact CG2-CE1 3.98Å; I359-F448 HydrophobicContact CG2-CE2 4.38Å; I359-F448 HydrophobicContact CG2-CZ 3.43Å; I359-F448 VanDerWaalsContact CG2-CZ 3.43Å; L360-F448 HydrophobicContact CD2-CB 3.73Å; L360-F448 HydrophobicContact CD2-CD1 3.3Å; L360-F448 HydrophobicContact CD2-CD2 4.25Å; L360-F448 HydrophobicContact CD2-CE1 4.02Å; L360-F448 HydrophobicContact CD2-CG 3.48Å; L360-F448 VanDerWaalsContact CD2-CG 3.48Å; L360-F448 HydrophobicContact CG-CD1 3.86Å; L360-F448 HydrophobicContact CG-CE1 4.22Å; L360-F448 HydrophobicContact CG-CG 4.49Å; V363-F448 HydrophobicContact CG1-CE2 4.42Å; V363-F448 HydrophobicContact CG2-CE2 4.05Å; V363-F448 HydrophobicContact CG2-CZ 4.44Å; L444-F448 HydrophobicContact CB-CD2 4.44Å; L444-F448 HydrophobicContact CD2-CE2 4.01Å; L444-F448 WeakPolarHBondContact O-CD2 3.08Å; L444-F448 PolarHBondContact O-N 3Å; F448-S451 VanDerWaalsContact O-CB 3.31Å; F448-S451 WeakPolarHBondContact O-CB 3.14Å; F448-S451 PolarHBondContact O-N 3.4Å; F448-L452 HydrophobicContact CB-CB 3.75Å
449G89.9Confident83.1Confident22 Ų2259 Ų5923%0.22735%0.347CS..THydrogen-bonded Turntrans50.9-137-178.100000113.3Y445 S451 L452 A453Y445-G449 WeakPolarHBondContact CD2-O 3.43Å; Y445-G449 VanDerWaalsContact CE2-C 3.47Å; Y445-G449 VanDerWaalsContact CE2-O 3.3Å; Y445-G449 WeakPolarHBondContact CE2-O 3.38Å; Y445-G449 VanDerWaalsContact O-CA 3.24Å; Y445-G449 WeakPolarHBondContact O-CA 3.24Å; Y445-G449 PolarHBondContact O-N 2.97Å; G449-S451 PolarHBondContact O-N 3.01Å; G449-L452 WeakPolarHBondContact O-CB 3.26Å; G449-L452 PolarHBondContact O-N 2.73Å; G449-A453 PolarHBondContact O-N 2.96Å
450D88Confident80.7Confident109 Ų10962.8 Ų62.858%0.58337%0.368SS*.Hα-helixtrans-63.6-24.2-175.9-64.3-24.1000113.4Y445 L452 A453 V454Y445-D450 PolarHBondContact OH-OD1 3.18Å; D450-L452 PolarHBondContact O-N 3.35Å; D450-A453 PolarHBondContact O-N 2.92Å; D450-A453 VanDerWaalsContact O-N 3.12Å; D450-V454 VanDerWaalsContact O-CG2 3.32Å; D450-V454 WeakPolarHBondContact O-CG2 3.46Å; D450-V454 PolarHBondContact O-N 3.01Å
451S89.3Confident78.1Confident55 Ų5567.9 Ų67.939%0.38540%0.404SS..Hα-helixtrans-58.4-32.5173.4-59.60000112.1Y356 F448 G449 R455Y356-S451 VanDerWaalsContact OH-CB 3.23Å; Y356-S451 WeakPolarHBondContact OH-CB 3.36Å; Y356-S451 PolarHBondContact OH-OG 3.12Å; Y356-S451 VanDerWaalsContact OH-OG 3.13Å; F448-S451 VanDerWaalsContact O-CB 3.31Å; F448-S451 WeakPolarHBondContact O-CB 3.14Å; F448-S451 PolarHBondContact O-N 3.4Å; G449-S451 PolarHBondContact O-N 3.01Å; S451-R455 WeakPolarHBondContact O-CG 3.1Å
452L89.4Confident75.5Confident0 Ų072.6 Ų72.60%043%0.433CS..Hα-helixtrans-79.3-43.4173.5-173.565.3000111.2V363 L367 Y441 L444 F448 G449 D450 V454 R455 F456V363-L452 HydrophobicContact CG1-CD1 3.99Å; L367-L452 HydrophobicContact CD1-CD1 4.28Å; L367-L452 HydrophobicContact CD1-CD2 4.26Å; Y441-L452 HydrophobicContact CE2-CD2 4.26Å; L444-L452 HydrophobicContact CB-CD2 3.85Å; F448-L452 HydrophobicContact CB-CB 3.75Å; G449-L452 WeakPolarHBondContact O-CB 3.26Å; G449-L452 PolarHBondContact O-N 2.73Å; D450-L452 PolarHBondContact O-N 3.35Å; L452-V454 PolarHBondContact O-N 3.17Å; L452-R455 WeakPolarHBondContact O-CB 3.46Å; L452-R455 PolarHBondContact O-N 3.06Å; L452-F456 HydrophobicContact CD1-CE2 3.8Å; L452-F456 HydrophobicContact CG-CE2 4Å; L452-F456 VanDerWaalsContact O-CD2 3.23Å; L452-F456 WeakPolarHBondContact O-CD2 3.46Å
453A86.1Confident72.6Confident19 Ų1972.1 Ų72.116%0.15744%0.442CS..Hα-helixtrans-62-38.7-177.900000113.6Y445 G449 D450 R455 F456 S457Y445-A453 HydrophobicContact CE2-CB 3.98Å; G449-A453 PolarHBondContact O-N 2.96Å; D450-A453 PolarHBondContact O-N 2.92Å; D450-A453 VanDerWaalsContact O-N 3.12Å; A453-R455 PolarHBondContact O-N 3.07Å; A453-F456 PolarHBondContact O-N 2.99Å; A453-F456 VanDerWaalsContact O-N 3.11Å; A453-S457 PolarHBondContact O-N 3.41Å; A453-S457 PolarHBondContact O-OG 2.95Å
454V86.4Confident69.6Low87 Ų8772.5 Ų72.553%0.52747%0.465SS..THydrogen-bonded Turntrans-61-30.8178.8172.10000112.2D450 L452 F456 S457 T458D450-V454 VanDerWaalsContact O-CG2 3.32Å; D450-V454 WeakPolarHBondContact O-CG2 3.46Å; D450-V454 PolarHBondContact O-N 3.01Å; L452-V454 PolarHBondContact O-N 3.17Å; V454-F456 VanDerWaalsContact C-N 3.27Å; V454-F456 PolarHBondContact O-N 2.88Å; V454-S457 PolarHBondContact O-N 3.37Å; V454-T458 PolarHBondContact O-OG1 3.2Å
455R81.9Confident66.4Low112 Ų11278.4 Ų78.442%0.42351%0.505SS..THydrogen-bonded Turntrans-71.8-18.6178.7-61.2-67-158.6-166.94114.1E364 S451 L452 A453E364-R455 HydrophobicContact CG-CB 4.08Å; E364-R455 WeakPolarHBondContact OE2-CD 3.37Å; E364-R455 IonicContact OE2-NE 2.68Å; S451-R455 WeakPolarHBondContact O-CG 3.1Å; L452-R455 WeakPolarHBondContact O-CB 3.46Å; L452-R455 PolarHBondContact O-N 3.06Å; A453-R455 PolarHBondContact O-N 3.07Å
456F78.1Confident63.5Low74 Ų7479.7 Ų79.733%0.32552%0.524SS..THydrogen-bonded Turntrans-101.2-21.3174.5-64.4-79.7000112.7E364 L367 K368 Y441 L452 A453 V454 T458E364-F456 HydrophobicContact CG-CZ 4.29Å; L367-F456 HydrophobicContact CB-CE1 4.2Å; L367-F456 HydrophobicContact CB-CZ 3.73Å; L367-F456 HydrophobicContact CD1-CE2 3.92Å; L367-F456 HydrophobicContact CD1-CZ 3.66Å; L367-F456 HydrophobicContact CG-CZ 4.37Å; K368-F456 HydrophobicContact CG-CE1 3.81Å; Y441-F456 HydrophobicContact CE2-CD2 4.19Å; Y441-F456 HydrophobicContact CE2-CE2 4.21Å; L452-F456 HydrophobicContact CD1-CE2 3.8Å; L452-F456 HydrophobicContact CG-CE2 4Å; L452-F456 VanDerWaalsContact O-CD2 3.23Å; L452-F456 WeakPolarHBondContact O-CD2 3.46Å; A453-F456 PolarHBondContact O-N 2.99Å; A453-F456 VanDerWaalsContact O-N 3.11Å; V454-F456 VanDerWaalsContact C-N 3.27Å; V454-F456 PolarHBondContact O-N 2.88Å; F456-T458 VanDerWaalsContact C-N 3.33Å; F456-T458 PolarHBondContact O-N 3.09Å
457S60.7Low60.6Low98 Ų9881.8 Ų81.869%0.68554%0.536SS*.THydrogen-bonded Turntrans-84-0.6-176-54.60000114.3A453 V454A453-S457 PolarHBondContact O-N 3.41Å; A453-S457 PolarHBondContact O-OG 2.95Å; V454-S457 PolarHBondContact O-N 3.37Å
458T47.7Very low57.6Low110 Ų11085.8 Ų85.868%0.67557%0.568SS**THydrogen-bonded Turntrans-120.717-172.345.90000115.4V454 F456V454-T458 PolarHBondContact O-OG1 3.2Å; F456-T458 VanDerWaalsContact C-N 3.33Å; F456-T458 PolarHBondContact O-N 3.09Å
459G38Very low54.5Low55 Ų5589.9 Ų89.957%0.56760%0.603SS**SBendtrans-90.6143172.900000112.9S461G459-S461 PolarHBondContact O-N 3.45Å
460P39.5Very low51.7Low128 Ų12894.9 Ų94.983%0.83163%0.632SS**PPolyproline II helixtrans-62.5126.2171.227.2-31.3000108.8L462P460-L462 PolarHBondContact O-N 2.59Å
461S34.3Very low48.9Very low108 Ų10895.3 Ų95.376%0.75564%0.643SS**PPolyproline II helixtrans-48.6120.1178.850.20000111.7G459 G463G459-S461 PolarHBondContact O-N 3.45Å; S461-G463 PolarHBondContact O-N 3.42Å
462L36.7Very low45.9Very low177 Ų177100.9 Ų100.993%0.92766%0.663SS**PPolyproline II helixtrans-55128.7152.1-94.399.6000107.3P460P460-L462 PolarHBondContact O-N 2.59Å
463G30Very low43Very low75 Ų75106.5 Ų106.577%0.77370%0.7SS**SBendtrans-61147.9-160.400000116.1S461S461-G463 PolarHBondContact O-N 3.42Å
464G29.3Very low40.5Very low76 Ų76111.1 Ų111.178%0.78473%0.728SS**  trans79.384.513600000117.7
465C23.8Very low37.5Very low124 Ų124114 Ų11484%0.83874%0.74SS**  trans-147.9134.6137.7-96.80000108.9
466P30.8Very low34.9Very low117 Ų117115.4 Ų115.476%0.7676%0.762SS**PPolyproline II helixtrans-76.1150.6178.133.1-32000109.9S468P466-S468 PolarHBondContact O-N 2.85Å
467P30.9Very low32.5Very low131 Ų131123.2 Ų123.285%0.85179%0.789SS**PPolyproline II helixtrans-73.6126.1178.129.6-30.9000110
468S27.6Very low31Very low118 Ų118128.3 Ų128.383%0.82580%0.799SS**PPolyproline II helixtrans-72.2133.4163.8430000109.7P466P466-S468 PolarHBondContact O-N 2.85Å
469A26.3Very low29.8Very low93 Ų93131.1 Ų131.177%0.76980%0.804SS**PPolyproline II helixtrans-59148.1-175.500000113.7
470P31.6Very low29.8Very low127 Ų127134 Ų13483%0.82581%0.813SS**PPolyproline II helixtrans-82.8131.2170.332.5-29.7000110.8
471S27.8Very low29.8Very low118 Ų118133.2 Ų133.283%0.82581%0.808SS**PPolyproline II helixtrans-78119.2168.4510000110.7
472Q27.7Very low29.3Very low172 Ų172131.4 Ų131.480%0.80481%0.806SS**PPolyproline II helixtrans-70.8163.1165.9-74.4-168.2-22.600112.2
473P27.8Very low29.3Very low118 Ų118129.6 Ų129.677%0.76681%0.805SS**  -142.3-178115.743.5-29.8000112.3
474P32.8Very low29.2Very low116 Ų116130.8 Ų130.875%0.75381%0.807SS**  -116.1168.1-87.628-7.5000114.6
475D25Very low29.2Very low146 Ų146131.9 Ų131.978%0.78181%0.81SS**  trans-26.4137.1176.5-69.1-55.4000120.8
476T27.6Very low29.3Very low143 Ų143133.6 Ų133.688%0.87781%0.81SS**  -151.1109.112644.60000112.6
477R27.6Very low30Very low237 Ų237132.9 Ų132.989%0.89481%0.806SS**  trans16.9123.2146.9-78.4179173.7175.4-1.6119.9
478K28.2Very low29.7Very low205 Ų205133.5 Ų133.589%0.89180%0.802SS**  170.4118.799.2-117.1176.5173.2179.20111
479E23.5Very low29.8Very low169 Ų169134.6 Ų134.679%0.7980%0.804SS**  trans-82.7166.6158.6-121.7-169.3159.600109.6
480P37.2Very low29.9Very low117 Ų117135.9 Ų135.976%0.7680%0.802SS**  -151.2-159.261.946.8-24.2000113.9
481P39.1Very low30Very low111 Ų111141.9 Ų141.972%0.72181%0.809SS**  -115.6178-110.325.5-0.5000114.5
482G24Very low30Very low70 Ų70146.1 Ų146.172%0.72281%0.812SS**  trans-63-164-176.300000117.2
483P37.6Very low30.1Very low138 Ų138145.6 Ų145.690%0.89681%0.812SS**  -147.6-174.552.738.3-15.5000116.7
484A26.4Very low30.5Very low100 Ų100146 Ų14683%0.82681%0.814SS**  trans-62154.9-174.600000118
485A29Very low30.3Very low100 Ų100148 Ų14883%0.82681%0.814SS**  trans-167.7127.4140.900000112.3
486N26.6Very low30.5Very low159 Ų159149.5 Ų149.585%0.8582%0.821SS**  trans-77.2-175.7158.4-84.3-17.8000110.1
487P46.4Very low30.5Very low103 Ų103148.7 Ų148.767%0.66982%0.815SS**  cis-131.6-167-43.335.1-15.4000112.2
488D24.4Very low30.5Very low143 Ų143142.2 Ų142.277%0.76581%0.812SS**  trans82.4112.4158.9-62.8-29000120.2
489T29.7Very low30.5Very low141 Ų141139.9 Ų139.987%0.86581%0.81SS**  -158.7123.5123.75.30000113.2
490T27.3Very low30.7Very low121 Ų121140 Ų14074%0.74282%0.815SS**  trans-50.6150.8163.142.80000113.6
491R34.4Very low30.2Very low253 Ų253141.2 Ų141.296%0.95582%0.815SS**  trans-165.5138.9132.4-102.2157.6-165-160.14.6112.8
492K28.6Very low29.7Very low206 Ų206144.1 Ų144.190%0.89682%0.823SS**  trans-84.7160.9-169-74.1168.7166.9174.40112.4
493M29.7Very low30Very low162 Ų162146 Ų14680%0.79883%0.825SS**  trans-37.8166.3153.6-80.4-175.3174.200114.6
494P35.2Very low30.1Very low126 Ų126144.6 Ų144.682%0.81882%0.816SS**  -132.3143.6121.532.4-18.5000114.2
495Q29.6Very low30.1Very low159 Ų159150.6 Ų150.674%0.74382%0.817SS**  trans-84.8154.9162.4-67.7-150.6-18.500111
496L28.3Very low30.1Very low177 Ų177152.9 Ų152.993%0.92781%0.811SS**  trans-139.7114.3160.6-88.9165.2000111.1
497T27.1Very low30Very low125 Ų125152.5 Ų152.577%0.76781%0.809SS**  trans-77.4149.5158.332.10000111.6
498A28.2Very low29Very low101 Ų101151.5 Ų151.584%0.83582%0.817SS**  -179.2135.2128.200000112.9
499N27.6Very low29.3Very low156 Ų156150.1 Ų150.183%0.83482%0.819SS**  trans-77.5161.5168.1-70.6-32.6000111.9
500L28.5Very low29.8Very low171 Ų171149.5 Ų149.590%0.89582%0.817SS**  179.7145.4120.1-95.7156.6000113.7
501N27.1Very low29.7Very low143 Ų143154.9 Ų154.977%0.76582%0.824SS**  trans-53.5159.8176.4-72.4-31.8000115.5
502I28.9Very low29.4Very low172 Ų172149.4 Ų149.488%0.88282%0.818SS**  -166.3135.8130-84.6136.1000109.9
503S29.7Very low29.2Very low111 Ų111148 Ų14878%0.77682%0.815SS**  trans-124.6151.4158.5-143.90000106
504P39.2Very low29.3Very low108 Ų108145.9 Ų145.970%0.70181%0.814SS**  -156.3165.38637-15.4000117.9
505R27.3Very low29Very low225 Ų225144 Ų14485%0.84981%0.809SS**  trans19.4155.3141.1-60.8-176171.6178.9-2.7120.8
506Q27.7Very low30Very low148 Ų148141.9 Ų141.969%0.69281%0.809SS**  cis-169.616811.9-128.8173.81800110.7
507D25.8Very low30.5Very low152 Ų152139 Ų13981%0.81380%0.801SS**  trans87.6129.9150.4-72.2-11000124.7
508G25.3Very low30.5Very low82 Ų82137.9 Ų137.985%0.84580%0.798SS**  trans145.990.6153.100000116.9
509S30.6Very low30.4Very low114 Ų114141.2 Ų141.280%0.79780%0.801SS**  trans-109.1156.4161.8-1490000108.4
510P39.1Very low30.3Very low128 Ų128137.9 Ų137.983%0.83180%0.795SS**  -152.8169.789.135.7-14.2000117.9
511R26.8Very low30.2Very low234 Ų234133.9 Ų133.988%0.88379%0.786SS**  trans-38.5161.8171.8-76.3174.9163.3-173.5-5.1118.2
512T26.6Very low30.2Very low137 Ų137133.9 Ų133.984%0.8479%0.792SS**  178.9128.4105.6-61.90000112.3
513E25.6Very low30Very low176 Ų176130 Ų13082%0.82279%0.785SS**  trans-87.9155.8161.3-128.5-166.4-155.900108.6
514P31.4Very low30.6Very low119 Ų119131 Ų13177%0.77379%0.789SS**  -157.217877.338.1-15.7000116.7
515A28.6Very low29.9Very low86 Ų86129.2 Ų129.271%0.71179%0.79SS**  trans-100.1-169.6162.600000110.7
516P51.2Low29.9Very low115 Ų115130.1 Ų130.175%0.74779%0.794SS**  cis-125-161.7-25.942.2-23.6000110.6
517P38.9Very low29.8Very low116 Ų116127.7 Ų127.775%0.75379%0.793SS**  -155.2153.269.838-14.1000119.6
518S27Very low29.8Very low102 Ų102128.1 Ų128.171%0.71380%0.795SS**  36.8151.4126.1-40.20000127.3
519L25.9Very low29.7Very low170 Ų170127.7 Ų127.789%0.8978%0.783SS**  trans105.8137.1150.1-61.1173.5000116.7
520A26Very low29.5Very low86 Ų86133.7 Ų133.771%0.71179%0.788SS**  cis-165.4152.3-3.200000112.5
521A25.8Very low28.9Very low87 Ų87131.9 Ų131.972%0.71978%0.778SS**  trans33.7129.7137.500000123.3
522T27.3Very low28.8Very low144 Ų144125.6 Ų125.688%0.88377%0.771SS**  -179.4135.610529.20000112.2
523A25.5Very low28.7Very low90 Ų90123.9 Ų123.974%0.74476%0.764SS**  trans-108.4-170.3160.800000107.3
524P40.3Very low28.7Very low131 Ų131120.7 Ų120.785%0.85176%0.761SS**  cis-144.8178.50.637.5-15.8000116.7
525G25.5Very low28.4Very low71 Ų71120 Ų12073%0.73276%0.759SS**  115.1109.7126.300000120.2
526R28Very low28.3Very low245 Ų245120.5 Ų120.593%0.92576%0.757SS**  155.2110.7111.7-88.3-177.4169.4-177.8-2113.6
527S23.9Very low27.1Very low96 Ų96121.6 Ų121.667%0.67176%0.756SS**  -3.3152.312954.40000119
528L25.7Very low26.6Very low162 Ų162123.5 Ų123.585%0.84875%0.754SS**  cis-177.6152.535-117.1148.4000110.4
529A24.8Very low26.5Very low73 Ų73129.3 Ų129.360%0.60376%0.761SS**  trans76.1129.7133.600000125.6
530R26.2Very low26.6Very low240 Ų240133.2 Ų133.291%0.90676%0.764SS**  65.5152.4128.9-79.8177.4152.8168.8-7.1119.5
531S25.1Very low26.6Very low89 Ų89137 Ų13762%0.62277%0.772SS**  cis179.1143.5-19.146.60000107.8
532S24.7Very low26.6Very low103 Ų103138.8 Ų138.872%0.7278%0.779SS**  trans55.4140.4142.258.10000124.7
533S25.5Very low26.6Very low101 Ų101137.5 Ų137.571%0.70678%0.776SS**  trans95.8115134.632.40000123.3
534S24.6Very low26.6Very low108 Ų108139.3 Ų139.376%0.75578%0.783SS**  trans46.1130.813164.70000122.7
535S26Very low26.1Very low104 Ų104144.5 Ų144.573%0.72779%0.786SS**  158.6130102.565.20000114.4
536S26.1Very low27.1Very low97 Ų97147 Ų14768%0.67879%0.789SS**  trans40.8139.2134.471.10000123.9
537I26.8Very low27Very low138 Ų138139.2 Ų139.271%0.70879%0.785SS**  151.8130120.3-83.5165.8000116.6
538Q27.2Very low27.2Very low156 Ų156143.8 Ų143.873%0.72980%0.796SS**  trans79.2119143.7-81.8165.16.600127.8
539R25.7Very low27.2Very low225 Ų225147.9 Ų147.985%0.84980%0.8SS**  51.6136116.1-70.9-175.4177-178.7-1.4122.8
540R27.2Very low27.3Very low252 Ų252150.1 Ų150.195%0.95181%0.812SS**  -168.5148.4117.2-107.9174.9178.1-175-0.4115.3
541N26.3Very low27.5Very low164 Ų164143.7 Ų143.788%0.87781%0.809SS**  trans-95.8164178.8-90.4-6.1000112.6
542S26.2Very low27.6Very low125 Ų125143 Ų14387%0.87482%0.816SS**  trans-163.1158.1137.4610000113.7
543S27Very low28.1Very low117 Ų117144.2 Ų144.282%0.81882%0.822SS**  trans-133.9157.1-159.951.80000112.5
544S27Very low28.8Very low128 Ų128144.7 Ų144.790%0.89583%0.825SS**  trans-164.8156.514856.20000113.7
545R29.5Very low28.9Very low241 Ų241151.3 Ų151.391%0.90983%0.834SS**  trans-134.4-176.2-163.4-126.7-163.5177.3-171.20.6110.1
546P45.8Very low29.6Very low123 Ų123154 Ų15480%0.79984%0.84SS**  -125.1-169.9-12838.7-16.8000116.4
547G25Very low29.8Very low82 Ų82154.8 Ų154.885%0.84584%0.84SS**  trans-134.9149.4176.900000115.9
548Q29.3Very low29.8Very low192 Ų192158.3 Ų158.390%0.89785%0.851SS**  trans-103.1162.5-167-95.1-178.5-32.900115.7
549R26Very low30Very low247 Ų247156.7 Ų156.793%0.93285%0.852SS**  trans156.3155.3135.8-88.3172.2-176.9-166.21.6109.5
550S27Very low30.2Very low121 Ų121156 Ų15685%0.84686%0.855SS**  cis-177.9155.5-19.21730000106.4
551A29.8Very low30.1Very low104 Ų104147.9 Ų147.986%0.8684%0.842SS**  trans-92.9164.6-168.600000117.1
552G26.2Very low30.3Very low74 Ų74151.9 Ų151.976%0.76385%0.845SS**  trans166.2154.4163.700000115.4
553P37Very low30.6Very low129 Ų129154.9 Ų154.984%0.83884%0.842SS**  trans-113.8169.5-130.240.7-33.2000120.1
554S39.7Very low30.8Very low111 Ų111154.5 Ų154.578%0.77684%0.837SS**  trans-8.9138.3166.155.70000123
555R27.2Very low31.1Very low247 Ų247154.2 Ų154.293%0.93283%0.832SS**  trans-158.8119.1144.3-120.5176.8150.5174.7-6.4112.4
556D40.2Very low31.8Very low160 Ų160148.4 Ų148.486%0.85683%0.826SS**  trans-57129.2166-74.3-51.8000111.3
557V29.9Very low31.6Very low114 Ų114151.7 Ų151.769%0.69183%0.831SS**  trans-161.3104.9140.7-1750000108.5
558F27Very low32.7Very low213 Ų213155.1 Ų155.193%0.93484%0.835SS**  trans-135.2113.6139.3-95.5-74.3000110.2
559T30.4Very low33.8Very low121 Ų121148.6 Ų148.674%0.74282%0.82SS**  trans-61.4134.2174.616.10000111.1A561T559-A561 PolarHBondContact O-N 3.26Å; T559-A561 VanDerWaalsContact O-N 3.14Å
560K30Very low34.6Very low210 Ų210140.9 Ų140.991%0.91380%0.801SS**  trans-61.4106.3173.9-143.6172-171.7173.80109.7
561A26.5Very low35.3Very low83 Ų83139.2 Ų139.269%0.68679%0.788SS**PPolyproline II helixtrans-80.4118.5169.500000109.7T559T559-A561 PolarHBondContact O-N 3.26Å; T559-A561 VanDerWaalsContact O-N 3.14Å
562R28.5Very low35.8Very low247 Ų247138 Ų13893%0.93277%0.77SS**PPolyproline II helixtrans-73.9126.2170.2-76.3-175.2-163.7-176.24.3109.4
563F33.1Very low36.5Very low188 Ų188140.7 Ų140.783%0.82576%0.761SS**PPolyproline II helixtrans-87.9149160.3-73.8-81.3000110.2
564P32.3Very low36.7Very low109 Ų109137.6 Ų137.671%0.70874%0.742SS**PPolyproline II helixtrans-68.8161.5179.730-33.6000111.5
565P33.3Very low36.7Very low122 Ų122137.8 Ų137.879%0.79273%0.729SS**PPolyproline II helixtrans-68159.6-173.729.1-33.9000112.6
566P44Very low37.1Very low120 Ų120131.7 Ų131.778%0.77971%0.714SS**PPolyproline II helixtrans-79.1133.9-161.631.3-33.1000112
567Q41Very low37.4Very low192 Ų192128.9 Ų128.990%0.89770%0.698SS**PPolyproline II helixtrans-75131.2150.5-71.9-161.710.400108.2G569Q567-G569 PolarHBondContact O-N 3.11Å; Q567-G569 VanDerWaalsContact O-N 3.11Å
568T47.9Very low38Very low153 Ų153126.3 Ų126.394%0.93970%0.695SS**SBendtrans-67.499.7-167.4-8.30000111.5
569G52.7Low38.8Very low56 Ų56118.5 Ų118.558%0.57768%0.675SS**SBendtrans169.6149168.400000112.9Q567Q567-G569 PolarHBondContact O-N 3.11Å; Q567-G569 VanDerWaalsContact O-N 3.11Å
570P43.3Very low39.4Very low84 Ų84120.9 Ų120.955%0.54567%0.67SS.*  trans-63.3141.5176.626.4-32.5000110.4T572P570-T572 PolarHBondContact O-N 3.16Å; P570-T572 VanDerWaalsContact O-N 3.12Å; P570-T572 PolarHBondContact O-OG1 3.1Å
571P41.8Very low40Very low87 Ų87118.6 Ų118.657%0.56566%0.663SS**  trans-61120.5-179.525.2-32.9000109.6F573P571-F573 HydrophobicContact CB-CE2 4.22Å
572T40.3Very low40.4Very low78 Ų78123.6 Ų123.648%0.47967%0.674SS.*EExtended strand (participates in β ladder)trans-106.1117.9-178.4-550000108.8P570 Q592P570-T572 PolarHBondContact O-N 3.16Å; P570-T572 VanDerWaalsContact O-N 3.12Å; P570-T572 PolarHBondContact O-OG1 3.1Å; T572-Q592 HydrophobicContact CG2-CG 3.97Å
573F41.4Very low41.5Very low131 Ų131115 Ų11558%0.57566%0.663SS**EExtended strand (participates in β ladder)trans-102.7129.8173.1-70.2-86.4000109.5P571 T593P571-F573 HydrophobicContact CB-CE2 4.22Å; F573-T593 PolarHBondContact O-N 2.83Å
574S39.4Very low41.8Very low63 Ų63116 Ų11644%0.44166%0.661SS.*EExtended strand (participates in β ladder)trans-129.7128173.170.90000110.1
575F40.2Very low42.3Very low115 Ų115120.9 Ų120.950%0.50467%0.665SS.*EExtended strand (participates in β ladder)trans-133.9154.8172.952-91.8000110.4I577 F591F575-I577 HydrophobicContact CD2-CD1 4.31Å; F575-I577 HydrophobicContact CD2-CG1 4.13Å; F575-I577 HydrophobicContact CE2-CD1 4.08Å; F575-I577 HydrophobicContact CE2-CG1 4.41Å; F575-F591 PolarHBondContact N-O 3.08Å; F575-F591 PolarHBondContact O-N 3.4Å
576L36.2Very low43Very low119 Ų119119.1 Ų119.162%0.62366%0.655SS**EExtended strand (participates in β ladder)trans-119.2113.5-169.2-146.3153.5000107.9
577I46.2Very low43Very low101 Ų101122.9 Ų122.952%0.51866%0.662SS.*EExtended strand (participates in β ladder)trans-97.7105.3178.6-58.2178000107.9F575 G588F575-I577 HydrophobicContact CD2-CD1 4.31Å; F575-I577 HydrophobicContact CD2-CG1 4.13Å; F575-I577 HydrophobicContact CE2-CD1 4.08Å; F575-I577 HydrophobicContact CE2-CG1 4.41Å; I577-G588 WeakPolarHBondContact O-CA 3.31Å
578G42.8Very low43.5Very low61 Ų61115.2 Ų115.263%0.62964%0.635SS**  trans-89.6111.1170.200000110.6
579G44.6Very low43.3Very low49 Ų49117.5 Ų117.551%0.50563%0.626SS.*PPolyproline II helixtrans-98.5143.9172.300000112
580R41.5Very low42.7Very low171 Ų171122.8 Ų122.865%0.64563%0.629SS**EExtended strand (participates in β ladder)trans-98.9117.4163.3-68.6-172.5-173.3-144.59.8108.3
581Q42.1Very low42.5Very low161 Ų161123.9 Ų123.975%0.75263%0.625SS**EExtended strand (participates in β ladder)trans-101.6132.4161-99.4-163.3-20.100108.4G583 R584Q581-G583 VanDerWaalsContact C-N 3.33Å; Q581-G583 PolarHBondContact O-N 3.42Å; Q581-G583 VanDerWaalsContact O-N 3.13Å; Q581-R584 PolarHBondContact O-N 3.3Å
582M36Very low42.5Very low189 Ų189125.7 Ų125.793%0.93163%0.626SS**THydrogen-bonded Turntrans42.750.4174.6-93.881.7177.300114.7R584M582-R584 VanDerWaalsContact C-N 3.28Å; M582-R584 PolarHBondContact O-N 3.44Å
583G50.6Low42.4Very low67 Ų67125.1 Ų125.169%0.69162%0.622SS**THydrogen-bonded Turntrans72.1-0.7167.100000117.8Q581Q581-G583 VanDerWaalsContact C-N 3.33Å; Q581-G583 PolarHBondContact O-N 3.42Å; Q581-G583 VanDerWaalsContact O-N 3.13Å
584R40.9Very low42.3Very low207 Ų207123.2 Ų123.278%0.78163%0.626SS**EExtended strand (participates in β ladder)trans-106.5138.9170.2-72.1-169.1179.2-128.91.6111.6Q581 M582 C586Q581-R584 PolarHBondContact O-N 3.3Å; M582-R584 VanDerWaalsContact C-N 3.28Å; M582-R584 PolarHBondContact O-N 3.44Å; R584-C586 PolarHBondContact O-N 3Å
585R41.3Very low42.2Very low212 Ų212126.6 Ų126.680%0.863%0.633SS**EExtended strand (participates in β ladder)trans-73.2116.2176-72.4-171.3-175.3-161.43.6109
586C48.2Very low42.3Very low86 Ų86126.6 Ų126.658%0.58165%0.646SS**PPolyproline II helixtrans-96.8148.2169-63.60000109.8R584 G588R584-C586 PolarHBondContact O-N 3Å; C586-G588 PolarHBondContact O-N 2.97Å
587Q45.6Very low42.5Very low199 Ų199125.8 Ų125.893%0.9365%0.651SS**PPolyproline II helixtrans-66.8119.7170.9-68.4-160.8-5.600109
588G50.2Low42.2Very low31 Ų31126 Ų12632%0.3266%0.659SS.*PPolyproline II helixtrans-63.7152.7-177.200000112.5I577 C586I577-G588 WeakPolarHBondContact O-CA 3.31Å; C586-G588 PolarHBondContact O-N 2.97Å
589R43.7Very low42.1Very low201 Ų201128.6 Ų128.676%0.75867%0.665SS**EExtended strand (participates in β ladder)trans-84.6130.9173.3-71.4-175.3-178.6-177.70.6109.5F591R589-F591 HydrophobicContact CB-CE2 3.88Å; R589-F591 HydrophobicContact CB-CZ 4.22Å; R589-F591 WeakPolarHBondContact O-CD2 3.48Å
590R40.7Very low41.7Very low166 Ų166132 Ų13263%0.62668%0.678SS**EExtended strand (participates in β ladder)trans-83.4124.2175.1-174.1178-179.8168.41.5108.7
591F39.8Very low41.9Very low107 Ų107132.8 Ų132.847%0.46969%0.694SS.*EExtended strand (participates in β ladder)trans-107132.4173.7-66.5-89.9000108.8F575 R589F575-F591 PolarHBondContact N-O 3.08Å; F575-F591 PolarHBondContact O-N 3.4Å; R589-F591 HydrophobicContact CB-CE2 3.88Å; R589-F591 HydrophobicContact CB-CZ 4.22Å; R589-F591 WeakPolarHBondContact O-CD2 3.48Å
592Q40.1Very low41.9Very low126 Ų126129.7 Ų129.759%0.58969%0.69SS**EExtended strand (participates in β ladder)trans-129.1123.5179.3-171.4171.1-500107.4T572T572-Q592 HydrophobicContact CG2-CG 3.97Å
593T39.2Very low42.2Very low65 Ų65127.2 Ų127.240%0.39969%0.686SS.*EExtended strand (participates in β ladder)trans-116.2126.5176.1690000108.4F573F573-T593 PolarHBondContact O-N 2.83Å
594S38.1Very low41.5Very low92 Ų92130.5 Ų130.564%0.64369%0.692SS**EExtended strand (participates in β ladder)trans-108.7122.6172.354.60000108.2S596S594-S596 PolarHBondContact O-N 3.26Å
595F39Very low41.1Very low134 Ų134125.6 Ų125.659%0.58869%0.687SS**  trans-82.6112172-65.2-82000108.5
596S41.6Very low40.8Very low114 Ų114121.7 Ų121.780%0.79769%0.689SS**PPolyproline II helixtrans-76.8134166.2-174.40000108.7S594S594-S596 PolarHBondContact O-N 3.26Å
597S40.8Very low40.3Very low103 Ų103127.5 Ų127.572%0.7270%0.699SS**PPolyproline II helixtrans-63.2136.8167.9-179.20000109.3
598P39.9Very low39.8Very low106 Ų106122.8 Ų122.869%0.68869%0.694SS**PPolyproline II helixtrans-68.8145.3173.127.4-31.5000110.4
599P40.1Very low39Very low114 Ų114129.6 Ų129.674%0.7471%0.711SS**PPolyproline II helixtrans-66.5151.5173.629.3-32.5000110.1
600P36Very low38.4Very low122 Ų122123.5 Ų123.579%0.79270%0.704SS**PPolyproline II helixtrans-63.8142.1-177.825.6-32.3000111.6S602P600-S602 PolarHBondContact O-N 2.74Å; P600-S602 VanDerWaalsContact O-N 3.08Å
601L46.8Very low38.1Very low186 Ų186123.5 Ų123.597%0.97471%0.71SS**  trans-62.8102.8175.6-81153.7000110.7
602S41Very low37.7Very low97 Ų97127.1 Ų127.168%0.67873%0.726SS**  trans-147.4128.6152.569.10000110.6P600P600-S602 PolarHBondContact O-N 2.74Å; P600-S602 VanDerWaalsContact O-N 3.08Å
603T42.7Very low37.5Very low136 Ų136128.4 Ų128.483%0.83474%0.736SS**  trans79.987.1167.868.70000117.8
604V36.1Very low37.2Very low137 Ų137130 Ų13083%0.8375%0.748SS**  trans-130.3126.1150.6-177.60000107.4
605P33.1Very low37.3Very low103 Ų103132.3 Ų132.367%0.66976%0.757SS**  trans-76.3157.9-17832-33.4000111.4R607P605-R607 PolarHBondContact O-N 3.16Å
606P34.6Very low37.3Very low130 Ų130132.7 Ų132.784%0.84476%0.764SS**  trans-68124.5-17927.6-32.4000110.6A608P606-A608 PolarHBondContact O-N 2.69Å
607R38.2Very low36.8Very low209 Ų209129.5 Ų129.579%0.78975%0.749SS**  trans-82.2104172.3-80.6-177.2162.9-176.3-4.8109.5P605 Y609P605-R607 PolarHBondContact O-N 3.16Å; R607-Y609 HydrophobicContact CB-CE2 4.34Å; R607-Y609 PolarHBondContact O-N 2.68Å
608A33.7Very low36.8Very low99 Ų99135 Ų13582%0.81875%0.754SS**  trans-70.7111.6167.200000109.8P606 A610P606-A608 PolarHBondContact O-N 2.69Å; A608-A610 PolarHBondContact O-N 3.19Å
609Y34.5Very low36.5Very low175 Ų175135.1 Ų135.169%0.68675%0.753SS**  trans-87.782.7168.6-83-83.1000109.7R607R607-Y609 HydrophobicContact CB-CE2 4.34Å; R607-Y609 PolarHBondContact O-N 2.68Å
610A31.1Very low36.5Very low73 Ų73133.2 Ų133.260%0.60375%0.753SS**  trans-89.8115155.700000107.9A608A608-A610 PolarHBondContact O-N 3.19Å
611H33.9Very low36.3Very low165 Ų165135.8 Ų135.876%0.76475%0.752SS**  trans153.9119130.2-79.5-58.3000114
612K32.4Very low35.7Very low183 Ų183132 Ų13280%0.79674%0.739SS**  trans67.497.3139.7-60.9-172.7-179.5-1760118.1
613L34.4Very low35.5Very low153 Ų153134.4 Ų134.480%0.80175%0.749SS**  trans-45.3129.3149.4-68.1159.2000111V615L613-V615 PolarHBondContact O-N 2.88Å
614P33Very low35.1Very low100 Ų100138.7 Ų138.765%0.64975%0.75SS**  trans-72.2118.3146.923.5-16.8000107.5I616P614-I616 HydrophobicContact CB-CG1 4.39Å; P614-I616 PolarHBondContact O-N 2.67Å
615V40Very low35.1Very low139 Ų139143.2 Ų143.284%0.84275%0.752SS**  trans-57.3102.9164.9175.40000107.4L613L613-V615 PolarHBondContact O-N 2.88Å
616I40.6Very low35Very low142 Ų142150.3 Ų150.373%0.72877%0.766SS**  trans-100.593.1172.2-61.9174.3000107.3P614P614-I616 HydrophobicContact CB-CG1 4.39Å; P614-I616 PolarHBondContact O-N 2.67Å
617G31.1Very low34.8Very low47 Ų47150.4 Ų150.449%0.48576%0.764SS.*  trans-58154.6173.500000112.5V619G617-V619 PolarHBondContact O-N 3.02Å
618R40.3Very low34.4Very low220 Ų220145.9 Ų145.983%0.8376%0.763SS**  trans-46.6108.8162.2-69.7175.5175.7167.5-1.7109.4G620R618-G620 VanDerWaalsContact C-N 3.31Å; R618-G620 PolarHBondContact O-N 2.85Å
619V34Very low34.2Very low108 Ų108145.4 Ų145.466%0.65575%0.754SS**  trans-95.874.9157.2-173.30000107G617 K621G617-V619 PolarHBondContact O-N 3.02Å; V619-K621 HydrophobicContact CG1-CB 4.27Å; V619-K621 HydrophobicContact CG1-CD 3.65Å; V619-K621 HydrophobicContact CG1-CG 3.54Å; V619-K621 PolarHBondContact O-N 3.44Å
620G38.3Very low33.9Very low73 Ų73145.5 Ų145.575%0.75376%0.76SS**  trans-68.486.8154.200000107.4R618R618-G620 VanDerWaalsContact C-N 3.31Å; R618-G620 PolarHBondContact O-N 2.85Å
621K33Very low33.7Very low176 Ų176151.7 Ų151.777%0.76577%0.769SS**  trans-83.5127.3164.2-88.8168.8-176.7-177.90107.6V619V619-K621 HydrophobicContact CG1-CB 4.27Å; V619-K621 HydrophobicContact CG1-CD 3.65Å; V619-K621 HydrophobicContact CG1-CG 3.54Å; V619-K621 PolarHBondContact O-N 3.44Å
622P33.8Very low33.5Very low107 Ų107148.7 Ų148.770%0.69577%0.767SS**  trans-61.5147.2169.627-32.2000109R624P622-R624 VanDerWaalsContact C-N 3.35Å; P622-R624 PolarHBondContact O-N 3.11Å
623V37.8Very low33.3Very low148 Ų148147.3 Ų147.390%0.89777%0.768SS**  trans-54.797.6172177.50000108.4
624R33.6Very low32.9Very low225 Ų225148.4 Ų148.485%0.84977%0.768SS**  trans-80.3127.4159.7-81-168174.9-150.9-0.3106.9P622 W626P622-R624 VanDerWaalsContact C-N 3.35Å; P622-R624 PolarHBondContact O-N 3.11Å; R624-W626 PolarHBondContact O-N 3.14Å
625R36.3Very low32.7Very low233 Ų233150.5 Ų150.588%0.87977%0.773SS**  trans-42.9134.1167.5-82.1177.8-176.8165.31.2109.3T627R625-T627 PolarHBondContact O-N 2.87Å; R625-T627 VanDerWaalsContact O-N 3.14Å
626W30.4Very low32.2Very low251 Ų251149.7 Ų149.795%0.95177%0.771SS**  trans-57.2117.1173.1-72.434.8000108.6R624R624-W626 PolarHBondContact O-N 3.14Å
627T30.8Very low31.9Very low132 Ų132152.6 Ų152.681%0.8179%0.787SS**  trans-75.5125.5155.844.90000107.1R625 S629R625-T627 PolarHBondContact O-N 2.87Å; R625-T627 VanDerWaalsContact O-N 3.14Å; T627-S629 PolarHBondContact O-N 3.48Å; T627-S629 VanDerWaalsContact O-N 3.14Å
628C30.2Very low31.9Very low115 Ų115157.9 Ų157.978%0.77780%0.802SS**  trans-42.8117.9171.4-1130000110.2H630C628-H630 PolarHBondContact O-N 3.41Å
629S28.3Very low31.5Very low89 Ų89154.6 Ų154.662%0.62280%0.801SS**  trans-78.9108.3165.853.30000107.2T627 Y631T627-S629 PolarHBondContact O-N 3.48Å; T627-S629 VanDerWaalsContact O-N 3.14Å; S629-Y631 VanDerWaalsContact C-N 3.28Å; S629-Y631 PolarHBondContact O-N 3.33Å; S629-Y631 WeakPolarHBondContact OG-CE2 3.43Å
630H28.2Very low31.3Very low177 Ų177157.2 Ų157.282%0.81981%0.809SS**  trans-66.391.2166-74.6-85.9000108C628 S632C628-H630 PolarHBondContact O-N 3.41Å; H630-S632 PolarHBondContact O-N 3.35Å
631Y27.6Very low30.9Very low202 Ų202162.2 Ų162.279%0.79281%0.812SS**  trans-8798.8157.7-77.5-82.6000107.3S629 L633S629-Y631 VanDerWaalsContact C-N 3.28Å; S629-Y631 PolarHBondContact O-N 3.33Å; S629-Y631 WeakPolarHBondContact OG-CE2 3.43Å; Y631-L633 PolarHBondContact O-N 3.2Å; Y631-L633 VanDerWaalsContact O-N 3.15Å
632S28.8Very low30.8Very low102 Ų102161.3 Ų161.371%0.71382%0.815SS**  trans-67.4103.9162.1-70.50000107.7H630 H634H630-S632 PolarHBondContact O-N 3.35Å; S632-H634 PolarHBondContact O-N 3.23Å
633L29.8Very low30.6Very low155 Ų155164.9 Ų164.981%0.81282%0.823SS**  trans-72.687.4159.3-74.3169.5000107Y631 L635Y631-L633 PolarHBondContact O-N 3.2Å; Y631-L633 VanDerWaalsContact O-N 3.15Å; L633-L635 VanDerWaalsContact C-N 3.3Å; L633-L635 PolarHBondContact O-N 3.38Å; L633-L635 VanDerWaalsContact O-N 3.08Å
634H25.5Very low30.1Very low175 Ų175166.1 Ų166.181%0.8182%0.818SS**  trans-66.297.5155.4-102.6-77.3000106.9S632S632-H634 PolarHBondContact O-N 3.23Å
635L29.5Very low29.8Very low144 Ų144161.6 Ų161.675%0.75482%0.815SS**  trans-78.5121154.9-88.8136.4000106.6L633 L637L633-L635 VanDerWaalsContact C-N 3.3Å; L633-L635 PolarHBondContact O-N 3.38Å; L633-L635 VanDerWaalsContact O-N 3.08Å; L635-L637 PolarHBondContact O-N 3.45Å
636P28.5Very low29.3Very low123 Ų123155.7 Ų155.780%0.79981%0.81SS**  trans-66.6122167.127.8-28.7000108.2
637L33.4Very low29.1Very low203 Ų203147 Ų147100%1.06380%0.797SS**  trans-6.70167.4-58.3167.6000118.2M392 L635M392-L637 HydrophobicContact CE-CB 3.86Å; M392-L637 HydrophobicContact CE-CD1 3.59Å; M392-L637 HydrophobicContact CE-CD2 3.27Å; M392-L637 HydrophobicContact CE-CG 3.67Å; M392-L637 HydrophobicContact SD-CB 3.75Å; M392-L637 HydrophobicContact SD-CD1 3.19Å; M392-L637 WeakPolarHBondContact SD-CD1 3.47Å; M392-L637 HydrophobicContact SD-CD2 4.08Å; M392-L637 HydrophobicContact SD-CG 3.77Å; L635-L637 PolarHBondContact O-N 3.45Å

Retrieved 637 of 637 residues in 1989.2 ms (Link to these results)