A0A087XK87_POEFO Loading...

RPE-retinal G protein-coupled receptor

Receptor for all-trans- and 11-cis-retinal. Binds preferentially to the former and may catalyze the isomerization of the chromophore by a retinochrome-like mechanism.

AlphaFold DB , UniProt , Accession A0A087XK87, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 295 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
1M42.4Very low72.9Confident241 Ų241104.1 Ų104.1100%1.18758%0.58SS**  01160-76.2173.6-172.400107T3M1-T3 PolarHBondContact O-N 3.43Å
2V52.3Low74.5Confident136 Ų13699.7 Ų99.782%0.82456%0.562SS**  trans-72.4115.1170.2179.40000105.9
3T56.1Low75.8Confident119 Ų119100.5 Ų100.573%0.7356%0.558SS**PPolyproline II helixtrans-62.3125.4172.341.50000108.2M1 Y5M1-T3 PolarHBondContact O-N 3.43Å; T3-Y5 PolarHBondContact O-N 2.69Å
4P66.3Low76.9Confident90 Ų90104 Ų10458%0.58457%0.565SS**PPolyproline II helixtrans-58.814017723.4-31.5000109.5
5Y75.8Confident77.9Confident118 Ų11899 Ų9946%0.46354%0.538SS..PPolyproline II helixtrans-56.8139.9176.1-81-91.4000110.1T3 Y80T3-Y5 PolarHBondContact O-N 2.69Å; Y5-Y80 HydrophobicContact CD1-CD1 4.46Å; Y5-Y80 HydrophobicContact CD1-CG 4.31Å; Y5-Y80 AromaticContact CD2-CD1 3.27Å; Y5-Y80 HydrophobicContact CD2-CD1 3.27Å; Y5-Y80 AromaticContact CD2-CE1 3.63Å; Y5-Y80 HydrophobicContact CD2-CE1 3.63Å; Y5-Y80 AromaticContact CD2-CG 3.91Å; Y5-Y80 HydrophobicContact CD2-CG 3.91Å; Y5-Y80 HydrophobicContact CE1-CG 4.35Å; Y5-Y80 AromaticContact CE2-CD1 3.44Å; Y5-Y80 HydrophobicContact CE2-CD1 3.44Å; Y5-Y80 VanDerWaalsContact CE2-CD1 3.44Å; Y5-Y80 HydrophobicContact CE2-CD2 4.34Å; Y5-Y80 AromaticContact CE2-CE1 3.37Å; Y5-Y80 HydrophobicContact CE2-CE1 3.37Å; Y5-Y80 HydrophobicContact CE2-CE2 4.25Å; Y5-Y80 AromaticContact CE2-CG 3.97Å; Y5-Y80 HydrophobicContact CE2-CG 3.97Å; Y5-Y80 AromaticContact CE2-CZ 3.82Å; Y5-Y80 AromaticContact CG-CD1 3.84Å; Y5-Y80 HydrophobicContact CG-CD1 3.84Å; Y5-Y80 HydrophobicContact CG-CG 4.09Å
6P80.4Confident78.8Confident113 Ų11393 Ų9373%0.73451%0.505SS*.PPolyproline II helixtrans-62140.9179.126.6-33.6000110.1
7L84.6Confident79.7Confident55 Ų5594.9 Ų94.929%0.28851%0.508SS..PPolyproline II helixtrans-70143.1178.2-62175.6000110.5E13 V16 R79L7-E13 HydrophobicContact CD1-CG 3.81Å; L7-V16 HydrophobicContact CD2-CG2 3.74Å; L7-R79 HydrophobicContact CD2-CG 4.43Å
8P84.3Confident80.5Confident24 Ų2491.6 Ų91.616%0.15649%0.494CS..PPolyproline II helixtrans-59148.4168.5-19.130.2000111.5G10 F11 L158P8-G10 PolarHBondContact O-N 2.78Å; P8-F11 HydrophobicContact CB-CD2 4.06Å; P8-F11 PolarHBondContact O-N 3.48Å; P8-L158 HydrophobicContact CG-CD1 4.39Å; P8-L158 VanDerWaalsContact CG-O 3.32Å; P8-L158 WeakPolarHBondContact CG-O 3.24Å
9E83.2Confident81.2Confident186 Ų18688.2 Ų88.287%0.86948%0.475SS*.THydrogen-bonded Turntrans-57.2134.1-178.8-167.8178.2178.200111.7
10G85.6Confident81.9Confident46 Ų4683.8 Ų83.847%0.47445%0.451SS..THydrogen-bonded Turntrans86.73.5-179.700000115.7P8 K245P8-G10 PolarHBondContact O-N 2.78Å; G10-K245 WeakPolarHBondContact O-CE 3.42Å
11F90.9Very high82.6Confident17 Ų1781.5 Ų81.58%0.07544%0.441CS..  trans-117.2137.9175.6-64.4-86000112.8P8 D15 V16 L19 P157 L158 P244 K245 M248P8-F11 HydrophobicContact CB-CD2 4.06Å; P8-F11 PolarHBondContact O-N 3.48Å; F11-D15 HydrophobicContact CB-CB 4.48Å; F11-D15 HydrophobicContact CD1-CB 4Å; F11-V16 HydrophobicContact CB-CG2 4.14Å; F11-L19 HydrophobicContact CD1-CD1 4.11Å; F11-L19 HydrophobicContact CE1-CD1 3.82Å; F11-P157 HydrophobicContact CE2-CB 4.34Å; F11-P157 HydrophobicContact CZ-CB 4.42Å; F11-L158 HydrophobicContact CB-CD1 4.3Å; F11-L158 HydrophobicContact CD1-CD1 3.82Å; F11-L158 HydrophobicContact CD2-CD1 4.02Å; F11-L158 HydrophobicContact CE1-CD1 4.08Å; F11-L158 HydrophobicContact CE2-CB 4.43Å; F11-L158 HydrophobicContact CE2-CD1 4.25Å; F11-L158 HydrophobicContact CG-CD1 3.78Å; F11-L158 HydrophobicContact CZ-CB 4.22Å; F11-L158 HydrophobicContact CZ-CD1 4.29Å; F11-P244 HydrophobicContact CD2-CB 4.42Å; F11-P244 HydrophobicContact CE2-CB 3.5Å; F11-P244 HydrophobicContact CZ-CB 3.69Å; F11-K245 HydrophobicContact CD1-CG 4.44Å; F11-K245 HydrophobicContact CE1-CG 4.18Å; F11-M248 HydrophobicContact CE1-CG 3.9Å; F11-M248 HydrophobicContact CZ-CG 3.66Å
12S92.5Very high85.1Confident51 Ų5172.8 Ų72.836%0.35740%0.404SS..  trans-93.8165167.369.50000111.1F14 D15 V16S12-F14 PolarHBondContact O-N 3.29Å; S12-D15 VanDerWaalsContact CB-OD2 3.31Å; S12-D15 WeakPolarHBondContact CB-OD2 3.4Å; S12-D15 PolarHBondContact N-OD2 2.68Å; S12-D15 WeakPolarHBondContact O-CB 3.48Å; S12-D15 PolarHBondContact O-N 3.07Å; S12-D15 PolarHBondContact OG-N 3.28Å; S12-D15 PolarHBondContact OG-OD2 3.41Å; S12-V16 WeakPolarHBondContact O-CG2 3.49Å; S12-V16 PolarHBondContact O-N 2.91Å; S12-V16 VanDerWaalsContact O-N 3.11Å
13E90.5Very high87.2Confident110 Ų11066.5 Ų66.551%0.51437%0.365SS..Hα-helixtrans-56.8-38174.5-64.5-164.8143.600112.3L7 D15 V16 F17 R79L7-E13 HydrophobicContact CD1-CG 3.81Å; E13-D15 VanDerWaalsContact C-N 3.35Å; E13-V16 PolarHBondContact O-N 3.13Å; E13-F17 WeakPolarHBondContact O-CB 3.39Å; E13-F17 PolarHBondContact O-N 3.37Å; E13-R79 IonicContact OE1-CZ 3.66Å; E13-R79 VanDerWaalsContact OE1-CZ 3.24Å; E13-R79 IonicContact OE1-NH1 2.74Å; E13-R79 PolarHBondContact OE1-NH1 3.3Å; E13-R79 IonicContact OE1-NH2 3.74Å; E13-R79 PolarHBondContact OE1-NH2 3.36Å; E13-R79 IonicContact OE2-NH2 3.69Å
14F91.8Very high89.2Confident150 Ų15063.5 Ų63.566%0.65835%0.345SS*.Hα-helixtrans-64.3-39.8176.7-179.8-99.1000111.8S12 S18S12-F14 PolarHBondContact O-N 3.29Å; F14-S18 WeakPolarHBondContact CZ-OG 3.19Å; F14-S18 WeakPolarHBondContact O-CB 3.27Å; F14-S18 PolarHBondContact O-N 2.89Å; F14-S18 PolarHBondContact O-OG 3.39Å
15D92.3Very high90.7Very high29 Ų2963.7 Ų63.716%0.15534%0.344CS..Hα-helixtrans-62.2-50.1176.5-60.3-63.8000110.2F11 S12 E13 F17 S18 L19 K245F11-D15 HydrophobicContact CB-CB 4.48Å; F11-D15 HydrophobicContact CD1-CB 4Å; S12-D15 VanDerWaalsContact CB-OD2 3.31Å; S12-D15 WeakPolarHBondContact CB-OD2 3.4Å; S12-D15 PolarHBondContact N-OD2 2.68Å; S12-D15 WeakPolarHBondContact O-CB 3.48Å; S12-D15 PolarHBondContact O-N 3.07Å; S12-D15 PolarHBondContact OG-N 3.28Å; S12-D15 PolarHBondContact OG-OD2 3.41Å; E13-D15 VanDerWaalsContact C-N 3.35Å; D15-F17 PolarHBondContact O-N 3.47Å; D15-S18 PolarHBondContact O-N 3.28Å; D15-L19 WeakPolarHBondContact O-CB 3.26Å; D15-L19 WeakPolarHBondContact O-CD1 3.44Å; D15-L19 WeakPolarHBondContact O-CG 3.19Å; D15-L19 PolarHBondContact O-N 3.27Å; D15-K245 IonicContact OD1-NZ 2.85Å; D15-K245 PolarHBondContact OD1-NZ 2.87Å; D15-K245 VanDerWaalsContact OD2-CE 3.29Å; D15-K245 WeakPolarHBondContact OD2-CE 3.29Å; D15-K245 IonicContact OD2-NZ 2.72Å; D15-K245 PolarHBondContact OD2-NZ 2.99Å
16V92.6Very high91.6Very high3 Ų359.6 Ų59.62%0.01833%0.329CS..Hα-helixtrans-61.2-47.7-178.6-174.90000111.1L7 F11 S12 E13 S18 L19 G20 S76 R79 L158L7-V16 HydrophobicContact CD2-CG2 3.74Å; F11-V16 HydrophobicContact CB-CG2 4.14Å; S12-V16 WeakPolarHBondContact O-CG2 3.49Å; S12-V16 PolarHBondContact O-N 2.91Å; S12-V16 VanDerWaalsContact O-N 3.11Å; E13-V16 PolarHBondContact O-N 3.13Å; V16-S18 PolarHBondContact O-N 2.92Å; V16-L19 PolarHBondContact O-N 3.21Å; V16-G20 PolarHBondContact O-N 2.99Å; V16-S76 VanDerWaalsContact CG1-O 3.25Å; V16-S76 WeakPolarHBondContact CG1-O 3.23Å; V16-S76 WeakPolarHBondContact CG1-OG 3.39Å; V16-S76 PolarHBondContact O-OG 3.16Å; V16-R79 HydrophobicContact CG1-CG 4.33Å; V16-L158 HydrophobicContact CB-CD1 4.43Å; V16-L158 HydrophobicContact CG1-CD1 4.35Å; V16-L158 HydrophobicContact CG2-CD1 3.68Å
17F93.4Very high92.4Very high126 Ų12654.2 Ų54.255%0.55329%0.294SS*.Hα-helixtrans-60.9-43.1177.5178.8-98.6000112.4E13 D15 S21 F77E13-F17 WeakPolarHBondContact O-CB 3.39Å; E13-F17 PolarHBondContact O-N 3.37Å; D15-F17 PolarHBondContact O-N 3.47Å; F17-S21 WeakPolarHBondContact O-CB 3.14Å; F17-S21 PolarHBondContact O-N 3.48Å; F17-S21 PolarHBondContact O-OG 3.46Å; F17-F77 HydrophobicContact CD2-CD1 4.25Å; F17-F77 HydrophobicContact CD2-CE1 4.01Å; F17-F77 HydrophobicContact CE2-CE1 4.1Å
18S94.3Very high93Very high35 Ų3556 Ų5625%0.24530%0.304CS..Hα-helixtrans-65.7-45.8179.2-60.90000111.4F14 D15 V16 S21 C22F14-S18 WeakPolarHBondContact CZ-OG 3.19Å; F14-S18 WeakPolarHBondContact O-CB 3.27Å; F14-S18 PolarHBondContact O-N 2.89Å; F14-S18 PolarHBondContact O-OG 3.39Å; D15-S18 PolarHBondContact O-N 3.28Å; V16-S18 PolarHBondContact O-N 2.92Å; S18-S21 PolarHBondContact O-N 3.16Å; S18-C22 PolarHBondContact O-N 3.25Å; S18-C22 PolarHBondContact O-SG 2.87Å
19L93.3Very high93.6Very high27 Ų2758.7 Ų58.714%0.14132%0.316CS..Hα-helixtrans-62.2-45.3178.1-67.3167.2000111.1F11 D15 V16 S21 C22 L23 L158 M248 I252F11-L19 HydrophobicContact CD1-CD1 4.11Å; F11-L19 HydrophobicContact CE1-CD1 3.82Å; D15-L19 WeakPolarHBondContact O-CB 3.26Å; D15-L19 WeakPolarHBondContact O-CD1 3.44Å; D15-L19 WeakPolarHBondContact O-CG 3.19Å; D15-L19 PolarHBondContact O-N 3.27Å; V16-L19 PolarHBondContact O-N 3.21Å; L19-S21 VanDerWaalsContact C-N 3.33Å; L19-S21 PolarHBondContact O-N 3.08Å; L19-C22 PolarHBondContact O-N 2.89Å; L19-L23 WeakPolarHBondContact O-CB 3.31Å; L19-L23 VanDerWaalsContact O-CG 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.28Å; L19-L23 PolarHBondContact O-N 3.43Å; L19-L158 HydrophobicContact CB-CD2 4.1Å; L19-L158 HydrophobicContact CD1-CD2 3.74Å; L19-M248 HydrophobicContact CD1-CG 4.47Å; L19-M248 HydrophobicContact CD2-CB 4.32Å; L19-I252 HydrophobicContact CD2-CD1 3.18Å
20G95.4Very high94.3Very high0 Ų049.9 Ų49.90%028%0.275CS..Hα-helixtrans-60.4-41.8174.400000112.6V16 L23 L24 A73 S76V16-G20 PolarHBondContact O-N 2.99Å; G20-L23 PolarHBondContact O-N 2.97Å; G20-L24 WeakPolarHBondContact O-CB 3.45Å; G20-L24 PolarHBondContact O-N 3.05Å; G20-A73 WeakPolarHBondContact O-CB 3.38Å; G20-S76 PolarHBondContact N-OG 3.21Å
21S96.6Very high94.9Very high35 Ų3551.7 Ų51.725%0.24527%0.27CS..Hα-helixtrans-65.8-43.5177.6-59.70000112.4F17 S18 L19 L24 V25F17-S21 WeakPolarHBondContact O-CB 3.14Å; F17-S21 PolarHBondContact O-N 3.48Å; F17-S21 PolarHBondContact O-OG 3.46Å; S18-S21 PolarHBondContact O-N 3.16Å; L19-S21 VanDerWaalsContact C-N 3.33Å; L19-S21 PolarHBondContact O-N 3.08Å; S21-L24 PolarHBondContact O-N 2.93Å; S21-V25 VanDerWaalsContact O-CG2 3.32Å; S21-V25 WeakPolarHBondContact O-CG2 3.43Å; S21-V25 PolarHBondContact O-N 2.82Å
22C96.1Very high95.2Very high58 Ų5856.1 Ų56.139%0.39229%0.294SS..Hα-helixtrans-59.7-49.5175.4-68.40000111.3S18 L19 L24 V25 E26S18-C22 PolarHBondContact O-N 3.25Å; S18-C22 PolarHBondContact O-SG 2.87Å; L19-C22 PolarHBondContact O-N 2.89Å; C22-L24 VanDerWaalsContact C-N 3.3Å; C22-L24 PolarHBondContact O-N 3.01Å; C22-V25 PolarHBondContact O-N 2.88Å; C22-E26 WeakPolarHBondContact O-CB 3.43Å; C22-E26 VanDerWaalsContact O-CG 3.29Å; C22-E26 WeakPolarHBondContact O-CG 3.47Å; C22-E26 PolarHBondContact O-N 2.96Å
23L96.3Very high95.3Very high4 Ų456.1 Ų56.12%0.02129%0.29CS..Hα-helixtrans-59.9-39178-71170.6000112.4L19 G20 G27 A69 A72 A73 I252 K255L19-L23 WeakPolarHBondContact O-CB 3.31Å; L19-L23 VanDerWaalsContact O-CG 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.28Å; L19-L23 PolarHBondContact O-N 3.43Å; G20-L23 PolarHBondContact O-N 2.97Å; L23-G27 PolarHBondContact O-N 3.1Å; L23-A69 HydrophobicContact CD2-CB 4.4Å; L23-A72 HydrophobicContact CD1-CB 3.97Å; L23-A73 HydrophobicContact CB-CB 3.81Å; L23-I252 HydrophobicContact CD2-CG1 4.31Å; L23-K255 HydrophobicContact CD2-CD 3.48Å; L23-K255 VanDerWaalsContact CD2-CD 3.48Å
24L97.6Very high95.7Very high57 Ų5751 Ų5130%0.29827%0.266SS..Hα-helixtrans-66.2-48.2176.6-177.763.3000111.4G20 S21 C22 G27 L28 T70 A73 F77G20-L24 WeakPolarHBondContact O-CB 3.45Å; G20-L24 PolarHBondContact O-N 3.05Å; S21-L24 PolarHBondContact O-N 2.93Å; C22-L24 VanDerWaalsContact C-N 3.3Å; C22-L24 PolarHBondContact O-N 3.01Å; L24-G27 PolarHBondContact O-N 3.32Å; L24-L28 HydrophobicContact CD1-CD1 3.86Å; L24-L28 HydrophobicContact CD1-CG 4Å; L24-L28 HydrophobicContact CG-CD1 3.92Å; L24-L28 HydrophobicContact CG-CG 4.38Å; L24-L28 WeakPolarHBondContact O-CB 3.29Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.09Å; L24-T70 HydrophobicContact CD1-CG2 4.29Å; L24-A73 HydrophobicContact CB-CB 3.87Å; L24-F77 HydrophobicContact CB-CE2 4.43Å; L24-F77 HydrophobicContact CD2-CE2 4.07Å; L24-F77 HydrophobicContact CD2-CZ 4.34Å
25V97.1Very high95.9Very high94 Ų9445.1 Ų45.157%0.5725%0.245SC*.Hα-helixtrans-62-47.1-179.6169.80000110.6S21 C22 L29S21-V25 VanDerWaalsContact O-CG2 3.32Å; S21-V25 WeakPolarHBondContact O-CG2 3.43Å; S21-V25 PolarHBondContact O-N 2.82Å; C22-V25 PolarHBondContact O-N 2.88Å; V25-L29 WeakPolarHBondContact O-CB 3.45Å; V25-L29 PolarHBondContact O-N 3.38Å
26E95.3Very high96Very high31 Ų3146.2 Ų46.215%0.14525%0.253CS..Hα-helixtrans-62.9-44.4176.9-70.5168.2-171.400111.8C22 G30 I252 T256C22-E26 WeakPolarHBondContact O-CB 3.43Å; C22-E26 VanDerWaalsContact O-CG 3.29Å; C22-E26 WeakPolarHBondContact O-CG 3.47Å; C22-E26 PolarHBondContact O-N 2.96Å; E26-G30 PolarHBondContact O-N 2.83Å; E26-I252 WeakPolarHBondContact OE1-CG2 3.09Å; E26-T256 VanDerWaalsContact CD-CG2 3.47Å; E26-T256 HydrophobicContact CG-CG2 4.1Å; E26-T256 VanDerWaalsContact OE1-CG2 3.23Å; E26-T256 WeakPolarHBondContact OE1-CG2 3.44Å
27G97.3Very high96.1Very high1 Ų146.2 Ų46.21%0.0125%0.253CS..Hα-helixtrans-59.2-50177.100000112.2L23 L24 F31 C66L23-G27 PolarHBondContact O-N 3.1Å; L24-G27 PolarHBondContact O-N 3.32Å; G27-F31 WeakPolarHBondContact O-CB 3.49Å; G27-F31 PolarHBondContact O-N 2.78Å; G27-C66 WeakPolarHBondContact O-CB 3.46Å
28L97.8Very high96.3Very high92 Ų9241.9 Ų41.948%0.48224%0.235SC..Hα-helixtrans-68.5-46.2-179.6-67.6177.2000112.3L24 F31 L32L24-L28 HydrophobicContact CD1-CD1 3.86Å; L24-L28 HydrophobicContact CD1-CG 4Å; L24-L28 HydrophobicContact CG-CD1 3.92Å; L24-L28 HydrophobicContact CG-CG 4.38Å; L24-L28 WeakPolarHBondContact O-CB 3.29Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.09Å; L28-F31 PolarHBondContact O-N 2.89Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.05Å; L28-L32 PolarHBondContact O-N 3.32Å
29L97.1Very high96.4Very high81 Ų8143.2 Ų43.242%0.42424%0.242SC..Hα-helixtrans-64.4-48.8-179.6178.859.2000111.2V25 F31 L32 L33 T259V25-L29 WeakPolarHBondContact O-CB 3.45Å; V25-L29 PolarHBondContact O-N 3.38Å; L29-F31 VanDerWaalsContact C-N 3.29Å; L29-F31 PolarHBondContact O-N 3.28Å; L29-L32 PolarHBondContact O-N 3.35Å; L29-L33 HydrophobicContact CD1-CD1 4.01Å; L29-L33 HydrophobicContact CD1-CG 4.21Å; L29-L33 HydrophobicContact CG-CD1 4.02Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.23Å; L29-T259 HydrophobicContact CD2-CG2 3.63Å; L29-T259 HydrophobicContact CG-CG2 3.98Å
30G97.5Very high96.4Very high0 Ų042 Ų420%024%0.235CC..Hα-helixtrans-60.6-40176.400000111.6E26 L33 N34 C66E26-G30 PolarHBondContact O-N 2.83Å; G30-L33 PolarHBondContact O-N 3.44Å; G30-N34 WeakPolarHBondContact O-CB 3.47Å; G30-N34 PolarHBondContact O-N 2.66Å; G30-N34 PolarHBondContact O-ND2 3.24Å; G30-C66 VanDerWaalsContact CA-SG 3.53Å
31F97.6Very high96.3Very high85 Ų8542.9 Ų42.937%0.37324%0.239SC..Hα-helixtrans-60.8-49.3176.8-176.6-83.8000111.5G27 L28 L29 L33 N34 A35 I63 C66 M67G27-F31 WeakPolarHBondContact O-CB 3.49Å; G27-F31 PolarHBondContact O-N 2.78Å; L28-F31 PolarHBondContact O-N 2.89Å; L29-F31 VanDerWaalsContact C-N 3.29Å; L29-F31 PolarHBondContact O-N 3.28Å; F31-L33 PolarHBondContact O-N 3.18Å; F31-N34 PolarHBondContact O-N 3.32Å; F31-A35 HydrophobicContact CD1-CB 4.46Å; F31-A35 HydrophobicContact CE1-CB 4.3Å; F31-A35 WeakPolarHBondContact O-CB 3.36Å; F31-A35 PolarHBondContact O-N 2.83Å; F31-I63 HydrophobicContact CB-CD1 4.38Å; F31-I63 HydrophobicContact CD2-CD1 3.52Å; F31-I63 HydrophobicContact CD2-CG2 4.13Å; F31-I63 HydrophobicContact CE2-CD1 3.84Å; F31-I63 HydrophobicContact CE2-CG2 3.96Å; F31-I63 HydrophobicContact CG-CD1 3.9Å; F31-I63 HydrophobicContact CZ-CD1 4.44Å; F31-I63 WeakPolarHBondContact O-CD1 3.4Å; F31-C66 HydrophobicContact CB-CB 4.09Å; F31-C66 PolarHBondContact N-SG 3.37Å; F31-M67 HydrophobicContact CE2-CE 4.1Å
32L96.9Very high96.3Very high110 Ų11045.4 Ų45.458%0.57625%0.249SC*.Hα-helixtrans-60.6-47-179.7-70.3170.9000111.9L28 L29 N34 A35 V36L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.05Å; L28-L32 PolarHBondContact O-N 3.32Å; L29-L32 PolarHBondContact O-N 3.35Å; L32-N34 PolarHBondContact O-N 2.9Å; L32-A35 PolarHBondContact O-N 3.34Å; L32-V36 WeakPolarHBondContact O-CG2 3.37Å; L32-V36 PolarHBondContact O-N 3.4Å
33L95.8Very high96.2Very high50 Ų5050.1 Ų50.126%0.26226%0.263SS..Hα-helixtrans-63.9-40.7-179.3-67.9171.6000112.4L29 G30 F31 T37 T259 P262L29-L33 HydrophobicContact CD1-CD1 4.01Å; L29-L33 HydrophobicContact CD1-CG 4.21Å; L29-L33 HydrophobicContact CG-CD1 4.02Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.23Å; G30-L33 PolarHBondContact O-N 3.44Å; F31-L33 PolarHBondContact O-N 3.18Å; L33-T37 PolarHBondContact O-N 3.45Å; L33-T37 PolarHBondContact O-OG1 3.01Å; L33-T259 HydrophobicContact CD1-CG2 3.95Å; L33-P262 HydrophobicContact CB-CB 4.04Å; L33-P262 HydrophobicContact CB-CG 3.9Å
34N97.4Very high96Very high2 Ų250.3 Ų50.31%0.01126%0.264CS..Hα-helixtrans-76.3-31.7177.8-73.6-72.3000112.3G30 F31 L32 T37 I38 A59 I63 P258 P262G30-N34 WeakPolarHBondContact O-CB 3.47Å; G30-N34 PolarHBondContact O-N 2.66Å; G30-N34 PolarHBondContact O-ND2 3.24Å; F31-N34 PolarHBondContact O-N 3.32Å; L32-N34 PolarHBondContact O-N 2.9Å; N34-T37 WeakPolarHBondContact O-CB 3.27Å; N34-T37 PolarHBondContact O-N 3.34Å; N34-I38 WeakPolarHBondContact O-CG1 3.2Å; N34-I38 PolarHBondContact O-N 2.96Å; N34-A59 HydrophobicContact CB-CB 4.1Å; N34-A59 WeakPolarHBondContact OD1-CA 3.21Å; N34-I63 HydrophobicContact CB-CD1 3.78Å; N34-I63 HydrophobicContact CB-CG1 3.89Å; N34-P258 PolarHBondContact ND2-O 3.36Å; N34-P262 WeakPolarHBondContact OD1-CG 3.44Å
35A96.9Very high95.7Very high28 Ų2857.2 Ų57.223%0.23129%0.287CS..Hα-helixtrans-63.4-43.4172.500000111.2F31 L32 T37 I38 V39F31-A35 HydrophobicContact CD1-CB 4.46Å; F31-A35 HydrophobicContact CE1-CB 4.3Å; F31-A35 WeakPolarHBondContact O-CB 3.36Å; F31-A35 PolarHBondContact O-N 2.83Å; L32-A35 PolarHBondContact O-N 3.34Å; A35-T37 VanDerWaalsContact C-N 3.28Å; A35-T37 PolarHBondContact O-N 2.96Å; A35-I38 PolarHBondContact O-N 3.01Å; A35-V39 WeakPolarHBondContact O-CB 3.44Å; A35-V39 VanDerWaalsContact O-CG2 3.27Å; A35-V39 WeakPolarHBondContact O-CG2 3.42Å; A35-V39 PolarHBondContact O-N 3.46Å
36V94.8Very high95.3Very high51 Ų5157.6 Ų57.631%0.30928%0.282SS..Hα-helixtrans-58.1-43.2172.9170.80000110.8L32 V39 A40 I276 L279L32-V36 WeakPolarHBondContact O-CG2 3.37Å; L32-V36 PolarHBondContact O-N 3.4Å; V36-V39 PolarHBondContact O-N 3.17Å; V36-A40 WeakPolarHBondContact O-CB 3.25Å; V36-A40 PolarHBondContact O-N 3.03Å; V36-I276 HydrophobicContact CG1-CG2 4.27Å; V36-L279 HydrophobicContact CG1-CD2 4.48Å
37T94.5Very high95.2Very high4 Ų456.3 Ų56.33%0.02528%0.276CS..Hα-helixtrans-59.1-48.7176.6-67.50000112.4L33 N34 A35 A40 F41 V55 A59 Y272L33-T37 PolarHBondContact O-N 3.45Å; L33-T37 PolarHBondContact O-OG1 3.01Å; N34-T37 WeakPolarHBondContact O-CB 3.27Å; N34-T37 PolarHBondContact O-N 3.34Å; A35-T37 VanDerWaalsContact C-N 3.28Å; A35-T37 PolarHBondContact O-N 2.96Å; T37-A40 PolarHBondContact O-N 2.76Å; T37-F41 PolarHBondContact O-N 3.35Å; T37-F41 VanDerWaalsContact O-N 3.09Å; T37-V55 HydrophobicContact CG2-CG1 4.11Å; T37-A59 HydrophobicContact CG2-CB 3.44Å; T37-A59 VanDerWaalsContact CG2-CB 3.44Å; T37-Y272 WeakPolarHBondContact CA-OH 3.32Å; T37-Y272 WeakPolarHBondContact CB-OH 3.45Å; T37-Y272 WeakPolarHBondContact CG2-OH 3.43Å; T37-Y272 PolarHBondContact OG1-OH 3.42Å
38I96.7Very high95.1Very high35 Ų3562.1 Ų62.118%0.17930%0.298CS..Hα-helixtrans-61.2-50.8178.1-73168.7000110.3N34 A35 A40 F41 L42 F56 A59 M60 I63N34-I38 WeakPolarHBondContact O-CG1 3.2Å; N34-I38 PolarHBondContact O-N 2.96Å; A35-I38 PolarHBondContact O-N 3.01Å; I38-A40 VanDerWaalsContact C-N 3.33Å; I38-A40 PolarHBondContact O-N 3Å; I38-F41 PolarHBondContact O-N 2.88Å; I38-L42 HydrophobicContact CG2-CD1 3.89Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.4Å; I38-L42 PolarHBondContact O-N 2.91Å; I38-F56 HydrophobicContact CB-CE2 4.43Å; I38-F56 HydrophobicContact CG1-CD2 4.3Å; I38-F56 HydrophobicContact CG1-CE2 4.33Å; I38-F56 HydrophobicContact CG2-CE2 3.97Å; I38-A59 HydrophobicContact CD1-CB 4.31Å; I38-A59 HydrophobicContact CG1-CB 3.88Å; I38-M60 HydrophobicContact CD1-CG 4.16Å; I38-I63 HydrophobicContact CD1-CG1 3.76Å
39V95.8Very high95Very high63 Ų6360.1 Ų60.138%0.38229%0.289SS..Hα-helixtrans-62.6-40.7-179.4174.20000111A35 V36 L42 K43 L279A35-V39 WeakPolarHBondContact O-CB 3.44Å; A35-V39 VanDerWaalsContact O-CG2 3.27Å; A35-V39 WeakPolarHBondContact O-CG2 3.42Å; A35-V39 PolarHBondContact O-N 3.46Å; V36-V39 PolarHBondContact O-N 3.17Å; V39-L42 PolarHBondContact O-N 3.28Å; V39-K43 HydrophobicContact CG1-CG 3.94Å; V39-K43 VanDerWaalsContact O-CB 3.31Å; V39-K43 WeakPolarHBondContact O-CB 3.36Å; V39-K43 WeakPolarHBondContact O-CG 2.92Å; V39-K43 PolarHBondContact O-N 3.23Å; V39-L279 HydrophobicContact CB-CD2 4.3Å; V39-L279 HydrophobicContact CG1-CD1 3.99Å; V39-L279 HydrophobicContact CG1-CD2 3.89Å
40A93.6Very high95Very high0 Ų057.1 Ų57.10%028%0.275CS..Hα-helixtrans-60.7-47.8177.800000111.4V36 T37 I38 L42 K43 V44 L47 I276 L279V36-A40 WeakPolarHBondContact O-CB 3.25Å; V36-A40 PolarHBondContact O-N 3.03Å; T37-A40 PolarHBondContact O-N 2.76Å; I38-A40 VanDerWaalsContact C-N 3.33Å; I38-A40 PolarHBondContact O-N 3Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 3.31Å; A40-K43 PolarHBondContact O-N 2.86Å; A40-V44 VanDerWaalsContact O-CB 3.28Å; A40-V44 WeakPolarHBondContact O-CB 3.2Å; A40-V44 PolarHBondContact O-N 3.04Å; A40-L47 HydrophobicContact CB-CD1 3.78Å; A40-I276 HydrophobicContact CB-CG1 4.17Å; A40-L279 HydrophobicContact CB-CD2 3.87Å
41F94.7Very high94.8Very high19 Ų1958.3 Ų58.38%0.08328%0.283CS..Hα-helixtrans-60.6-42.1175.8-178-94.5000112.4T37 I38 R48 N52 F53 F56 W125T37-F41 PolarHBondContact O-N 3.35Å; T37-F41 VanDerWaalsContact O-N 3.09Å; I38-F41 PolarHBondContact O-N 2.88Å; F41-R48 HydrophobicContact CZ-CG 4.49Å; F41-R48 VanDerWaalsContact O-CG 3.27Å; F41-R48 WeakPolarHBondContact O-CG 3.47Å; F41-R48 PolarHBondContact O-NE 3.42Å; F41-N52 HydrophobicContact CD2-CB 3.99Å; F41-N52 HydrophobicContact CE2-CB 4.04Å; F41-F53 HydrophobicContact CE1-CD2 4.41Å; F41-F53 HydrophobicContact CE2-CB 4.19Å; F41-F53 HydrophobicContact CZ-CB 4Å; F41-F53 HydrophobicContact CZ-CD2 4.04Å; F41-F56 HydrophobicContact CB-CB 4.32Å; F41-F56 HydrophobicContact CB-CD2 3.97Å; F41-F56 HydrophobicContact CD1-CB 3.97Å; F41-F56 HydrophobicContact CD1-CD1 4.45Å; F41-F56 AromaticContact CD1-CD2 3.47Å; F41-F56 HydrophobicContact CD1-CD2 3.47Å; F41-F56 VanDerWaalsContact CD1-CD2 3.47Å; F41-F56 HydrophobicContact CD1-CE2 4.03Å; F41-F56 AromaticContact CD1-CG 3.71Å; F41-F56 HydrophobicContact CD1-CG 3.71Å; F41-F56 HydrophobicContact CD2-CB 4.12Å; F41-F56 HydrophobicContact CE1-CB 4.29Å; F41-F56 HydrophobicContact CE1-CD1 4.39Å; F41-F56 HydrophobicContact CE1-CD2 4.19Å; F41-F56 HydrophobicContact CE1-CG 4.04Å; F41-F56 HydrophobicContact CE2-CB 4.42Å; F41-F56 HydrophobicContact CG-CB 3.87Å; F41-F56 AromaticContact CG-CD2 3.89Å; F41-F56 HydrophobicContact CG-CD2 3.89Å; F41-F56 HydrophobicContact CG-CG 4.09Å; F41-W125 HydrophobicContact CZ-CH2 4.27Å
42L95.4Very high94.7Very high89 Ų8954.7 Ų54.747%0.46627%0.268SS..Hα-helixtrans-72.4-35.7-178.6-67.5176.4000113.1I38 V39 A40 R48 F56I38-L42 HydrophobicContact CG2-CD1 3.89Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.4Å; I38-L42 PolarHBondContact O-N 2.91Å; V39-L42 PolarHBondContact O-N 3.28Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 3.31Å; L42-R48 PolarHBondContact O-NH2 3.43Å; L42-F56 HydrophobicContact CD1-CE2 4.5Å; L42-F56 HydrophobicContact CD2-CE2 4.14Å; L42-F56 HydrophobicContact CG-CE2 4.16Å
43K93.4Very high94.8Very high157 Ų15751.3 Ų51.368%0.68325%0.248SC*.Hα-helixtrans-95.6-33-173.8-67-69-173.8175.10113.7V39 A40 L279V39-K43 HydrophobicContact CG1-CG 3.94Å; V39-K43 VanDerWaalsContact O-CB 3.31Å; V39-K43 WeakPolarHBondContact O-CB 3.36Å; V39-K43 WeakPolarHBondContact O-CG 2.92Å; V39-K43 PolarHBondContact O-N 3.23Å; A40-K43 PolarHBondContact O-N 2.86Å; K43-L279 HydrophobicContact CB-CD1 4.07Å; K43-L279 HydrophobicContact CG-CD1 4.49Å
44V92.3Very high94.8Very high7 Ų748.9 Ų48.94%0.04224%0.236CC..  trans-94.4109-177.6-174.20000109.7A40 E46 L47 L279A40-V44 VanDerWaalsContact O-CB 3.28Å; A40-V44 WeakPolarHBondContact O-CB 3.2Å; A40-V44 PolarHBondContact O-N 3.04Å; V44-E46 VanDerWaalsContact C-N 3.26Å; V44-E46 HydrophobicContact CG1-CB 4.31Å; V44-E46 PolarHBondContact O-N 2.99Å; V44-L47 HydrophobicContact CB-CB 4.31Å; V44-L47 HydrophobicContact CB-CD1 4.04Å; V44-L47 HydrophobicContact CB-CG 3.96Å; V44-L47 HydrophobicContact CG1-CB 4.5Å; V44-L47 HydrophobicContact CG1-CD1 4.39Å; V44-L47 HydrophobicContact CG1-CG 3.91Å; V44-L47 HydrophobicContact CG2-CD1 4.47Å; V44-L47 PolarHBondContact O-N 3.25Å; V44-L47 VanDerWaalsContact O-N 3.07Å; V44-L279 HydrophobicContact CG2-CB 4.2Å
45R90.8Very high94.8Very high203 Ų20349.1 Ų49.177%0.76624%0.237SC*.G310 helixtrans-60.2-37.3-174.9-175.4178.3177.9175.9-0.4112L47 R48R45-L47 PolarHBondContact O-N 3.19Å; R45-R48 WeakPolarHBondContact O-CB 3.48Å; R45-R48 PolarHBondContact O-N 3.43Å; R45-R48 VanDerWaalsContact O-N 3.13Å
46E90.7Very high94.9Very high102 Ų10249.1 Ų49.148%0.47723%0.232SC..G310 helixtrans-64.1-24.3179.3-64.390154.900112.9V44 R48 K284V44-E46 VanDerWaalsContact C-N 3.26Å; V44-E46 HydrophobicContact CG1-CB 4.31Å; V44-E46 PolarHBondContact O-N 2.99Å; E46-R48 VanDerWaalsContact C-N 3.34Å; E46-K284 IonicContact OE1-NZ 3.18Å; E46-K284 PolarHBondContact OE1-NZ 2.93Å
47L91.6Very high95Very high4 Ų446.8 Ų46.82%0.02122%0.218CC..G310 helixtrans-81.1-12.5176.7-67.9-172.9000113.3A40 V44 R45 T49 N52 N271 Y272A40-L47 HydrophobicContact CB-CD1 3.78Å; V44-L47 HydrophobicContact CB-CB 4.31Å; V44-L47 HydrophobicContact CB-CD1 4.04Å; V44-L47 HydrophobicContact CB-CG 3.96Å; V44-L47 HydrophobicContact CG1-CB 4.5Å; V44-L47 HydrophobicContact CG1-CD1 4.39Å; V44-L47 HydrophobicContact CG1-CG 3.91Å; V44-L47 HydrophobicContact CG2-CD1 4.47Å; V44-L47 PolarHBondContact O-N 3.25Å; V44-L47 VanDerWaalsContact O-N 3.07Å; R45-L47 PolarHBondContact O-N 3.19Å; L47-T49 VanDerWaalsContact C-N 3.29Å; L47-T49 PolarHBondContact O-N 2.86Å; L47-N52 WeakPolarHBondContact O-CB 3.26Å; L47-N52 PolarHBondContact O-ND2 2.83Å; L47-N271 WeakPolarHBondContact CD2-O 3.04Å; L47-Y272 HydrophobicContact CD2-CD2 4.38Å
48R95.3Very high95.2Very high122 Ų12246.7 Ų46.746%0.4622%0.217SC..  trans-78.977.5-177.2-60.1-176.5-162.7160.24.7111.3F41 L42 R45 E46 W125F41-R48 HydrophobicContact CZ-CG 4.49Å; F41-R48 VanDerWaalsContact O-CG 3.27Å; F41-R48 WeakPolarHBondContact O-CG 3.47Å; F41-R48 PolarHBondContact O-NE 3.42Å; L42-R48 PolarHBondContact O-NH2 3.43Å; R45-R48 WeakPolarHBondContact O-CB 3.48Å; R45-R48 PolarHBondContact O-N 3.43Å; R45-R48 VanDerWaalsContact O-N 3.13Å; E46-R48 VanDerWaalsContact C-N 3.34Å; R48-W125 WeakPolarHBondContact O-CZ2 3.28Å
49T95.5Very high95.3Very high50 Ų5045 Ų4531%0.30721%0.209SC..SBendtrans-122.4158.6177.265.30000110.6L47 S51 N52 F53L47-T49 VanDerWaalsContact C-N 3.29Å; L47-T49 PolarHBondContact O-N 2.86Å; T49-S51 VanDerWaalsContact C-N 3.31Å; T49-S51 PolarHBondContact O-N 3.39Å; T49-N52 PolarHBondContact O-N 3.28Å; T49-N52 WeakPolarHBondContact OG1-CB 2.92Å; T49-N52 PolarHBondContact OG1-N 3.48Å; T49-N52 PolarHBondContact OG1-ND2 3.34Å; T49-F53 PolarHBondContact O-N 2.96Å
50P96.8Very high95.4Very high18 Ų1845.4 Ų45.412%0.11721%0.208CC..Hα-helixtrans-55.9-41.6178.1-27.836.5000113.5F53 L54 L123 W125 A128P50-F53 WeakPolarHBondContact O-CB 3.29Å; P50-F53 PolarHBondContact O-N 3.45Å; P50-L54 PolarHBondContact O-N 3.01Å; P50-L123 HydrophobicContact CB-CB 4.19Å; P50-L123 HydrophobicContact CB-CD2 4.14Å; P50-L123 HydrophobicContact CB-CG 3.94Å; P50-L123 WeakPolarHBondContact CB-O 3.42Å; P50-L123 WeakPolarHBondContact CG-O 3.42Å; P50-W125 HydrophobicContact CG-CD2 3.86Å; P50-W125 HydrophobicContact CG-CG 3.82Å; P50-A128 HydrophobicContact CB-CB 3.91Å
51S94.9Very high95.7Very high26 Ų2645.4 Ų45.418%0.18221%0.208CC..Hα-helixtrans-62.6-46.2176.3-59.30000112.1T49 F53 L54 V55 D112T49-S51 VanDerWaalsContact C-N 3.31Å; T49-S51 PolarHBondContact O-N 3.39Å; S51-F53 VanDerWaalsContact C-N 3.26Å; S51-F53 PolarHBondContact O-N 3.26Å; S51-L54 WeakPolarHBondContact O-CB 3.4Å; S51-L54 PolarHBondContact O-N 2.92Å; S51-V55 PolarHBondContact O-N 2.77Å; S51-D112 WeakPolarHBondContact CB-OD2 3.11Å; S51-D112 PolarHBondContact OG-OD1 3.36Å; S51-D112 PolarHBondContact OG-OD2 2.95Å
52N95.3Very high95.9Very high8 Ų844.5 Ų44.54%0.04320%0.204CC..Hα-helixtrans-71.9-20.8178.6-69.1-15.1000112.6F41 L47 T49 L54 V55 F56F41-N52 HydrophobicContact CD2-CB 3.99Å; F41-N52 HydrophobicContact CE2-CB 4.04Å; L47-N52 WeakPolarHBondContact O-CB 3.26Å; L47-N52 PolarHBondContact O-ND2 2.83Å; T49-N52 PolarHBondContact O-N 3.28Å; T49-N52 WeakPolarHBondContact OG1-CB 2.92Å; T49-N52 PolarHBondContact OG1-N 3.48Å; T49-N52 PolarHBondContact OG1-ND2 3.34Å; N52-L54 VanDerWaalsContact C-N 3.31Å; N52-V55 WeakPolarHBondContact O-CB 3.47Å; N52-V55 PolarHBondContact O-N 3.44Å; N52-F56 WeakPolarHBondContact O-CB 3.43Å; N52-F56 PolarHBondContact O-N 2.9Å
53F97.6Very high96Very high39 Ų3941.2 Ų41.217%0.17119%0.186CC..Hα-helixtrans-66.4-33.4171.9175.4-104.5000112.1F41 T49 P50 S51 F56 S57 W125 A128 I129 A132F41-F53 HydrophobicContact CE1-CD2 4.41Å; F41-F53 HydrophobicContact CE2-CB 4.19Å; F41-F53 HydrophobicContact CZ-CB 4Å; F41-F53 HydrophobicContact CZ-CD2 4.04Å; T49-F53 PolarHBondContact O-N 2.96Å; P50-F53 WeakPolarHBondContact O-CB 3.29Å; P50-F53 PolarHBondContact O-N 3.45Å; S51-F53 VanDerWaalsContact C-N 3.26Å; S51-F53 PolarHBondContact O-N 3.26Å; F53-F56 HydrophobicContact CD2-CD1 4.1Å; F53-F56 HydrophobicContact CE2-CD1 4.15Å; F53-F56 HydrophobicContact CE2-CE1 4.46Å; F53-F56 PolarHBondContact O-N 3.44Å; F53-S57 WeakPolarHBondContact O-CB 3.29Å; F53-S57 PolarHBondContact O-N 3.2Å; F53-S57 PolarHBondContact O-OG 3.32Å; F53-W125 HydrophobicContact CB-CH2 4.19Å; F53-W125 HydrophobicContact CB-CZ3 3.77Å; F53-W125 HydrophobicContact CD2-CZ3 4.18Å; F53-W125 AromaticContact CG-CZ3 3.9Å; F53-W125 HydrophobicContact CG-CZ3 3.9Å; F53-A128 HydrophobicContact CD1-CB 4.14Å; F53-I129 HydrophobicContact CE1-CG1 4.09Å; F53-I129 HydrophobicContact CZ-CG1 4.41Å; F53-A132 HydrophobicContact CE1-CB 3.65Å; F53-A132 HydrophobicContact CZ-CB 4.23Å
54L97.9Very high96.3Very high0 Ų034.1 Ų34.10%016%0.157CC..Hα-helixtrans-65.6-41.1170.5-59-179.2000111.1P50 S51 N52 S57 L58 F105 A108 I109 D112 L123 A128 L131P50-L54 PolarHBondContact O-N 3.01Å; S51-L54 WeakPolarHBondContact O-CB 3.4Å; S51-L54 PolarHBondContact O-N 2.92Å; N52-L54 VanDerWaalsContact C-N 3.31Å; L54-S57 PolarHBondContact O-N 3.42Å; L54-L58 PolarHBondContact O-N 3.03Å; L54-F105 HydrophobicContact CD2-CD1 4.38Å; L54-F105 HydrophobicContact CD2-CE1 4.34Å; L54-A108 HydrophobicContact CD1-CB 4.16Å; L54-I109 HydrophobicContact CB-CD1 4.01Å; L54-I109 HydrophobicContact CB-CG1 3.68Å; L54-I109 HydrophobicContact CD1-CG1 4.35Å; L54-D112 HydrophobicContact CD1-CB 4.31Å; L54-L123 HydrophobicContact CD1-CD2 3.69Å; L54-L123 HydrophobicContact CG-CD2 4.2Å; L54-A128 HydrophobicContact CD2-CB 4.49Å; L54-L131 HydrophobicContact CD2-CD2 4.42Å
55V97.2Very high96.5Very high7 Ų734.1 Ų34.14%0.04216%0.157CC..Hα-helixtrans-64-41.9175.5-174.60000111.4T37 S51 N52 S57 L58 A59 I109 Y265 Y272T37-V55 HydrophobicContact CG2-CG1 4.11Å; S51-V55 PolarHBondContact O-N 2.77Å; N52-V55 WeakPolarHBondContact O-CB 3.47Å; N52-V55 PolarHBondContact O-N 3.44Å; V55-S57 VanDerWaalsContact C-N 3.31Å; V55-S57 PolarHBondContact O-N 3.33Å; V55-L58 WeakPolarHBondContact O-CB 3.29Å; V55-L58 PolarHBondContact O-N 2.99Å; V55-A59 PolarHBondContact O-N 3.36Å; V55-I109 HydrophobicContact CG2-CD1 4.06Å; V55-I109 HydrophobicContact CG2-CG1 4.47Å; V55-Y265 HydrophobicContact CB-CD1 4.31Å; V55-Y265 HydrophobicContact CB-CE1 4.43Å; V55-Y265 HydrophobicContact CG1-CD1 3.82Å; V55-Y265 HydrophobicContact CG1-CD2 4.08Å; V55-Y265 HydrophobicContact CG1-CE1 4.25Å; V55-Y265 HydrophobicContact CG1-CG 3.76Å; V55-Y265 HydrophobicContact CG2-CD1 3.51Å; V55-Y265 HydrophobicContact CG2-CE1 3.55Å; V55-Y265 HydrophobicContact CG2-CG 4.31Å; V55-Y272 HydrophobicContact CG1-CE2 4.31Å
56F97.6Very high96.9Very high28 Ų2824.5 Ų24.512%0.12312%0.121CC..Hα-helixtrans-58.6-44.4172.9168-94.5000111.3I38 F41 L42 N52 F53 A59 M60I38-F56 HydrophobicContact CB-CE2 4.43Å; I38-F56 HydrophobicContact CG1-CD2 4.3Å; I38-F56 HydrophobicContact CG1-CE2 4.33Å; I38-F56 HydrophobicContact CG2-CE2 3.97Å; F41-F56 HydrophobicContact CB-CB 4.32Å; F41-F56 HydrophobicContact CB-CD2 3.97Å; F41-F56 HydrophobicContact CD1-CB 3.97Å; F41-F56 HydrophobicContact CD1-CD1 4.45Å; F41-F56 AromaticContact CD1-CD2 3.47Å; F41-F56 HydrophobicContact CD1-CD2 3.47Å; F41-F56 VanDerWaalsContact CD1-CD2 3.47Å; F41-F56 HydrophobicContact CD1-CE2 4.03Å; F41-F56 AromaticContact CD1-CG 3.71Å; F41-F56 HydrophobicContact CD1-CG 3.71Å; F41-F56 HydrophobicContact CD2-CB 4.12Å; F41-F56 HydrophobicContact CE1-CB 4.29Å; F41-F56 HydrophobicContact CE1-CD1 4.39Å; F41-F56 HydrophobicContact CE1-CD2 4.19Å; F41-F56 HydrophobicContact CE1-CG 4.04Å; F41-F56 HydrophobicContact CE2-CB 4.42Å; F41-F56 HydrophobicContact CG-CB 3.87Å; F41-F56 AromaticContact CG-CD2 3.89Å; F41-F56 HydrophobicContact CG-CD2 3.89Å; F41-F56 HydrophobicContact CG-CG 4.09Å; L42-F56 HydrophobicContact CD1-CE2 4.5Å; L42-F56 HydrophobicContact CD2-CE2 4.14Å; L42-F56 HydrophobicContact CG-CE2 4.16Å; N52-F56 WeakPolarHBondContact O-CB 3.43Å; N52-F56 PolarHBondContact O-N 2.9Å; F53-F56 HydrophobicContact CD2-CD1 4.1Å; F53-F56 HydrophobicContact CE2-CD1 4.15Å; F53-F56 HydrophobicContact CE2-CE1 4.46Å; F53-F56 PolarHBondContact O-N 3.44Å; F56-A59 PolarHBondContact O-N 3.09Å; F56-M60 HydrophobicContact CD1-CE 3.93Å; F56-M60 HydrophobicContact CD1-SD 4.36Å; F56-M60 HydrophobicContact CE1-CE 3.46Å; F56-M60 VanDerWaalsContact CE1-CE 3.46Å; F56-M60 HydrophobicContact CE1-CG 4.25Å; F56-M60 HydrophobicContact CE1-SD 3.54Å; F56-M60 VanDerWaalsContact CE1-SD 3.54Å; F56-M60 HydrophobicContact CZ-CE 4.24Å; F56-M60 HydrophobicContact CZ-CG 4.24Å; F56-M60 HydrophobicContact CZ-SD 3.68Å; F56-M60 WeakPolarHBondContact O-CG 3.49Å; F56-M60 PolarHBondContact O-N 3.34Å
57S98.6Very high97.2Very high1 Ų124.1 Ų24.11%0.00712%0.12CC..Hα-helixtrans-68-38.1178.8-57.20000112.8F53 L54 V55 M60 A61F53-S57 WeakPolarHBondContact O-CB 3.29Å; F53-S57 PolarHBondContact O-N 3.2Å; F53-S57 PolarHBondContact O-OG 3.32Å; L54-S57 PolarHBondContact O-N 3.42Å; V55-S57 VanDerWaalsContact C-N 3.31Å; V55-S57 PolarHBondContact O-N 3.33Å; S57-M60 PolarHBondContact O-N 3.12Å; S57-A61 PolarHBondContact O-N 2.93Å; S57-A61 VanDerWaalsContact O-N 3.12Å
58L98.5Very high97.5Very high2 Ų224.1 Ų24.11%0.0112%0.12CC..Hα-helixtrans-58.6-47169.6177.456.8000111.4L54 V55 M60 A61 D62 S102 F105 I106 I109 N261 Y265L54-L58 PolarHBondContact O-N 3.03Å; V55-L58 WeakPolarHBondContact O-CB 3.29Å; V55-L58 PolarHBondContact O-N 2.99Å; L58-M60 VanDerWaalsContact C-N 3.28Å; L58-M60 PolarHBondContact O-N 3.26Å; L58-A61 WeakPolarHBondContact O-CB 3.38Å; L58-A61 PolarHBondContact O-N 3.47Å; L58-A61 VanDerWaalsContact O-N 3.08Å; L58-D62 WeakPolarHBondContact O-CB 3.21Å; L58-D62 PolarHBondContact O-N 3.46Å; L58-S102 WeakPolarHBondContact CD1-O 3.18Å; L58-S102 VanDerWaalsContact CD1-OG 3.23Å; L58-S102 WeakPolarHBondContact CD1-OG 3.5Å; L58-F105 HydrophobicContact CB-CB 3.8Å; L58-F105 HydrophobicContact CB-CG 4.44Å; L58-F105 HydrophobicContact CD1-CB 4.05Å; L58-F105 HydrophobicContact CG-CB 4.43Å; L58-I106 HydrophobicContact CD1-CG1 4.06Å; L58-I106 HydrophobicContact CD2-CG1 4.03Å; L58-I109 HydrophobicContact CB-CD1 4.29Å; L58-I109 HydrophobicContact CD2-CD1 3.99Å; L58-N261 HydrophobicContact CD2-CB 4.33Å; L58-Y265 HydrophobicContact CD2-CD2 4.27Å; L58-Y265 HydrophobicContact CD2-CE2 3.22Å; L58-Y265 VanDerWaalsContact CD2-OH 3.23Å; L58-Y265 WeakPolarHBondContact CD2-OH 3.17Å
59A98.4Very high97.6Very high1 Ų118.4 Ų18.41%0.00810%0.099CC..Hα-helixtrans-62.4-35.6179.200000112.4N34 T37 I38 V55 F56 D62 I63N34-A59 HydrophobicContact CB-CB 4.1Å; N34-A59 WeakPolarHBondContact OD1-CA 3.21Å; T37-A59 HydrophobicContact CG2-CB 3.44Å; T37-A59 VanDerWaalsContact CG2-CB 3.44Å; I38-A59 HydrophobicContact CD1-CB 4.31Å; I38-A59 HydrophobicContact CG1-CB 3.88Å; V55-A59 PolarHBondContact O-N 3.36Å; F56-A59 PolarHBondContact O-N 3.09Å; A59-D62 PolarHBondContact O-N 2.92Å; A59-I63 VanDerWaalsContact O-CG1 3.25Å; A59-I63 WeakPolarHBondContact O-CG1 3.48Å; A59-I63 PolarHBondContact O-N 2.88Å
60M98.6Very high97.6Very high71 Ų7118.3 Ų18.335%0.3510%0.098SC..Hα-helixtrans-63.4-41.9172.1-67.9-167.7-62.100112.4I38 F56 S57 L58 G64 W136I38-M60 HydrophobicContact CD1-CG 4.16Å; F56-M60 HydrophobicContact CD1-CE 3.93Å; F56-M60 HydrophobicContact CD1-SD 4.36Å; F56-M60 HydrophobicContact CE1-CE 3.46Å; F56-M60 VanDerWaalsContact CE1-CE 3.46Å; F56-M60 HydrophobicContact CE1-CG 4.25Å; F56-M60 HydrophobicContact CE1-SD 3.54Å; F56-M60 VanDerWaalsContact CE1-SD 3.54Å; F56-M60 HydrophobicContact CZ-CE 4.24Å; F56-M60 HydrophobicContact CZ-CG 4.24Å; F56-M60 HydrophobicContact CZ-SD 3.68Å; F56-M60 WeakPolarHBondContact O-CG 3.49Å; F56-M60 PolarHBondContact O-N 3.34Å; S57-M60 PolarHBondContact O-N 3.12Å; L58-M60 VanDerWaalsContact C-N 3.28Å; L58-M60 PolarHBondContact O-N 3.26Å; M60-G64 PolarHBondContact O-N 2.88Å; M60-W136 HydrophobicContact CB-CZ2 4.28Å
61A98.7Very high97.6Very high0 Ų020.3 Ų20.30%011%0.108CC..Hα-helixtrans-63.4-44.7174.600000111.4S57 L58 I63 G64 I65 T98 A101 W136S57-A61 PolarHBondContact O-N 2.93Å; S57-A61 VanDerWaalsContact O-N 3.12Å; L58-A61 WeakPolarHBondContact O-CB 3.38Å; L58-A61 PolarHBondContact O-N 3.47Å; L58-A61 VanDerWaalsContact O-N 3.08Å; A61-I63 PolarHBondContact O-N 3.22Å; A61-G64 WeakPolarHBondContact O-CA 3.36Å; A61-G64 PolarHBondContact O-N 3.5Å; A61-I65 PolarHBondContact O-N 2.94Å; A61-I65 VanDerWaalsContact O-N 3.1Å; A61-T98 WeakPolarHBondContact O-CB 3.5Å; A61-A101 HydrophobicContact CB-CB 3.93Å; A61-W136 HydrophobicContact CB-CH2 3.89Å; A61-W136 HydrophobicContact CB-CZ2 4.22Å
62D98.6Very high97.7Very high0 Ų019.1 Ų19.10%010%0.099CC..Hα-helixtrans-64.5-37.1179.3-77.2-8.7000112.5L58 A59 G64 I65 C66 S102 P258 N261L58-D62 WeakPolarHBondContact O-CB 3.21Å; L58-D62 PolarHBondContact O-N 3.46Å; A59-D62 PolarHBondContact O-N 2.92Å; D62-G64 PolarHBondContact O-N 3.38Å; D62-I65 PolarHBondContact O-N 3.45Å; D62-I65 VanDerWaalsContact O-N 3.15Å; D62-C66 PolarHBondContact O-N 2.93Å; D62-C66 PolarHBondContact O-SG 3.23Å; D62-S102 WeakPolarHBondContact OD1-CB 3.46Å; D62-S102 PolarHBondContact OD1-OG 3.36Å; D62-P258 HydrophobicContact CB-CB 3.84Å; D62-P258 HydrophobicContact CB-CG 4.21Å; D62-N261 PolarHBondContact OD1-ND2 3.11Å; D62-N261 VanDerWaalsContact OD2-CB 3.25Å; D62-N261 WeakPolarHBondContact OD2-CB 3.37Å; D62-N261 PolarHBondContact OD2-ND2 3.43Å
63I98.5Very high97.8Very high20 Ų2018.7 Ų18.710%0.10310%0.097CC..Hα-helixtrans-56.6-41.6169.2-72-67.8000110.9F31 N34 I38 A59 A61 C66 M67F31-I63 HydrophobicContact CB-CD1 4.38Å; F31-I63 HydrophobicContact CD2-CD1 3.52Å; F31-I63 HydrophobicContact CD2-CG2 4.13Å; F31-I63 HydrophobicContact CE2-CD1 3.84Å; F31-I63 HydrophobicContact CE2-CG2 3.96Å; F31-I63 HydrophobicContact CG-CD1 3.9Å; F31-I63 HydrophobicContact CZ-CD1 4.44Å; F31-I63 WeakPolarHBondContact O-CD1 3.4Å; N34-I63 HydrophobicContact CB-CD1 3.78Å; N34-I63 HydrophobicContact CB-CG1 3.89Å; I38-I63 HydrophobicContact CD1-CG1 3.76Å; A59-I63 VanDerWaalsContact O-CG1 3.25Å; A59-I63 WeakPolarHBondContact O-CG1 3.48Å; A59-I63 PolarHBondContact O-N 2.88Å; A61-I63 PolarHBondContact O-N 3.22Å; I63-C66 WeakPolarHBondContact O-CB 3.19Å; I63-C66 PolarHBondContact O-N 3.47Å; I63-M67 HydrophobicContact CG2-CE 3.67Å; I63-M67 HydrophobicContact CG2-CG 4.46Å; I63-M67 HydrophobicContact CG2-SD 4.25Å; I63-M67 WeakPolarHBondContact O-CG 3.18Å; I63-M67 PolarHBondContact O-N 3.46Å
64G98.3Very high97.7Very high7 Ų722 Ų227%0.07211%0.111CC..Hα-helixtrans-60.8-43.5175.300000113M60 A61 D62 C66 M67 N68 Q94M60-G64 PolarHBondContact O-N 2.88Å; A61-G64 WeakPolarHBondContact O-CA 3.36Å; A61-G64 PolarHBondContact O-N 3.5Å; D62-G64 PolarHBondContact O-N 3.38Å; G64-C66 VanDerWaalsContact C-N 3.33Å; G64-C66 PolarHBondContact O-N 2.89Å; G64-M67 PolarHBondContact O-N 2.93Å; G64-N68 WeakPolarHBondContact O-CB 3.39Å; G64-N68 PolarHBondContact O-N 3.46Å; G64-Q94 VanDerWaalsContact C-NE2 3.28Å; G64-Q94 PolarHBondContact O-NE2 2.81Å
65I98.3Very high97.6Very high7 Ų722 Ų224%0.03611%0.111CC..Hα-helixtrans-63.9-40.8175.8-59.4171.2000110.5A61 D62 N68 A69 W224 K255 P258A61-I65 PolarHBondContact O-N 2.94Å; A61-I65 VanDerWaalsContact O-N 3.1Å; D62-I65 PolarHBondContact O-N 3.45Å; D62-I65 VanDerWaalsContact O-N 3.15Å; I65-N68 WeakPolarHBondContact O-CB 3.38Å; I65-N68 PolarHBondContact O-N 2.94Å; I65-A69 PolarHBondContact O-N 3.46Å; I65-W224 HydrophobicContact CD1-CZ2 4.48Å; I65-K255 HydrophobicContact CG2-CG 4.4Å; I65-P258 HydrophobicContact CB-CG 3.7Å; I65-P258 HydrophobicContact CD1-CG 4.1Å; I65-P258 HydrophobicContact CG1-CG 4.5Å; I65-P258 HydrophobicContact CG2-CG 3.59Å
66C98.4Very high97.5Very high2 Ų221.7 Ų21.71%0.01411%0.109CC..Hα-helixtrans-64.4-40.6177.1-69.20000113G27 G30 F31 D62 I63 G64 N68 A69 T70 P258G27-C66 WeakPolarHBondContact O-CB 3.46Å; G30-C66 VanDerWaalsContact CA-SG 3.53Å; F31-C66 HydrophobicContact CB-CB 4.09Å; F31-C66 PolarHBondContact N-SG 3.37Å; D62-C66 PolarHBondContact O-N 2.93Å; D62-C66 PolarHBondContact O-SG 3.23Å; I63-C66 WeakPolarHBondContact O-CB 3.19Å; I63-C66 PolarHBondContact O-N 3.47Å; G64-C66 VanDerWaalsContact C-N 3.33Å; G64-C66 PolarHBondContact O-N 2.89Å; C66-N68 VanDerWaalsContact C-N 3.35Å; C66-A69 PolarHBondContact O-N 3.32Å; C66-T70 WeakPolarHBondContact O-CB 3.48Å; C66-T70 PolarHBondContact O-N 3.45Å; C66-T70 PolarHBondContact O-OG1 3.41Å; C66-P258 VanDerWaalsContact SG-CB 3.52Å
67M97.6Very high97.3Very high94 Ų9424.3 Ų24.346%0.46312%0.121SC..Hα-helixtrans-61-46172.9-72.9177.4176.800110.8F31 I63 G64 A69 T70 I71F31-M67 HydrophobicContact CE2-CE 4.1Å; I63-M67 HydrophobicContact CG2-CE 3.67Å; I63-M67 HydrophobicContact CG2-CG 4.46Å; I63-M67 HydrophobicContact CG2-SD 4.25Å; I63-M67 WeakPolarHBondContact O-CG 3.18Å; I63-M67 PolarHBondContact O-N 3.46Å; G64-M67 PolarHBondContact O-N 2.93Å; M67-A69 PolarHBondContact O-N 3.36Å; M67-T70 PolarHBondContact O-N 2.89Å; M67-I71 WeakPolarHBondContact O-CG1 3.4Å; M67-I71 PolarHBondContact O-N 3.35Å
68N96.9Very high97Very high4 Ų427.1 Ų27.12%0.02114%0.136CC..Hα-helixtrans-58.3-47.1176.8-165-92.8000111.8G64 I65 C66 T70 I71 A72 H91 Q94 G95 K255G64-N68 WeakPolarHBondContact O-CB 3.39Å; G64-N68 PolarHBondContact O-N 3.46Å; I65-N68 WeakPolarHBondContact O-CB 3.38Å; I65-N68 PolarHBondContact O-N 2.94Å; C66-N68 VanDerWaalsContact C-N 3.35Å; N68-T70 VanDerWaalsContact C-N 3.33Å; N68-T70 PolarHBondContact O-N 3.49Å; N68-I71 PolarHBondContact O-N 3.48Å; N68-A72 WeakPolarHBondContact O-CB 3.32Å; N68-A72 PolarHBondContact O-N 3.11Å; N68-H91 VanDerWaalsContact CG-CE1 3.44Å; N68-H91 VanDerWaalsContact CG-NE2 3.31Å; N68-H91 PolarHBondContact ND2-CD2 2.88Å; N68-H91 PolarHBondContact ND2-CE1 3.43Å; N68-H91 VanDerWaalsContact ND2-CE1 3.31Å; N68-H91 PolarHBondContact ND2-NE2 3.38Å; N68-H91 PolarHBondContact ND2-O 3.35Å; N68-H91 PolarHBondContact O-NE2 3.27Å; N68-H91 PolarHBondContact OD1-CE1 2.94Å; N68-H91 PolarHBondContact OD1-NE2 3.35Å; N68-Q94 PolarHBondContact ND2-OE1 3.03Å; N68-G95 VanDerWaalsContact ND2-CA 3.28Å; N68-G95 WeakPolarHBondContact ND2-CA 3.36Å; N68-G95 PolarHBondContact ND2-N 2.94Å; N68-K255 PolarHBondContact OD1-NZ 3.31Å
69A96.8Very high96.7Very high1 Ų130.1 Ų30.11%0.00815%0.147CC..Hα-helixtrans-61.5-38.8175.800000112.7L23 I65 C66 M67 A72 A73 K255L23-A69 HydrophobicContact CD2-CB 4.4Å; I65-A69 PolarHBondContact O-N 3.46Å; C66-A69 PolarHBondContact O-N 3.32Å; M67-A69 PolarHBondContact O-N 3.36Å; A69-A72 WeakPolarHBondContact O-CB 3.32Å; A69-A72 PolarHBondContact O-N 2.85Å; A69-A73 WeakPolarHBondContact O-CB 3.39Å; A69-A73 PolarHBondContact O-N 3.02Å; A69-K255 HydrophobicContact CB-CD 4.18Å
70T97.1Very high96.3Very high48 Ų4833.8 Ų33.829%0.29416%0.161SC..Hα-helixtrans-68.7-39.1179.2-540000111.8L24 C66 M67 N68 A73 F74L24-T70 HydrophobicContact CD1-CG2 4.29Å; C66-T70 WeakPolarHBondContact O-CB 3.48Å; C66-T70 PolarHBondContact O-N 3.45Å; C66-T70 PolarHBondContact O-OG1 3.41Å; M67-T70 PolarHBondContact O-N 2.89Å; N68-T70 VanDerWaalsContact C-N 3.33Å; N68-T70 PolarHBondContact O-N 3.49Å; T70-A73 WeakPolarHBondContact O-CB 3.25Å; T70-A73 PolarHBondContact O-N 3.42Å; T70-F74 PolarHBondContact O-N 3.09Å
71I96.9Very high96.2Very high61 Ų6131.4 Ų31.431%0.31315%0.148SC..Hα-helixtrans-64-44.8174-67.2167.2000110.2M67 N68 A73 F74 S75 W81 Y83M67-I71 WeakPolarHBondContact O-CG1 3.4Å; M67-I71 PolarHBondContact O-N 3.35Å; N68-I71 PolarHBondContact O-N 3.48Å; I71-A73 VanDerWaalsContact C-N 3.34Å; I71-A73 PolarHBondContact O-N 2.82Å; I71-F74 PolarHBondContact O-N 2.83Å; I71-S75 PolarHBondContact O-N 3.41Å; I71-S75 PolarHBondContact O-OG 3.47Å; I71-W81 HydrophobicContact CG2-CH2 3.85Å; I71-W81 HydrophobicContact CG2-CZ3 4.01Å; I71-Y83 HydrophobicContact CG2-CD2 4.33Å; I71-Y83 HydrophobicContact CG2-CE2 3.65Å
72A96.1Very high96Very high0 Ų033.5 Ų33.50%016%0.162CC..Hα-helixtrans-60.4-41.8175.100000112.3L23 N68 A69 S75 S76 C161L23-A72 HydrophobicContact CD1-CB 3.97Å; N68-A72 WeakPolarHBondContact O-CB 3.32Å; N68-A72 PolarHBondContact O-N 3.11Å; A69-A72 WeakPolarHBondContact O-CB 3.32Å; A69-A72 PolarHBondContact O-N 2.85Å; A72-S75 PolarHBondContact O-N 2.81Å; A72-S76 WeakPolarHBondContact O-CB 2.99Å; A72-S76 PolarHBondContact O-N 3.27Å; A72-C161 HydrophobicContact CB-CB 3.44Å; A72-C161 VanDerWaalsContact CB-CB 3.44Å
73A96.9Very high95.9Very high0 Ų038.5 Ų38.50%018%0.182CC..Hα-helixtrans-60.6-46.1175.800000111.9G20 L23 L24 A69 T70 I71 S75 S76 F77G20-A73 WeakPolarHBondContact O-CB 3.38Å; L23-A73 HydrophobicContact CB-CB 3.81Å; L24-A73 HydrophobicContact CB-CB 3.87Å; A69-A73 WeakPolarHBondContact O-CB 3.39Å; A69-A73 PolarHBondContact O-N 3.02Å; T70-A73 WeakPolarHBondContact O-CB 3.25Å; T70-A73 PolarHBondContact O-N 3.42Å; I71-A73 VanDerWaalsContact C-N 3.34Å; I71-A73 PolarHBondContact O-N 2.82Å; A73-S75 PolarHBondContact O-N 3.01Å; A73-S76 WeakPolarHBondContact O-CB 2.88Å; A73-S76 PolarHBondContact O-N 3.1Å; A73-S76 VanDerWaalsContact O-N 3.13Å; A73-F77 HydrophobicContact CB-CE2 4.35Å; A73-F77 WeakPolarHBondContact O-CD2 3.36Å; A73-F77 PolarHBondContact O-N 3.22Å
74F96.4Very high95.7Very high107 Ų10739.3 Ų39.347%0.46920%0.195SC..Hα-helixtrans-59-48.4176.8178.7-102000111.9T70 I71 S76 F77 L78 P82 Y83T70-F74 PolarHBondContact O-N 3.09Å; I71-F74 PolarHBondContact O-N 2.83Å; F74-S76 VanDerWaalsContact C-N 3.26Å; F74-S76 PolarHBondContact O-N 3.48Å; F74-F77 PolarHBondContact O-N 3.02Å; F74-L78 HydrophobicContact CD1-CD1 3.98Å; F74-L78 HydrophobicContact CE1-CD1 3.44Å; F74-L78 VanDerWaalsContact CE1-CD1 3.44Å; F74-L78 HydrophobicContact CE1-CG 4.28Å; F74-L78 HydrophobicContact CZ-CD1 3.84Å; F74-L78 HydrophobicContact CZ-CG 4.37Å; F74-L78 PolarHBondContact O-N 3.31Å; F74-L78 VanDerWaalsContact O-N 3.15Å; F74-P82 HydrophobicContact CE1-CG 4.48Å; F74-Y83 VanDerWaalsContact CD1-OH 3.3Å; F74-Y83 WeakPolarHBondContact CD1-OH 3.28Å
75S95.4Very high95.6Very high0 Ų042.7 Ų42.70%022%0.217CC..Hα-helixtrans-60.1-35.6174.6-61.50000112.4I71 A72 A73 L78 R79 Y80 P82 T160I71-S75 PolarHBondContact O-N 3.41Å; I71-S75 PolarHBondContact O-OG 3.47Å; A72-S75 PolarHBondContact O-N 2.81Å; A73-S75 PolarHBondContact O-N 3.01Å; S75-L78 CarbonylContact O-C 3.47Å; S75-L78 WeakPolarHBondContact O-CB 3.44Å; S75-L78 PolarHBondContact O-N 2.89Å; S75-R79 PolarHBondContact O-N 2.84Å; S75-Y80 PolarHBondContact O-N 3.35Å; S75-Y80 VanDerWaalsContact O-O 3.08Å; S75-P82 WeakPolarHBondContact OG-CD 2.99Å; S75-T160 WeakPolarHBondContact CB-O 3.37Å; S75-T160 PolarHBondContact OG-O 2.9Å
76S94.7Very high95.5Very high1 Ų148.8 Ų48.81%0.00725%0.25CC..Hα-helixtrans-62.6-43.8175-169.90000112.8V16 G20 A72 A73 F74 L78 R79 T160V16-S76 VanDerWaalsContact CG1-O 3.25Å; V16-S76 WeakPolarHBondContact CG1-O 3.23Å; V16-S76 WeakPolarHBondContact CG1-OG 3.39Å; V16-S76 PolarHBondContact O-OG 3.16Å; G20-S76 PolarHBondContact N-OG 3.21Å; A72-S76 WeakPolarHBondContact O-CB 2.99Å; A72-S76 PolarHBondContact O-N 3.27Å; A73-S76 WeakPolarHBondContact O-CB 2.88Å; A73-S76 PolarHBondContact O-N 3.1Å; A73-S76 VanDerWaalsContact O-N 3.13Å; F74-S76 VanDerWaalsContact C-N 3.26Å; F74-S76 PolarHBondContact O-N 3.48Å; S76-L78 PolarHBondContact O-N 2.84Å; S76-R79 WeakPolarHBondContact O-CA 3.36Å; S76-R79 PolarHBondContact O-N 3Å; S76-T160 VanDerWaalsContact CA-CG2 3.45Å
77F94.1Very high95.4Very high84 Ų8449.5 Ų49.537%0.36826%0.258SS..Hα-helixtrans-65.9-27.9174.7-61.7-53.9000113.1F17 L24 A73 F74 R79F17-F77 HydrophobicContact CD2-CD1 4.25Å; F17-F77 HydrophobicContact CD2-CE1 4.01Å; F17-F77 HydrophobicContact CE2-CE1 4.1Å; L24-F77 HydrophobicContact CB-CE2 4.43Å; L24-F77 HydrophobicContact CD2-CE2 4.07Å; L24-F77 HydrophobicContact CD2-CZ 4.34Å; A73-F77 HydrophobicContact CB-CE2 4.35Å; A73-F77 WeakPolarHBondContact O-CD2 3.36Å; A73-F77 PolarHBondContact O-N 3.22Å; F74-F77 PolarHBondContact O-N 3.02Å; F77-R79 VanDerWaalsContact C-N 3.33Å
78L92.6Very high95.4Very high60 Ų6045.1 Ų45.131%0.31424%0.237SC..Hα-helixtrans-76.8-19.5171-66.6-179.6000113.3F74 S75 S76 Y80 P82F74-L78 HydrophobicContact CD1-CD1 3.98Å; F74-L78 HydrophobicContact CE1-CD1 3.44Å; F74-L78 VanDerWaalsContact CE1-CD1 3.44Å; F74-L78 HydrophobicContact CE1-CG 4.28Å; F74-L78 HydrophobicContact CZ-CD1 3.84Å; F74-L78 HydrophobicContact CZ-CG 4.37Å; F74-L78 PolarHBondContact O-N 3.31Å; F74-L78 VanDerWaalsContact O-N 3.15Å; S75-L78 CarbonylContact O-C 3.47Å; S75-L78 WeakPolarHBondContact O-CB 3.44Å; S75-L78 PolarHBondContact O-N 2.89Å; S76-L78 PolarHBondContact O-N 2.84Å; L78-Y80 HydrophobicContact CB-CD1 3.84Å; L78-Y80 HydrophobicContact CB-CE1 3.74Å; L78-Y80 HydrophobicContact CD1-CE1 4.29Å; L78-Y80 HydrophobicContact CG-CE1 4.46Å; L78-Y80 VanDerWaalsContact O-CD1 3.28Å; L78-Y80 WeakPolarHBondContact O-CD1 3.47Å; L78-Y80 PolarHBondContact O-N 3.38Å; L78-P82 HydrophobicContact CD1-CB 4.12Å; L78-P82 HydrophobicContact CD1-CG 3.85Å
79R91.1Very high95.4Very high64 Ų6447.2 Ų47.224%0.24225%0.246CC..THydrogen-bonded Turntrans66.215.8-173.8-48.1175.2179.5-170.4-3.4114.3L7 E13 V16 S75 S76 F77L7-R79 HydrophobicContact CD2-CG 4.43Å; E13-R79 IonicContact OE1-CZ 3.66Å; E13-R79 VanDerWaalsContact OE1-CZ 3.24Å; E13-R79 IonicContact OE1-NH1 2.74Å; E13-R79 PolarHBondContact OE1-NH1 3.3Å; E13-R79 IonicContact OE1-NH2 3.74Å; E13-R79 PolarHBondContact OE1-NH2 3.36Å; E13-R79 IonicContact OE2-NH2 3.69Å; V16-R79 HydrophobicContact CG1-CG 4.33Å; S75-R79 PolarHBondContact O-N 2.84Å; S76-R79 WeakPolarHBondContact O-CA 3.36Å; S76-R79 PolarHBondContact O-N 3Å; F77-R79 VanDerWaalsContact C-N 3.33Å
80Y90.8Very high95.5Very high78 Ų7851.5 Ų51.531%0.30627%0.272SS..SBendtrans-156.6164.1173.975.8-77.3000110.4Y5 S75 L78 P82Y5-Y80 HydrophobicContact CD1-CD1 4.46Å; Y5-Y80 HydrophobicContact CD1-CG 4.31Å; Y5-Y80 AromaticContact CD2-CD1 3.27Å; Y5-Y80 HydrophobicContact CD2-CD1 3.27Å; Y5-Y80 AromaticContact CD2-CE1 3.63Å; Y5-Y80 HydrophobicContact CD2-CE1 3.63Å; Y5-Y80 AromaticContact CD2-CG 3.91Å; Y5-Y80 HydrophobicContact CD2-CG 3.91Å; Y5-Y80 HydrophobicContact CE1-CG 4.35Å; Y5-Y80 AromaticContact CE2-CD1 3.44Å; Y5-Y80 HydrophobicContact CE2-CD1 3.44Å; Y5-Y80 VanDerWaalsContact CE2-CD1 3.44Å; Y5-Y80 HydrophobicContact CE2-CD2 4.34Å; Y5-Y80 AromaticContact CE2-CE1 3.37Å; Y5-Y80 HydrophobicContact CE2-CE1 3.37Å; Y5-Y80 HydrophobicContact CE2-CE2 4.25Å; Y5-Y80 AromaticContact CE2-CG 3.97Å; Y5-Y80 HydrophobicContact CE2-CG 3.97Å; Y5-Y80 AromaticContact CE2-CZ 3.82Å; Y5-Y80 AromaticContact CG-CD1 3.84Å; Y5-Y80 HydrophobicContact CG-CD1 3.84Å; Y5-Y80 HydrophobicContact CG-CG 4.09Å; S75-Y80 PolarHBondContact O-N 3.35Å; S75-Y80 VanDerWaalsContact O-O 3.08Å; L78-Y80 HydrophobicContact CB-CD1 3.84Å; L78-Y80 HydrophobicContact CB-CE1 3.74Å; L78-Y80 HydrophobicContact CD1-CE1 4.29Å; L78-Y80 HydrophobicContact CG-CE1 4.46Å; L78-Y80 VanDerWaalsContact O-CD1 3.28Å; L78-Y80 WeakPolarHBondContact O-CD1 3.47Å; L78-Y80 PolarHBondContact O-N 3.38Å; Y80-P82 HydrophobicContact CD2-CB 4.43Å; Y80-P82 HydrophobicContact CE2-CB 3.7Å; Y80-P82 WeakPolarHBondContact O-CD 3.36Å
81W95Very high95.5Very high21 Ų2149.7 Ų49.78%0.0826%0.26CS..  trans-84.6113171.7-178-103.8000111.5I71 Y83 G84 G87 H91 Y155 R159 T160I71-W81 HydrophobicContact CG2-CH2 3.85Å; I71-W81 HydrophobicContact CG2-CZ3 4.01Å; W81-Y83 AromaticContact CD2-CD2 3.96Å; W81-Y83 HydrophobicContact CD2-CD2 3.96Å; W81-Y83 AromaticContact CE2-CD2 3.66Å; W81-Y83 HydrophobicContact CE3-CD2 4.09Å; W81-Y83 AromaticContact CH2-CD2 3.63Å; W81-Y83 HydrophobicContact CH2-CD2 3.63Å; W81-Y83 HydrophobicContact CH2-CE2 4.21Å; W81-Y83 AromaticContact CZ2-CD2 3.5Å; W81-Y83 HydrophobicContact CZ2-CD2 3.5Å; W81-Y83 VanDerWaalsContact CZ2-CD2 3.5Å; W81-Y83 HydrophobicContact CZ2-CE2 4.48Å; W81-Y83 HydrophobicContact CZ2-CG 4.08Å; W81-Y83 AromaticContact CZ3-CD2 3.95Å; W81-Y83 HydrophobicContact CZ3-CD2 3.95Å; W81-Y83 HydrophobicContact CZ3-CE2 4.28Å; W81-G84 PolarHBondContact NE1-O 2.9Å; W81-G87 WeakPolarHBondContact CZ2-O 3.45Å; W81-H91 HydrophobicContact CH2-CB 3.6Å; W81-H91 AromaticContact CH2-CD2 3.48Å; W81-H91 VanDerWaalsContact CH2-CD2 3.48Å; W81-H91 WeakPolarHBondContact CH2-CD2 3.42Å; W81-H91 AromaticContact CH2-CG 3.54Å; W81-H91 HydrophobicContact CZ2-CB 3.85Å; W81-Y155 HydrophobicContact CB-CD1 4.24Å; W81-Y155 HydrophobicContact CB-CE1 3.62Å; W81-Y155 AromaticContact CD1-CE1 3.56Å; W81-Y155 HydrophobicContact CD2-CE1 4.36Å; W81-Y155 HydrophobicContact CG-CD1 4.39Å; W81-Y155 AromaticContact CG-CE1 3.57Å; W81-Y155 HydrophobicContact CG-CE1 3.57Å; W81-R159 PolarHBondContact N-O 3.1Å; W81-T160 WeakPolarHBondContact CZ3-O 3.42Å
82P95.4Very high95.6Very high45 Ų4546.9 Ų46.929%0.29225%0.246SC..THydrogen-bonded Turntrans-87.5-7.5-173.836.3-37.6000114.5F74 S75 L78 Y80F74-P82 HydrophobicContact CE1-CG 4.48Å; S75-P82 WeakPolarHBondContact OG-CD 2.99Å; L78-P82 HydrophobicContact CD1-CB 4.12Å; L78-P82 HydrophobicContact CD1-CG 3.85Å; Y80-P82 HydrophobicContact CD2-CB 4.43Å; Y80-P82 HydrophobicContact CE2-CB 3.7Å; Y80-P82 WeakPolarHBondContact O-CD 3.36Å
83Y95.8Very high95.7Very high105 Ų10549.5 Ų49.541%0.41226%0.258SS..THydrogen-bonded Turntrans-96.99-168.3-49.5-77.4000114.4I71 F74 W81 G87I71-Y83 HydrophobicContact CG2-CD2 4.33Å; I71-Y83 HydrophobicContact CG2-CE2 3.65Å; F74-Y83 VanDerWaalsContact CD1-OH 3.3Å; F74-Y83 WeakPolarHBondContact CD1-OH 3.28Å; W81-Y83 AromaticContact CD2-CD2 3.96Å; W81-Y83 HydrophobicContact CD2-CD2 3.96Å; W81-Y83 AromaticContact CE2-CD2 3.66Å; W81-Y83 HydrophobicContact CE3-CD2 4.09Å; W81-Y83 AromaticContact CH2-CD2 3.63Å; W81-Y83 HydrophobicContact CH2-CD2 3.63Å; W81-Y83 HydrophobicContact CH2-CE2 4.21Å; W81-Y83 AromaticContact CZ2-CD2 3.5Å; W81-Y83 HydrophobicContact CZ2-CD2 3.5Å; W81-Y83 VanDerWaalsContact CZ2-CD2 3.5Å; W81-Y83 HydrophobicContact CZ2-CE2 4.48Å; W81-Y83 HydrophobicContact CZ2-CG 4.08Å; W81-Y83 AromaticContact CZ3-CD2 3.95Å; W81-Y83 HydrophobicContact CZ3-CD2 3.95Å; W81-Y83 HydrophobicContact CZ3-CE2 4.28Å; Y83-G87 WeakPolarHBondContact O-CA 3.34Å; Y83-G87 PolarHBondContact O-N 3.45Å
84G95.6Very high95.7Very high37 Ų3751.9 Ų51.938%0.38127%0.269SS..Hα-helixtrans63.7-172.3-178.900000114.1W81 C88W81-G84 PolarHBondContact NE1-O 2.9Å; G84-C88 PolarHBondContact O-N 3.04Å; G84-C88 VanDerWaalsContact O-N 3.07Å
85S95.1Very high95.8Very high77 Ų7747.4 Ų47.454%0.53825%0.253SS..Hα-helixtrans-66-44.9-177.5-172.80000112.2G87 C88 Q89S85-G87 VanDerWaalsContact C-N 3.31Å; S85-G87 PolarHBondContact O-N 3.1Å; S85-C88 WeakPolarHBondContact O-CA 3.37Å; S85-C88 WeakPolarHBondContact O-CB 3.43Å; S85-C88 PolarHBondContact O-N 3.26Å; S85-Q89 WeakPolarHBondContact O-CG 3.34Å; S85-Q89 PolarHBondContact O-N 3.33Å
86D96.1Very high95.9Very high135 Ų13548.4 Ų48.472%0.72226%0.257SS*.Hα-helixtrans-61.9-39.6178.8-62.8-13000112.2C88 Q89 T90D86-C88 VanDerWaalsContact C-N 3.29Å; D86-C88 PolarHBondContact O-N 3.4Å; D86-Q89 PolarHBondContact O-N 2.85Å; D86-T90 WeakPolarHBondContact O-CB 3.46Å; D86-T90 PolarHBondContact O-N 3.08Å; D86-T90 PolarHBondContact O-OG1 3.5Å
87G97.1Very high96Very high18 Ų1850.3 Ų50.319%0.18627%0.267CS..Hα-helixtrans-62.8-38.2172.700000111.9W81 Y83 S85 T90 H91W81-G87 WeakPolarHBondContact CZ2-O 3.45Å; Y83-G87 WeakPolarHBondContact O-CA 3.34Å; Y83-G87 PolarHBondContact O-N 3.45Å; S85-G87 VanDerWaalsContact C-N 3.31Å; S85-G87 PolarHBondContact O-N 3.1Å; G87-T90 PolarHBondContact O-N 3.46Å; G87-H91 VanDerWaalsContact O-CB 3.24Å; G87-H91 WeakPolarHBondContact O-CB 3.37Å; G87-H91 PolarHBondContact O-N 3.5Å
88C97.3Very high96.2Very high2 Ų246.9 Ų46.91%0.01425%0.253CS..Hα-helixtrans-64.4-47.2177.1-175.20000112G84 S85 D86 T90 H91 G92 Y155 C162G84-C88 PolarHBondContact O-N 3.04Å; G84-C88 VanDerWaalsContact O-N 3.07Å; S85-C88 WeakPolarHBondContact O-CA 3.37Å; S85-C88 WeakPolarHBondContact O-CB 3.43Å; S85-C88 PolarHBondContact O-N 3.26Å; D86-C88 VanDerWaalsContact C-N 3.29Å; D86-C88 PolarHBondContact O-N 3.4Å; C88-T90 VanDerWaalsContact C-N 3.34Å; C88-T90 PolarHBondContact O-N 3.44Å; C88-H91 PolarHBondContact O-N 3.1Å; C88-G92 PolarHBondContact O-N 3.46Å; C88-Y155 HydrophobicContact CB-CE1 4.11Å; C88-C162 WeakPolarHBondContact CA-SG 3.29Å; C88-C162 HydrophobicContact CB-CB 4.04Å; C88-C162 WeakPolarHBondContact CB-SG 3.23Å; C88-C162 VanDerWaalsContact O-CB 3.23Å; C88-C162 WeakPolarHBondContact O-CB 3.38Å; C88-C162 WeakPolarHBondContact SG-CB 3.23Å; C88-C162 CovalentContact SG-SG 2.02Å; C88-C162 PolarHBondContact SG-SG 2.87Å
89Q97.8Very high96.5Very high48 Ų4844.6 Ų44.622%0.22424%0.242CC..Hα-helixtrans-59.4-45.4175.3-64.4-55.5-48.400111.3S85 D86 G92 F93 L147 Y153S85-Q89 WeakPolarHBondContact O-CG 3.34Å; S85-Q89 PolarHBondContact O-N 3.33Å; D86-Q89 PolarHBondContact O-N 2.85Å; Q89-G92 PolarHBondContact O-N 2.93Å; Q89-F93 WeakPolarHBondContact O-CB 3.25Å; Q89-F93 PolarHBondContact O-N 3.39Å; Q89-L147 HydrophobicContact CB-CD2 3.84Å; Q89-Y153 PolarHBondContact NE2-O 3Å
90T97.9Very high96.8Very high91 Ų9141.8 Ų41.856%0.55823%0.232SC*.Hα-helixtrans-63.3-43.7178.1-56.90000111.7D86 G87 C88 Q94D86-T90 WeakPolarHBondContact O-CB 3.46Å; D86-T90 PolarHBondContact O-N 3.08Å; D86-T90 PolarHBondContact O-OG1 3.5Å; G87-T90 PolarHBondContact O-N 3.46Å; C88-T90 VanDerWaalsContact C-N 3.34Å; C88-T90 PolarHBondContact O-N 3.44Å; T90-Q94 VanDerWaalsContact O-CB 3.23Å; T90-Q94 WeakPolarHBondContact O-CB 3.35Å; T90-Q94 PolarHBondContact O-N 2.84Å
91H98Very high97.2Very high9 Ų938 Ų384%0.04222%0.218CC..Hα-helixtrans-64.1-44.5177.4177.9-79.6000111.9N68 W81 G87 C88 G95 C162N68-H91 VanDerWaalsContact CG-CE1 3.44Å; N68-H91 VanDerWaalsContact CG-NE2 3.31Å; N68-H91 PolarHBondContact ND2-CD2 2.88Å; N68-H91 PolarHBondContact ND2-CE1 3.43Å; N68-H91 VanDerWaalsContact ND2-CE1 3.31Å; N68-H91 PolarHBondContact ND2-NE2 3.38Å; N68-H91 PolarHBondContact ND2-O 3.35Å; N68-H91 PolarHBondContact O-NE2 3.27Å; N68-H91 PolarHBondContact OD1-CE1 2.94Å; N68-H91 PolarHBondContact OD1-NE2 3.35Å; W81-H91 HydrophobicContact CH2-CB 3.6Å; W81-H91 AromaticContact CH2-CD2 3.48Å; W81-H91 VanDerWaalsContact CH2-CD2 3.48Å; W81-H91 WeakPolarHBondContact CH2-CD2 3.42Å; W81-H91 AromaticContact CH2-CG 3.54Å; W81-H91 HydrophobicContact CZ2-CB 3.85Å; G87-H91 VanDerWaalsContact O-CB 3.24Å; G87-H91 WeakPolarHBondContact O-CB 3.37Å; G87-H91 PolarHBondContact O-N 3.5Å; C88-H91 PolarHBondContact O-N 3.1Å; H91-G95 PolarHBondContact O-N 3.5Å; H91-C162 HydrophobicContact CB-CB 4.49Å; H91-C162 PolarHBondContact ND1-N 3.47Å; H91-C162 PolarHBondContact ND1-O 3.49Å
92G97.5Very high97.4Very high2 Ų237 Ų372%0.02121%0.214CC..Hα-helixtrans-59.8-51.3175.500000111.5C88 Q89 F96C88-G92 PolarHBondContact O-N 3.46Å; Q89-G92 PolarHBondContact O-N 2.93Å; G92-F96 WeakPolarHBondContact O-CB 3.35Å; G92-F96 PolarHBondContact O-N 3.39Å
93F98.4Very high97.5Very high55 Ų5535.5 Ų35.524%0.24120%0.203CC..Hα-helixtrans-56.9-54177.1170.4-100.5000112.4Q89 G95 F96 M97 A143 A144 L147 Y153Q89-F93 WeakPolarHBondContact O-CB 3.25Å; Q89-F93 PolarHBondContact O-N 3.39Å; F93-G95 PolarHBondContact O-N 2.96Å; F93-F96 PolarHBondContact O-N 3.26Å; F93-M97 HydrophobicContact CE1-SD 4.09Å; F93-M97 HydrophobicContact CZ-SD 3.85Å; F93-M97 VanDerWaalsContact O-CB 3.28Å; F93-M97 WeakPolarHBondContact O-CB 3.47Å; F93-M97 PolarHBondContact O-N 3.19Å; F93-A143 HydrophobicContact CD2-CB 3.84Å; F93-A143 WeakPolarHBondContact CD2-O 3.4Å; F93-A143 HydrophobicContact CE2-CB 3.91Å; F93-A144 HydrophobicContact CE2-CB 4.24Å; F93-L147 HydrophobicContact CB-CD1 3.97Å; F93-L147 HydrophobicContact CB-CD2 4.41Å; F93-L147 HydrophobicContact CB-CG 4.42Å; F93-L147 HydrophobicContact CD2-CD1 3.63Å; F93-L147 HydrophobicContact CD2-CG 4.44Å; F93-L147 HydrophobicContact CE2-CD1 4.37Å; F93-L147 HydrophobicContact CG-CD1 3.88Å; F93-Y153 HydrophobicContact CB-CE2 4.02Å
94Q98.2Very high97.6Very high50 Ų5031 Ų3123%0.23419%0.185CC..Hα-helixtrans-63.4-45.9-176.3177.4-81-45.900111.5G64 N68 T90 F96 T98G64-Q94 VanDerWaalsContact C-NE2 3.28Å; G64-Q94 PolarHBondContact O-NE2 2.81Å; N68-Q94 PolarHBondContact ND2-OE1 3.03Å; T90-Q94 VanDerWaalsContact O-CB 3.23Å; T90-Q94 WeakPolarHBondContact O-CB 3.35Å; T90-Q94 PolarHBondContact O-N 2.84Å; Q94-F96 VanDerWaalsContact C-N 3.34Å; Q94-F96 PolarHBondContact O-N 3.32Å; Q94-T98 PolarHBondContact NE2-OG1 3.47Å; Q94-T98 WeakPolarHBondContact O-CB 3.43Å; Q94-T98 WeakPolarHBondContact O-CG2 3.18Å; Q94-T98 PolarHBondContact O-N 3.34Å; Q94-T98 VanDerWaalsContact O-N 3.1Å; Q94-T98 PolarHBondContact O-OG1 3.44Å
95G97.3Very high97.7Very high13 Ų1329.2 Ų29.213%0.13417%0.167CC..Hα-helixtrans-62.8-42.2178.400000111.8N68 H91 F93 T98 A99N68-G95 VanDerWaalsContact ND2-CA 3.28Å; N68-G95 WeakPolarHBondContact ND2-CA 3.36Å; N68-G95 PolarHBondContact ND2-N 2.94Å; H91-G95 PolarHBondContact O-N 3.5Å; F93-G95 PolarHBondContact O-N 2.96Å; G95-T98 PolarHBondContact O-OG1 3.19Å; G95-A99 WeakPolarHBondContact O-CB 3.26Å; G95-A99 PolarHBondContact O-N 3.33Å
96F97.2Very high97.9Very high21 Ų2126.2 Ų26.29%0.09215%0.145CC..Hα-helixtrans-72.2-44.8-179.2-159.7-115.4000112.3G92 F93 Q94 T98 A99 L100 A143 Y153 L164 Y176 M180G92-F96 WeakPolarHBondContact O-CB 3.35Å; G92-F96 PolarHBondContact O-N 3.39Å; F93-F96 PolarHBondContact O-N 3.26Å; Q94-F96 VanDerWaalsContact C-N 3.34Å; Q94-F96 PolarHBondContact O-N 3.32Å; F96-T98 VanDerWaalsContact C-N 3.31Å; F96-T98 PolarHBondContact O-N 3.4Å; F96-A99 WeakPolarHBondContact O-CB 3.43Å; F96-A99 PolarHBondContact O-N 3.04Å; F96-L100 HydrophobicContact CD1-CD1 3.99Å; F96-L100 HydrophobicContact CD1-CG 4.3Å; F96-L100 HydrophobicContact CE1-CD1 3.65Å; F96-L100 HydrophobicContact CE1-CD2 4.39Å; F96-L100 HydrophobicContact CE1-CG 4.11Å; F96-L100 HydrophobicContact CE2-CD2 4.4Å; F96-L100 HydrophobicContact CZ-CD1 4.18Å; F96-L100 HydrophobicContact CZ-CD2 4.09Å; F96-L100 HydrophobicContact CZ-CG 4.28Å; F96-L100 VanDerWaalsContact O-CG 3.29Å; F96-L100 WeakPolarHBondContact O-CG 3.49Å; F96-L100 PolarHBondContact O-N 3.23Å; F96-A143 HydrophobicContact CB-CB 4.34Å; F96-A143 HydrophobicContact CD1-CB 3.96Å; F96-Y153 HydrophobicContact CB-CE1 4.14Å; F96-Y153 VanDerWaalsContact CB-OH 3.29Å; F96-Y153 WeakPolarHBondContact CB-OH 3.4Å; F96-Y153 WeakPolarHBondContact CD1-OH 3.49Å; F96-Y153 HydrophobicContact CG-CE1 4.41Å; F96-L164 HydrophobicContact CD2-CD1 4.16Å; F96-L164 HydrophobicContact CE1-CD1 4.07Å; F96-L164 HydrophobicContact CE2-CD1 3.52Å; F96-L164 HydrophobicContact CE2-CG 4.33Å; F96-L164 HydrophobicContact CZ-CD1 3.48Å; F96-L164 VanDerWaalsContact CZ-CD1 3.48Å; F96-L164 HydrophobicContact CZ-CG 4.46Å; F96-Y176 WeakPolarHBondContact CE1-OH 3.36Å; F96-M180 HydrophobicContact CE1-CG 4.48Å; F96-M180 HydrophobicContact CZ-CE 3.83Å; F96-M180 HydrophobicContact CZ-CG 4.23Å; F96-M180 HydrophobicContact CZ-SD 3.83Å
97M98.4Very high98Very high42 Ų4219.9 Ų19.921%0.20711%0.111CC..Hα-helixtrans-55.7-46.4174.9177.1-177.8168.900111.6F93 L100 A101 W136 A139 A140 A143F93-M97 HydrophobicContact CE1-SD 4.09Å; F93-M97 HydrophobicContact CZ-SD 3.85Å; F93-M97 VanDerWaalsContact O-CB 3.28Å; F93-M97 WeakPolarHBondContact O-CB 3.47Å; F93-M97 PolarHBondContact O-N 3.19Å; M97-L100 PolarHBondContact O-N 2.86Å; M97-A101 WeakPolarHBondContact O-CB 3.48Å; M97-A101 PolarHBondContact O-N 2.99Å; M97-W136 HydrophobicContact CE-CE3 3.5Å; M97-W136 HydrophobicContact CE-CZ3 3.82Å; M97-A139 HydrophobicContact CG-CB 4.4Å; M97-A140 HydrophobicContact CE-CB 4.06Å; M97-A140 HydrophobicContact CG-CB 4.48Å; M97-A140 HydrophobicContact SD-CB 4.12Å; M97-A143 HydrophobicContact CB-CB 3.72Å
98T98.4Very high98Very high12 Ų1219.4 Ų19.47%0.07411%0.106CC..Hα-helixtrans-73.1-36.1-177.653.30000112.4A61 Q94 G95 F96 A101 S102A61-T98 WeakPolarHBondContact O-CB 3.5Å; Q94-T98 PolarHBondContact NE2-OG1 3.47Å; Q94-T98 WeakPolarHBondContact O-CB 3.43Å; Q94-T98 WeakPolarHBondContact O-CG2 3.18Å; Q94-T98 PolarHBondContact O-N 3.34Å; Q94-T98 VanDerWaalsContact O-N 3.1Å; Q94-T98 PolarHBondContact O-OG1 3.44Å; G95-T98 PolarHBondContact O-OG1 3.19Å; F96-T98 VanDerWaalsContact C-N 3.31Å; F96-T98 PolarHBondContact O-N 3.4Å; T98-A101 PolarHBondContact O-N 3.01Å; T98-S102 WeakPolarHBondContact O-CB 3.5Å; T98-S102 PolarHBondContact O-N 3.37Å
99A97.9Very high98Very high11 Ų1119.4 Ų19.49%0.09111%0.106CC..Hα-helixtrans-57.1-50.4168.800000112.5G95 F96 S102 L103 W224G95-A99 WeakPolarHBondContact O-CB 3.26Å; G95-A99 PolarHBondContact O-N 3.33Å; F96-A99 WeakPolarHBondContact O-CB 3.43Å; F96-A99 PolarHBondContact O-N 3.04Å; A99-S102 PolarHBondContact O-N 3.44Å; A99-L103 PolarHBondContact O-N 2.91Å; A99-L103 VanDerWaalsContact O-N 3.09Å; A99-W224 HydrophobicContact CB-CH2 3.44Å; A99-W224 VanDerWaalsContact CB-CH2 3.44Å; A99-W224 HydrophobicContact CB-CZ2 4.37Å; A99-W224 HydrophobicContact CB-CZ3 4.04Å
100L98.1Very high98Very high5 Ų517.1 Ų17.13%0.02610%0.095CC..Hα-helixtrans-63.1-47.3178.7-66.4-169.9000111.2F96 M97 S102 L103 H104 A139 W142 N184F96-L100 HydrophobicContact CD1-CD1 3.99Å; F96-L100 HydrophobicContact CD1-CG 4.3Å; F96-L100 HydrophobicContact CE1-CD1 3.65Å; F96-L100 HydrophobicContact CE1-CD2 4.39Å; F96-L100 HydrophobicContact CE1-CG 4.11Å; F96-L100 HydrophobicContact CE2-CD2 4.4Å; F96-L100 HydrophobicContact CZ-CD1 4.18Å; F96-L100 HydrophobicContact CZ-CD2 4.09Å; F96-L100 HydrophobicContact CZ-CG 4.28Å; F96-L100 VanDerWaalsContact O-CG 3.29Å; F96-L100 WeakPolarHBondContact O-CG 3.49Å; F96-L100 PolarHBondContact O-N 3.23Å; M97-L100 PolarHBondContact O-N 2.86Å; L100-S102 VanDerWaalsContact C-N 3.29Å; L100-S102 PolarHBondContact O-N 3.26Å; L100-L103 PolarHBondContact O-N 3.32Å; L100-H104 PolarHBondContact O-CD2 2.87Å; L100-H104 PolarHBondContact O-N 2.92Å; L100-A139 HydrophobicContact CB-CB 3.85Å; L100-W142 HydrophobicContact CD1-CB 3.48Å; L100-W142 VanDerWaalsContact CD1-CB 3.48Å; L100-W142 HydrophobicContact CD1-CG 4.37Å; L100-N184 HydrophobicContact CD2-CB 3.78Å
101A98.7Very high98Very high0 Ų017.3 Ų17.30%09%0.086CC..Hα-helixtrans-56.9-43.4176.700000111.7A61 M97 T98 H104 F105 I135 W136 A139A61-A101 HydrophobicContact CB-CB 3.93Å; M97-A101 WeakPolarHBondContact O-CB 3.48Å; M97-A101 PolarHBondContact O-N 2.99Å; T98-A101 PolarHBondContact O-N 3.01Å; A101-H104 PolarHBondContact O-N 3.28Å; A101-F105 HydrophobicContact CB-CD2 4.46Å; A101-F105 HydrophobicContact CB-CE2 4.39Å; A101-F105 WeakPolarHBondContact O-CD2 3.3Å; A101-F105 PolarHBondContact O-N 2.87Å; A101-I135 HydrophobicContact CB-CG2 4.46Å; A101-W136 HydrophobicContact CB-CD2 4.34Å; A101-W136 HydrophobicContact CB-CE3 3.83Å; A101-W136 HydrophobicContact CB-CH2 4.07Å; A101-W136 HydrophobicContact CB-CZ3 3.69Å; A101-A139 HydrophobicContact CB-CB 4.03Å
102S98.4Very high97.9Very high0 Ų017.2 Ų17.20%09%0.086CC..Hα-helixtrans-58.6-48.9176.7-177.50000111.8L58 D62 T98 A99 L100 H104 F105 I106 N261L58-S102 WeakPolarHBondContact CD1-O 3.18Å; L58-S102 VanDerWaalsContact CD1-OG 3.23Å; L58-S102 WeakPolarHBondContact CD1-OG 3.5Å; D62-S102 WeakPolarHBondContact OD1-CB 3.46Å; D62-S102 PolarHBondContact OD1-OG 3.36Å; T98-S102 WeakPolarHBondContact O-CB 3.5Å; T98-S102 PolarHBondContact O-N 3.37Å; A99-S102 PolarHBondContact O-N 3.44Å; L100-S102 VanDerWaalsContact C-N 3.29Å; L100-S102 PolarHBondContact O-N 3.26Å; S102-H104 PolarHBondContact O-N 3.17Å; S102-F105 PolarHBondContact O-N 3.42Å; S102-I106 VanDerWaalsContact O-CG1 3.29Å; S102-I106 WeakPolarHBondContact O-CG1 3.15Å; S102-I106 PolarHBondContact O-N 3.17Å; S102-N261 PolarHBondContact OG-ND2 3Å
103L97.6Very high97.8Very high13 Ų1317.7 Ų17.77%0.0689%0.087CC..Hα-helixtrans-56.8-46.2176.2-75.5170.6000112.9A99 L100 I106 A107 L220 W224A99-L103 PolarHBondContact O-N 2.91Å; A99-L103 VanDerWaalsContact O-N 3.09Å; L100-L103 PolarHBondContact O-N 3.32Å; L103-I106 PolarHBondContact O-N 3.4Å; L103-A107 PolarHBondContact O-N 2.77Å; L103-A107 VanDerWaalsContact O-N 3.17Å; L103-L220 HydrophobicContact CD2-CD1 3.6Å; L103-W224 HydrophobicContact CD1-CD2 4.27Å; L103-W224 HydrophobicContact CD1-CE3 4.24Å; L103-W224 HydrophobicContact CD2-CB 4.48Å; L103-W224 HydrophobicContact CD2-CD2 3.88Å; L103-W224 HydrophobicContact CD2-CG 3.77Å; L103-W224 HydrophobicContact CG-CD2 4.26Å; L103-W224 HydrophobicContact CG-CZ2 4.45Å
104H98.6Very high97.7Very high9 Ų918.4 Ų18.44%0.0429%0.088CC..Hα-helixtrans-66.7-40178.9-82.6-84.5000112.3L100 A101 S102 A107 A108 I135 F138 N184 Q188L100-H104 PolarHBondContact O-CD2 2.87Å; L100-H104 PolarHBondContact O-N 2.92Å; A101-H104 PolarHBondContact O-N 3.28Å; S102-H104 PolarHBondContact O-N 3.17Å; H104-A107 PolarHBondContact O-N 3.14Å; H104-A108 WeakPolarHBondContact O-CB 3.46Å; H104-A108 PolarHBondContact O-N 2.86Å; H104-I135 HydrophobicContact CB-CB 4.3Å; H104-I135 HydrophobicContact CB-CD1 4.18Å; H104-I135 HydrophobicContact CB-CG1 3.95Å; H104-I135 HydrophobicContact CB-CG2 3.49Å; H104-I135 VanDerWaalsContact CB-CG2 3.49Å; H104-F138 AromaticContact CE1-CD1 3.52Å; H104-F138 AromaticContact CE1-CE1 3.59Å; H104-F138 AromaticContact NE2-CD1 3.48Å; H104-F138 WeakPolarHBondContact NE2-CD1 3.47Å; H104-F138 AromaticContact NE2-CE1 3.65Å; H104-N184 PolarHBondContact NE2-OD1 3.36Å; H104-Q188 PolarHBondContact CE1-NE2 3.28Å; H104-Q188 PolarHBondContact ND1-NE2 2.85Å
105F98.6Very high97.6Very high0 Ų018 Ų180%09%0.086CC..Hα-helixtrans-68.2-35.6176.3-77.6-61.4000112.5L54 L58 A101 S102 A107 A108 I109 A132 I135 W136L54-F105 HydrophobicContact CD2-CD1 4.38Å; L54-F105 HydrophobicContact CD2-CE1 4.34Å; L58-F105 HydrophobicContact CB-CB 3.8Å; L58-F105 HydrophobicContact CB-CG 4.44Å; L58-F105 HydrophobicContact CD1-CB 4.05Å; L58-F105 HydrophobicContact CG-CB 4.43Å; A101-F105 HydrophobicContact CB-CD2 4.46Å; A101-F105 HydrophobicContact CB-CE2 4.39Å; A101-F105 WeakPolarHBondContact O-CD2 3.3Å; A101-F105 PolarHBondContact O-N 2.87Å; S102-F105 PolarHBondContact O-N 3.42Å; F105-A107 VanDerWaalsContact C-N 3.3Å; F105-A107 PolarHBondContact O-N 3.34Å; F105-A108 PolarHBondContact O-N 3.29Å; F105-I109 WeakPolarHBondContact O-CB 3.43Å; F105-I109 VanDerWaalsContact O-CD1 3.26Å; F105-I109 WeakPolarHBondContact O-CD1 3.29Å; F105-I109 VanDerWaalsContact O-CG1 3.29Å; F105-I109 WeakPolarHBondContact O-CG1 3.35Å; F105-I109 PolarHBondContact O-N 3.13Å; F105-A132 HydrophobicContact CE1-CB 3.84Å; F105-A132 HydrophobicContact CZ-CB 3.96Å; F105-I135 HydrophobicContact CD1-CD1 3.79Å; F105-I135 HydrophobicContact CD2-CG2 3.95Å; F105-I135 HydrophobicContact CE1-CB 4.33Å; F105-I135 HydrophobicContact CE1-CD1 3.76Å; F105-I135 HydrophobicContact CE1-CG2 4.25Å; F105-I135 HydrophobicContact CE2-CB 4.41Å; F105-I135 HydrophobicContact CE2-CG2 3.62Å; F105-I135 HydrophobicContact CG-CD1 4.39Å; F105-I135 HydrophobicContact CG-CG2 4.36Å; F105-I135 HydrophobicContact CZ-CB 4.04Å; F105-I135 HydrophobicContact CZ-CD1 4.33Å; F105-I135 HydrophobicContact CZ-CG2 3.77Å; F105-W136 HydrophobicContact CE2-CD2 4.48Å; F105-W136 AromaticContact CE2-CE2 3.88Å; F105-W136 HydrophobicContact CE2-CZ2 4.27Å; F105-W136 AromaticContact CE2-NE1 3.6Å; F105-W136 AromaticContact CZ-CD1 3.89Å; F105-W136 AromaticContact CZ-NE1 3.65Å
106I97.5Very high97.3Very high14 Ų1421.7 Ų21.77%0.07210%0.1CC..Hα-helixtrans-57.1-46171.1-68.8164.2000110.3L58 S102 L103 I109 A110 V192 L220L58-I106 HydrophobicContact CD1-CG1 4.06Å; L58-I106 HydrophobicContact CD2-CG1 4.03Å; S102-I106 VanDerWaalsContact O-CG1 3.29Å; S102-I106 WeakPolarHBondContact O-CG1 3.15Å; S102-I106 PolarHBondContact O-N 3.17Å; L103-I106 PolarHBondContact O-N 3.4Å; I106-I109 PolarHBondContact O-N 3.3Å; I106-A110 PolarHBondContact O-N 3.3Å; I106-V192 HydrophobicContact CG2-CG2 4.1Å; I106-L220 HydrophobicContact CD1-CD1 4.36Å
107A98.3Very high97.2Very high2 Ų223.4 Ų23.42%0.01711%0.106CC..Hα-helixtrans-66.4-43.5177.400000112.6L103 H104 F105 I109 A110 W111 Q188 V191 V192L103-A107 PolarHBondContact O-N 2.77Å; L103-A107 VanDerWaalsContact O-N 3.17Å; H104-A107 PolarHBondContact O-N 3.14Å; F105-A107 VanDerWaalsContact C-N 3.3Å; F105-A107 PolarHBondContact O-N 3.34Å; A107-I109 VanDerWaalsContact C-N 3.27Å; A107-I109 PolarHBondContact O-N 2.71Å; A107-A110 PolarHBondContact O-N 3Å; A107-A110 VanDerWaalsContact O-N 3.17Å; A107-W111 WeakPolarHBondContact O-CB 3.47Å; A107-W111 PolarHBondContact O-N 3.15Å; A107-Q188 HydrophobicContact CB-CB 4.1Å; A107-V191 HydrophobicContact CB-CB 4.28Å; A107-V191 HydrophobicContact CB-CG1 4.08Å; A107-V192 HydrophobicContact CB-CG2 4.13Å
108A98.3Very high97Very high8 Ų823 Ų237%0.06611%0.107CC..Hα-helixtrans-58.4-40176.500000112.2L54 H104 F105 W111 D112 L131 I135L54-A108 HydrophobicContact CD1-CB 4.16Å; H104-A108 WeakPolarHBondContact O-CB 3.46Å; H104-A108 PolarHBondContact O-N 2.86Å; F105-A108 PolarHBondContact O-N 3.29Å; A108-W111 PolarHBondContact O-N 3.02Å; A108-D112 PolarHBondContact O-N 3.49Å; A108-L131 HydrophobicContact CB-CD2 3.75Å; A108-L131 HydrophobicContact CB-CG 4.43Å; A108-I135 HydrophobicContact CB-CD1 3.97Å
109I97.1Very high96.8Very high3 Ų325.2 Ų25.22%0.01512%0.121CC..Hα-helixtrans-69-44.4176-73.7154.3000110.8L54 V55 L58 F105 I106 A107 W111 D112 R113 Y265L54-I109 HydrophobicContact CB-CD1 4.01Å; L54-I109 HydrophobicContact CB-CG1 3.68Å; L54-I109 HydrophobicContact CD1-CG1 4.35Å; V55-I109 HydrophobicContact CG2-CD1 4.06Å; V55-I109 HydrophobicContact CG2-CG1 4.47Å; L58-I109 HydrophobicContact CB-CD1 4.29Å; L58-I109 HydrophobicContact CD2-CD1 3.99Å; F105-I109 WeakPolarHBondContact O-CB 3.43Å; F105-I109 VanDerWaalsContact O-CD1 3.26Å; F105-I109 WeakPolarHBondContact O-CD1 3.29Å; F105-I109 VanDerWaalsContact O-CG1 3.29Å; F105-I109 WeakPolarHBondContact O-CG1 3.35Å; F105-I109 PolarHBondContact O-N 3.13Å; I106-I109 PolarHBondContact O-N 3.3Å; A107-I109 VanDerWaalsContact C-N 3.27Å; A107-I109 PolarHBondContact O-N 2.71Å; I109-W111 PolarHBondContact O-N 3.19Å; I109-D112 PolarHBondContact O-N 3.41Å; I109-R113 HydrophobicContact CG2-CG 4.41Å; I109-R113 WeakPolarHBondContact O-CB 3.21Å; I109-R113 WeakPolarHBondContact O-CG 3.34Å; I109-R113 PolarHBondContact O-N 3.03Å; I109-Y265 HydrophobicContact CB-CE1 4.14Å; I109-Y265 WeakPolarHBondContact CB-OH 3.34Å; I109-Y265 HydrophobicContact CD1-CE1 3.61Å; I109-Y265 HydrophobicContact CD1-CE2 4.5Å; I109-Y265 VanDerWaalsContact CD1-CZ 3.45Å; I109-Y265 WeakPolarHBondContact CD1-OH 3.15Å; I109-Y265 HydrophobicContact CG1-CE1 4.09Å; I109-Y265 HydrophobicContact CG2-CD1 4.47Å; I109-Y265 HydrophobicContact CG2-CE1 3.32Å; I109-Y265 WeakPolarHBondContact CG2-OH 3.42Å
110A97Very high96.5Very high0 Ų034 Ų340%015%0.151CC..Hα-helixtrans-57.7-42.7177.500000110.6I106 A107 R113 Y114 V192 S195 Y196I106-A110 PolarHBondContact O-N 3.3Å; A107-A110 PolarHBondContact O-N 3Å; A107-A110 VanDerWaalsContact O-N 3.17Å; A110-R113 PolarHBondContact O-N 2.94Å; A110-Y114 PolarHBondContact O-N 3.02Å; A110-V192 HydrophobicContact CB-CB 4.41Å; A110-V192 HydrophobicContact CB-CG2 4.03Å; A110-S195 WeakPolarHBondContact O-CB 3.36Å; A110-Y196 HydrophobicContact CB-CD2 4.09Å; A110-Y196 HydrophobicContact CB-CE2 3.55Å
111W97.6Very high96.3Very high95 Ų9537.4 Ų37.436%0.3617%0.173SC..Hα-helixtrans-62.7-45.2175175.785.9000112.9A107 A108 I109 Y114 H115 L123 V191A107-W111 WeakPolarHBondContact O-CB 3.47Å; A107-W111 PolarHBondContact O-N 3.15Å; A108-W111 PolarHBondContact O-N 3.02Å; I109-W111 PolarHBondContact O-N 3.19Å; W111-Y114 WeakPolarHBondContact O-CB 3.38Å; W111-Y114 PolarHBondContact O-N 3.13Å; W111-H115 AromaticContact CD1-CE1 3.66Å; W111-H115 AromaticContact CD1-ND1 3.96Å; W111-H115 AromaticContact CD2-CE1 4Å; W111-H115 AromaticContact CD2-ND1 3.82Å; W111-H115 AromaticContact CE2-CE1 3.29Å; W111-H115 AromaticContact CE2-ND1 3.55Å; W111-H115 AromaticContact CZ2-CE1 3.66Å; W111-H115 AromaticContact CZ2-ND1 3.94Å; W111-H115 AromaticContact NE1-CE1 3.11Å; W111-H115 PolarHBondContact NE1-CE1 3.41Å; W111-H115 AromaticContact NE1-ND1 3.69Å; W111-H115 PolarHBondContact O-N 3.44Å; W111-H115 VanDerWaalsContact O-N 3.1Å; W111-H115 PolarHBondContact O-ND1 2.99Å; W111-L123 HydrophobicContact CH2-CD1 4.38Å; W111-L123 HydrophobicContact CZ3-CD1 3.87Å; W111-V191 HydrophobicContact CB-CG1 4.12Å
112D96.8Very high96.1Very high7 Ų745.8 Ų45.84%0.03721%0.209CC..Hα-helixtrans-60.4-46.2175.1174.954000111.5S51 L54 A108 I109 Y114 H115 Q116 L123S51-D112 WeakPolarHBondContact CB-OD2 3.11Å; S51-D112 PolarHBondContact OG-OD1 3.36Å; S51-D112 PolarHBondContact OG-OD2 2.95Å; L54-D112 HydrophobicContact CD1-CB 4.31Å; A108-D112 PolarHBondContact O-N 3.49Å; I109-D112 PolarHBondContact O-N 3.41Å; D112-Y114 VanDerWaalsContact C-N 3.31Å; D112-Y114 PolarHBondContact O-N 3.46Å; D112-H115 WeakPolarHBondContact O-CB 3.33Å; D112-H115 PolarHBondContact O-N 3.37Å; D112-H115 VanDerWaalsContact O-N 3.09Å; D112-Q116 PolarHBondContact O-N 3.31Å; D112-L123 HydrophobicContact CB-CD2 4.43Å; D112-L123 VanDerWaalsContact OD1-CB 3.25Å; D112-L123 WeakPolarHBondContact OD1-CB 3.24Å
113R94.6Very high95.9Very high11 Ų1146.7 Ų46.74%0.04221%0.214CC..Hα-helixtrans-62.1-39.3177.1-72.3-179.9179.1-87.510.8112I109 A110 H115 Q116 Y117 I199 G268I109-R113 HydrophobicContact CG2-CG 4.41Å; I109-R113 WeakPolarHBondContact O-CB 3.21Å; I109-R113 WeakPolarHBondContact O-CG 3.34Å; I109-R113 PolarHBondContact O-N 3.03Å; A110-R113 PolarHBondContact O-N 2.94Å; R113-H115 VanDerWaalsContact C-N 3.31Å; R113-H115 PolarHBondContact O-N 2.85Å; R113-Q116 PolarHBondContact O-N 3.35Å; R113-Y117 HydrophobicContact CB-CD2 4.43Å; R113-Y117 HydrophobicContact CB-CE2 4.47Å; R113-Y117 WeakPolarHBondContact O-CD2 3.38Å; R113-Y117 PolarHBondContact O-N 3.36Å; R113-I199 HydrophobicContact CB-CD1 4Å; R113-G268 PolarHBondContact NH1-O 3.37Å
114Y96.2Very high95.9Very high70 Ų7051.3 Ų51.328%0.27524%0.235SC..Hα-helixtrans-57.6-47.4173.5161.5-96.2000110.7A110 W111 D112 Q116 Y117 C118 T119A110-Y114 PolarHBondContact O-N 3.02Å; W111-Y114 WeakPolarHBondContact O-CB 3.38Å; W111-Y114 PolarHBondContact O-N 3.13Å; D112-Y114 VanDerWaalsContact C-N 3.31Å; D112-Y114 PolarHBondContact O-N 3.46Å; Y114-Q116 VanDerWaalsContact C-N 3.33Å; Y114-Q116 PolarHBondContact O-N 2.94Å; Y114-Y117 PolarHBondContact O-N 3.05Å; Y114-C118 HydrophobicContact CD2-CB 3.74Å; Y114-C118 HydrophobicContact CE2-CB 3.57Å; Y114-C118 HydrophobicContact CG-CB 4.5Å; Y114-C118 WeakPolarHBondContact O-CA 3.47Å; Y114-C118 WeakPolarHBondContact O-CB 3.45Å; Y114-C118 PolarHBondContact O-N 3.41Å; Y114-T119 HydrophobicContact CE1-CG2 3.97Å
115H96.1Very high95.9Very high42 Ų4256 Ų5619%0.19425%0.253CS..Iπ-helixtrans-63.1-40.1177.7-75.580.1000112.1W111 D112 R113 Y117 T119 R120 T121W111-H115 AromaticContact CD1-CE1 3.66Å; W111-H115 AromaticContact CD1-ND1 3.96Å; W111-H115 AromaticContact CD2-CE1 4Å; W111-H115 AromaticContact CD2-ND1 3.82Å; W111-H115 AromaticContact CE2-CE1 3.29Å; W111-H115 AromaticContact CE2-ND1 3.55Å; W111-H115 AromaticContact CZ2-CE1 3.66Å; W111-H115 AromaticContact CZ2-ND1 3.94Å; W111-H115 AromaticContact NE1-CE1 3.11Å; W111-H115 PolarHBondContact NE1-CE1 3.41Å; W111-H115 AromaticContact NE1-ND1 3.69Å; W111-H115 PolarHBondContact O-N 3.44Å; W111-H115 VanDerWaalsContact O-N 3.1Å; W111-H115 PolarHBondContact O-ND1 2.99Å; D112-H115 WeakPolarHBondContact O-CB 3.33Å; D112-H115 PolarHBondContact O-N 3.37Å; D112-H115 VanDerWaalsContact O-N 3.09Å; R113-H115 VanDerWaalsContact C-N 3.31Å; R113-H115 PolarHBondContact O-N 2.85Å; H115-Y117 PolarHBondContact O-N 3.48Å; H115-T119 WeakPolarHBondContact CA-OG1 3.41Å; H115-T119 PolarHBondContact CD2-OG1 2.8Å; H115-T119 CarbonylContact O-C 3.57Å; H115-T119 PolarHBondContact O-N 2.75Å; H115-T119 PolarHBondContact O-OG1 3.22Å; H115-R120 WeakPolarHBondContact O-CA 3.47Å; H115-R120 PolarHBondContact O-N 3.28Å; H115-T121 CarbonylContact C-O 3.54Å; H115-T121 PolarHBondContact O-N 3.04Å
116Q92.9Very high95.8Very high90 Ų9060 Ų6042%0.42128%0.28SS..Iπ-helixtrans-61.3-45.8178.4-170.2177.734.900112.7D112 R113 Y114D112-Q116 PolarHBondContact O-N 3.31Å; R113-Q116 PolarHBondContact O-N 3.35Å; Y114-Q116 VanDerWaalsContact C-N 3.33Å; Y114-Q116 PolarHBondContact O-N 2.94Å
117Y93.3Very high95.8Very high57 Ų5762.2 Ų62.222%0.22430%0.295CS..Iπ-helixtrans-94.3-35.2-172.7-67.3-67.9000114.4R113 Y114 H115 I199 F203 R210 F211R113-Y117 HydrophobicContact CB-CD2 4.43Å; R113-Y117 HydrophobicContact CB-CE2 4.47Å; R113-Y117 WeakPolarHBondContact O-CD2 3.38Å; R113-Y117 PolarHBondContact O-N 3.36Å; Y114-Y117 PolarHBondContact O-N 3.05Å; H115-Y117 PolarHBondContact O-N 3.48Å; Y117-I199 HydrophobicContact CD2-CD1 4.47Å; Y117-F203 AromaticContact CD1-CE1 4Å; Y117-F203 HydrophobicContact CD1-CE1 4Å; Y117-F203 HydrophobicContact CD1-CZ 4.3Å; Y117-F203 HydrophobicContact CE1-CE1 4.47Å; Y117-F203 HydrophobicContact CE1-CZ 4.45Å; Y117-F203 HydrophobicContact CG-CE1 4.2Å; Y117-F203 HydrophobicContact CG-CZ 4.38Å; Y117-R210 HydrophobicContact CE1-CG 4.28Å; Y117-F211 HydrophobicContact CD2-CE1 4.39Å; Y117-F211 AromaticContact CE2-CE1 3.69Å; Y117-F211 HydrophobicContact CE2-CE1 3.69Å; Y117-F211 HydrophobicContact CE2-CZ 4.29Å
118C95Very high95.8Very high34 Ų3462.1 Ų62.123%0.2329%0.294CS..Iπ-helixtrans-93.5-43.9-173.5-61.90000112.2Y114Y114-C118 HydrophobicContact CD2-CB 3.74Å; Y114-C118 HydrophobicContact CE2-CB 3.57Å; Y114-C118 HydrophobicContact CG-CB 4.5Å; Y114-C118 WeakPolarHBondContact O-CA 3.47Å; Y114-C118 WeakPolarHBondContact O-CB 3.45Å; Y114-C118 PolarHBondContact O-N 3.41Å
119T94.6Very high95.8Very high59 Ų5965.5 Ų65.536%0.36231%0.31SS..Iπ-helixtrans-105.6-11.2-176.671.60000113.6Y114 H115 T121Y114-T119 HydrophobicContact CE1-CG2 3.97Å; H115-T119 WeakPolarHBondContact CA-OG1 3.41Å; H115-T119 PolarHBondContact CD2-OG1 2.8Å; H115-T119 CarbonylContact O-C 3.57Å; H115-T119 PolarHBondContact O-N 2.75Å; H115-T119 PolarHBondContact O-OG1 3.22Å; T119-T121 PolarHBondContact O-N 2.97Å; T119-T121 PolarHBondContact OG1-OG1 3.18Å
120R91.8Very high95.9Very high194 Ų19469.1 Ų69.173%0.73234%0.336SS*.  trans58.125.7-174.7-58.1179.2172.4164.5-3113.6H115H115-R120 WeakPolarHBondContact O-CA 3.47Å; H115-R120 PolarHBondContact O-N 3.28Å
121T94.3Very high96Very high78 Ų7871.3 Ų71.348%0.47935%0.347SS..PPolyproline II helixtrans-86.4136.2175.1-56.50000109.5H115 T119H115-T121 CarbonylContact C-O 3.54Å; H115-T121 PolarHBondContact O-N 3.04Å; T119-T121 PolarHBondContact O-N 2.97Å; T119-T121 PolarHBondContact OG1-OG1 3.18Å
122K92.8Very high96Very high176 Ų17667 Ų6777%0.76533%0.332SS*.PPolyproline II helixtrans-98.5131.3177.2-65.8-176.4-179.2179.20110.4Q124K122-Q124 PolarHBondContact O-NE2 3.46Å
123L95.7Very high96.1Very high18 Ų1870.9 Ų70.99%0.09436%0.355CS..PPolyproline II helixtrans-62.8136.3172.9-173.762.7000111.1P50 L54 W111 D112 T127 A128P50-L123 HydrophobicContact CB-CB 4.19Å; P50-L123 HydrophobicContact CB-CD2 4.14Å; P50-L123 HydrophobicContact CB-CG 3.94Å; P50-L123 WeakPolarHBondContact CB-O 3.42Å; P50-L123 WeakPolarHBondContact CG-O 3.42Å; L54-L123 HydrophobicContact CD1-CD2 3.69Å; L54-L123 HydrophobicContact CG-CD2 4.2Å; W111-L123 HydrophobicContact CH2-CD1 4.38Å; W111-L123 HydrophobicContact CZ3-CD1 3.87Å; D112-L123 HydrophobicContact CB-CD2 4.43Å; D112-L123 VanDerWaalsContact OD1-CB 3.25Å; D112-L123 WeakPolarHBondContact OD1-CB 3.24Å; L123-T127 HydrophobicContact CD1-CG2 3.74Å; L123-A128 HydrophobicContact CD2-CB 3.84Å; L123-A128 HydrophobicContact CG-CB 4.11Å
124Q97.1Very high96.3Very high111 Ų11175.9 Ų75.952%0.51938%0.378SS..PPolyproline II helixtrans-99154.7177.6-57.5-55-49.400110.8K122 S126 T127 A128K122-Q124 PolarHBondContact O-NE2 3.46Å; Q124-S126 PolarHBondContact O-N 3.38Å; Q124-T127 PolarHBondContact O-N 2.96Å; Q124-A128 PolarHBondContact O-N 2.92Å
125W97.8Very high96.4Very high108 Ų10872.7 Ų72.741%0.40937%0.365SS..Hα-helixtrans-59.1-43.5179.3-82.3108.7000113.3F41 R48 P50 F53 T127 A128 I129F41-W125 HydrophobicContact CZ-CH2 4.27Å; R48-W125 WeakPolarHBondContact O-CZ2 3.28Å; P50-W125 HydrophobicContact CG-CD2 3.86Å; P50-W125 HydrophobicContact CG-CG 3.82Å; F53-W125 HydrophobicContact CB-CH2 4.19Å; F53-W125 HydrophobicContact CB-CZ3 3.77Å; F53-W125 HydrophobicContact CD2-CZ3 4.18Å; F53-W125 AromaticContact CG-CZ3 3.9Å; F53-W125 HydrophobicContact CG-CZ3 3.9Å; W125-T127 VanDerWaalsContact C-N 3.31Å; W125-T127 PolarHBondContact O-N 3.41Å; W125-A128 PolarHBondContact O-N 3.34Å; W125-I129 HydrophobicContact CE3-CD1 4.23Å; W125-I129 HydrophobicContact CE3-CG1 4.39Å; W125-I129 WeakPolarHBondContact O-CB 3.25Å; W125-I129 VanDerWaalsContact O-CG1 3.29Å; W125-I129 WeakPolarHBondContact O-CG1 3.4Å; W125-I129 PolarHBondContact O-N 3.26Å
126S97.8Very high96.5Very high82 Ų8273.5 Ų73.557%0.57337%0.367SS*.Hα-helixtrans-58-44.9178.151.90000111.5Q124 S130Q124-S126 PolarHBondContact O-N 3.38Å; S126-S130 VanDerWaalsContact O-CB 3.26Å; S126-S130 WeakPolarHBondContact O-CB 3.36Å; S126-S130 PolarHBondContact O-N 3.18Å; S126-S130 PolarHBondContact O-OG 2.85Å
127T97.5Very high96.8Very high61 Ų6175.3 Ų75.337%0.37438%0.377SS..Hα-helixtrans-66.1-46.8176.5-48.60000111.7L123 Q124 W125 I129 S130 L131L123-T127 HydrophobicContact CD1-CG2 3.74Å; Q124-T127 PolarHBondContact O-N 2.96Å; W125-T127 VanDerWaalsContact C-N 3.31Å; W125-T127 PolarHBondContact O-N 3.41Å; T127-I129 PolarHBondContact O-N 2.81Å; T127-S130 PolarHBondContact O-N 3.44Å; T127-L131 WeakPolarHBondContact O-CB 3.48Å; T127-L131 PolarHBondContact O-N 3.49Å
128A98.2Very high97.1Very high0 Ų074.8 Ų74.80%038%0.376CS..Hα-helixtrans-62.5-42.9-179.100000112.5P50 F53 L54 L123 Q124 W125 A132P50-A128 HydrophobicContact CB-CB 3.91Å; F53-A128 HydrophobicContact CD1-CB 4.14Å; L54-A128 HydrophobicContact CD2-CB 4.49Å; L123-A128 HydrophobicContact CD2-CB 3.84Å; L123-A128 HydrophobicContact CG-CB 4.11Å; Q124-A128 PolarHBondContact O-N 2.92Å; W125-A128 PolarHBondContact O-N 3.34Å; A128-A132 WeakPolarHBondContact O-CB 3.46Å; A128-A132 PolarHBondContact O-N 3.46Å
129I98.4Very high97.2Very high79 Ų7973.1 Ų73.141%0.40537%0.365SS..Hα-helixtrans-67.8-47.3177.5-67167.6000110.5F53 W125 T127 L131 A132 V133F53-I129 HydrophobicContact CE1-CG1 4.09Å; F53-I129 HydrophobicContact CZ-CG1 4.41Å; W125-I129 HydrophobicContact CE3-CD1 4.23Å; W125-I129 HydrophobicContact CE3-CG1 4.39Å; W125-I129 WeakPolarHBondContact O-CB 3.25Å; W125-I129 VanDerWaalsContact O-CG1 3.29Å; W125-I129 WeakPolarHBondContact O-CG1 3.4Å; W125-I129 PolarHBondContact O-N 3.26Å; T127-I129 PolarHBondContact O-N 2.81Å; I129-L131 VanDerWaalsContact C-N 3.28Å; I129-L131 PolarHBondContact O-N 2.88Å; I129-A132 PolarHBondContact O-N 2.86Å; I129-V133 HydrophobicContact CG2-CG2 4.41Å; I129-V133 WeakPolarHBondContact O-CG2 3.41Å; I129-V133 PolarHBondContact O-N 3.18Å
130S98.4Very high97.4Very high79 Ų7971.5 Ų71.555%0.55236%0.357SS*.Hα-helixtrans-60.2-41.8178.9-57.10000111.4S126 T127 F134S126-S130 VanDerWaalsContact O-CB 3.26Å; S126-S130 WeakPolarHBondContact O-CB 3.36Å; S126-S130 PolarHBondContact O-N 3.18Å; S126-S130 PolarHBondContact O-OG 2.85Å; T127-S130 PolarHBondContact O-N 3.44Å; S130-F134 WeakPolarHBondContact O-CB 2.94Å; S130-F134 PolarHBondContact O-N 2.91Å
131L98.3Very high97.7Very high47 Ų4767 Ų6725%0.24634%0.343CS..Hα-helixtrans-64-45.3176.3-174.958.6000111.5L54 A108 T127 I129 F134 I135L54-L131 HydrophobicContact CD2-CD2 4.42Å; A108-L131 HydrophobicContact CB-CD2 3.75Å; A108-L131 HydrophobicContact CB-CG 4.43Å; T127-L131 WeakPolarHBondContact O-CB 3.48Å; T127-L131 PolarHBondContact O-N 3.49Å; I129-L131 VanDerWaalsContact C-N 3.28Å; I129-L131 PolarHBondContact O-N 2.88Å; L131-F134 PolarHBondContact O-N 2.94Å; L131-I135 HydrophobicContact CD1-CD1 4.08Å; L131-I135 HydrophobicContact CD1-CG1 4.32Å; L131-I135 HydrophobicContact CG-CD1 3.86Å; L131-I135 HydrophobicContact CG-CG1 4.5Å; L131-I135 WeakPolarHBondContact O-CB 3.48Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.35Å
132A98.7Very high97.9Very high4 Ų463.8 Ų63.83%0.03332%0.322CS..Hα-helixtrans-63.3-43.8178.100000112.5F53 F105 A128 I129 I135 W136F53-A132 HydrophobicContact CE1-CB 3.65Å; F53-A132 HydrophobicContact CZ-CB 4.23Å; F105-A132 HydrophobicContact CE1-CB 3.84Å; F105-A132 HydrophobicContact CZ-CB 3.96Å; A128-A132 WeakPolarHBondContact O-CB 3.46Å; A128-A132 PolarHBondContact O-N 3.46Å; I129-A132 PolarHBondContact O-N 2.86Å; A132-I135 PolarHBondContact O-N 2.96Å; A132-W136 PolarHBondContact O-N 3.44Å
133V98.7Very high98.2Very high88 Ų8855.4 Ų55.453%0.53329%0.286SS..Hα-helixtrans-60.3-47.5175.21710000110.3I129 I135 W136 M137I129-V133 HydrophobicContact CG2-CG2 4.41Å; I129-V133 WeakPolarHBondContact O-CG2 3.41Å; I129-V133 PolarHBondContact O-N 3.18Å; V133-I135 PolarHBondContact O-N 2.96Å; V133-W136 PolarHBondContact O-N 2.94Å; V133-M137 HydrophobicContact CG1-CG 4.35Å; V133-M137 WeakPolarHBondContact O-CB 3.37Å; V133-M137 VanDerWaalsContact O-CG 3.26Å; V133-M137 WeakPolarHBondContact O-CG 3.16Å; V133-M137 PolarHBondContact O-N 3.31Å
134F98.6Very high98.3Very high116 Ų11656 Ų5651%0.50929%0.293SS..Hα-helixtrans-58-47.9176.7173.2-97.8000111.9S130 L131 W136 M137 F138S130-F134 WeakPolarHBondContact O-CB 2.94Å; S130-F134 PolarHBondContact O-N 2.91Å; L131-F134 PolarHBondContact O-N 2.94Å; F134-W136 PolarHBondContact O-N 3.31Å; F134-M137 PolarHBondContact O-N 3.41Å; F134-F138 HydrophobicContact CE1-CB 4.38Å; F134-F138 HydrophobicContact CE1-CG 4.47Å; F134-F138 HydrophobicContact CZ-CB 4.33Å; F134-F138 HydrophobicContact CZ-CD2 4.15Å; F134-F138 HydrophobicContact CZ-CG 4.23Å; F134-F138 WeakPolarHBondContact O-CB 3.19Å; F134-F138 PolarHBondContact O-N 3.4Å
135I98.8Very high98.3Very high4 Ų451.7 Ų51.72%0.02127%0.273CS..Hα-helixtrans-58.7-48.2-179.9-72.9169.4000111.2A101 H104 F105 A108 L131 A132 V133 F138 A139A101-I135 HydrophobicContact CB-CG2 4.46Å; H104-I135 HydrophobicContact CB-CB 4.3Å; H104-I135 HydrophobicContact CB-CD1 4.18Å; H104-I135 HydrophobicContact CB-CG1 3.95Å; H104-I135 HydrophobicContact CB-CG2 3.49Å; H104-I135 VanDerWaalsContact CB-CG2 3.49Å; F105-I135 HydrophobicContact CD1-CD1 3.79Å; F105-I135 HydrophobicContact CD2-CG2 3.95Å; F105-I135 HydrophobicContact CE1-CB 4.33Å; F105-I135 HydrophobicContact CE1-CD1 3.76Å; F105-I135 HydrophobicContact CE1-CG2 4.25Å; F105-I135 HydrophobicContact CE2-CB 4.41Å; F105-I135 HydrophobicContact CE2-CG2 3.62Å; F105-I135 HydrophobicContact CG-CD1 4.39Å; F105-I135 HydrophobicContact CG-CG2 4.36Å; F105-I135 HydrophobicContact CZ-CB 4.04Å; F105-I135 HydrophobicContact CZ-CD1 4.33Å; F105-I135 HydrophobicContact CZ-CG2 3.77Å; A108-I135 HydrophobicContact CB-CD1 3.97Å; L131-I135 HydrophobicContact CD1-CD1 4.08Å; L131-I135 HydrophobicContact CD1-CG1 4.32Å; L131-I135 HydrophobicContact CG-CD1 3.86Å; L131-I135 HydrophobicContact CG-CG1 4.5Å; L131-I135 WeakPolarHBondContact O-CB 3.48Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.35Å; A132-I135 PolarHBondContact O-N 2.96Å; V133-I135 PolarHBondContact O-N 2.96Å; I135-F138 PolarHBondContact O-N 3.26Å; I135-A139 VanDerWaalsContact O-CB 3.29Å; I135-A139 WeakPolarHBondContact O-CB 3.23Å; I135-A139 PolarHBondContact O-N 3.17Å
136W98.8Very high98.3Very high58 Ų5846.9 Ų46.922%0.2226%0.256CS..Hα-helixtrans-63.3-43.8179.2-81.2115.4000112.4M60 A61 M97 A101 F105 A132 V133 F134 A140M60-W136 HydrophobicContact CB-CZ2 4.28Å; A61-W136 HydrophobicContact CB-CH2 3.89Å; A61-W136 HydrophobicContact CB-CZ2 4.22Å; M97-W136 HydrophobicContact CE-CE3 3.5Å; M97-W136 HydrophobicContact CE-CZ3 3.82Å; A101-W136 HydrophobicContact CB-CD2 4.34Å; A101-W136 HydrophobicContact CB-CE3 3.83Å; A101-W136 HydrophobicContact CB-CH2 4.07Å; A101-W136 HydrophobicContact CB-CZ3 3.69Å; F105-W136 HydrophobicContact CE2-CD2 4.48Å; F105-W136 AromaticContact CE2-CE2 3.88Å; F105-W136 HydrophobicContact CE2-CZ2 4.27Å; F105-W136 AromaticContact CE2-NE1 3.6Å; F105-W136 AromaticContact CZ-CD1 3.89Å; F105-W136 AromaticContact CZ-NE1 3.65Å; A132-W136 PolarHBondContact O-N 3.44Å; V133-W136 PolarHBondContact O-N 2.94Å; F134-W136 PolarHBondContact O-N 3.31Å; W136-A140 VanDerWaalsContact O-CB 3.29Å; W136-A140 WeakPolarHBondContact O-CB 3.47Å; W136-A140 PolarHBondContact O-N 3.15Å
137M98.8Very high98.2Very high129 Ų12946.8 Ų46.864%0.63525%0.248SC*.Hα-helixtrans-65.7-40177.6-68.2-57.8-61.800112V133 F134 A140 F141V133-M137 HydrophobicContact CG1-CG 4.35Å; V133-M137 WeakPolarHBondContact O-CB 3.37Å; V133-M137 VanDerWaalsContact O-CG 3.26Å; V133-M137 WeakPolarHBondContact O-CG 3.16Å; V133-M137 PolarHBondContact O-N 3.31Å; F134-M137 PolarHBondContact O-N 3.41Å; M137-A140 PolarHBondContact O-N 2.64Å; M137-F141 WeakPolarHBondContact O-CB 3.49Å; M137-F141 PolarHBondContact O-N 3.3Å
138F98.6Very high98.2Very high45 Ų4550 Ų5020%0.19726%0.262CS..Hα-helixtrans-68.5-42178.8-168.5-110000111.8H104 F134 I135 F141 W142 F183 N184H104-F138 AromaticContact CE1-CD1 3.52Å; H104-F138 AromaticContact CE1-CE1 3.59Å; H104-F138 AromaticContact NE2-CD1 3.48Å; H104-F138 WeakPolarHBondContact NE2-CD1 3.47Å; H104-F138 AromaticContact NE2-CE1 3.65Å; F134-F138 HydrophobicContact CE1-CB 4.38Å; F134-F138 HydrophobicContact CE1-CG 4.47Å; F134-F138 HydrophobicContact CZ-CB 4.33Å; F134-F138 HydrophobicContact CZ-CD2 4.15Å; F134-F138 HydrophobicContact CZ-CG 4.23Å; F134-F138 WeakPolarHBondContact O-CB 3.19Å; F134-F138 PolarHBondContact O-N 3.4Å; I135-F138 PolarHBondContact O-N 3.26Å; F138-F141 WeakPolarHBondContact O-CB 3.19Å; F138-F141 PolarHBondContact O-N 2.98Å; F138-W142 AromaticContact CD1-CD1 3.89Å; F138-W142 AromaticContact CE1-CD1 3.64Å; F138-W142 AromaticContact CE1-NE1 3.36Å; F138-W142 AromaticContact CE2-NE1 3.41Å; F138-W142 AromaticContact CZ-CD1 3.75Å; F138-W142 AromaticContact CZ-NE1 3.03Å; F138-W142 VanDerWaalsContact O-CD1 3.27Å; F138-W142 PolarHBondContact O-N 3.14Å; F138-W142 VanDerWaalsContact O-N 3.15Å; F138-F183 HydrophobicContact CE1-CB 4.3Å; F138-F183 HydrophobicContact CZ-CB 3.96Å; F138-F183 HydrophobicContact CZ-CG 4.42Å; F138-N184 WeakPolarHBondContact CE1-OD1 2.96Å
139A98.7Very high98Very high0 Ų052.2 Ų52.20%029%0.285CS..Hα-helixtrans-62.8-44.2173.400000111.8M97 L100 A101 I135 F141 W142 A143M97-A139 HydrophobicContact CG-CB 4.4Å; L100-A139 HydrophobicContact CB-CB 3.85Å; A101-A139 HydrophobicContact CB-CB 4.03Å; I135-A139 VanDerWaalsContact O-CB 3.29Å; I135-A139 WeakPolarHBondContact O-CB 3.23Å; I135-A139 PolarHBondContact O-N 3.17Å; A139-F141 PolarHBondContact O-N 3.14Å; A139-W142 PolarHBondContact O-N 2.74Å; A139-A143 WeakPolarHBondContact O-CB 3.48Å; A139-A143 PolarHBondContact O-N 2.8Å
140A98.6Very high97.8Very high25 Ų2552.4 Ų52.421%0.20728%0.281CS..Hα-helixtrans-62.5-41.217600000112M97 W136 M137 A143 A144M97-A140 HydrophobicContact CE-CB 4.06Å; M97-A140 HydrophobicContact CG-CB 4.48Å; M97-A140 HydrophobicContact SD-CB 4.12Å; W136-A140 VanDerWaalsContact O-CB 3.29Å; W136-A140 WeakPolarHBondContact O-CB 3.47Å; W136-A140 PolarHBondContact O-N 3.15Å; M137-A140 PolarHBondContact O-N 2.64Å; A140-A143 PolarHBondContact O-N 3.06Å; A140-A144 VanDerWaalsContact O-CB 3.25Å; A140-A144 WeakPolarHBondContact O-CB 3.29Å; A140-A144 PolarHBondContact O-N 3.45Å
141F98.1Very high97.6Very high98 Ų9848.8 Ų48.843%0.4326%0.256SS..Hα-helixtrans-56-55.8175.3167.5-96000111.2M137 F138 A139 A143 A144 M145M137-F141 WeakPolarHBondContact O-CB 3.49Å; M137-F141 PolarHBondContact O-N 3.3Å; F138-F141 WeakPolarHBondContact O-CB 3.19Å; F138-F141 PolarHBondContact O-N 2.98Å; A139-F141 PolarHBondContact O-N 3.14Å; F141-A143 VanDerWaalsContact C-N 3.31Å; F141-A143 PolarHBondContact O-N 2.96Å; F141-A144 PolarHBondContact O-N 2.93Å; F141-M145 HydrophobicContact CD2-CE 3.67Å; F141-M145 HydrophobicContact CE2-CE 3.53Å; F141-M145 HydrophobicContact CE2-SD 3.92Å; F141-M145 HydrophobicContact CG-CE 4.36Å; F141-M145 HydrophobicContact CZ-CE 4.11Å; F141-M145 HydrophobicContact CZ-CG 4.42Å; F141-M145 HydrophobicContact CZ-SD 3.93Å; F141-M145 VanDerWaalsContact O-CE 3.26Å; F141-M145 WeakPolarHBondContact O-CE 3.29Å; F141-M145 WeakPolarHBondContact O-CG 3.15Å; F141-M145 PolarHBondContact O-N 2.87Å
142W98.1Very high97.4Very high12 Ų1250.5 Ų50.55%0.04526%0.262CS..Hα-helixtrans-64.2-35.8-178.4-78106.9000112.9L100 F138 A139 P146 W150 Y176 P179 M180 F183 N184L100-W142 HydrophobicContact CD1-CB 3.48Å; L100-W142 VanDerWaalsContact CD1-CB 3.48Å; L100-W142 HydrophobicContact CD1-CG 4.37Å; F138-W142 AromaticContact CD1-CD1 3.89Å; F138-W142 AromaticContact CE1-CD1 3.64Å; F138-W142 AromaticContact CE1-NE1 3.36Å; F138-W142 AromaticContact CE2-NE1 3.41Å; F138-W142 AromaticContact CZ-CD1 3.75Å; F138-W142 AromaticContact CZ-NE1 3.03Å; F138-W142 VanDerWaalsContact O-CD1 3.27Å; F138-W142 PolarHBondContact O-N 3.14Å; F138-W142 VanDerWaalsContact O-N 3.15Å; A139-W142 PolarHBondContact O-N 2.74Å; W142-P146 WeakPolarHBondContact O-CD 3.33Å; W142-W150 HydrophobicContact CH2-CH2 4.33Å; W142-W150 HydrophobicContact CZ3-CH2 4.16Å; W142-W150 HydrophobicContact CZ3-CZ3 4.16Å; W142-Y176 HydrophobicContact CE3-CD2 4.44Å; W142-Y176 AromaticContact CE3-CE2 3.79Å; W142-Y176 HydrophobicContact CE3-CE2 3.79Å; W142-Y176 HydrophobicContact CZ3-CD2 4.34Å; W142-Y176 HydrophobicContact CZ3-CE2 4.15Å; W142-Y176 PolarHBondContact O-OH 3.26Å; W142-P179 HydrophobicContact CH2-CB 3.88Å; W142-P179 HydrophobicContact CH2-CG 4.11Å; W142-P179 HydrophobicContact CZ3-CG 4.37Å; W142-M180 HydrophobicContact CD2-CB 4.4Å; W142-M180 HydrophobicContact CD2-CG 4.3Å; W142-M180 HydrophobicContact CE3-CB 3.66Å; W142-M180 HydrophobicContact CE3-CG 3.85Å; W142-M180 HydrophobicContact CH2-CB 4.43Å; W142-M180 HydrophobicContact CZ3-CB 3.69Å; W142-M180 HydrophobicContact CZ3-CG 4.4Å; W142-F183 HydrophobicContact CZ2-CB 4.35Å; W142-F183 AromaticContact CZ2-CD2 3.93Å; W142-F183 HydrophobicContact CZ2-CD2 3.93Å; W142-F183 HydrophobicContact CZ2-CG 4.47Å; W142-N184 VanDerWaalsContact CG-ND2 3.33Å; W142-N184 PolarHBondContact NE1-ND2 3.49Å
143A98.3Very high97.3Very high0 Ų050.3 Ų50.30%026%0.261CS..Hα-helixtrans-74-25.4176.600000114F93 F96 M97 A139 A140 F141 P146 Y153F93-A143 HydrophobicContact CD2-CB 3.84Å; F93-A143 WeakPolarHBondContact CD2-O 3.4Å; F93-A143 HydrophobicContact CE2-CB 3.91Å; F96-A143 HydrophobicContact CB-CB 4.34Å; F96-A143 HydrophobicContact CD1-CB 3.96Å; M97-A143 HydrophobicContact CB-CB 3.72Å; A139-A143 WeakPolarHBondContact O-CB 3.48Å; A139-A143 PolarHBondContact O-N 2.8Å; A140-A143 PolarHBondContact O-N 3.06Å; F141-A143 VanDerWaalsContact C-N 3.31Å; F141-A143 PolarHBondContact O-N 2.96Å; A143-P146 WeakPolarHBondContact O-CD 3.41Å; A143-Y153 PolarHBondContact O-OH 2.9Å
144A98.3Very high97.1Very high29 Ų2948.8 Ų48.824%0.2425%0.25CC..Hα-helixtrans-76.1-25.4176.100000112.8F93 A140 F141 L147 I148F93-A144 HydrophobicContact CE2-CB 4.24Å; A140-A144 VanDerWaalsContact O-CB 3.25Å; A140-A144 WeakPolarHBondContact O-CB 3.29Å; A140-A144 PolarHBondContact O-N 3.45Å; F141-A144 PolarHBondContact O-N 2.93Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 2.91Å; A144-I148 PolarHBondContact O-N 3.4Å
145M97.6Very high96.8Very high22 Ų2246.3 Ų46.311%0.10824%0.238CC..G310 helixtrans-55.9-44.7-175.6-65.2-56.5100.700114F141 L147 I148 G149 W150 Y176F141-M145 HydrophobicContact CD2-CE 3.67Å; F141-M145 HydrophobicContact CE2-CE 3.53Å; F141-M145 HydrophobicContact CE2-SD 3.92Å; F141-M145 HydrophobicContact CG-CE 4.36Å; F141-M145 HydrophobicContact CZ-CE 4.11Å; F141-M145 HydrophobicContact CZ-CG 4.42Å; F141-M145 HydrophobicContact CZ-SD 3.93Å; F141-M145 VanDerWaalsContact O-CE 3.26Å; F141-M145 WeakPolarHBondContact O-CE 3.29Å; F141-M145 WeakPolarHBondContact O-CG 3.15Å; F141-M145 PolarHBondContact O-N 2.87Å; M145-L147 VanDerWaalsContact C-N 3.27Å; M145-L147 PolarHBondContact O-N 3.32Å; M145-I148 HydrophobicContact CE-CD1 3.75Å; M145-I148 WeakPolarHBondContact O-CG1 3.32Å; M145-I148 PolarHBondContact O-N 3.45Å; M145-I148 VanDerWaalsContact O-N 3.14Å; M145-I148 HydrophobicContact SD-CD1 4Å; M145-G149 PolarHBondContact O-N 3.09Å; M145-W150 CarbonylContact C-O 3.45Å; M145-W150 HydrophobicContact CB-CB 4.26Å; M145-W150 HydrophobicContact CB-CE3 4.11Å; M145-W150 HydrophobicContact CG-CE3 3.79Å; M145-W150 HydrophobicContact CG-CZ3 4.29Å; M145-W150 PolarHBondContact O-N 3.49Å; M145-W150 HydrophobicContact SD-CE3 3.83Å; M145-W150 HydrophobicContact SD-CZ3 4.35Å; M145-Y176 HydrophobicContact CB-CD2 4.14Å; M145-Y176 HydrophobicContact CB-CE2 3.63Å; M145-Y176 HydrophobicContact CG-CE2 4.23Å
146P96.8Very high96.3Very high6 Ų646.5 Ų46.54%0.03924%0.238CC..G310 helixtrans-62.9-29.9175.5-23.834.5000114.1W142 A143 I148 G149 W150 Y153 L164 Y176W142-P146 WeakPolarHBondContact O-CD 3.33Å; A143-P146 WeakPolarHBondContact O-CD 3.41Å; P146-I148 PolarHBondContact O-N 2.93Å; P146-G149 PolarHBondContact O-N 2.97Å; P146-W150 WeakPolarHBondContact CA-O 3.47Å; P146-Y153 HydrophobicContact CB-CD1 4.43Å; P146-Y153 HydrophobicContact CB-CD2 3.82Å; P146-Y153 HydrophobicContact CB-CE1 4.33Å; P146-Y153 HydrophobicContact CB-CE2 3.69Å; P146-Y153 HydrophobicContact CB-CG 4.18Å; P146-Y153 HydrophobicContact CG-CE1 4.2Å; P146-Y153 HydrophobicContact CG-CE2 4Å; P146-L164 HydrophobicContact CB-CD2 4.06Å; P146-L164 HydrophobicContact CG-CD2 3.4Å; P146-L164 VanDerWaalsContact CG-CD2 3.4Å; P146-Y176 HydrophobicContact CG-CE1 4.23Å; P146-Y176 HydrophobicContact CG-CE2 4.45Å
147L96.8Very high95.8Very high80 Ų8045.1 Ų45.142%0.41924%0.237SC..G310 helixtrans-68.8-25.5177.1-61.4177.5000112.6Q89 F93 A144 M145 Y153Q89-L147 HydrophobicContact CB-CD2 3.84Å; F93-L147 HydrophobicContact CB-CD1 3.97Å; F93-L147 HydrophobicContact CB-CD2 4.41Å; F93-L147 HydrophobicContact CB-CG 4.42Å; F93-L147 HydrophobicContact CD2-CD1 3.63Å; F93-L147 HydrophobicContact CD2-CG 4.44Å; F93-L147 HydrophobicContact CE2-CD1 4.37Å; F93-L147 HydrophobicContact CG-CD1 3.88Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 2.91Å; M145-L147 VanDerWaalsContact C-N 3.27Å; M145-L147 PolarHBondContact O-N 3.32Å; L147-Y153 HydrophobicContact CD2-CD2 3.83Å; L147-Y153 HydrophobicContact CD2-CE2 4.08Å; L147-Y153 HydrophobicContact CG-CD2 4.37Å; L147-Y153 HydrophobicContact CG-CE2 4.17Å
148I96.3Very high95.3Very high128 Ų12839 Ų3966%0.65621%0.207SC*.G310 helixtrans-104.310.1-179.864.7172.2000112.6A144 M145 P146A144-I148 PolarHBondContact O-N 3.4Å; M145-I148 HydrophobicContact CE-CD1 3.75Å; M145-I148 WeakPolarHBondContact O-CG1 3.32Å; M145-I148 PolarHBondContact O-N 3.45Å; M145-I148 VanDerWaalsContact O-N 3.14Å; M145-I148 HydrophobicContact SD-CD1 4Å; P146-I148 PolarHBondContact O-N 2.93Å
149G93.9Very high95Very high47 Ų4744.1 Ų44.149%0.48523%0.225SC..THydrogen-bonded Turntrans991.317000000116.4M145 P146 G151 N172M145-G149 PolarHBondContact O-N 3.09Å; P146-G149 PolarHBondContact O-N 2.97Å; G149-G151 CarbonylContact C-O 3.52Å; G149-N172 PolarHBondContact O-ND2 3.18Å; G149-N172 PolarHBondContact O-OD1 3.24Å
150W95.9Very high94.6Very high84 Ų8444.1 Ų44.132%0.31823%0.225SC..SBendtrans-96.395.7171-170.730.1000110.2W142 M145 P146 S175 Y176 P179W142-W150 HydrophobicContact CH2-CH2 4.33Å; W142-W150 HydrophobicContact CZ3-CH2 4.16Å; W142-W150 HydrophobicContact CZ3-CZ3 4.16Å; M145-W150 CarbonylContact C-O 3.45Å; M145-W150 HydrophobicContact CB-CB 4.26Å; M145-W150 HydrophobicContact CB-CE3 4.11Å; M145-W150 HydrophobicContact CG-CE3 3.79Å; M145-W150 HydrophobicContact CG-CZ3 4.29Å; M145-W150 PolarHBondContact O-N 3.49Å; M145-W150 HydrophobicContact SD-CE3 3.83Å; M145-W150 HydrophobicContact SD-CZ3 4.35Å; P146-W150 WeakPolarHBondContact CA-O 3.47Å; W150-S175 WeakPolarHBondContact CZ2-O 3.39Å; W150-S175 PolarHBondContact NE1-OG 3.39Å; W150-Y176 AromaticContact CD2-CD2 3.94Å; W150-Y176 HydrophobicContact CD2-CD2 3.94Å; W150-Y176 HydrophobicContact CE3-CD2 4.23Å; W150-Y176 HydrophobicContact CG-CD2 4.18Å; W150-Y176 WeakPolarHBondContact O-CD2 3.42Å; W150-P179 HydrophobicContact CH2-CG 4.08Å; W150-P179 HydrophobicContact CZ2-CG 3.99Å
151G93.4Very high94.3Very high3 Ų343.1 Ų43.13%0.03122%0.216CC..SBendtrans84.2179-154.400000111.9G149 N172G149-G151 CarbonylContact C-O 3.52Å; G151-N172 PolarHBondContact N-ND2 3.32Å; G151-N172 PolarHBondContact N-OD1 3.36Å
152E93.8Very high94.1Very high82 Ų8238.8 Ų38.838%0.38320%0.198SC..  trans-149.5142.3179.1-175.4173.4-17200109.2L164 D165 K168E152-L164 CarbonylContact O-C 3.38Å; E152-L164 WeakPolarHBondContact O-CA 3.39Å; E152-D165 HydrophobicContact CB-CB 4.37Å; E152-D165 PolarHBondContact O-N 3.39Å; E152-K168 IonicContact OE1-NZ 3.72Å; E152-K168 IonicContact OE2-NZ 2.89Å; E152-K168 PolarHBondContact OE2-NZ 2.91Å
153Y96.3Very high93.9Very high1 Ų139.4 Ų39.40%0.00420%0.203CC..EExtended strand (participates in β ladder)trans-94.8132.1166-68.7-56.8000109.7Q89 F93 F96 A143 P146 L147 T163 L164Q89-Y153 PolarHBondContact NE2-O 3Å; F93-Y153 HydrophobicContact CB-CE2 4.02Å; F96-Y153 HydrophobicContact CB-CE1 4.14Å; F96-Y153 VanDerWaalsContact CB-OH 3.29Å; F96-Y153 WeakPolarHBondContact CB-OH 3.4Å; F96-Y153 WeakPolarHBondContact CD1-OH 3.49Å; F96-Y153 HydrophobicContact CG-CE1 4.41Å; A143-Y153 PolarHBondContact O-OH 2.9Å; P146-Y153 HydrophobicContact CB-CD1 4.43Å; P146-Y153 HydrophobicContact CB-CD2 3.82Å; P146-Y153 HydrophobicContact CB-CE1 4.33Å; P146-Y153 HydrophobicContact CB-CE2 3.69Å; P146-Y153 HydrophobicContact CB-CG 4.18Å; P146-Y153 HydrophobicContact CG-CE1 4.2Å; P146-Y153 HydrophobicContact CG-CE2 4Å; L147-Y153 HydrophobicContact CD2-CD2 3.83Å; L147-Y153 HydrophobicContact CD2-CE2 4.08Å; L147-Y153 HydrophobicContact CG-CD2 4.37Å; L147-Y153 HydrophobicContact CG-CE2 4.17Å; Y153-T163 CarbonylContact C-O 3.3Å; Y153-T163 VanDerWaalsContact CA-O 3.31Å; Y153-T163 WeakPolarHBondContact CA-O 3.35Å; Y153-L164 HydrophobicContact CD1-CD2 4.04Å; Y153-L164 HydrophobicContact CD1-CG 4.36Å; Y153-L164 HydrophobicContact CE1-CD2 3.68Å; Y153-L164 HydrophobicContact CE1-CG 3.97Å
154D94.6Very high93.6Very high56 Ų5639.8 Ų39.830%0.29921%0.205SC..EExtended strand (participates in β ladder)trans-145.8178.6172.9-157.6-3.6000109.9C162 T163 D165D154-C162 CarbonylContact O-C 3.58Å; D154-C162 VanDerWaalsContact O-CA 3.31Å; D154-C162 WeakPolarHBondContact O-CA 3.49Å; D154-T163 PolarHBondContact N-O 3.45Å; D154-T163 PolarHBondContact O-N 3.02Å; D154-D165 HydrophobicContact CB-CB 3.85Å
155Y92.3Very high93.2Very high64 Ų6439.1 Ų39.125%0.25120%0.197SC..EExtended strand (participates in β ladder)trans-61.5137.2177.2-61.9-65.6000112.3W81 C88 R159W81-Y155 HydrophobicContact CB-CD1 4.24Å; W81-Y155 HydrophobicContact CB-CE1 3.62Å; W81-Y155 AromaticContact CD1-CE1 3.56Å; W81-Y155 HydrophobicContact CD2-CE1 4.36Å; W81-Y155 HydrophobicContact CG-CD1 4.39Å; W81-Y155 AromaticContact CG-CE1 3.57Å; W81-Y155 HydrophobicContact CG-CE1 3.57Å; C88-Y155 HydrophobicContact CB-CE1 4.11Å; Y155-R159 HydrophobicContact CG-CB 4.45Å
156E89.5Confident92.6Very high8 Ų838.8 Ų38.84%0.03720%0.195CC..  trans-63.8167.8162.978.4-173.9159.900111L158 R159 T160 C161 T163 M248E156-L158 HydrophobicContact CG-CB 4.3Å; E156-L158 PolarHBondContact O-N 3.3Å; E156-L158 VanDerWaalsContact O-N 3.1Å; E156-R159 WeakPolarHBondContact O-CA 3.26Å; E156-R159 PolarHBondContact O-N 3Å; E156-T160 PolarHBondContact OE1-OG1 3.23Å; E156-C161 PolarHBondContact N-O 3.23Å; E156-C161 WeakPolarHBondContact OE1-CB 3.28Å; E156-C161 PolarHBondContact OE1-N 3.19Å; E156-C161 VanDerWaalsContact OE1-N 3.15Å; E156-C161 PolarHBondContact OE1-SG 2.7Å; E156-C161 PolarHBondContact OE2-SG 3.05Å; E156-T163 HydrophobicContact CB-CG2 4.24Å; E156-M248 HydrophobicContact CB-SD 4.36Å; E156-M248 VanDerWaalsContact CD-CE 3.44Å; E156-M248 HydrophobicContact CG-CE 4.27Å; E156-M248 HydrophobicContact CG-SD 3.9Å; E156-M248 VanDerWaalsContact OE2-CE 3.31Å; E156-M248 WeakPolarHBondContact OE2-CE 3.13Å
157P87.9Confident91.8Very high28 Ų2840.6 Ų40.618%0.18221%0.208CC..THydrogen-bonded Turntrans-55.1-33.6-177.5-27.836.3000115.1F11 R159 P244 R247F11-P157 HydrophobicContact CE2-CB 4.34Å; F11-P157 HydrophobicContact CZ-CB 4.42Å; P157-R159 VanDerWaalsContact C-N 3.26Å; P157-R159 PolarHBondContact O-N 3.23Å; P157-P244 HydrophobicContact CB-CB 4.09Å; P157-R247 HydrophobicContact CG-CB 3.96Å
158L88.5Confident90.9Very high2 Ų242.3 Ų42.31%0.0121%0.212CC..THydrogen-bonded Turntrans-76.8-11.3176.5-172.162.1000113P8 F11 V16 L19 E156 T160 M248P8-L158 HydrophobicContact CG-CD1 4.39Å; P8-L158 VanDerWaalsContact CG-O 3.32Å; P8-L158 WeakPolarHBondContact CG-O 3.24Å; F11-L158 HydrophobicContact CB-CD1 4.3Å; F11-L158 HydrophobicContact CD1-CD1 3.82Å; F11-L158 HydrophobicContact CD2-CD1 4.02Å; F11-L158 HydrophobicContact CE1-CD1 4.08Å; F11-L158 HydrophobicContact CE2-CB 4.43Å; F11-L158 HydrophobicContact CE2-CD1 4.25Å; F11-L158 HydrophobicContact CG-CD1 3.78Å; F11-L158 HydrophobicContact CZ-CB 4.22Å; F11-L158 HydrophobicContact CZ-CD1 4.29Å; V16-L158 HydrophobicContact CB-CD1 4.43Å; V16-L158 HydrophobicContact CG1-CD1 4.35Å; V16-L158 HydrophobicContact CG2-CD1 3.68Å; L19-L158 HydrophobicContact CB-CD2 4.1Å; L19-L158 HydrophobicContact CD1-CD2 3.74Å; E156-L158 HydrophobicContact CG-CB 4.3Å; E156-L158 PolarHBondContact O-N 3.3Å; E156-L158 VanDerWaalsContact O-N 3.1Å; L158-T160 HydrophobicContact CD2-CG2 4.15Å; L158-T160 VanDerWaalsContact CD2-OG1 3.32Å; L158-T160 WeakPolarHBondContact CD2-OG1 3.43Å; L158-T160 HydrophobicContact CG-CG2 3.81Å; L158-T160 WeakPolarHBondContact CG-OG1 3.22Å; L158-T160 WeakPolarHBondContact O-CG2 3.16Å; L158-T160 PolarHBondContact O-N 3.01Å; L158-M248 HydrophobicContact CB-CE 3.84Å; L158-M248 HydrophobicContact CB-CG 4.48Å; L158-M248 HydrophobicContact CB-SD 3.76Å; L158-M248 HydrophobicContact CD2-CE 4.02Å
159R90.6Very high90.2Very high151 Ų15137.5 Ų37.557%0.5719%0.194SC*.SBendtrans5630.4-180-47.1-172.284-176.68.1114.5W81 Y155 E156 P157W81-R159 PolarHBondContact N-O 3.1Å; Y155-R159 HydrophobicContact CG-CB 4.45Å; E156-R159 WeakPolarHBondContact O-CA 3.26Å; E156-R159 PolarHBondContact O-N 3Å; P157-R159 VanDerWaalsContact C-N 3.26Å; P157-R159 PolarHBondContact O-N 3.23Å
160T91Very high89.9Confident1 Ų138.5 Ų38.51%0.00619%0.189CC..SBendtrans-112.3-11.7-179.346.90000112.9S75 S76 W81 E156 L158S75-T160 WeakPolarHBondContact CB-O 3.37Å; S75-T160 PolarHBondContact OG-O 2.9Å; S76-T160 VanDerWaalsContact CA-CG2 3.45Å; W81-T160 WeakPolarHBondContact CZ3-O 3.42Å; E156-T160 PolarHBondContact OE1-OG1 3.23Å; L158-T160 HydrophobicContact CD2-CG2 4.15Å; L158-T160 VanDerWaalsContact CD2-OG1 3.32Å; L158-T160 WeakPolarHBondContact CD2-OG1 3.43Å; L158-T160 HydrophobicContact CG-CG2 3.81Å; L158-T160 WeakPolarHBondContact CG-OG1 3.22Å; L158-T160 WeakPolarHBondContact O-CG2 3.16Å; L158-T160 PolarHBondContact O-N 3.01Å
161C92.7Very high89.7Confident4 Ų445.6 Ų45.63%0.02722%0.215CC..SBendtrans-148.8169.5172105.30000109.9A72 E156A72-C161 HydrophobicContact CB-CB 3.44Å; A72-C161 VanDerWaalsContact CB-CB 3.44Å; E156-C161 PolarHBondContact N-O 3.23Å; E156-C161 WeakPolarHBondContact OE1-CB 3.28Å; E156-C161 PolarHBondContact OE1-N 3.19Å; E156-C161 VanDerWaalsContact OE1-N 3.15Å; E156-C161 PolarHBondContact OE1-SG 2.7Å; E156-C161 PolarHBondContact OE2-SG 3.05Å
162C94.7Very high89.7Confident6 Ų647.9 Ų47.94%0.04123%0.227CC..EExtended strand (participates in β ladder)trans-119.1138.7-176.7-610000111.5C88 H91 D154C88-C162 WeakPolarHBondContact CA-SG 3.29Å; C88-C162 HydrophobicContact CB-CB 4.04Å; C88-C162 WeakPolarHBondContact CB-SG 3.23Å; C88-C162 VanDerWaalsContact O-CB 3.23Å; C88-C162 WeakPolarHBondContact O-CB 3.38Å; C88-C162 WeakPolarHBondContact SG-CB 3.23Å; C88-C162 CovalentContact SG-SG 2.02Å; C88-C162 PolarHBondContact SG-SG 2.87Å; H91-C162 HydrophobicContact CB-CB 4.49Å; H91-C162 PolarHBondContact ND1-N 3.47Å; H91-C162 PolarHBondContact ND1-O 3.49Å; D154-C162 CarbonylContact O-C 3.58Å; D154-C162 VanDerWaalsContact O-CA 3.31Å; D154-C162 WeakPolarHBondContact O-CA 3.49Å
163T92.9Very high89.6Confident26 Ų2644.3 Ų44.316%0.1621%0.21CC..EExtended strand (participates in β ladder)trans-146.2179.2-177.2-168.60000110Y153 D154 E156 D165 Y166 Y227Y153-T163 CarbonylContact C-O 3.3Å; Y153-T163 VanDerWaalsContact CA-O 3.31Å; Y153-T163 WeakPolarHBondContact CA-O 3.35Å; D154-T163 PolarHBondContact N-O 3.45Å; D154-T163 PolarHBondContact O-N 3.02Å; E156-T163 HydrophobicContact CB-CG2 4.24Å; T163-D165 PolarHBondContact O-N 2.86Å; T163-Y166 HydrophobicContact CG2-CE1 4.23Å; T163-Y227 PolarHBondContact OG1-OH 3.5Å
164L91.8Very high89.4Confident7 Ų746 Ų464%0.03722%0.22CC..EExtended strand (participates in β ladder)trans-59.8127.8171.9-72.9170.4000110F96 P146 E152 Y153 Y166 Y176 M180F96-L164 HydrophobicContact CD2-CD1 4.16Å; F96-L164 HydrophobicContact CE1-CD1 4.07Å; F96-L164 HydrophobicContact CE2-CD1 3.52Å; F96-L164 HydrophobicContact CE2-CG 4.33Å; F96-L164 HydrophobicContact CZ-CD1 3.48Å; F96-L164 VanDerWaalsContact CZ-CD1 3.48Å; F96-L164 HydrophobicContact CZ-CG 4.46Å; P146-L164 HydrophobicContact CB-CD2 4.06Å; P146-L164 HydrophobicContact CG-CD2 3.4Å; P146-L164 VanDerWaalsContact CG-CD2 3.4Å; E152-L164 CarbonylContact O-C 3.38Å; E152-L164 WeakPolarHBondContact O-CA 3.39Å; Y153-L164 HydrophobicContact CD1-CD2 4.04Å; Y153-L164 HydrophobicContact CD1-CG 4.36Å; Y153-L164 HydrophobicContact CE1-CD2 3.68Å; Y153-L164 HydrophobicContact CE1-CG 3.97Å; L164-Y166 WeakPolarHBondContact O-CD1 3.48Å; L164-Y166 PolarHBondContact O-N 3.3Å; L164-Y176 HydrophobicContact CD1-CE1 3.78Å; L164-Y176 HydrophobicContact CD2-CD1 4.46Å; L164-Y176 HydrophobicContact CD2-CE1 3.7Å; L164-Y176 HydrophobicContact CG-CE1 4.42Å; L164-M180 HydrophobicContact CD1-CE 4.19Å
165D90.4Very high89.4Confident15 Ų1545.9 Ų45.98%0.0822%0.224CC..  trans-72.197.6176.3-177.414.9000110.3E152 D154 T163 S167 K168 Y173E152-D165 HydrophobicContact CB-CB 4.37Å; E152-D165 PolarHBondContact O-N 3.39Å; D154-D165 HydrophobicContact CB-CB 3.85Å; T163-D165 PolarHBondContact O-N 2.86Å; D165-S167 VanDerWaalsContact OD1-CB 3.23Å; D165-S167 WeakPolarHBondContact OD1-CB 3.39Å; D165-S167 PolarHBondContact OD1-N 3.42Å; D165-S167 PolarHBondContact OD1-OG 3.27Å; D165-K168 WeakPolarHBondContact OD2-CD 3.33Å; D165-K168 WeakPolarHBondContact OD2-CE 3.05Å; D165-K168 IonicContact OD2-NZ 2.73Å; D165-K168 PolarHBondContact OD2-NZ 2.97Å; D165-Y173 VanDerWaalsContact O-CD2 3.25Å; D165-Y173 WeakPolarHBondContact O-CD2 3.46Å
166Y84.6Confident89.6Confident15 Ų1542.9 Ų42.96%0.05921%0.212CC..  trans-96.34.5173.460.9-100.3000112.4T163 L164 Y173 L230 A234 A239 R247T163-Y166 HydrophobicContact CG2-CE1 4.23Å; L164-Y166 WeakPolarHBondContact O-CD1 3.48Å; L164-Y166 PolarHBondContact O-N 3.3Å; Y166-Y173 VanDerWaalsContact CB-CE2 3.47Å; Y166-Y173 VanDerWaalsContact CB-OH 3.32Å; Y166-Y173 WeakPolarHBondContact CB-OH 3.33Å; Y166-L230 HydrophobicContact CE2-CD1 4.46Å; Y166-L230 HydrophobicContact CE2-CD2 4.39Å; Y166-L230 HydrophobicContact CE2-CG 4.42Å; Y166-A234 HydrophobicContact CD2-CB 3.99Å; Y166-A234 HydrophobicContact CG-CB 4.25Å; Y166-A239 HydrophobicContact CD2-CB 3.72Å; Y166-A239 HydrophobicContact CE2-CB 4.11Å; Y166-R247 HydrophobicContact CE2-CG 4.5Å
167S81Confident89.8Confident45 Ų4542.6 Ų42.632%0.31521%0.211SC..SBendtrans-73.3-30.4-174.371.30000113.2D165D165-S167 VanDerWaalsContact OD1-CB 3.23Å; D165-S167 WeakPolarHBondContact OD1-CB 3.39Å; D165-S167 PolarHBondContact OD1-N 3.42Å; D165-S167 PolarHBondContact OD1-OG 3.27Å
168K77.4Confident90Very high115 Ų11545.2 Ų45.250%0.522%0.222SC..SBendtrans-83.1-27.4-177.2-62.6171.4-169.5154.80113.2E152 D165 D170E152-K168 IonicContact OE1-NZ 3.72Å; E152-K168 IonicContact OE2-NZ 2.89Å; E152-K168 PolarHBondContact OE2-NZ 2.91Å; D165-K168 WeakPolarHBondContact OD2-CD 3.33Å; D165-K168 WeakPolarHBondContact OD2-CE 3.05Å; D165-K168 IonicContact OD2-NZ 2.73Å; D165-K168 PolarHBondContact OD2-NZ 2.97Å; K168-D170 HydrophobicContact CB-CB 4.32Å; K168-D170 PolarHBondContact O-N 3.42Å; K168-D170 VanDerWaalsContact O-N 3.1Å
169G81.2Confident90.3Very high28 Ų2846.6 Ų46.629%0.28923%0.231SC..  trans53.928.6-176.700000113.5A234G169-A234 WeakPolarHBondContact CA-O 3.47Å
170D88.3Confident90.5Very high68 Ų6840.2 Ų40.236%0.36421%0.208SC..  trans-80.5174-170.775.5-13.2000112.3K168 N172 Y173 V174K168-D170 HydrophobicContact CB-CB 4.32Å; K168-D170 PolarHBondContact O-N 3.42Å; K168-D170 VanDerWaalsContact O-N 3.1Å; D170-N172 PolarHBondContact O-N 2.85Å; D170-N172 PolarHBondContact OD1-N 3.43Å; D170-Y173 PolarHBondContact O-N 2.92Å; D170-Y173 VanDerWaalsContact OD1-CB 3.3Å; D170-Y173 WeakPolarHBondContact OD1-CB 3.29Å; D170-Y173 PolarHBondContact OD1-N 3.43Å; D170-V174 WeakPolarHBondContact O-CG2 3.47Å; D170-V174 PolarHBondContact O-N 2.87Å
171R91.5Very high90.6Very high233 Ų23340.6 Ų40.688%0.87921%0.211SC*.Hα-helixtrans-59.2-32.8179.7-69.4-176.5-178.6-176.20.9112.3S175R171-S175 WeakPolarHBondContact O-CB 3.27Å; R171-S175 PolarHBondContact O-N 3.1Å; R171-S175 PolarHBondContact O-OG 2.94Å; R171-S175 VanDerWaalsContact O-OG 3.06Å
172N92.9Very high90.7Very high50 Ų5044.7 Ų44.727%0.26723%0.231SC..Hα-helixtrans-63.7-54.9177.7-171.331.7000110.2G149 G151 D170 V174 S175 Y176G149-N172 PolarHBondContact O-ND2 3.18Å; G149-N172 PolarHBondContact O-OD1 3.24Å; G151-N172 PolarHBondContact N-ND2 3.32Å; G151-N172 PolarHBondContact N-OD1 3.36Å; D170-N172 PolarHBondContact O-N 2.85Å; D170-N172 PolarHBondContact OD1-N 3.43Å; N172-V174 PolarHBondContact O-N 3.05Å; N172-S175 PolarHBondContact O-N 2.96Å; N172-S175 PolarHBondContact O-OG 3.41Å; N172-Y176 PolarHBondContact O-N 2.99Å; N172-Y176 VanDerWaalsContact O-N 3.11Å
173Y91.6Very high90.7Very high7 Ų749 Ų493%0.02725%0.25CC..Hα-helixtrans-55.8-50.6176.4175.2-101.2000112.1D165 Y166 D170 S175 Y176 L177 A231 A234 A235D165-Y173 VanDerWaalsContact O-CD2 3.25Å; D165-Y173 WeakPolarHBondContact O-CD2 3.46Å; Y166-Y173 VanDerWaalsContact CB-CE2 3.47Å; Y166-Y173 VanDerWaalsContact CB-OH 3.32Å; Y166-Y173 WeakPolarHBondContact CB-OH 3.33Å; D170-Y173 PolarHBondContact O-N 2.92Å; D170-Y173 VanDerWaalsContact OD1-CB 3.3Å; D170-Y173 WeakPolarHBondContact OD1-CB 3.29Å; D170-Y173 PolarHBondContact OD1-N 3.43Å; Y173-S175 PolarHBondContact O-N 3.4Å; Y173-Y176 PolarHBondContact O-N 3.05Å; Y173-L177 HydrophobicContact CE1-CB 4.38Å; Y173-L177 HydrophobicContact CE1-CD2 3.79Å; Y173-L177 VanDerWaalsContact O-CB 3.25Å; Y173-L177 WeakPolarHBondContact O-CB 3.46Å; Y173-L177 PolarHBondContact O-N 3.25Å; Y173-A231 WeakPolarHBondContact OH-CA 3.3Å; Y173-A231 PolarHBondContact OH-O 2.9Å; Y173-A234 HydrophobicContact CE1-CB 4.05Å; Y173-A235 HydrophobicContact CE1-CB 4.16Å
174V92.9Very high90.8Very high38 Ų3847.9 Ų47.923%0.2324%0.243CC..Hα-helixtrans-63.5-44.3-177.5175.90000111.5D170 N172 Y176 L177 I178 A235D170-V174 WeakPolarHBondContact O-CG2 3.47Å; D170-V174 PolarHBondContact O-N 2.87Å; N172-V174 PolarHBondContact O-N 3.05Å; V174-Y176 VanDerWaalsContact C-N 3.25Å; V174-Y176 PolarHBondContact O-N 3.4Å; V174-L177 PolarHBondContact O-N 3.08Å; V174-I178 HydrophobicContact CG1-CD1 3.76Å; V174-I178 HydrophobicContact CG1-CG1 4.36Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.4Å; V174-A235 HydrophobicContact CG2-CB 3.96Å
175S94.7Very high90.8Very high53 Ų5349.7 Ų49.737%0.37125%0.252SS..Hα-helixtrans-64.5-30.3179.973.80000112.9W150 R171 N172 Y173 P179W150-S175 WeakPolarHBondContact CZ2-O 3.39Å; W150-S175 PolarHBondContact NE1-OG 3.39Å; R171-S175 WeakPolarHBondContact O-CB 3.27Å; R171-S175 PolarHBondContact O-N 3.1Å; R171-S175 PolarHBondContact O-OG 2.94Å; R171-S175 VanDerWaalsContact O-OG 3.06Å; N172-S175 PolarHBondContact O-N 2.96Å; N172-S175 PolarHBondContact O-OG 3.41Å; Y173-S175 PolarHBondContact O-N 3.4Å; S175-P179 WeakPolarHBondContact O-CD 3.38Å; S175-P179 VanDerWaalsContact O-CG 3.29Å; S175-P179 WeakPolarHBondContact O-CG 3.33Å
176Y95Very high91Very high1 Ų151 Ų510%0.00427%0.269CS..Hα-helixtrans-78.4-47.4174.3172.7-106.5000111.8F96 W142 M145 P146 W150 L164 N172 Y173 V174 I178 P179 M180F96-Y176 WeakPolarHBondContact CE1-OH 3.36Å; W142-Y176 HydrophobicContact CE3-CD2 4.44Å; W142-Y176 AromaticContact CE3-CE2 3.79Å; W142-Y176 HydrophobicContact CE3-CE2 3.79Å; W142-Y176 HydrophobicContact CZ3-CD2 4.34Å; W142-Y176 HydrophobicContact CZ3-CE2 4.15Å; W142-Y176 PolarHBondContact O-OH 3.26Å; M145-Y176 HydrophobicContact CB-CD2 4.14Å; M145-Y176 HydrophobicContact CB-CE2 3.63Å; M145-Y176 HydrophobicContact CG-CE2 4.23Å; P146-Y176 HydrophobicContact CG-CE1 4.23Å; P146-Y176 HydrophobicContact CG-CE2 4.45Å; W150-Y176 AromaticContact CD2-CD2 3.94Å; W150-Y176 HydrophobicContact CD2-CD2 3.94Å; W150-Y176 HydrophobicContact CE3-CD2 4.23Å; W150-Y176 HydrophobicContact CG-CD2 4.18Å; W150-Y176 WeakPolarHBondContact O-CD2 3.42Å; L164-Y176 HydrophobicContact CD1-CE1 3.78Å; L164-Y176 HydrophobicContact CD2-CD1 4.46Å; L164-Y176 HydrophobicContact CD2-CE1 3.7Å; L164-Y176 HydrophobicContact CG-CE1 4.42Å; N172-Y176 PolarHBondContact O-N 2.99Å; N172-Y176 VanDerWaalsContact O-N 3.11Å; Y173-Y176 PolarHBondContact O-N 3.05Å; V174-Y176 VanDerWaalsContact C-N 3.25Å; V174-Y176 PolarHBondContact O-N 3.4Å; Y176-I178 PolarHBondContact O-N 3.16Å; Y176-P179 WeakPolarHBondContact O-CD 3.5Å; Y176-P179 WeakPolarHBondContact O-CG 3.35Å; Y176-M180 HydrophobicContact CE1-CB 4.48Å; Y176-M180 HydrophobicContact CE1-CE 4.39Å; Y176-M180 HydrophobicContact CE1-CG 4.31Å; Y176-M180 WeakPolarHBondContact O-CB 3.47Å; Y176-M180 PolarHBondContact O-N 2.99Å; Y176-M180 VanDerWaalsContact O-N 3.16Å
177L93.5Very high91.6Very high1 Ų153.8 Ų53.81%0.00528%0.284CS..Hα-helixtrans-60.7-43.7-174.1178.774.9000112.5Y173 V174 M180 S181 A231 A235Y173-L177 HydrophobicContact CE1-CB 4.38Å; Y173-L177 HydrophobicContact CE1-CD2 3.79Å; Y173-L177 VanDerWaalsContact O-CB 3.25Å; Y173-L177 WeakPolarHBondContact O-CB 3.46Å; Y173-L177 PolarHBondContact O-N 3.25Å; V174-L177 PolarHBondContact O-N 3.08Å; L177-M180 HydrophobicContact CD1-CE 3.8Å; L177-M180 PolarHBondContact O-N 3.39Å; L177-S181 WeakPolarHBondContact O-CB 3.4Å; L177-S181 PolarHBondContact O-N 2.96Å; L177-S181 PolarHBondContact O-OG 3.26Å; L177-A231 HydrophobicContact CD1-CB 3.9Å; L177-A231 WeakPolarHBondContact CD2-O 3.26Å; L177-A235 HydrophobicContact CD2-CB 3.48Å; L177-A235 VanDerWaalsContact CD2-CB 3.48Å
178I93Very high92.3Very high84 Ų8452.7 Ų52.743%0.43127%0.273SS..Hα-helixtrans-58.9-60.6-175-68.9170.2000111.7V174 Y176 M180 S181 I182V174-I178 HydrophobicContact CG1-CD1 3.76Å; V174-I178 HydrophobicContact CG1-CG1 4.36Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.4Å; Y176-I178 PolarHBondContact O-N 3.16Å; I178-M180 VanDerWaalsContact C-N 3.34Å; I178-M180 PolarHBondContact O-N 2.81Å; I178-S181 PolarHBondContact O-N 3.35Å; I178-I182 HydrophobicContact CG2-CD1 3.97Å; I178-I182 WeakPolarHBondContact O-CG1 3.19Å; I178-I182 PolarHBondContact O-N 3.02Å; I178-I182 VanDerWaalsContact O-N 3.08Å
179P95.1Very high93.2Very high30 Ų3049 Ų4920%0.19526%0.261CS..Hα-helixtrans-66.6-37.7-18028.9-36.4000111.5W142 W150 S175 Y176 S181 I182 F183W142-P179 HydrophobicContact CH2-CB 3.88Å; W142-P179 HydrophobicContact CH2-CG 4.11Å; W142-P179 HydrophobicContact CZ3-CG 4.37Å; W150-P179 HydrophobicContact CH2-CG 4.08Å; W150-P179 HydrophobicContact CZ2-CG 3.99Å; S175-P179 WeakPolarHBondContact O-CD 3.38Å; S175-P179 VanDerWaalsContact O-CG 3.29Å; S175-P179 WeakPolarHBondContact O-CG 3.33Å; Y176-P179 WeakPolarHBondContact O-CD 3.5Å; Y176-P179 WeakPolarHBondContact O-CG 3.35Å; P179-S181 VanDerWaalsContact C-N 3.34Å; P179-S181 PolarHBondContact O-N 2.83Å; P179-I182 PolarHBondContact O-N 2.9Å; P179-F183 HydrophobicContact CB-CD2 4.43Å; P179-F183 WeakPolarHBondContact O-CD2 3.4Å; P179-F183 PolarHBondContact O-N 2.9Å
180M94.5Very high93.9Very high17 Ų1754.3 Ų54.38%0.08428%0.276CS..Hα-helixtrans-57-48.2176.5-176.7-79.2-73.200111F96 W142 L164 Y176 L177 I178 F183 N184F96-M180 HydrophobicContact CE1-CG 4.48Å; F96-M180 HydrophobicContact CZ-CE 3.83Å; F96-M180 HydrophobicContact CZ-CG 4.23Å; F96-M180 HydrophobicContact CZ-SD 3.83Å; W142-M180 HydrophobicContact CD2-CB 4.4Å; W142-M180 HydrophobicContact CD2-CG 4.3Å; W142-M180 HydrophobicContact CE3-CB 3.66Å; W142-M180 HydrophobicContact CE3-CG 3.85Å; W142-M180 HydrophobicContact CH2-CB 4.43Å; W142-M180 HydrophobicContact CZ3-CB 3.69Å; W142-M180 HydrophobicContact CZ3-CG 4.4Å; L164-M180 HydrophobicContact CD1-CE 4.19Å; Y176-M180 HydrophobicContact CE1-CB 4.48Å; Y176-M180 HydrophobicContact CE1-CE 4.39Å; Y176-M180 HydrophobicContact CE1-CG 4.31Å; Y176-M180 WeakPolarHBondContact O-CB 3.47Å; Y176-M180 PolarHBondContact O-N 2.99Å; Y176-M180 VanDerWaalsContact O-N 3.16Å; L177-M180 HydrophobicContact CD1-CE 3.8Å; L177-M180 PolarHBondContact O-N 3.39Å; I178-M180 VanDerWaalsContact C-N 3.34Å; I178-M180 PolarHBondContact O-N 2.81Å; M180-F183 PolarHBondContact O-N 3.47Å; M180-N184 VanDerWaalsContact O-CB 3.24Å; M180-N184 WeakPolarHBondContact O-CB 3.21Å; M180-N184 PolarHBondContact O-N 3.49Å; M180-N184 PolarHBondContact O-ND2 3.01Å; M180-N184 HydrophobicContact SD-CB 4.39Å
181S93Very high94.4Very high9 Ų952.7 Ų52.76%0.06327%0.268CS..Hα-helixtrans-64.2-40.9178.8-64.80000112.5L177 I178 P179 M185 G186L177-S181 WeakPolarHBondContact O-CB 3.4Å; L177-S181 PolarHBondContact O-N 2.96Å; L177-S181 PolarHBondContact O-OG 3.26Å; I178-S181 PolarHBondContact O-N 3.35Å; P179-S181 VanDerWaalsContact C-N 3.34Å; P179-S181 PolarHBondContact O-N 2.83Å; S181-M185 CarbonylContact O-C 3.6Å; S181-M185 WeakPolarHBondContact O-CA 3.4Å; S181-M185 WeakPolarHBondContact O-CB 3.28Å; S181-M185 PolarHBondContact O-N 2.78Å; S181-G186 PolarHBondContact O-N 3.37Å
182I94.5Very high94.7Very high90 Ų9041.6 Ų41.646%0.46223%0.227SC..Iπ-helixtrans-62.3-51178-69.8166.3000110.5I178 P179 G186 I187I178-I182 HydrophobicContact CG2-CD1 3.97Å; I178-I182 WeakPolarHBondContact O-CG1 3.19Å; I178-I182 PolarHBondContact O-N 3.02Å; I178-I182 VanDerWaalsContact O-N 3.08Å; P179-I182 PolarHBondContact O-N 2.9Å; I182-G186 PolarHBondContact O-N 2.89Å; I182-I187 PolarHBondContact O-N 2.92Å
183F95.9Very high94.9Very high98 Ų9841.8 Ų41.843%0.4323%0.228SC..Iπ-helixtrans-77.1-38-174-73.8-68.9000113.9F138 W142 P179 M180 I187 Q188F138-F183 HydrophobicContact CE1-CB 4.3Å; F138-F183 HydrophobicContact CZ-CB 3.96Å; F138-F183 HydrophobicContact CZ-CG 4.42Å; W142-F183 HydrophobicContact CZ2-CB 4.35Å; W142-F183 AromaticContact CZ2-CD2 3.93Å; W142-F183 HydrophobicContact CZ2-CD2 3.93Å; W142-F183 HydrophobicContact CZ2-CG 4.47Å; P179-F183 HydrophobicContact CB-CD2 4.43Å; P179-F183 WeakPolarHBondContact O-CD2 3.4Å; P179-F183 PolarHBondContact O-N 2.9Å; M180-F183 PolarHBondContact O-N 3.47Å; F183-I187 HydrophobicContact CD1-CD1 3.75Å; F183-I187 HydrophobicContact CE1-CD1 4.2Å; F183-Q188 PolarHBondContact O-NE2 3.43Å
184N95Very high95.2Very high1 Ų143.3 Ų43.31%0.00524%0.239CC..Iπ-helixtrans-97.7-15.9-173.2-64.3-77.1000114.3L100 H104 F138 W142 M180 Q188L100-N184 HydrophobicContact CD2-CB 3.78Å; H104-N184 PolarHBondContact NE2-OD1 3.36Å; F138-N184 WeakPolarHBondContact CE1-OD1 2.96Å; W142-N184 VanDerWaalsContact CG-ND2 3.33Å; W142-N184 PolarHBondContact NE1-ND2 3.49Å; M180-N184 VanDerWaalsContact O-CB 3.24Å; M180-N184 WeakPolarHBondContact O-CB 3.21Å; M180-N184 PolarHBondContact O-N 3.49Å; M180-N184 PolarHBondContact O-ND2 3.01Å; M180-N184 HydrophobicContact SD-CB 4.39Å; N184-Q188 WeakPolarHBondContact O-CG 3.48Å
185M91.6Very high95.4Very high46 Ų4641.8 Ų41.823%0.22723%0.23CC..Iπ-helixtrans-125.5-51.5179.2-167.2163.8172.700112.2S181 Q188 V189 W224S181-M185 CarbonylContact O-C 3.6Å; S181-M185 WeakPolarHBondContact O-CA 3.4Å; S181-M185 WeakPolarHBondContact O-CB 3.28Å; S181-M185 PolarHBondContact O-N 2.78Å; M185-Q188 PolarHBondContact O-N 3.48Å; M185-V189 HydrophobicContact CG-CG2 4.35Å; M185-V189 WeakPolarHBondContact O-CB 3.48Å; M185-V189 VanDerWaalsContact O-CG2 3.26Å; M185-V189 WeakPolarHBondContact O-CG2 3.28Å; M185-V189 PolarHBondContact O-N 2.9Å; M185-W224 HydrophobicContact CE-CB 4.34Å
186G94.6Very high95.5Very high42 Ų4240 Ų4043%0.43322%0.216SC..Iπ-helixtrans-58.7-55.8-177.900000112.9S181 I182 Q188 V189 F190S181-G186 PolarHBondContact O-N 3.37Å; I182-G186 PolarHBondContact O-N 2.89Å; G186-Q188 VanDerWaalsContact C-N 3.31Å; G186-Q188 PolarHBondContact O-N 3.47Å; G186-V189 PolarHBondContact O-N 2.88Å; G186-F190 WeakPolarHBondContact O-CB 3.46Å; G186-F190 PolarHBondContact O-N 2.91Å
187I96.5Very high95.6Very high73 Ų7344.8 Ų44.837%0.37424%0.238SC..Hα-helixtrans-61.4-40.7177.4-72.8168.4000111.2I182 F183 F190 V191I182-I187 PolarHBondContact O-N 2.92Å; F183-I187 HydrophobicContact CD1-CD1 3.75Å; F183-I187 HydrophobicContact CE1-CD1 4.2Å; I187-F190 WeakPolarHBondContact O-CB 3.42Å; I187-F190 PolarHBondContact O-N 3.07Å; I187-V191 HydrophobicContact CG2-CG2 4.34Å; I187-V191 WeakPolarHBondContact O-CG2 3.23Å; I187-V191 PolarHBondContact O-N 3.23Å
188Q96.1Very high95.7Very high22 Ų2246.6 Ų46.610%0.10325%0.25CS..Hα-helixtrans-68-44.3-176.9-51.1-44.3-40.600111.7H104 A107 F183 N184 M185 G186 F190 V191 V192H104-Q188 PolarHBondContact CE1-NE2 3.28Å; H104-Q188 PolarHBondContact ND1-NE2 2.85Å; A107-Q188 HydrophobicContact CB-CB 4.1Å; F183-Q188 PolarHBondContact O-NE2 3.43Å; N184-Q188 WeakPolarHBondContact O-CG 3.48Å; M185-Q188 PolarHBondContact O-N 3.48Å; G186-Q188 VanDerWaalsContact C-N 3.31Å; G186-Q188 PolarHBondContact O-N 3.47Å; Q188-F190 VanDerWaalsContact C-N 3.3Å; Q188-F190 PolarHBondContact O-N 3.37Å; Q188-V191 PolarHBondContact O-N 3.01Å; Q188-V192 WeakPolarHBondContact O-CG2 3.31Å; Q188-V192 PolarHBondContact O-N 3.37Å
189V95.7Very high95.9Very high39 Ų3942.6 Ų42.624%0.23623%0.23CC..Hα-helixtrans-59.8-42.31731700000110.5M185 G186 V192 L193 L220M185-V189 HydrophobicContact CG-CG2 4.35Å; M185-V189 WeakPolarHBondContact O-CB 3.48Å; M185-V189 VanDerWaalsContact O-CG2 3.26Å; M185-V189 WeakPolarHBondContact O-CG2 3.28Å; M185-V189 PolarHBondContact O-N 2.9Å; G186-V189 PolarHBondContact O-N 2.88Å; V189-V192 PolarHBondContact O-N 3.33Å; V189-L193 WeakPolarHBondContact O-CB 3.23Å; V189-L193 PolarHBondContact O-N 3.25Å; V189-L220 HydrophobicContact CG2-CD2 4.01Å
190F97Very high95.9Very high138 Ų13842.6 Ų42.661%0.60523%0.233SC*.Hα-helixtrans-61.9-44.4176.5174.8-99.1000112.6G186 I187 Q188 L193 S194G186-F190 WeakPolarHBondContact O-CB 3.46Å; G186-F190 PolarHBondContact O-N 2.91Å; I187-F190 WeakPolarHBondContact O-CB 3.42Å; I187-F190 PolarHBondContact O-N 3.07Å; Q188-F190 VanDerWaalsContact C-N 3.3Å; Q188-F190 PolarHBondContact O-N 3.37Å; F190-L193 PolarHBondContact O-N 3.07Å; F190-S194 WeakPolarHBondContact O-CB 3.47Å; F190-S194 PolarHBondContact O-N 2.96Å; F190-S194 PolarHBondContact O-OG 3.14Å
191V98Very high95.9Very high34 Ų3447.3 Ų47.321%0.20626%0.255CS..Hα-helixtrans-61.9-46.4177.1170.20000110.8A107 W111 I187 Q188 S194 S195A107-V191 HydrophobicContact CB-CB 4.28Å; A107-V191 HydrophobicContact CB-CG1 4.08Å; W111-V191 HydrophobicContact CB-CG1 4.12Å; I187-V191 HydrophobicContact CG2-CG2 4.34Å; I187-V191 WeakPolarHBondContact O-CG2 3.23Å; I187-V191 PolarHBondContact O-N 3.23Å; Q188-V191 PolarHBondContact O-N 3.01Å; V191-S194 PolarHBondContact O-OG 2.91Å; V191-S195 WeakPolarHBondContact O-CB 2.98Å; V191-S195 PolarHBondContact O-N 2.02Å; V191-S195 PolarHBondContact O-OG 2.96Å
192V97.3Very high96Very high1 Ų150.8 Ų50.81%0.00627%0.266CS..Hα-helixtrans-62.1-48.4177.8172.80000110.8I106 A107 A110 Q188 V189 Y196 L217 L220I106-V192 HydrophobicContact CG2-CG2 4.1Å; A107-V192 HydrophobicContact CB-CG2 4.13Å; A110-V192 HydrophobicContact CB-CB 4.41Å; A110-V192 HydrophobicContact CB-CG2 4.03Å; Q188-V192 WeakPolarHBondContact O-CG2 3.31Å; Q188-V192 PolarHBondContact O-N 3.37Å; V189-V192 PolarHBondContact O-N 3.33Å; V192-Y196 HydrophobicContact CG1-CD2 3.81Å; V192-Y196 HydrophobicContact CG1-CE2 4.08Å; V192-Y196 WeakPolarHBondContact O-CD2 3.31Å; V192-Y196 PolarHBondContact O-N 3.22Å; V192-L217 HydrophobicContact CG1-CB 4.45Å; V192-L217 HydrophobicContact CG1-CD1 4.32Å; V192-L220 HydrophobicContact CB-CD2 4.24Å; V192-L220 HydrophobicContact CG1-CD2 4.18Å; V192-L220 HydrophobicContact CG2-CD2 4.15Å
193L97.1Very high96Very high54 Ų5447.2 Ų47.228%0.28325%0.248SC..Hα-helixtrans-58.4-56.6179.9177.766.6000111.6V189 F190 S195 Y196 Q197 L217V189-L193 WeakPolarHBondContact O-CB 3.23Å; V189-L193 PolarHBondContact O-N 3.25Å; F190-L193 PolarHBondContact O-N 3.07Å; L193-S195 VanDerWaalsContact C-N 3.33Å; L193-S195 PolarHBondContact O-N 3.08Å; L193-Y196 PolarHBondContact O-N 3.44Å; L193-Q197 HydrophobicContact CD1-CG 4.07Å; L193-Q197 VanDerWaalsContact CD1-NE2 3.34Å; L193-Q197 HydrophobicContact CG-CG 4.48Å; L193-Q197 VanDerWaalsContact O-CB 3.28Å; L193-Q197 WeakPolarHBondContact O-CB 3.17Å; L193-Q197 WeakPolarHBondContact O-CG 3.39Å; L193-Q197 PolarHBondContact O-N 2.98Å; L193-L217 HydrophobicContact CB-CD1 4.44Å; L193-L217 HydrophobicContact CD1-CD2 3.42Å; L193-L217 VanDerWaalsContact CD1-CD2 3.42Å
194S97.8Very high96Very high39 Ų3951.4 Ų51.427%0.27327%0.266SS..Hα-helixtrans-62.7-39.1-176.957.10000112.3F190 V191 S198F190-S194 WeakPolarHBondContact O-CB 3.47Å; F190-S194 PolarHBondContact O-N 2.96Å; F190-S194 PolarHBondContact O-OG 3.14Å; V191-S194 PolarHBondContact O-OG 2.91Å; S194-S198 WeakPolarHBondContact O-CB 3.49Å; S194-S198 PolarHBondContact O-N 2.98Å; S194-S198 VanDerWaalsContact O-N 3.1Å; S194-S198 PolarHBondContact O-OG 2.8Å
195S97.6Very high96Very high6 Ų659.6 Ų59.64%0.04230%0.301CS..Hα-helixtrans-62.8-54.1177.1-63.80000111.6A110 V191 L193 S198 I199A110-S195 WeakPolarHBondContact O-CB 3.36Å; V191-S195 WeakPolarHBondContact O-CB 2.98Å; V191-S195 PolarHBondContact O-N 2.02Å; V191-S195 PolarHBondContact O-OG 2.96Å; L193-S195 VanDerWaalsContact C-N 3.33Å; L193-S195 PolarHBondContact O-N 3.08Å; S195-S198 PolarHBondContact O-N 3.19Å; S195-I199 VanDerWaalsContact O-CG1 3.3Å; S195-I199 WeakPolarHBondContact O-CG1 3.43Å; S195-I199 PolarHBondContact O-N 3.29Å
196Y96.3Very high96.1Very high16 Ų1660.8 Ų60.86%0.06331%0.311CS..Hα-helixtrans-74.1-29.7-176.2-78-65.3000113.7A110 V192 L193 I199 A200 F211 P213 P216A110-Y196 HydrophobicContact CB-CD2 4.09Å; A110-Y196 HydrophobicContact CB-CE2 3.55Å; V192-Y196 HydrophobicContact CG1-CD2 3.81Å; V192-Y196 HydrophobicContact CG1-CE2 4.08Å; V192-Y196 WeakPolarHBondContact O-CD2 3.31Å; V192-Y196 PolarHBondContact O-N 3.22Å; L193-Y196 PolarHBondContact O-N 3.44Å; Y196-I199 HydrophobicContact CD1-CD1 3.87Å; Y196-I199 HydrophobicContact CE1-CD1 4.16Å; Y196-I199 PolarHBondContact O-N 2.94Å; Y196-A200 WeakPolarHBondContact O-CB 3.38Å; Y196-A200 PolarHBondContact O-N 3.25Å; Y196-F211 HydrophobicContact CD1-CE2 4.01Å; Y196-F211 HydrophobicContact CD1-CZ 4.45Å; Y196-F211 AromaticContact CE1-CE2 3.64Å; Y196-F211 HydrophobicContact CE1-CE2 3.64Å; Y196-F211 AromaticContact CE1-CZ 3.99Å; Y196-F211 HydrophobicContact CE1-CZ 3.99Å; Y196-P213 VanDerWaalsContact CB-O 3.29Å; Y196-P213 WeakPolarHBondContact CB-O 3.34Å; Y196-P213 HydrophobicContact CD1-CB 4.07Å; Y196-P213 WeakPolarHBondContact O-CB 3.07Å; Y196-P216 HydrophobicContact CD1-CG 4.39Å; Y196-P216 HydrophobicContact CD2-CB 4.02Å; Y196-P216 HydrophobicContact CD2-CG 4.36Å; Y196-P216 HydrophobicContact CE1-CB 4.43Å; Y196-P216 HydrophobicContact CE1-CG 3.84Å; Y196-P216 HydrophobicContact CE2-CB 3.46Å; Y196-P216 VanDerWaalsContact CE2-CB 3.46Å; Y196-P216 HydrophobicContact CE2-CG 3.8Å
197Q96.5Very high95.9Very high100 Ų10061.9 Ų61.947%0.46732%0.322SS..Hα-helixtrans-62-44.8169.3-77.4179.7-18.700111.3L193 I199 A200 Q201L193-Q197 HydrophobicContact CD1-CG 4.07Å; L193-Q197 VanDerWaalsContact CD1-NE2 3.34Å; L193-Q197 HydrophobicContact CG-CG 4.48Å; L193-Q197 VanDerWaalsContact O-CB 3.28Å; L193-Q197 WeakPolarHBondContact O-CB 3.17Å; L193-Q197 WeakPolarHBondContact O-CG 3.39Å; L193-Q197 PolarHBondContact O-N 2.98Å; Q197-I199 PolarHBondContact O-N 3.18Å; Q197-A200 WeakPolarHBondContact O-CB 3.42Å; Q197-A200 PolarHBondContact O-N 3.46Å; Q197-Q201 WeakPolarHBondContact O-CG 3.48Å; Q197-Q201 PolarHBondContact O-N 3.43Å
198S96.9Very high95.4Very high39 Ų3962.2 Ų62.227%0.27333%0.325SS..Hα-helixtrans-63.3-41.8177-61.60000111.8S194 S195 Q201 R202S194-S198 WeakPolarHBondContact O-CB 3.49Å; S194-S198 PolarHBondContact O-N 2.98Å; S194-S198 VanDerWaalsContact O-N 3.1Å; S194-S198 PolarHBondContact O-OG 2.8Å; S195-S198 PolarHBondContact O-N 3.19Å; S198-Q201 PolarHBondContact O-N 2.85Å; S198-R202 WeakPolarHBondContact O-CB 3.34Å; S198-R202 PolarHBondContact O-N 2.9Å
199I95.9Very high95Very high0 Ų065.6 Ų65.60%035%0.349CS..Hα-helixtrans-61.6-44.4174.1-66.3165.4000110.7R113 Y117 S195 Y196 Q197 Q201 R202 F203 F211 P213R113-I199 HydrophobicContact CB-CD1 4Å; Y117-I199 HydrophobicContact CD2-CD1 4.47Å; S195-I199 VanDerWaalsContact O-CG1 3.3Å; S195-I199 WeakPolarHBondContact O-CG1 3.43Å; S195-I199 PolarHBondContact O-N 3.29Å; Y196-I199 HydrophobicContact CD1-CD1 3.87Å; Y196-I199 HydrophobicContact CE1-CD1 4.16Å; Y196-I199 PolarHBondContact O-N 2.94Å; Q197-I199 PolarHBondContact O-N 3.18Å; I199-Q201 VanDerWaalsContact C-N 3.34Å; I199-Q201 PolarHBondContact O-N 2.93Å; I199-R202 WeakPolarHBondContact O-CB 3.4Å; I199-R202 PolarHBondContact O-N 3.46Å; I199-R202 VanDerWaalsContact O-N 3.13Å; I199-F203 HydrophobicContact CG2-CD1 4.36Å; I199-F203 HydrophobicContact CG2-CD2 4.01Å; I199-F203 HydrophobicContact CG2-CE1 3.96Å; I199-F203 HydrophobicContact CG2-CE2 3.58Å; I199-F203 HydrophobicContact CG2-CG 4.37Å; I199-F203 HydrophobicContact CG2-CZ 3.55Å; I199-F203 WeakPolarHBondContact O-CG 3.33Å; I199-F203 PolarHBondContact O-N 3.36Å; I199-F211 HydrophobicContact CG2-CZ 4.07Å; I199-P213 HydrophobicContact CG2-CB 4.42Å; I199-P213 HydrophobicContact CG2-CG 4.16Å
200A95.8Very high94.5Very high31 Ų3169.6 Ų69.626%0.25636%0.36SS..Hα-helixtrans-60-44.2177.500000112.2Y196 Q197 R202 F203 K204 P213Y196-A200 WeakPolarHBondContact O-CB 3.38Å; Y196-A200 PolarHBondContact O-N 3.25Å; Q197-A200 WeakPolarHBondContact O-CB 3.42Å; Q197-A200 PolarHBondContact O-N 3.46Å; A200-R202 VanDerWaalsContact C-N 3.32Å; A200-R202 PolarHBondContact O-N 3.45Å; A200-F203 PolarHBondContact O-N 2.93Å; A200-K204 WeakPolarHBondContact O-CB 3.36Å; A200-K204 PolarHBondContact O-N 2.92Å; A200-P213 HydrophobicContact CB-CB 3.99Å; A200-P213 HydrophobicContact CB-CG 3.95Å
201Q95.6Very high94.2Very high116 Ų11664.5 Ų64.554%0.54234%0.337SS..Hα-helixtrans-61.8-41.1174.3-68.6175.418.100111.6Q197 S198 I199 K204 K205Q197-Q201 WeakPolarHBondContact O-CG 3.48Å; Q197-Q201 PolarHBondContact O-N 3.43Å; S198-Q201 PolarHBondContact O-N 2.85Å; I199-Q201 VanDerWaalsContact C-N 3.34Å; I199-Q201 PolarHBondContact O-N 2.93Å; Q201-K204 PolarHBondContact O-N 3.49Å; Q201-K205 WeakPolarHBondContact O-CG 3.25Å; Q201-K205 PolarHBondContact O-N 3.13Å
202R95Very high93.9Very high82 Ų8267.2 Ų67.231%0.30935%0.351SS..Hα-helixtrans-63.8-43.8176.9-176.158.6168.8171.7-2.3112S198 I199 A200 K205 T206S198-R202 WeakPolarHBondContact O-CB 3.34Å; S198-R202 PolarHBondContact O-N 2.9Å; I199-R202 WeakPolarHBondContact O-CB 3.4Å; I199-R202 PolarHBondContact O-N 3.46Å; I199-R202 VanDerWaalsContact O-N 3.13Å; A200-R202 VanDerWaalsContact C-N 3.32Å; A200-R202 PolarHBondContact O-N 3.45Å; R202-K205 PolarHBondContact O-N 2.92Å; R202-T206 WeakPolarHBondContact O-CB 3.16Å; R202-T206 WeakPolarHBondContact O-CG2 3.17Å; R202-T206 PolarHBondContact O-N 3.2Å; R202-T206 PolarHBondContact O-OG1 2.96Å
203F94.7Very high93.6Very high15 Ų1567.8 Ų67.87%0.06635%0.354CS..Hα-helixtrans-63.8-42.2175.8-70.7-9.3000111.7Y117 I199 A200 K205 T206 G207 P209 R210 F211 P213Y117-F203 AromaticContact CD1-CE1 4Å; Y117-F203 HydrophobicContact CD1-CE1 4Å; Y117-F203 HydrophobicContact CD1-CZ 4.3Å; Y117-F203 HydrophobicContact CE1-CE1 4.47Å; Y117-F203 HydrophobicContact CE1-CZ 4.45Å; Y117-F203 HydrophobicContact CG-CE1 4.2Å; Y117-F203 HydrophobicContact CG-CZ 4.38Å; I199-F203 HydrophobicContact CG2-CD1 4.36Å; I199-F203 HydrophobicContact CG2-CD2 4.01Å; I199-F203 HydrophobicContact CG2-CE1 3.96Å; I199-F203 HydrophobicContact CG2-CE2 3.58Å; I199-F203 HydrophobicContact CG2-CG 4.37Å; I199-F203 HydrophobicContact CG2-CZ 3.55Å; I199-F203 WeakPolarHBondContact O-CG 3.33Å; I199-F203 PolarHBondContact O-N 3.36Å; A200-F203 PolarHBondContact O-N 2.93Å; F203-K205 PolarHBondContact O-N 3.36Å; F203-T206 PolarHBondContact O-N 2.82Å; F203-T206 PolarHBondContact O-OG1 3.31Å; F203-G207 PolarHBondContact O-N 2.93Å; F203-P209 HydrophobicContact CB-CB 4.44Å; F203-P209 HydrophobicContact CD2-CB 4.27Å; F203-R210 HydrophobicContact CE1-CG 4.39Å; F203-R210 HydrophobicContact CE2-CB 4.37Å; F203-R210 HydrophobicContact CZ-CB 3.91Å; F203-R210 HydrophobicContact CZ-CG 4.24Å; F203-F211 HydrophobicContact CE2-CD1 4.19Å; F203-F211 HydrophobicContact CE2-CE1 4.03Å; F203-F211 HydrophobicContact CE2-CZ 4.23Å; F203-F211 HydrophobicContact CZ-CD1 4.26Å; F203-F211 AromaticContact CZ-CE1 3.87Å; F203-F211 HydrophobicContact CZ-CE1 3.87Å; F203-F211 HydrophobicContact CZ-CZ 4.3Å; F203-P213 HydrophobicContact CD2-CG 3.8Å; F203-P213 HydrophobicContact CE2-CG 4.02Å
204K94.6Very high93.3Very high186 Ų18669.1 Ų69.181%0.80936%0.362SS*.Hα-helixtrans-60.8-42.8175.4-173177.6179.41800112.2A200 Q201A200-K204 WeakPolarHBondContact O-CB 3.36Å; A200-K204 PolarHBondContact O-N 2.92Å; Q201-K204 PolarHBondContact O-N 3.49Å
205K94.6Very high93Very high173 Ų17369.8 Ų69.875%0.75236%0.364SS*.Hα-helixtrans-68.5-32.8178.2-74-179.6-179.4-179.30113.6Q201 R202 F203Q201-K205 WeakPolarHBondContact O-CG 3.25Å; Q201-K205 PolarHBondContact O-N 3.13Å; R202-K205 PolarHBondContact O-N 2.92Å; F203-K205 PolarHBondContact O-N 3.36Å
206T93.6Very high92.8Very high71 Ų7170.1 Ų70.144%0.43637%0.366SS..Hα-helixtrans-95.4-13.5-176.152.70000113.8R202 F203 N208R202-T206 WeakPolarHBondContact O-CB 3.16Å; R202-T206 WeakPolarHBondContact O-CG2 3.17Å; R202-T206 PolarHBondContact O-N 3.2Å; R202-T206 PolarHBondContact O-OG1 2.96Å; F203-T206 PolarHBondContact O-N 2.82Å; F203-T206 PolarHBondContact O-OG1 3.31Å; T206-N208 PolarHBondContact O-N 3.12Å
207G91.3Very high92.7Very high65 Ų6570.9 Ų70.967%0.6737%0.371SS*.THydrogen-bonded Turntrans68.513.9-178.500000114.4F203 P209F203-G207 PolarHBondContact O-N 2.93Å; G207-P209 WeakPolarHBondContact O-CD 3.28Å
208N86.7Confident92.6Very high80 Ų8072.9 Ų72.943%0.42838%0.378SS..  trans-126.775.9-175-170.70.6000111.6T206 R210T206-N208 PolarHBondContact O-N 3.12Å; N208-R210 PolarHBondContact ND2-NH2 2.74Å; N208-R210 PolarHBondContact O-N 3.01Å
209P86.9Confident92.5Very high93 Ų9372 Ų7260%0.60437%0.371SS*.  trans-71.1125.7176.630-33.1000110.8F203 G207F203-P209 HydrophobicContact CB-CB 4.44Å; F203-P209 HydrophobicContact CD2-CB 4.27Å; G207-P209 WeakPolarHBondContact O-CD 3.28Å
210R86.4Confident92.4Very high123 Ų12372.5 Ų72.546%0.46437%0.374SS..  trans-91.8-27.1176.6-63.1-61.8-174.9151.2-2.4113.8Y117 F203 N208 E270Y117-R210 HydrophobicContact CE1-CG 4.28Å; F203-R210 HydrophobicContact CE1-CG 4.39Å; F203-R210 HydrophobicContact CE2-CB 4.37Å; F203-R210 HydrophobicContact CZ-CB 3.91Å; F203-R210 HydrophobicContact CZ-CG 4.24Å; N208-R210 PolarHBondContact ND2-NH2 2.74Å; N208-R210 PolarHBondContact O-N 3.01Å; R210-E270 IonicContact NH1-OE1 2.78Å
211F89.6Confident92.3Very high31 Ų3175 Ų7514%0.13638%0.383CS..SBendtrans-162172177.160-90.2000108.6Y117 Y196 I199 F203 P213Y117-F211 HydrophobicContact CD2-CE1 4.39Å; Y117-F211 AromaticContact CE2-CE1 3.69Å; Y117-F211 HydrophobicContact CE2-CE1 3.69Å; Y117-F211 HydrophobicContact CE2-CZ 4.29Å; Y196-F211 HydrophobicContact CD1-CE2 4.01Å; Y196-F211 HydrophobicContact CD1-CZ 4.45Å; Y196-F211 AromaticContact CE1-CE2 3.64Å; Y196-F211 HydrophobicContact CE1-CE2 3.64Å; Y196-F211 AromaticContact CE1-CZ 3.99Å; Y196-F211 HydrophobicContact CE1-CZ 3.99Å; I199-F211 HydrophobicContact CG2-CZ 4.07Å; F203-F211 HydrophobicContact CE2-CD1 4.19Å; F203-F211 HydrophobicContact CE2-CE1 4.03Å; F203-F211 HydrophobicContact CE2-CZ 4.23Å; F203-F211 HydrophobicContact CZ-CD1 4.26Å; F203-F211 AromaticContact CZ-CE1 3.87Å; F203-F211 HydrophobicContact CZ-CE1 3.87Å; F203-F211 HydrophobicContact CZ-CZ 4.3Å; F211-P213 HydrophobicContact CE2-CB 4.36Å; F211-P213 HydrophobicContact CE2-CG 4.41Å; F211-P213 WeakPolarHBondContact O-CD 3.48Å
212N91.4Very high92.3Very high91 Ų9174.6 Ų74.649%0.48738%0.379SS..  trans-82.1110.1175.6-174.6-17.7000111N214 T215N212-N214 PolarHBondContact O-N 3.33Å; N212-N214 WeakPolarHBondContact OD1-CB 3.41Å; N212-N214 PolarHBondContact OD1-N 3.11Å; N212-T215 WeakPolarHBondContact CB-OG1 3.41Å; N212-T215 PolarHBondContact O-N 3.21Å; N212-T215 PolarHBondContact O-OG1 3.27Å
213P91.3Very high92.3Very high13 Ų1370.7 Ų70.78%0.08436%0.364CS..THydrogen-bonded Turntrans-70.7-15.1-176.1-18.935.5000113.8Y196 I199 A200 F203 F211 P216Y196-P213 VanDerWaalsContact CB-O 3.29Å; Y196-P213 WeakPolarHBondContact CB-O 3.34Å; Y196-P213 HydrophobicContact CD1-CB 4.07Å; Y196-P213 WeakPolarHBondContact O-CB 3.07Å; I199-P213 HydrophobicContact CG2-CB 4.42Å; I199-P213 HydrophobicContact CG2-CG 4.16Å; A200-P213 HydrophobicContact CB-CB 3.99Å; A200-P213 HydrophobicContact CB-CG 3.95Å; F203-P213 HydrophobicContact CD2-CG 3.8Å; F203-P213 HydrophobicContact CE2-CG 4.02Å; F211-P213 HydrophobicContact CE2-CB 4.36Å; F211-P213 HydrophobicContact CE2-CG 4.41Å; F211-P213 WeakPolarHBondContact O-CD 3.48Å; P213-P216 WeakPolarHBondContact O-CD 3.32Å
214N90.9Very high92.3Very high82 Ų8271 Ų7144%0.43937%0.365SS..Hα-helixtrans-81.1-22.9-179.8-62.8-43000112.9N212 K218N212-N214 PolarHBondContact O-N 3.33Å; N212-N214 WeakPolarHBondContact OD1-CB 3.41Å; N212-N214 PolarHBondContact OD1-N 3.11Å; N214-K218 WeakPolarHBondContact O-CG 3.32Å; N214-K218 PolarHBondContact O-N 3.38Å; N214-K218 VanDerWaalsContact O-N 3.12Å
215T92.6Very high92.2Very high53 Ų5363 Ų6333%0.32534%0.335SS..Hα-helixtrans-60.6-47.4-174.4-48.50000112.5N212 L217 K218 T219 L264N212-T215 WeakPolarHBondContact CB-OG1 3.41Å; N212-T215 PolarHBondContact O-N 3.21Å; N212-T215 PolarHBondContact O-OG1 3.27Å; T215-L217 PolarHBondContact O-N 3.34Å; T215-K218 PolarHBondContact O-N 3.46Å; T215-T219 PolarHBondContact O-N 2.96Å; T215-T219 PolarHBondContact O-OG1 3.18Å; T215-T219 VanDerWaalsContact O-OG1 3.13Å; T215-L264 HydrophobicContact CG2-CD2 3.52Å
216P93.2Very high92.2Very high13 Ų1357 Ų578%0.08431%0.314CS..Hα-helixtrans-59.9-43.1-178.3-26.838.4000113.6Y196 P213 T219 L220 L264Y196-P216 HydrophobicContact CD1-CG 4.39Å; Y196-P216 HydrophobicContact CD2-CB 4.02Å; Y196-P216 HydrophobicContact CD2-CG 4.36Å; Y196-P216 HydrophobicContact CE1-CB 4.43Å; Y196-P216 HydrophobicContact CE1-CG 3.84Å; Y196-P216 HydrophobicContact CE2-CB 3.46Å; Y196-P216 VanDerWaalsContact CE2-CB 3.46Å; Y196-P216 HydrophobicContact CE2-CG 3.8Å; P213-P216 WeakPolarHBondContact O-CD 3.32Å; P216-T219 PolarHBondContact O-N 2.81Å; P216-L220 WeakPolarHBondContact O-CB 3.45Å; P216-L220 PolarHBondContact O-N 3.36Å; P216-L264 HydrophobicContact CB-CD1 4.47Å
217L92.9Very high92.1Very high31 Ų3155.4 Ų55.416%0.16230%0.3CS..Hα-helixtrans-64.6-44.5176.817867.9000111.7V192 L193 T215 T219 L220 L221V192-L217 HydrophobicContact CG1-CB 4.45Å; V192-L217 HydrophobicContact CG1-CD1 4.32Å; L193-L217 HydrophobicContact CB-CD1 4.44Å; L193-L217 HydrophobicContact CD1-CD2 3.42Å; L193-L217 VanDerWaalsContact CD1-CD2 3.42Å; T215-L217 PolarHBondContact O-N 3.34Å; L217-T219 VanDerWaalsContact C-N 3.33Å; L217-T219 PolarHBondContact O-N 3.26Å; L217-L220 PolarHBondContact O-N 2.82Å; L217-L221 HydrophobicContact CD1-CD1 4.15Å; L217-L221 HydrophobicContact CD1-CG 4.23Å; L217-L221 HydrophobicContact CG-CD1 4.05Å; L217-L221 HydrophobicContact CG-CG 4.47Å; L217-L221 WeakPolarHBondContact O-CG 3.05Å; L217-L221 PolarHBondContact O-N 3.06Å
218K94.1Very high92Very high143 Ų14352.6 Ų52.662%0.62227%0.272SS*.Hα-helixtrans-61.5-42.9178.3-73.9-179.2178.1-171.60111.5N214 T215 L221 F222N214-K218 WeakPolarHBondContact O-CG 3.32Å; N214-K218 PolarHBondContact O-N 3.38Å; N214-K218 VanDerWaalsContact O-N 3.12Å; T215-K218 PolarHBondContact O-N 3.46Å; K218-L221 PolarHBondContact O-N 3.15Å; K218-F222 VanDerWaalsContact O-CB 3.24Å; K218-F222 WeakPolarHBondContact O-CB 3.28Å; K218-F222 PolarHBondContact O-N 3.32Å
219T94.7Very high92.2Very high20 Ų2053.8 Ų53.812%0.12328%0.282CS..Hα-helixtrans-63.6-45.2175.8-61.20000111.6T215 P216 L217 L221 F222 C223 F260 L264T215-T219 PolarHBondContact O-N 2.96Å; T215-T219 PolarHBondContact O-OG1 3.18Å; T215-T219 VanDerWaalsContact O-OG1 3.13Å; P216-T219 PolarHBondContact O-N 2.81Å; L217-T219 VanDerWaalsContact C-N 3.33Å; L217-T219 PolarHBondContact O-N 3.26Å; T219-L221 PolarHBondContact O-N 2.82Å; T219-F222 PolarHBondContact O-N 3.45Å; T219-C223 PolarHBondContact O-N 2.91Å; T219-C223 PolarHBondContact O-SG 3.22Å; T219-F260 HydrophobicContact CG2-CB 3.46Å; T219-F260 VanDerWaalsContact CG2-CB 3.46Å; T219-F260 HydrophobicContact CG2-CD2 4.28Å; T219-F260 HydrophobicContact CG2-CG 3.88Å; T219-L264 HydrophobicContact CG2-CD1 3.83Å
220L94.4Very high92.4Very high10 Ų1050.1 Ų50.15%0.05226%0.257CS..Hα-helixtrans-57.5-49.2177.2179.569.8000111.3L103 I106 V189 V192 P216 L217 F222 C223 W224L103-L220 HydrophobicContact CD2-CD1 3.6Å; I106-L220 HydrophobicContact CD1-CD1 4.36Å; V189-L220 HydrophobicContact CG2-CD2 4.01Å; V192-L220 HydrophobicContact CB-CD2 4.24Å; V192-L220 HydrophobicContact CG1-CD2 4.18Å; V192-L220 HydrophobicContact CG2-CD2 4.15Å; P216-L220 WeakPolarHBondContact O-CB 3.45Å; P216-L220 PolarHBondContact O-N 3.36Å; L217-L220 PolarHBondContact O-N 2.82Å; L220-F222 VanDerWaalsContact C-N 3.35Å; L220-C223 PolarHBondContact O-N 3.2Å; L220-W224 WeakPolarHBondContact O-CB 3.23Å; L220-W224 PolarHBondContact O-N 3.05Å
221L94.2Very high92.5Very high85 Ų8544.7 Ų44.745%0.44524%0.238SC..Hα-helixtrans-66.8-35.3178.8-67.6175.4000112.4L217 K218 T219 G225 P226L217-L221 HydrophobicContact CD1-CD1 4.15Å; L217-L221 HydrophobicContact CD1-CG 4.23Å; L217-L221 HydrophobicContact CG-CD1 4.05Å; L217-L221 HydrophobicContact CG-CG 4.47Å; L217-L221 WeakPolarHBondContact O-CG 3.05Å; L217-L221 PolarHBondContact O-N 3.06Å; K218-L221 PolarHBondContact O-N 3.15Å; T219-L221 PolarHBondContact O-N 2.82Å; L221-G225 WeakPolarHBondContact O-CA 3.44Å; L221-G225 PolarHBondContact O-N 3.06Å; L221-P226 WeakPolarHBondContact O-CD 3.34Å
222F94.9Very high92.4Very high106 Ų10647.9 Ų47.947%0.46525%0.252SS..Hα-helixtrans-65.5-46175.8174.6-99.6000112.1K218 T219 L220 P226 L253 F260K218-F222 VanDerWaalsContact O-CB 3.24Å; K218-F222 WeakPolarHBondContact O-CB 3.28Å; K218-F222 PolarHBondContact O-N 3.32Å; T219-F222 PolarHBondContact O-N 3.45Å; L220-F222 VanDerWaalsContact C-N 3.35Å; F222-P226 WeakPolarHBondContact O-CD 3.5Å; F222-L253 HydrophobicContact CE1-CD2 4.04Å; F222-L253 HydrophobicContact CE2-CD2 4.36Å; F222-L253 HydrophobicContact CZ-CD2 3.71Å; F222-F260 HydrophobicContact CD1-CE2 4.28Å; F222-F260 HydrophobicContact CE1-CE2 4.02Å; F222-F260 HydrophobicContact CE1-CZ 4.32Å
223C95.8Very high92.3Very high0 Ų047.1 Ų47.10%024%0.243CC..Hα-helixtrans-74.2-50.8-177.7-56.40000111.3T219 L220 L253 A254T219-C223 PolarHBondContact O-N 2.91Å; T219-C223 PolarHBondContact O-SG 3.22Å; L220-C223 PolarHBondContact O-N 3.2Å; C223-L253 WeakPolarHBondContact CA-O 3.49Å; C223-L253 CarbonylContact O-C 3.54Å; C223-L253 VanDerWaalsContact O-C 3.3Å; C223-A254 WeakPolarHBondContact O-CA 3.25Å; C223-A254 PolarHBondContact O-N 2.93Å
224W94.5Very high92Very high23 Ų2346.6 Ų46.69%0.08724%0.239CC..Hα-helixtrans-100.5-22-168.5-66.393.9000114.3I65 A99 L103 M185 L220 Y227 G228 A254 S257I65-W224 HydrophobicContact CD1-CZ2 4.48Å; A99-W224 HydrophobicContact CB-CH2 3.44Å; A99-W224 VanDerWaalsContact CB-CH2 3.44Å; A99-W224 HydrophobicContact CB-CZ2 4.37Å; A99-W224 HydrophobicContact CB-CZ3 4.04Å; L103-W224 HydrophobicContact CD1-CD2 4.27Å; L103-W224 HydrophobicContact CD1-CE3 4.24Å; L103-W224 HydrophobicContact CD2-CB 4.48Å; L103-W224 HydrophobicContact CD2-CD2 3.88Å; L103-W224 HydrophobicContact CD2-CG 3.77Å; L103-W224 HydrophobicContact CG-CD2 4.26Å; L103-W224 HydrophobicContact CG-CZ2 4.45Å; M185-W224 HydrophobicContact CE-CB 4.34Å; L220-W224 WeakPolarHBondContact O-CB 3.23Å; L220-W224 PolarHBondContact O-N 3.05Å; W224-Y227 PolarHBondContact O-N 3.3Å; W224-G228 PolarHBondContact O-N 2.94Å; W224-A254 HydrophobicContact CD2-CB 4.32Å; W224-A254 HydrophobicContact CE3-CB 3.92Å; W224-A254 HydrophobicContact CH2-CB 4.26Å; W224-A254 HydrophobicContact CZ3-CB 3.89Å; W224-S257 PolarHBondContact NE1-OG 3.47Å
225G92.9Very high91.7Very high17 Ų1744 Ų4418%0.17523%0.229CC..Hα-helixtrans-57-50.1-178.800000113.4L221 Y227 G228 V229L221-G225 WeakPolarHBondContact O-CA 3.44Å; L221-G225 PolarHBondContact O-N 3.06Å; G225-Y227 VanDerWaalsContact C-N 3.29Å; G225-Y227 PolarHBondContact O-N 3.13Å; G225-G228 PolarHBondContact O-N 3.48Å; G225-V229 WeakPolarHBondContact O-CG2 3.29Å; G225-V229 PolarHBondContact O-N 3.39Å
226P93.6Very high91.3Very high47 Ų4747.7 Ų47.731%0.30525%0.252SS..Hα-helixtrans-56.8-40.8177.6-27.536.3000113.2L221 F222 V229 L230 A250 L253L221-P226 WeakPolarHBondContact O-CD 3.34Å; F222-P226 WeakPolarHBondContact O-CD 3.5Å; P226-V229 PolarHBondContact O-N 3.5Å; P226-L230 WeakPolarHBondContact O-CB 3.3Å; P226-L230 PolarHBondContact O-N 3.35Å; P226-A250 HydrophobicContact CB-CB 4.09Å; P226-L253 HydrophobicContact CB-CD1 4.17Å; P226-L253 HydrophobicContact CG-CD1 3.77Å
227Y91Very high90.9Very high37 Ų3750.9 Ų50.915%0.14527%0.268CS..Hα-helixtrans-67.7-43177.7-168.5-93.6000112T163 W224 G225 V229 L230 A231 A250 P251T163-Y227 PolarHBondContact OG1-OH 3.5Å; W224-Y227 PolarHBondContact O-N 3.3Å; G225-Y227 VanDerWaalsContact C-N 3.29Å; G225-Y227 PolarHBondContact O-N 3.13Å; Y227-V229 PolarHBondContact O-N 3.33Å; Y227-L230 PolarHBondContact O-N 2.96Å; Y227-A231 WeakPolarHBondContact O-CB 3.36Å; Y227-A231 PolarHBondContact O-N 3.35Å; Y227-A250 HydrophobicContact CD2-CB 4.49Å; Y227-P251 HydrophobicContact CD2-CB 4.11Å; Y227-P251 HydrophobicContact CE2-CB 4.1Å
228G90.8Very high90.3Very high7 Ų752.8 Ų52.87%0.07228%0.278CS..Hα-helixtrans-59.7-45.4174.300000112.3W224 G225 L230 A231 F232W224-G228 PolarHBondContact O-N 2.94Å; G225-G228 PolarHBondContact O-N 3.48Å; G228-L230 PolarHBondContact O-N 3.25Å; G228-A231 PolarHBondContact O-N 3.37Å; G228-F232 VanDerWaalsContact O-CD2 3.27Å; G228-F232 WeakPolarHBondContact O-CD2 3.31Å; G228-F232 PolarHBondContact O-N 2.95Å
229V90.8Very high89.7Confident105 Ų10546 Ų4664%0.63625%0.249SC*.Hα-helixtrans-60.3-45.3176.7171.20000111.2G225 P226 Y227 F232 Y233G225-V229 WeakPolarHBondContact O-CG2 3.29Å; G225-V229 PolarHBondContact O-N 3.39Å; P226-V229 PolarHBondContact O-N 3.5Å; Y227-V229 PolarHBondContact O-N 3.33Å; V229-F232 PolarHBondContact O-N 3.15Å; V229-Y233 WeakPolarHBondContact O-CB 3.3Å; V229-Y233 PolarHBondContact O-N 2.85Å
230L89.8Confident89Confident16 Ų1648.5 Ų48.58%0.08426%0.264CS..Hα-helixtrans-61.3-45.4177.2176.762000111.8Y166 P226 Y227 G228 Y233 A234 R247 A250Y166-L230 HydrophobicContact CE2-CD1 4.46Å; Y166-L230 HydrophobicContact CE2-CD2 4.39Å; Y166-L230 HydrophobicContact CE2-CG 4.42Å; P226-L230 WeakPolarHBondContact O-CB 3.3Å; P226-L230 PolarHBondContact O-N 3.35Å; Y227-L230 PolarHBondContact O-N 2.96Å; G228-L230 PolarHBondContact O-N 3.25Å; L230-Y233 PolarHBondContact O-N 3.21Å; L230-A234 WeakPolarHBondContact O-CB 3.46Å; L230-A234 PolarHBondContact O-N 3.31Å; L230-R247 HydrophobicContact CD1-CG 4.01Å; L230-R247 HydrophobicContact CD2-CB 4.38Å; L230-R247 HydrophobicContact CD2-CG 4.37Å; L230-A250 HydrophobicContact CB-CB 4.38Å; L230-A250 HydrophobicContact CD2-CB 3.94Å
231A88.2Confident88.3Confident9 Ų953.8 Ų53.87%0.07429%0.292CS..Hα-helixtrans-64.2-41.5-179.500000112.2Y173 L177 Y227 G228 A234 A235Y173-A231 WeakPolarHBondContact OH-CA 3.3Å; Y173-A231 PolarHBondContact OH-O 2.9Å; L177-A231 HydrophobicContact CD1-CB 3.9Å; L177-A231 WeakPolarHBondContact CD2-O 3.26Å; Y227-A231 WeakPolarHBondContact O-CB 3.36Å; Y227-A231 PolarHBondContact O-N 3.35Å; G228-A231 PolarHBondContact O-N 3.37Å; A231-A234 WeakPolarHBondContact O-CB 3.01Å; A231-A234 PolarHBondContact O-N 3.31Å; A231-A235 PolarHBondContact O-N 3.04Å
232F88.1Confident87.8Confident97 Ų9751.3 Ų51.343%0.42528%0.28SS..Hα-helixtrans-68.8-40.2174.9-86.3-69.5000112.6G228 V229 A234 A235 V236G228-F232 VanDerWaalsContact O-CD2 3.27Å; G228-F232 WeakPolarHBondContact O-CD2 3.31Å; G228-F232 PolarHBondContact O-N 2.95Å; V229-F232 PolarHBondContact O-N 3.15Å; F232-A234 VanDerWaalsContact C-N 3.25Å; F232-A234 PolarHBondContact O-N 3.32Å; F232-A235 WeakPolarHBondContact O-CB 3.33Å; F232-A235 PolarHBondContact O-N 3.3Å; F232-V236 PolarHBondContact O-N 2.98Å
233Y88.6Confident87.4Confident76 Ų7648.8 Ų48.830%0.29828%0.276SS..Hα-helixtrans-56.3-45.1174.5176.3-101.5000110.7V229 L230 A235 V236 D237 V242V229-Y233 WeakPolarHBondContact O-CB 3.3Å; V229-Y233 PolarHBondContact O-N 2.85Å; L230-Y233 PolarHBondContact O-N 3.21Å; Y233-A235 PolarHBondContact O-N 3.48Å; Y233-A235 VanDerWaalsContact O-N 3.11Å; Y233-V236 PolarHBondContact O-N 3.38Å; Y233-D237 HydrophobicContact CD2-CB 4.44Å; Y233-D237 HydrophobicContact CE2-CB 3.79Å; Y233-D237 PolarHBondContact O-N 3.26Å; Y233-D237 VanDerWaalsContact O-O 3.13Å; Y233-D237 PolarHBondContact OH-OD2 3.08Å; Y233-V242 HydrophobicContact CD1-CG2 3.78Å; Y233-V242 HydrophobicContact CE1-CG2 3.44Å; Y233-V242 VanDerWaalsContact CE1-CG2 3.44Å
234A85.6Confident87Confident1 Ų150.4 Ų50.41%0.00829%0.286CS..Hα-helixtrans-61.4-17.517700000115.3Y166 G169 Y173 L230 A231 F232 D237 A239Y166-A234 HydrophobicContact CD2-CB 3.99Å; Y166-A234 HydrophobicContact CG-CB 4.25Å; G169-A234 WeakPolarHBondContact CA-O 3.47Å; Y173-A234 HydrophobicContact CE1-CB 4.05Å; L230-A234 WeakPolarHBondContact O-CB 3.46Å; L230-A234 PolarHBondContact O-N 3.31Å; A231-A234 WeakPolarHBondContact O-CB 3.01Å; A231-A234 PolarHBondContact O-N 3.31Å; F232-A234 VanDerWaalsContact C-N 3.25Å; F232-A234 PolarHBondContact O-N 3.32Å; A234-D237 CarbonylContact C-O 3.16Å; A234-D237 WeakPolarHBondContact CA-O 3.42Å; A234-A239 HydrophobicContact CB-CB 3.63Å
235A84.9Confident86.6Confident27 Ų2753.6 Ų53.622%0.22330%0.301CS..Hα-helixtrans-91.6-19.1176.400000113.6Y173 V174 L177 A231 F232 Y233Y173-A235 HydrophobicContact CE1-CB 4.16Å; V174-A235 HydrophobicContact CG2-CB 3.96Å; L177-A235 HydrophobicContact CD2-CB 3.48Å; L177-A235 VanDerWaalsContact CD2-CB 3.48Å; A231-A235 PolarHBondContact O-N 3.04Å; F232-A235 WeakPolarHBondContact O-CB 3.33Å; F232-A235 PolarHBondContact O-N 3.3Å; Y233-A235 PolarHBondContact O-N 3.48Å; Y233-A235 VanDerWaalsContact O-N 3.11Å
236V85.1Confident86.2Confident132 Ų13257.7 Ų57.780%0.832%0.318SS*.Hα-helixtrans-102.3-30.9-179.1-176.60000111.2F232 Y233F232-V236 PolarHBondContact O-N 2.98Å; Y233-V236 PolarHBondContact O-N 3.38Å
237D84.3Confident85.9Confident79 Ų7956.8 Ų56.842%0.42231%0.309SS..SBendtrans-147.4170-174.8-164.79.7000110.6Y233 A234 A239Y233-D237 HydrophobicContact CD2-CB 4.44Å; Y233-D237 HydrophobicContact CE2-CB 3.79Å; Y233-D237 PolarHBondContact O-N 3.26Å; Y233-D237 VanDerWaalsContact O-O 3.13Å; Y233-D237 PolarHBondContact OH-OD2 3.08Å; A234-D237 CarbonylContact C-O 3.16Å; A234-D237 WeakPolarHBondContact CA-O 3.42Å; D237-A239 PolarHBondContact O-N 2.64Å; D237-A239 VanDerWaalsContact O-N 3.13Å
238N80.3Confident85.9Confident72 Ų7255.1 Ų55.139%0.38530%0.302SS..  trans-72.6107.8-177.1-175.4-0.8000111.7T240 L241N238-T240 VanDerWaalsContact CG-OG1 3.25Å; N238-T240 PolarHBondContact ND2-OG1 3.18Å; N238-T240 PolarHBondContact O-N 3.1Å; N238-T240 WeakPolarHBondContact OD1-CB 3.42Å; N238-T240 WeakPolarHBondContact OD1-CG2 3.23Å; N238-T240 PolarHBondContact OD1-N 3.06Å; N238-T240 PolarHBondContact OD1-OG1 2.99Å; N238-L241 HydrophobicContact CB-CD1 4.31Å; N238-L241 HydrophobicContact CB-CG 4.28Å; N238-L241 WeakPolarHBondContact O-CB 3.24Å; N238-L241 WeakPolarHBondContact O-CG 3.1Å; N238-L241 PolarHBondContact O-N 2.9Å
239A80.3Confident85.9Confident1 Ų158.9 Ų58.91%0.00832%0.32CS..G310 helixtrans-58-21.817800000114.4Y166 A234 D237 L241 V242 R247Y166-A239 HydrophobicContact CD2-CB 3.72Å; Y166-A239 HydrophobicContact CE2-CB 4.11Å; A234-A239 HydrophobicContact CB-CB 3.63Å; D237-A239 PolarHBondContact O-N 2.64Å; D237-A239 VanDerWaalsContact O-N 3.13Å; A239-L241 PolarHBondContact O-N 3.38Å; A239-V242 WeakPolarHBondContact O-CB 3.19Å; A239-V242 PolarHBondContact O-N 2.57Å; A239-V242 VanDerWaalsContact O-N 3.1Å; A239-R247 WeakPolarHBondContact O-CD 3.16Å; A239-R247 PolarHBondContact O-NE 3.27Å
240T80.6Confident85.9Confident71 Ų7154.1 Ų54.144%0.43629%0.292SS..G310 helixtrans-69.7-15.3177.972.60000112.9N238 V242N238-T240 VanDerWaalsContact CG-OG1 3.25Å; N238-T240 PolarHBondContact ND2-OG1 3.18Å; N238-T240 PolarHBondContact O-N 3.1Å; N238-T240 WeakPolarHBondContact OD1-CB 3.42Å; N238-T240 WeakPolarHBondContact OD1-CG2 3.23Å; N238-T240 PolarHBondContact OD1-N 3.06Å; N238-T240 PolarHBondContact OD1-OG1 2.99Å; T240-V242 PolarHBondContact O-N 3.45Å
241L80.9Confident86Confident121 Ų12154.2 Ų54.263%0.63429%0.293SS*.G310 helixtrans-67.3-25.6170.7-64.1175.2000112N238 A239N238-L241 HydrophobicContact CB-CD1 4.31Å; N238-L241 HydrophobicContact CB-CG 4.28Å; N238-L241 WeakPolarHBondContact O-CB 3.24Å; N238-L241 WeakPolarHBondContact O-CG 3.1Å; N238-L241 PolarHBondContact O-N 2.9Å; A239-L241 PolarHBondContact O-N 3.38Å
242V83.4Confident86.2Confident33 Ų3354.8 Ų54.820%0.230%0.295CS..SBendtrans-77.9130173.5-176.10000109Y233 A239 T240 L246 R247Y233-V242 HydrophobicContact CD1-CG2 3.78Å; Y233-V242 HydrophobicContact CE1-CG2 3.44Å; Y233-V242 VanDerWaalsContact CE1-CG2 3.44Å; A239-V242 WeakPolarHBondContact O-CB 3.19Å; A239-V242 PolarHBondContact O-N 2.57Å; A239-V242 VanDerWaalsContact O-N 3.1Å; T240-V242 PolarHBondContact O-N 3.45Å; V242-L246 HydrophobicContact CG1-CB 3.67Å; V242-L246 HydrophobicContact CG1-CD1 4.24Å; V242-R247 HydrophobicContact CB-CG 3.98Å; V242-R247 HydrophobicContact CG1-CG 3.83Å; V242-R247 PolarHBondContact O-NE 2.92Å
243S86.8Confident86.5Confident53 Ų5352 Ų5237%0.37128%0.284SS..  trans-53.8141.1-178.977.30000111.2K245 L246 R247S243-K245 PolarHBondContact O-N 3.19Å; S243-K245 VanDerWaalsContact O-N 3.11Å; S243-L246 PolarHBondContact O-N 3.31Å; S243-L246 VanDerWaalsContact OG-CG 3.3Å; S243-L246 WeakPolarHBondContact OG-CG 3.45Å; S243-L246 PolarHBondContact OG-N 2.96Å; S243-R247 PolarHBondContact O-N 2.92Å; S243-R247 VanDerWaalsContact O-N 3.1Å
244P86.4Confident86.7Confident34 Ų3448.7 Ų48.722%0.22127%0.272CS..Hα-helixtrans-52.8-36.4-179.9-27.334000112.9F11 P157 R247 M248F11-P244 HydrophobicContact CD2-CB 4.42Å; F11-P244 HydrophobicContact CE2-CB 3.5Å; F11-P244 HydrophobicContact CZ-CB 3.69Å; P157-P244 HydrophobicContact CB-CB 4.09Å; P244-R247 WeakPolarHBondContact O-CB 3.4Å; P244-R247 PolarHBondContact O-N 3.48Å; P244-M248 WeakPolarHBondContact O-CG 3.47Å; P244-M248 PolarHBondContact O-N 2.94Å
245K86.9Confident87.1Confident90 Ų9049.9 Ų49.939%0.39128%0.277SS..Hα-helixtrans-64-45.6177.3-59.1-170.5-178.5-1590112.8G10 F11 D15 S243 R247 M248 I249G10-K245 WeakPolarHBondContact O-CE 3.42Å; F11-K245 HydrophobicContact CD1-CG 4.44Å; F11-K245 HydrophobicContact CE1-CG 4.18Å; D15-K245 IonicContact OD1-NZ 2.85Å; D15-K245 PolarHBondContact OD1-NZ 2.87Å; D15-K245 VanDerWaalsContact OD2-CE 3.29Å; D15-K245 WeakPolarHBondContact OD2-CE 3.29Å; D15-K245 IonicContact OD2-NZ 2.72Å; D15-K245 PolarHBondContact OD2-NZ 2.99Å; S243-K245 PolarHBondContact O-N 3.19Å; S243-K245 VanDerWaalsContact O-N 3.11Å; K245-R247 VanDerWaalsContact C-N 3.28Å; K245-R247 PolarHBondContact O-N 3.32Å; K245-M248 WeakPolarHBondContact O-CB 3.25Å; K245-M248 PolarHBondContact O-N 2.89Å; K245-M248 VanDerWaalsContact O-N 3.07Å; K245-I249 PolarHBondContact O-N 3.47Å
246L82.9Confident87.6Confident103 Ų10349.4 Ų49.454%0.53927%0.271SS..Hα-helixtrans-64.2-36.8177.2-73.9176.1000111.4V242 S243 M248 I249V242-L246 HydrophobicContact CG1-CB 3.67Å; V242-L246 HydrophobicContact CG1-CD1 4.24Å; S243-L246 PolarHBondContact O-N 3.31Å; S243-L246 VanDerWaalsContact OG-CG 3.3Å; S243-L246 WeakPolarHBondContact OG-CG 3.45Å; S243-L246 PolarHBondContact OG-N 2.96Å; L246-M248 PolarHBondContact O-N 2.9Å; L246-I249 HydrophobicContact CD2-CD1 4.01Å; L246-I249 PolarHBondContact O-N 3.47Å
247R89.1Confident88.2Confident29 Ų2943.1 Ų43.111%0.10923%0.234CC..Hα-helixtrans-63.6-22.6173.8-71.6-169.2-84.2148.6-2.2113.5P157 Y166 L230 A239 V242 S243 P244 K245 P251P157-R247 HydrophobicContact CG-CB 3.96Å; Y166-R247 HydrophobicContact CE2-CG 4.5Å; L230-R247 HydrophobicContact CD1-CG 4.01Å; L230-R247 HydrophobicContact CD2-CB 4.38Å; L230-R247 HydrophobicContact CD2-CG 4.37Å; A239-R247 WeakPolarHBondContact O-CD 3.16Å; A239-R247 PolarHBondContact O-NE 3.27Å; V242-R247 HydrophobicContact CB-CG 3.98Å; V242-R247 HydrophobicContact CG1-CG 3.83Å; V242-R247 PolarHBondContact O-NE 2.92Å; S243-R247 PolarHBondContact O-N 2.92Å; S243-R247 VanDerWaalsContact O-N 3.1Å; P244-R247 WeakPolarHBondContact O-CB 3.4Å; P244-R247 PolarHBondContact O-N 3.48Å; K245-R247 VanDerWaalsContact C-N 3.28Å; K245-R247 PolarHBondContact O-N 3.32Å; R247-P251 WeakPolarHBondContact O-CD 3.46Å; R247-P251 WeakPolarHBondContact O-CG 3.17Å
248M90.8Very high88.8Confident2 Ų239.4 Ų39.41%0.0121%0.214CC..Hα-helixtrans-85.2-28.4174.3-67.3-61-5700113.7F11 L19 E156 L158 P244 K245 L246 A250 P251 I252F11-M248 HydrophobicContact CE1-CG 3.9Å; F11-M248 HydrophobicContact CZ-CG 3.66Å; L19-M248 HydrophobicContact CD1-CG 4.47Å; L19-M248 HydrophobicContact CD2-CB 4.32Å; E156-M248 HydrophobicContact CB-SD 4.36Å; E156-M248 VanDerWaalsContact CD-CE 3.44Å; E156-M248 HydrophobicContact CG-CE 4.27Å; E156-M248 HydrophobicContact CG-SD 3.9Å; E156-M248 VanDerWaalsContact OE2-CE 3.31Å; E156-M248 WeakPolarHBondContact OE2-CE 3.13Å; L158-M248 HydrophobicContact CB-CE 3.84Å; L158-M248 HydrophobicContact CB-CG 4.48Å; L158-M248 HydrophobicContact CB-SD 3.76Å; L158-M248 HydrophobicContact CD2-CE 4.02Å; P244-M248 WeakPolarHBondContact O-CG 3.47Å; P244-M248 PolarHBondContact O-N 2.94Å; K245-M248 WeakPolarHBondContact O-CB 3.25Å; K245-M248 PolarHBondContact O-N 2.89Å; K245-M248 VanDerWaalsContact O-N 3.07Å; L246-M248 PolarHBondContact O-N 2.9Å; M248-A250 PolarHBondContact O-N 2.96Å; M248-P251 VanDerWaalsContact O-CD 3.26Å; M248-P251 WeakPolarHBondContact O-CD 3.27Å; M248-P251 VanDerWaalsContact O-CG 3.3Å; M248-P251 WeakPolarHBondContact O-CG 3.32Å; M248-I252 WeakPolarHBondContact O-CD1 3.34Å; M248-I252 VanDerWaalsContact O-CG1 3.3Å; M248-I252 WeakPolarHBondContact O-CG1 3.3Å; M248-I252 PolarHBondContact O-N 3.3Å
249I90.3Very high89.5Confident85 Ų8536.9 Ų36.944%0.43620%0.201SC..Hα-helixtrans-63.9-43.8-179.2-66.8174.5000111.2K245 L246 I252 L253K245-I249 PolarHBondContact O-N 3.47Å; L246-I249 HydrophobicContact CD2-CD1 4.01Å; L246-I249 PolarHBondContact O-N 3.47Å; I249-I252 PolarHBondContact O-N 3.47Å; I249-L253 HydrophobicContact CG2-CD1 3.92Å; I249-L253 HydrophobicContact CG2-CG 4.27Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 3.4Å
250A91.6Very high90.2Very high6 Ų640.3 Ų40.35%0.0522%0.216CC..Hα-helixtrans-59-50.2-17800000114.1P226 Y227 L230 M248 I252 L253 A254P226-A250 HydrophobicContact CB-CB 4.09Å; Y227-A250 HydrophobicContact CD2-CB 4.49Å; L230-A250 HydrophobicContact CB-CB 4.38Å; L230-A250 HydrophobicContact CD2-CB 3.94Å; M248-A250 PolarHBondContact O-N 2.96Å; A250-I252 VanDerWaalsContact C-N 3.34Å; A250-I252 PolarHBondContact O-N 2.93Å; A250-L253 PolarHBondContact O-N 2.96Å; A250-A254 PolarHBondContact O-N 3.39Å; A250-A254 VanDerWaalsContact O-N 3.1Å
251P90.7Very high90.9Very high17 Ų1737.2 Ų37.211%0.1120%0.196CC..Hα-helixtrans-67.3-30.3176.323.5-32.6000113.3Y227 R247 M248 A254 K255Y227-P251 HydrophobicContact CD2-CB 4.11Å; Y227-P251 HydrophobicContact CE2-CB 4.1Å; R247-P251 WeakPolarHBondContact O-CD 3.46Å; R247-P251 WeakPolarHBondContact O-CG 3.17Å; M248-P251 VanDerWaalsContact O-CD 3.26Å; M248-P251 WeakPolarHBondContact O-CD 3.27Å; M248-P251 VanDerWaalsContact O-CG 3.3Å; M248-P251 WeakPolarHBondContact O-CG 3.32Å; P251-A254 PolarHBondContact O-N 3.46Å; P251-K255 WeakPolarHBondContact O-CB 3.48Å; P251-K255 VanDerWaalsContact O-CG 3.28Å; P251-K255 WeakPolarHBondContact O-CG 3.32Å; P251-K255 PolarHBondContact O-N 2.88Å
252I92.4Very high91.4Very high21 Ų2132 Ų3211%0.10817%0.17CC..Hα-helixtrans-63.5-49.1172.8-69.8166.1000110.4L19 L23 E26 M248 I249 A250 A254 K255 T256L19-I252 HydrophobicContact CD2-CD1 3.18Å; L23-I252 HydrophobicContact CD2-CG1 4.31Å; E26-I252 WeakPolarHBondContact OE1-CG2 3.09Å; M248-I252 WeakPolarHBondContact O-CD1 3.34Å; M248-I252 VanDerWaalsContact O-CG1 3.3Å; M248-I252 WeakPolarHBondContact O-CG1 3.3Å; M248-I252 PolarHBondContact O-N 3.3Å; I249-I252 PolarHBondContact O-N 3.47Å; A250-I252 VanDerWaalsContact C-N 3.34Å; A250-I252 PolarHBondContact O-N 2.93Å; I252-A254 PolarHBondContact O-N 3.1Å; I252-K255 CarbonylContact O-C 3.6Å; I252-K255 WeakPolarHBondContact O-CA 3.33Å; I252-K255 WeakPolarHBondContact O-CB 3.36Å; I252-K255 PolarHBondContact O-N 2.77Å; I252-T256 PolarHBondContact O-N 3.46Å; I252-T256 VanDerWaalsContact O-N 3.08Å
253L94.4Very high91.6Very high39 Ų3934.3 Ų34.320%0.20418%0.181CC..Hα-helixtrans-57.7-39.8176.5-70.1175.2000111.8F222 C223 P226 I249 A250 K255 T256F222-L253 HydrophobicContact CE1-CD2 4.04Å; F222-L253 HydrophobicContact CE2-CD2 4.36Å; F222-L253 HydrophobicContact CZ-CD2 3.71Å; C223-L253 WeakPolarHBondContact CA-O 3.49Å; C223-L253 CarbonylContact O-C 3.54Å; C223-L253 VanDerWaalsContact O-C 3.3Å; P226-L253 HydrophobicContact CB-CD1 4.17Å; P226-L253 HydrophobicContact CG-CD1 3.77Å; I249-L253 HydrophobicContact CG2-CD1 3.92Å; I249-L253 HydrophobicContact CG2-CG 4.27Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 3.4Å; A250-L253 PolarHBondContact O-N 2.96Å; L253-K255 VanDerWaalsContact C-N 3.32Å; L253-K255 PolarHBondContact O-N 2.92Å; L253-T256 PolarHBondContact O-N 3.23Å; L253-T256 PolarHBondContact O-OG1 2.91Å
254A93.8Very high91.8Very high6 Ų633.4 Ų33.45%0.0517%0.171CC..Hα-helixtrans-61.6-41174.100000112.1C223 W224 A250 P251 I252 T256 S257C223-A254 WeakPolarHBondContact O-CA 3.25Å; C223-A254 PolarHBondContact O-N 2.93Å; W224-A254 HydrophobicContact CD2-CB 4.32Å; W224-A254 HydrophobicContact CE3-CB 3.92Å; W224-A254 HydrophobicContact CH2-CB 4.26Å; W224-A254 HydrophobicContact CZ3-CB 3.89Å; A250-A254 PolarHBondContact O-N 3.39Å; A250-A254 VanDerWaalsContact O-N 3.1Å; P251-A254 PolarHBondContact O-N 3.46Å; I252-A254 PolarHBondContact O-N 3.1Å; A254-T256 PolarHBondContact O-N 3.47Å; A254-S257 VanDerWaalsContact O-CB 3.23Å; A254-S257 WeakPolarHBondContact O-CB 3.13Å; A254-S257 PolarHBondContact O-N 2.92Å; A254-S257 VanDerWaalsContact O-N 3.14Å
255K94Very high91.5Very high26 Ų2632.5 Ų32.511%0.11316%0.164CC..Hα-helixtrans-70.8-10.2177.4-71.9173.5-176.5-63.20114.4L23 I65 N68 A69 P251 I252 L253 S257 P258L23-K255 HydrophobicContact CD2-CD 3.48Å; L23-K255 VanDerWaalsContact CD2-CD 3.48Å; I65-K255 HydrophobicContact CG2-CG 4.4Å; N68-K255 PolarHBondContact OD1-NZ 3.31Å; A69-K255 HydrophobicContact CB-CD 4.18Å; P251-K255 WeakPolarHBondContact O-CB 3.48Å; P251-K255 VanDerWaalsContact O-CG 3.28Å; P251-K255 WeakPolarHBondContact O-CG 3.32Å; P251-K255 PolarHBondContact O-N 2.88Å; I252-K255 CarbonylContact O-C 3.6Å; I252-K255 WeakPolarHBondContact O-CA 3.33Å; I252-K255 WeakPolarHBondContact O-CB 3.36Å; I252-K255 PolarHBondContact O-N 2.77Å; L253-K255 VanDerWaalsContact C-N 3.32Å; L253-K255 PolarHBondContact O-N 2.92Å; K255-S257 VanDerWaalsContact C-N 3.34Å; K255-P258 VanDerWaalsContact O-CD 3.25Å; K255-P258 WeakPolarHBondContact O-CD 3.37Å
256T94.9Very high91.2Very high17 Ų1729.4 Ų29.410%0.10416%0.155CC..THydrogen-bonded Turntrans-77.6-16.4168.669.40000113.9E26 I252 L253 A254 P258 T259 F260E26-T256 VanDerWaalsContact CD-CG2 3.47Å; E26-T256 HydrophobicContact CG-CG2 4.1Å; E26-T256 VanDerWaalsContact OE1-CG2 3.23Å; E26-T256 WeakPolarHBondContact OE1-CG2 3.44Å; I252-T256 PolarHBondContact O-N 3.46Å; I252-T256 VanDerWaalsContact O-N 3.08Å; L253-T256 PolarHBondContact O-N 3.23Å; L253-T256 PolarHBondContact O-OG1 2.91Å; A254-T256 PolarHBondContact O-N 3.47Å; T256-P258 VanDerWaalsContact C-CD 3.46Å; T256-T259 WeakPolarHBondContact O-CB 3.38Å; T256-T259 PolarHBondContact O-N 2.79Å; T256-F260 WeakPolarHBondContact O-CD2 3.42Å; T256-F260 PolarHBondContact O-N 3.1Å
257S96.6Very high90.8Very high1 Ų130.6 Ų30.61%0.00716%0.161CC..Hα-helixtrans-52-44.7-177.9-171.10000113.8W224 A254 K255 T259 F260 N261W224-S257 PolarHBondContact NE1-OG 3.47Å; A254-S257 VanDerWaalsContact O-CB 3.23Å; A254-S257 WeakPolarHBondContact O-CB 3.13Å; A254-S257 PolarHBondContact O-N 2.92Å; A254-S257 VanDerWaalsContact O-N 3.14Å; K255-S257 VanDerWaalsContact C-N 3.34Å; S257-T259 PolarHBondContact O-N 3.4Å; S257-T259 VanDerWaalsContact O-N 3.14Å; S257-F260 PolarHBondContact O-N 2.88Å; S257-F260 VanDerWaalsContact O-N 3.14Å; S257-N261 WeakPolarHBondContact O-CB 3.49Å; S257-N261 VanDerWaalsContact O-CG 3.23Å; S257-N261 PolarHBondContact O-N 3.47Å; S257-N261 PolarHBondContact O-ND2 3.27Å
258P97.2Very high90Very high0 Ų029.7 Ų29.70%016%0.161CC..Hα-helixtrans-55-27.5175.1-30.739.7000115.4N34 D62 I65 C66 K255 T256 P262N34-P258 PolarHBondContact ND2-O 3.36Å; D62-P258 HydrophobicContact CB-CB 3.84Å; D62-P258 HydrophobicContact CB-CG 4.21Å; I65-P258 HydrophobicContact CB-CG 3.7Å; I65-P258 HydrophobicContact CD1-CG 4.1Å; I65-P258 HydrophobicContact CG1-CG 4.5Å; I65-P258 HydrophobicContact CG2-CG 3.59Å; C66-P258 VanDerWaalsContact SG-CB 3.52Å; K255-P258 VanDerWaalsContact O-CD 3.25Å; K255-P258 WeakPolarHBondContact O-CD 3.37Å; T256-P258 VanDerWaalsContact C-CD 3.46Å; P258-P262 WeakPolarHBondContact O-CD 3.44Å
259T95.9Very high89.4Confident19 Ų1931 Ų3112%0.11717%0.168CC..Hα-helixtrans-79.4-41.9178.5-620000110.9L29 L33 T256 S257 L263L29-T259 HydrophobicContact CD2-CG2 3.63Å; L29-T259 HydrophobicContact CG-CG2 3.98Å; L33-T259 HydrophobicContact CD1-CG2 3.95Å; T256-T259 WeakPolarHBondContact O-CB 3.38Å; T256-T259 PolarHBondContact O-N 2.79Å; S257-T259 PolarHBondContact O-N 3.4Å; S257-T259 VanDerWaalsContact O-N 3.14Å; T259-L263 WeakPolarHBondContact O-CG 3.32Å
260F95.3Very high88.8Confident74 Ų7432.5 Ų32.533%0.32517%0.173SC..Hα-helixtrans-74.3-33.3-179.1-69.6-68.5000113T219 F222 T256 S257 L263 L264T219-F260 HydrophobicContact CG2-CB 3.46Å; T219-F260 VanDerWaalsContact CG2-CB 3.46Å; T219-F260 HydrophobicContact CG2-CD2 4.28Å; T219-F260 HydrophobicContact CG2-CG 3.88Å; F222-F260 HydrophobicContact CD1-CE2 4.28Å; F222-F260 HydrophobicContact CE1-CE2 4.02Å; F222-F260 HydrophobicContact CE1-CZ 4.32Å; T256-F260 WeakPolarHBondContact O-CD2 3.42Å; T256-F260 PolarHBondContact O-N 3.1Å; S257-F260 PolarHBondContact O-N 2.88Å; S257-F260 VanDerWaalsContact O-N 3.14Å; F260-L263 WeakPolarHBondContact O-CB 3.49Å; F260-L263 PolarHBondContact O-N 3.28Å; F260-L264 WeakPolarHBondContact O-CG 3.37Å; F260-L264 PolarHBondContact O-N 3.19Å
261N95.2Very high88.1Confident5 Ų538.2 Ų38.23%0.02720%0.203CC..Hα-helixtrans-53.9-60.2-177-78.3-14.1000111.9L58 D62 S102 S257 L263 L264 Y265L58-N261 HydrophobicContact CD2-CB 4.33Å; D62-N261 PolarHBondContact OD1-ND2 3.11Å; D62-N261 VanDerWaalsContact OD2-CB 3.25Å; D62-N261 WeakPolarHBondContact OD2-CB 3.37Å; D62-N261 PolarHBondContact OD2-ND2 3.43Å; S102-N261 PolarHBondContact OG-ND2 3Å; S257-N261 WeakPolarHBondContact O-CB 3.49Å; S257-N261 VanDerWaalsContact O-CG 3.23Å; S257-N261 PolarHBondContact O-N 3.47Å; S257-N261 PolarHBondContact O-ND2 3.27Å; N261-L263 PolarHBondContact O-N 3.07Å; N261-L264 WeakPolarHBondContact O-CB 3.5Å; N261-L264 PolarHBondContact O-N 3.48Å; N261-Y265 HydrophobicContact CB-CE2 4.47Å; N261-Y265 WeakPolarHBondContact O-CD2 3.45Å; N261-Y265 PolarHBondContact O-N 3.02Å; N261-Y265 VanDerWaalsContact O-N 3.1Å
262P90.8Very high87.6Confident11 Ų1137.6 Ų37.67%0.07120%0.198CC..Hα-helixtrans-54-37.2177.1-28.436.1000114.2L33 N34 P258 Y265 A266L33-P262 HydrophobicContact CB-CB 4.04Å; L33-P262 HydrophobicContact CB-CG 3.9Å; N34-P262 WeakPolarHBondContact OD1-CG 3.44Å; P258-P262 WeakPolarHBondContact O-CD 3.44Å; P262-Y265 PolarHBondContact O-N 3.22Å; P262-A266 WeakPolarHBondContact O-CB 3.44Å; P262-A266 PolarHBondContact O-N 3.23Å
263L88.8Confident87.2Confident82 Ų8242.7 Ų42.743%0.42922%0.216SC..Hα-helixtrans-65.3-43.1178.1-61.5176.5000111.4T259 F260 N261 Y265 A266 L267T259-L263 WeakPolarHBondContact O-CG 3.32Å; F260-L263 WeakPolarHBondContact O-CB 3.49Å; F260-L263 PolarHBondContact O-N 3.28Å; N261-L263 PolarHBondContact O-N 3.07Å; L263-Y265 VanDerWaalsContact C-N 3.32Å; L263-Y265 PolarHBondContact O-N 3.38Å; L263-A266 PolarHBondContact O-N 3.04Å; L263-L267 WeakPolarHBondContact O-CB 3.35Å; L263-L267 VanDerWaalsContact O-CG 3.23Å; L263-L267 WeakPolarHBondContact O-CG 3.46Å; L263-L267 PolarHBondContact O-N 3.35Å
264L89.8Confident86.6Confident34 Ų3441.7 Ų41.718%0.17822%0.215CC..Hα-helixtrans-62.5-39.1175-67.6176.7000112T215 P216 T219 F260 N261 G268T215-L264 HydrophobicContact CG2-CD2 3.52Å; P216-L264 HydrophobicContact CB-CD1 4.47Å; T219-L264 HydrophobicContact CG2-CD1 3.83Å; F260-L264 WeakPolarHBondContact O-CG 3.37Å; F260-L264 PolarHBondContact O-N 3.19Å; N261-L264 WeakPolarHBondContact O-CB 3.5Å; N261-L264 PolarHBondContact O-N 3.48Å; L264-G268 PolarHBondContact O-N 2.88Å
265Y81.3Confident86.1Confident15 Ų1541.6 Ų41.66%0.05922%0.215CC..Hα-helixtrans-66.8-47.6176.2-74.7-74000112.7V55 L58 I109 N261 P262 L263 G268 N269V55-Y265 HydrophobicContact CB-CD1 4.31Å; V55-Y265 HydrophobicContact CB-CE1 4.43Å; V55-Y265 HydrophobicContact CG1-CD1 3.82Å; V55-Y265 HydrophobicContact CG1-CD2 4.08Å; V55-Y265 HydrophobicContact CG1-CE1 4.25Å; V55-Y265 HydrophobicContact CG1-CG 3.76Å; V55-Y265 HydrophobicContact CG2-CD1 3.51Å; V55-Y265 HydrophobicContact CG2-CE1 3.55Å; V55-Y265 HydrophobicContact CG2-CG 4.31Å; L58-Y265 HydrophobicContact CD2-CD2 4.27Å; L58-Y265 HydrophobicContact CD2-CE2 3.22Å; L58-Y265 VanDerWaalsContact CD2-OH 3.23Å; L58-Y265 WeakPolarHBondContact CD2-OH 3.17Å; I109-Y265 HydrophobicContact CB-CE1 4.14Å; I109-Y265 WeakPolarHBondContact CB-OH 3.34Å; I109-Y265 HydrophobicContact CD1-CE1 3.61Å; I109-Y265 HydrophobicContact CD1-CE2 4.5Å; I109-Y265 VanDerWaalsContact CD1-CZ 3.45Å; I109-Y265 WeakPolarHBondContact CD1-OH 3.15Å; I109-Y265 HydrophobicContact CG1-CE1 4.09Å; I109-Y265 HydrophobicContact CG2-CD1 4.47Å; I109-Y265 HydrophobicContact CG2-CE1 3.32Å; I109-Y265 WeakPolarHBondContact CG2-OH 3.42Å; N261-Y265 HydrophobicContact CB-CE2 4.47Å; N261-Y265 WeakPolarHBondContact O-CD2 3.45Å; N261-Y265 PolarHBondContact O-N 3.02Å; N261-Y265 VanDerWaalsContact O-N 3.1Å; P262-Y265 PolarHBondContact O-N 3.22Å; L263-Y265 VanDerWaalsContact C-N 3.32Å; L263-Y265 PolarHBondContact O-N 3.38Å; Y265-G268 PolarHBondContact O-N 2.9Å; Y265-N269 WeakPolarHBondContact O-CB 3.2Å; Y265-N269 PolarHBondContact O-N 3.37Å
266A79.6Confident85.7Confident25 Ų2541.8 Ų41.821%0.20722%0.217CC..Hα-helixtrans-58.1-51.9176.300000110.3P262 L263 G268 N269 R273P262-A266 WeakPolarHBondContact O-CB 3.44Å; P262-A266 PolarHBondContact O-N 3.23Å; L263-A266 PolarHBondContact O-N 3.04Å; A266-G268 VanDerWaalsContact C-N 3.28Å; A266-G268 PolarHBondContact O-N 3.05Å; A266-N269 PolarHBondContact O-N 3.11Å; A266-R273 HydrophobicContact CB-CG 4.32Å; A266-R273 WeakPolarHBondContact O-CD 3.49Å; A266-R273 WeakPolarHBondContact O-CG 3.43Å
267L74.1Confident85.2Confident128 Ų12846.5 Ų46.567%0.6723%0.233SC*.Hα-helixtrans-63.6-32.3-178.9-67.6172.5000113.2L263L263-L267 WeakPolarHBondContact O-CB 3.35Å; L263-L267 VanDerWaalsContact O-CG 3.23Å; L263-L267 WeakPolarHBondContact O-CG 3.46Å; L263-L267 PolarHBondContact O-N 3.35Å
268G72.6Confident84.8Confident10 Ų1048.8 Ų48.810%0.10324%0.243CC..Hα-helixtrans-96.10.3-175.200000116.4R113 L264 Y265 A266R113-G268 PolarHBondContact NH1-O 3.37Å; L264-G268 PolarHBondContact O-N 2.88Å; Y265-G268 PolarHBondContact O-N 2.9Å; A266-G268 VanDerWaalsContact C-N 3.28Å; A266-G268 PolarHBondContact O-N 3.05Å
269N79Confident84.3Confident29 Ų2951.4 Ų51.416%0.15526%0.257CS..  trans-141.4103.7-178.4-174-18.1000111.8Y265 A266 N271 Y272 R273Y265-N269 WeakPolarHBondContact O-CB 3.2Å; Y265-N269 PolarHBondContact O-N 3.37Å; A266-N269 PolarHBondContact O-N 3.11Å; N269-N271 PolarHBondContact O-N 3.04Å; N269-N271 WeakPolarHBondContact OD1-CB 3.41Å; N269-N271 PolarHBondContact OD1-N 3.32Å; N269-N271 VanDerWaalsContact OD1-N 3.11Å; N269-Y272 VanDerWaalsContact CG-CB 3.43Å; N269-Y272 WeakPolarHBondContact O-CB 3.44Å; N269-Y272 PolarHBondContact O-N 2.89Å; N269-Y272 PolarHBondContact OD1-N 2.73Å; N269-Y272 VanDerWaalsContact OD1-N 3.09Å; N269-R273 PolarHBondContact O-N 2.71Å
270E77.3Confident84Confident118 Ų11856 Ų5655%0.55128%0.281SS*.Hα-helixtrans-59.9-41.6179.7-67173.5-164.500112.5R210 Y272 R273 G274R210-E270 IonicContact NH1-OE1 2.78Å; E270-Y272 VanDerWaalsContact C-N 3.29Å; E270-Y272 PolarHBondContact O-N 2.97Å; E270-R273 PolarHBondContact O-N 2.9Å; E270-G274 PolarHBondContact O-N 3.27Å
271N77Confident83.6Confident125 Ų12555.4 Ų55.467%0.66828%0.283SS*.Hα-helixtrans-63.9-39.6177.9-67.5-23.6000111.2L47 N269 G274 G275L47-N271 WeakPolarHBondContact CD2-O 3.04Å; N269-N271 PolarHBondContact O-N 3.04Å; N269-N271 WeakPolarHBondContact OD1-CB 3.41Å; N269-N271 PolarHBondContact OD1-N 3.32Å; N269-N271 VanDerWaalsContact OD1-N 3.11Å; N271-G274 PolarHBondContact O-N 3.46Å; N271-G275 PolarHBondContact O-N 3.44Å
272Y79.5Confident83.1Confident5 Ų558.2 Ų58.22%0.0231%0.313CS..Hα-helixtrans-66-44.5178.4-170.8-103.7000111.7T37 L47 V55 N269 E270 G274 G275 I276T37-Y272 WeakPolarHBondContact CA-OH 3.32Å; T37-Y272 WeakPolarHBondContact CB-OH 3.45Å; T37-Y272 WeakPolarHBondContact CG2-OH 3.43Å; T37-Y272 PolarHBondContact OG1-OH 3.42Å; L47-Y272 HydrophobicContact CD2-CD2 4.38Å; V55-Y272 HydrophobicContact CG1-CE2 4.31Å; N269-Y272 VanDerWaalsContact CG-CB 3.43Å; N269-Y272 WeakPolarHBondContact O-CB 3.44Å; N269-Y272 PolarHBondContact O-N 2.89Å; N269-Y272 PolarHBondContact OD1-N 2.73Å; N269-Y272 VanDerWaalsContact OD1-N 3.09Å; E270-Y272 VanDerWaalsContact C-N 3.29Å; E270-Y272 PolarHBondContact O-N 2.97Å; Y272-G274 VanDerWaalsContact C-N 3.32Å; Y272-G274 PolarHBondContact O-N 3.46Å; Y272-G275 PolarHBondContact O-N 3.11Å; Y272-I276 HydrophobicContact CD1-CD1 3.85Å; Y272-I276 HydrophobicContact CE1-CD1 3.28Å; Y272-I276 HydrophobicContact CE1-CG1 4.15Å; Y272-I276 PolarHBondContact O-N 3.21Å
273R84.3Confident82.7Confident127 Ų12763.7 Ų63.748%0.47934%0.337SS..Hα-helixtrans-57.2-44.9170.8-77.6170.847.7-176.8-4.8112.5A266 N269 E270 G275 I276 W277A266-R273 HydrophobicContact CB-CG 4.32Å; A266-R273 WeakPolarHBondContact O-CD 3.49Å; A266-R273 WeakPolarHBondContact O-CG 3.43Å; N269-R273 PolarHBondContact O-N 2.71Å; E270-R273 PolarHBondContact O-N 2.9Å; R273-G275 VanDerWaalsContact C-N 3.32Å; R273-G275 PolarHBondContact O-N 3.06Å; R273-I276 PolarHBondContact O-N 3.25Å; R273-W277 WeakPolarHBondContact O-CB 3.3Å; R273-W277 PolarHBondContact O-N 3.41Å
274G82.4Confident82.2Confident18 Ų1866.2 Ų66.219%0.18635%0.345CS..Hα-helixtrans-57.6-44.217700000112.6E270 N271 Y272 W277 Q278E270-G274 PolarHBondContact O-N 3.27Å; N271-G274 PolarHBondContact O-N 3.46Å; Y272-G274 VanDerWaalsContact C-N 3.32Å; Y272-G274 PolarHBondContact O-N 3.46Å; G274-W277 PolarHBondContact O-N 3.11Å; G274-Q278 WeakPolarHBondContact O-CB 3.45Å; G274-Q278 PolarHBondContact O-N 3.34Å
275G82.4Confident81.4Confident4 Ų468.4 Ų68.44%0.04136%0.356CS..Hα-helixtrans-70.9-38177.600000113.8N271 Y272 R273 W277 Q278 L279N271-G275 PolarHBondContact O-N 3.44Å; Y272-G275 PolarHBondContact O-N 3.11Å; R273-G275 VanDerWaalsContact C-N 3.32Å; R273-G275 PolarHBondContact O-N 3.06Å; G275-W277 VanDerWaalsContact C-N 3.33Å; G275-Q278 PolarHBondContact O-N 3.1Å; G275-L279 PolarHBondContact O-N 3.33Å
276I85.2Confident80.4Confident31 Ų3171.8 Ų71.816%0.15939%0.387CS..Hα-helixtrans-61.5-44.6172.1-72178.5000110.4V36 A40 Y272 R273 Q278 L279 L280V36-I276 HydrophobicContact CG1-CG2 4.27Å; A40-I276 HydrophobicContact CB-CG1 4.17Å; Y272-I276 HydrophobicContact CD1-CD1 3.85Å; Y272-I276 HydrophobicContact CE1-CD1 3.28Å; Y272-I276 HydrophobicContact CE1-CG1 4.15Å; Y272-I276 PolarHBondContact O-N 3.21Å; R273-I276 PolarHBondContact O-N 3.25Å; I276-Q278 PolarHBondContact O-N 3.05Å; I276-L279 WeakPolarHBondContact O-CB 3.4Å; I276-L279 PolarHBondContact O-N 3.46Å; I276-L280 HydrophobicContact CG2-CD1 3.76Å; I276-L280 HydrophobicContact CG2-CG 4.27Å; I276-L280 WeakPolarHBondContact O-CG 3.33Å; I276-L280 PolarHBondContact O-N 3.48Å
277W86.1Confident79.4Confident116 Ų11676.5 Ų76.544%0.43941%0.413SS..Hα-helixtrans-58.2-49.6176.1-178.7-97.2000111.1R273 G274 G275 L279 L280 T281 I285R273-W277 WeakPolarHBondContact O-CB 3.3Å; R273-W277 PolarHBondContact O-N 3.41Å; G274-W277 PolarHBondContact O-N 3.11Å; G275-W277 VanDerWaalsContact C-N 3.33Å; W277-L279 PolarHBondContact O-N 2.91Å; W277-L280 PolarHBondContact O-N 3.1Å; W277-T281 HydrophobicContact CD2-CG2 3.82Å; W277-T281 HydrophobicContact CE3-CG2 3.98Å; W277-T281 HydrophobicContact CG-CG2 4.48Å; W277-T281 HydrophobicContact CH2-CG2 3.9Å; W277-T281 HydrophobicContact CZ2-CG2 3.73Å; W277-T281 HydrophobicContact CZ3-CG2 4.02Å; W277-T281 PolarHBondContact NE1-OG1 2.98Å; W277-T281 PolarHBondContact O-N 3.29Å; W277-T281 PolarHBondContact O-OG1 3Å; W277-I285 HydrophobicContact CB-CD1 3.78Å; W277-I285 HydrophobicContact CB-CG1 3.68Å; W277-I285 VanDerWaalsContact CD1-CG1 3.42Å; W277-I285 HydrophobicContact CD2-CG1 4.39Å; W277-I285 HydrophobicContact CG-CD1 4.05Å; W277-I285 HydrophobicContact CG-CG1 3.54Å
278Q87.1Confident78Confident49 Ų4975.6 Ų75.623%0.22942%0.415CS..Hα-helixtrans-57.4-37176.3-175-176.2-8.800113G274 G275 I276 G282 E283 K284G274-Q278 WeakPolarHBondContact O-CB 3.45Å; G274-Q278 PolarHBondContact O-N 3.34Å; G275-Q278 PolarHBondContact O-N 3.1Å; I276-Q278 PolarHBondContact O-N 3.05Å; Q278-G282 WeakPolarHBondContact O-CA 3.31Å; Q278-G282 PolarHBondContact O-N 3.43Å; Q278-E283 WeakPolarHBondContact CA-O 3.29Å; Q278-E283 PolarHBondContact N-O 3.04Å; Q278-K284 HydrophobicContact CG-CG 4.41Å
279L87.8Confident76.4Confident54 Ų5483.5 Ų83.528%0.28345%0.449SS..Hα-helixtrans-65.5-45.9174.4178.271000111.9V36 V39 A40 K43 V44 G275 I276 W277V36-L279 HydrophobicContact CG1-CD2 4.48Å; V39-L279 HydrophobicContact CB-CD2 4.3Å; V39-L279 HydrophobicContact CG1-CD1 3.99Å; V39-L279 HydrophobicContact CG1-CD2 3.89Å; A40-L279 HydrophobicContact CB-CD2 3.87Å; K43-L279 HydrophobicContact CB-CD1 4.07Å; K43-L279 HydrophobicContact CG-CD1 4.49Å; V44-L279 HydrophobicContact CG2-CB 4.2Å; G275-L279 PolarHBondContact O-N 3.33Å; I276-L279 WeakPolarHBondContact O-CB 3.4Å; I276-L279 PolarHBondContact O-N 3.46Å; W277-L279 PolarHBondContact O-N 2.91Å
280L87.6Confident75Confident117 Ų11789.1 Ų89.161%0.61348%0.478SS*.Hα-helixtrans-78.3-33.4-172.1-66.9176.6000113.2I276 W277I276-L280 HydrophobicContact CG2-CD1 3.76Å; I276-L280 HydrophobicContact CG2-CG 4.27Å; I276-L280 WeakPolarHBondContact O-CG 3.33Å; I276-L280 PolarHBondContact O-N 3.48Å; W277-L280 PolarHBondContact O-N 3.1Å
281T88.4Confident73.3Confident61 Ų6188.4 Ų88.437%0.37448%0.478SS..Hα-helixtrans-112.7-16.8-173.267.50000113.5W277 E283W277-T281 HydrophobicContact CD2-CG2 3.82Å; W277-T281 HydrophobicContact CE3-CG2 3.98Å; W277-T281 HydrophobicContact CG-CG2 4.48Å; W277-T281 HydrophobicContact CH2-CG2 3.9Å; W277-T281 HydrophobicContact CZ2-CG2 3.73Å; W277-T281 HydrophobicContact CZ3-CG2 4.02Å; W277-T281 PolarHBondContact NE1-OG1 2.98Å; W277-T281 PolarHBondContact O-N 3.29Å; W277-T281 PolarHBondContact O-OG1 3Å; T281-E283 PolarHBondContact O-N 2.93Å; T281-E283 PolarHBondContact OG1-N 3.06Å; T281-E283 VanDerWaalsContact OG1-N 3.16Å
282G83.8Confident71.8Confident63 Ų6390.2 Ų90.265%0.64949%0.487SS*.SBendtrans77-5.4-170.100000114Q278Q278-G282 WeakPolarHBondContact O-CA 3.31Å; Q278-G282 PolarHBondContact O-N 3.43Å
283E82.1Confident70.2Confident127 Ų12797.9 Ų97.959%0.59352%0.521SS*.PPolyproline II helixtrans-101.7147.7-176.8-61.2-173.216100111.8Q278 T281Q278-E283 WeakPolarHBondContact CA-O 3.29Å; Q278-E283 PolarHBondContact N-O 3.04Å; T281-E283 PolarHBondContact O-N 2.93Å; T281-E283 PolarHBondContact OG1-N 3.06Å; T281-E283 VanDerWaalsContact OG1-N 3.16Å
284K79.4Confident68.2Low135 Ų13597 Ų9759%0.58753%0.534SS*.PPolyproline II helixtrans-83.6137.2168.7-68.9-172.4172.8-170.30109.1E46 Q278 A286E46-K284 IonicContact OE1-NZ 3.18Å; E46-K284 PolarHBondContact OE1-NZ 2.93Å; Q278-K284 HydrophobicContact CG-CG 4.41Å; K284-A286 PolarHBondContact O-N 3.13Å; K284-A286 VanDerWaalsContact O-N 3.08Å
285I73.1Confident66.2Low79 Ų79109.6 Ų109.641%0.40558%0.584SS.*PPolyproline II helixtrans-58.7118.5172-60.5-176.2000107.8W277 V287W277-I285 HydrophobicContact CB-CD1 3.78Å; W277-I285 HydrophobicContact CB-CG1 3.68Å; W277-I285 VanDerWaalsContact CD1-CG1 3.42Å; W277-I285 HydrophobicContact CD2-CG1 4.39Å; W277-I285 HydrophobicContact CG-CD1 4.05Å; W277-I285 HydrophobicContact CG-CG1 3.54Å; I285-V287 PolarHBondContact O-N 2.84Å; I285-V287 VanDerWaalsContact O-N 3.1Å
286A60.3Low65.3Low87 Ų87114.9 Ų114.972%0.71961%0.611SS**  trans-61.4114.4175.800000108.9K284 P288K284-A286 PolarHBondContact O-N 3.13Å; K284-A286 VanDerWaalsContact O-N 3.08Å; A286-P288 WeakPolarHBondContact O-CD 3.01Å
287V58.6Low64.3Low124 Ų124119.3 Ų119.375%0.75264%0.635SS**  trans-73120.5166-178.10000105.6I285 Q289I285-V287 PolarHBondContact O-N 2.84Å; I285-V287 VanDerWaalsContact O-N 3.1Å; V287-Q289 PolarHBondContact O-N 3.27Å
288P44.8Very low63.1Low109 Ų109119.5 Ų119.571%0.70865%0.645SS**  trans-54.4120.4174.8-20.930.9000108.2A286 I290A286-P288 WeakPolarHBondContact O-CD 3.01Å; P288-I290 PolarHBondContact O-N 2.79Å
289Q38.7Very low61.7Low176 Ų176123.6 Ų123.682%0.82267%0.67SS**  trans-65105.2168.8-67.7-126.2-18.600106.2V287 D291V287-Q289 PolarHBondContact O-N 3.27Å; Q289-D291 PolarHBondContact O-N 2.61Å
290I48.6Very low60.1Low147 Ų147128 Ų12875%0.75469%0.694SS**  trans-6995.9163-58.6175.2000104P288 N292P288-I290 PolarHBondContact O-N 2.79Å; I290-N292 VanDerWaalsContact C-N 3.33Å; I290-N292 PolarHBondContact O-N 2.72Å
291D42.4Very low58.2Low103 Ų103128.7 Ų128.755%0.55170%0.7SS**  trans-53.7102.8166.8-105.44.7000106.3Q289 K293Q289-D291 PolarHBondContact O-N 2.61Å; D291-K293 HydrophobicContact CB-CB 4.45Å; D291-K293 HydrophobicContact CB-CG 4.47Å; D291-K293 PolarHBondContact O-N 2.85Å; D291-K293 IonicContact OD2-NZ 3.24Å
292N44.7Very low56.1Low163 Ų163133.6 Ų133.687%0.87272%0.723SS**  trans-68.173.2161.9-93-12.2000107.2I290I290-N292 VanDerWaalsContact C-N 3.33Å; I290-N292 PolarHBondContact O-N 2.72Å
293K46.2Very low53.9Low165 Ų165139 Ų13972%0.71773%0.728SS**  trans-119.582.4171.8-83.2-174.2-180161.30109.9D291D291-K293 HydrophobicContact CB-CB 4.45Å; D291-K293 HydrophobicContact CB-CG 4.47Å; D291-K293 PolarHBondContact O-N 2.85Å; D291-K293 IonicContact OD2-NZ 3.24Å
294S43.3Very low51.6Low108 Ų108140 Ų14076%0.75574%0.74SS**  trans166.8100.8141.152.90000106.2
295K39Very low49Very low284 Ų284140.5 Ų140.5100%1.23575%0.754SS**  45.4091.6-82.3-166.4178.4-176.70112.8

Retrieved 295 of 295 residues in 218.7 ms (Link to these results)

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