A0A096M2K0_POEFO Loading...

CLN8 transmembrane ER and ERGIC protein

AlphaFold DB , UniProt , Accession A0A096M2K0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 288 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
1M42.9Very low49.9Very low232 Ų232140.1 Ų140.1100%1.14377%0.774SS**  0119.10-71.5-177.2168.300106.9
2P38.7Very low52.4Low128 Ų128140.3 Ų140.383%0.83177%0.765SS**  trans-74.4128.5176.318.9-8.3000108.7E4P2-E4 PolarHBondContact O-N 3.22Å
3T43.1Very low54.8Low137 Ų137131.1 Ų131.184%0.8472%0.716SS**  trans-65.3110.9175.7-36.90000108.3Q5T3-Q5 PolarHBondContact O-N 2.83Å
4E44.7Very low57.1Low180 Ų180125.1 Ų125.184%0.84169%0.688SS**  trans-58.2108.2167.9-79.8178.7151.500108.4P2 Q6P2-E4 PolarHBondContact O-N 3.22Å; E4-Q6 VanDerWaalsContact C-N 3.29Å; E4-Q6 PolarHBondContact O-N 2.97Å
5Q42.3Very low58.9Low180 Ų180124.2 Ų124.284%0.84169%0.691SS**  trans-64.298.3158.9-87.2174.9-42.800106.5T3 T7T3-Q5 PolarHBondContact O-N 2.83Å; Q5-T7 PolarHBondContact O-N 3.01Å
6Q40.8Very low60.6Low179 Ų179124.7 Ų124.784%0.83669%0.686SS**  trans-58.492.9156.8-98.4177.9-18.700106.9E4 T8E4-Q6 VanDerWaalsContact C-N 3.29Å; E4-Q6 PolarHBondContact O-N 2.97Å; Q6-T8 PolarHBondContact O-N 3.43Å
7T44.3Very low62Low128 Ų128117.5 Ų117.579%0.78565%0.647SS**  trans-61.295155.925.10000105.8Q5 S9Q5-T7 PolarHBondContact O-N 3.01Å; T7-S9 VanDerWaalsContact C-N 3.29Å; T7-S9 PolarHBondContact O-N 3.4Å
8T48.2Very low63.5Low132 Ų132115.2 Ų115.281%0.8163%0.63SS**  trans-55.799.8167.21.40000106.7Q6 L10Q6-T8 PolarHBondContact O-N 3.43Å; T8-L10 PolarHBondContact O-N 3.35Å; T8-L10 VanDerWaalsContact O-N 3.17Å
9S63.1Low65.1Low110 Ų110111.7 Ų111.777%0.76962%0.615SS**PPolyproline II helixtrans-59.5120.417553.80000107T7T7-S9 VanDerWaalsContact C-N 3.29Å; T7-S9 PolarHBondContact O-N 3.4Å
10L66.8Low66.6Low52 Ų52112.6 Ų112.627%0.27261%0.608SS.*PPolyproline II helixtrans-57.3148.3177.6-77.9172.7000110.6T8 Q12 A89 K92T8-L10 PolarHBondContact O-N 3.35Å; T8-L10 VanDerWaalsContact O-N 3.17Å; L10-Q12 PolarHBondContact O-N 2.95Å; L10-Q12 VanDerWaalsContact O-N 3.14Å; L10-A89 HydrophobicContact CD1-CB 4.26Å; L10-K92 HydrophobicContact CD1-CD 3.45Å; L10-K92 VanDerWaalsContact CD1-CD 3.45Å; L10-K92 HydrophobicContact CD1-CG 4.22Å
11P74.6Confident68Low83 Ų83113.3 Ų113.354%0.53961%0.612SS.*PPolyproline II helixtrans-53.5122.4176.3-21.532000110.1
12Q79.3Confident70.4Confident143 Ų143105.7 Ų105.767%0.66857%0.571SS**PPolyproline II helixtrans-87.3151167-68.9-62.2-55.800108.6L10 S14L10-Q12 PolarHBondContact O-N 2.95Å; L10-Q12 VanDerWaalsContact O-N 3.14Å; Q12-S14 PolarHBondContact O-N 3.31Å
13P83.3Confident73.2Confident20 Ų2099.7 Ų99.713%0.1353%0.532CS..PPolyproline II helixtrans-62136174.825.6-32000110.4F18 Q98 D100P13-F18 HydrophobicContact CB-CE2 4.05Å; P13-F18 HydrophobicContact CB-CZ 4.22Å; P13-F18 HydrophobicContact CG-CE2 3.89Å; P13-F18 HydrophobicContact CG-CZ 3.76Å; P13-Q98 HydrophobicContact CG-CB 4.16Å; P13-D100 VanDerWaalsContact CA-OD1 3.3Å; P13-D100 WeakPolarHBondContact CA-OD1 3.35Å
14S86.9Confident75.8Confident47 Ų4797.5 Ų97.533%0.32951%0.514SS..PPolyproline II helixtrans-58.6140.7175.7-690000110.3Q12 E16 C17 D100Q12-S14 PolarHBondContact O-N 3.31Å; S14-E16 PolarHBondContact O-N 3.07Å; S14-C17 VanDerWaalsContact O-CB 3.31Å; S14-C17 WeakPolarHBondContact O-CB 3.48Å; S14-C17 PolarHBondContact O-N 3.05Å; S14-D100 WeakPolarHBondContact CB-OD1 3.35Å; S14-D100 WeakPolarHBondContact CB-OD2 3.19Å; S14-D100 PolarHBondContact N-OD1 3.01Å; S14-D100 PolarHBondContact OG-OD2 2.94Å
15P84.6Confident78.3Confident112 Ų11294.5 Ų94.573%0.72750%0.5SS*.G310 helixtrans-55.6-29.5-179.6-26.334.1000113.8C17 F18P15-C17 PolarHBondContact O-N 2.66Å; P15-F18 WeakPolarHBondContact O-CB 3.31Å; P15-F18 PolarHBondContact O-N 2.72Å
16E86.4Confident80.9Confident132 Ų13287 Ų8762%0.61747%0.466SS*.G310 helixtrans-60.3-31.9177.9-62.5-178178.900112.9S14 F18 S19 Y22S14-E16 PolarHBondContact O-N 3.07Å; E16-F18 PolarHBondContact O-N 3.06Å; E16-F18 VanDerWaalsContact O-N 3.07Å; E16-S19 WeakPolarHBondContact O-CB 3.44Å; E16-S19 PolarHBondContact O-N 3.14Å; E16-Y22 WeakPolarHBondContact O-CB 3.48Å; E16-Y22 WeakPolarHBondContact O-CD1 3.37Å
17C84.6Confident83.7Confident3 Ų379.6 Ų79.62%0.0243%0.432CS..G310 helixtrans-60.7-19.2175.8-69.60000112.7S14 P15 R23 D100 W103S14-C17 VanDerWaalsContact O-CB 3.31Å; S14-C17 WeakPolarHBondContact O-CB 3.48Å; S14-C17 PolarHBondContact O-N 3.05Å; P15-C17 PolarHBondContact O-N 2.66Å; C17-R23 PolarHBondContact O-NE 3.26Å; C17-D100 PolarHBondContact SG-OD1 3.44Å; C17-W103 HydrophobicContact CB-CB 4.27Å; C17-W103 HydrophobicContact CB-CD2 3.94Å; C17-W103 HydrophobicContact CB-CG 3.71Å
18F88.2Confident86.2Confident76 Ų7677.1 Ų77.133%0.33342%0.42SS..G310 helixtrans-91.8-9.2176.9-56.9-86.4000114.1P13 P15 E16 W103 D152P13-F18 HydrophobicContact CB-CE2 4.05Å; P13-F18 HydrophobicContact CB-CZ 4.22Å; P13-F18 HydrophobicContact CG-CE2 3.89Å; P13-F18 HydrophobicContact CG-CZ 3.76Å; P15-F18 WeakPolarHBondContact O-CB 3.31Å; P15-F18 PolarHBondContact O-N 2.72Å; E16-F18 PolarHBondContact O-N 3.06Å; E16-F18 VanDerWaalsContact O-N 3.07Å; F18-W103 HydrophobicContact CD1-CZ2 4.4Å; F18-W103 HydrophobicContact CE1-CZ2 4.07Å; F18-D152 HydrophobicContact CD1-CB 4.05Å; F18-D152 HydrophobicContact CE1-CB 4.12Å
19S93.9Very high88.6Confident49 Ų4975.8 Ų75.834%0.34341%0.407SS..  trans-76131.5175.11780000111.6E16 D21 Y22 R23E16-S19 WeakPolarHBondContact O-CB 3.44Å; E16-S19 PolarHBondContact O-N 3.14Å; S19-D21 VanDerWaalsContact C-N 3.3Å; S19-D21 PolarHBondContact O-N 3.35Å; S19-D21 PolarHBondContact OG-N 2.87Å; S19-Y22 PolarHBondContact O-N 3.47Å; S19-R23 WeakPolarHBondContact O-CG 3.26Å; S19-R23 PolarHBondContact O-N 2.87Å
20W95.4Very high90.3Very high128 Ų12870.7 Ų70.749%0.48537%0.372SS..Hα-helixtrans-62.9-35.9175-85.5108.8000112.9Y22 R23 L24 V149 V150W20-Y22 VanDerWaalsContact C-N 3.33Å; W20-Y22 PolarHBondContact O-N 3.17Å; W20-R23 HydrophobicContact CE3-CB 4.46Å; W20-R23 PolarHBondContact O-N 2.81Å; W20-L24 HydrophobicContact CE3-CG 4.45Å; W20-L24 WeakPolarHBondContact O-CB 3.34Å; W20-L24 VanDerWaalsContact O-CG 3.26Å; W20-L24 WeakPolarHBondContact O-CG 3.3Å; W20-L24 PolarHBondContact O-N 2.92Å; W20-V149 HydrophobicContact CH2-CG1 4.28Å; W20-V149 HydrophobicContact CZ3-CG1 4.02Å; W20-V150 HydrophobicContact CH2-CG2 4.02Å
21D95.9Very high91.8Very high129 Ų12971.4 Ų71.469%0.6937%0.373SS*.Hα-helixtrans-62-45.4178.4-65.6-31.3000110.6S19 L24 Q25S19-D21 VanDerWaalsContact C-N 3.3Å; S19-D21 PolarHBondContact O-N 3.35Å; S19-D21 PolarHBondContact OG-N 2.87Å; D21-L24 PolarHBondContact O-N 3.34Å; D21-Q25 VanDerWaalsContact O-CB 3.23Å; D21-Q25 WeakPolarHBondContact O-CB 3.47Å; D21-Q25 PolarHBondContact O-N 3.49Å
22Y93.8Very high93Very high72 Ų7269.1 Ų69.128%0.28237%0.365SS..Hα-helixtrans-64.8-45.4177.3-177.5-104.2000111.9E16 S19 W20 L24 Q25 L26E16-Y22 WeakPolarHBondContact O-CB 3.48Å; E16-Y22 WeakPolarHBondContact O-CD1 3.37Å; S19-Y22 PolarHBondContact O-N 3.47Å; W20-Y22 VanDerWaalsContact C-N 3.33Å; W20-Y22 PolarHBondContact O-N 3.17Å; Y22-L24 PolarHBondContact O-N 2.9Å; Y22-Q25 PolarHBondContact O-N 3.5Å; Y22-L26 HydrophobicContact CD1-CD1 4.11Å; Y22-L26 HydrophobicContact CE1-CD1 3.41Å; Y22-L26 VanDerWaalsContact CE1-CD1 3.41Å; Y22-L26 HydrophobicContact CE1-CG 4.34Å; Y22-L26 HydrophobicContact CE2-CD1 4.14Å; Y22-L26 HydrophobicContact CE2-CG 4.39Å; Y22-L26 VanDerWaalsContact CZ-CD1 3.43Å; Y22-L26 PolarHBondContact O-N 2.75Å
23R96.4Very high93.9Very high2 Ų268 Ų681%0.00836%0.357CS..Hα-helixtrans-58.7-49.7176.9-70.1176.7180174.212.2111.3C17 S19 W20 Q25 L26 I27 W103 L107 V149 D152C17-R23 PolarHBondContact O-NE 3.26Å; S19-R23 WeakPolarHBondContact O-CG 3.26Å; S19-R23 PolarHBondContact O-N 2.87Å; W20-R23 HydrophobicContact CE3-CB 4.46Å; W20-R23 PolarHBondContact O-N 2.81Å; R23-Q25 VanDerWaalsContact C-N 3.35Å; R23-Q25 PolarHBondContact O-N 3.5Å; R23-L26 PolarHBondContact O-N 2.85Å; R23-I27 WeakPolarHBondContact O-CB 3.33Å; R23-I27 WeakPolarHBondContact O-CD1 3.3Å; R23-I27 WeakPolarHBondContact O-CG1 3.43Å; R23-I27 PolarHBondContact O-N 3.29Å; R23-W103 VanDerWaalsContact NH2-CH2 3.31Å; R23-L107 HydrophobicContact CB-CD2 3.76Å; R23-L107 HydrophobicContact CG-CD1 4.25Å; R23-L107 HydrophobicContact CG-CD2 3.86Å; R23-V149 HydrophobicContact CB-CG1 4.45Å; R23-V149 PolarHBondContact NH1-O 2.97Å; R23-D152 IonicContact CZ-OD2 3.83Å; R23-D152 IonicContact NH1-OD2 3.71Å; R23-D152 IonicContact NH2-OD2 2.98Å; R23-D152 PolarHBondContact NH2-OD2 3.39Å
24L97.6Very high94.6Very high90 Ų9067.1 Ų67.147%0.47135%0.352SS..Hα-helixtrans-65.2-38.2179.6-70.9174.2000112.1W20 D21 Y22 I27 S28W20-L24 HydrophobicContact CE3-CG 4.45Å; W20-L24 WeakPolarHBondContact O-CB 3.34Å; W20-L24 VanDerWaalsContact O-CG 3.26Å; W20-L24 WeakPolarHBondContact O-CG 3.3Å; W20-L24 PolarHBondContact O-N 2.92Å; D21-L24 PolarHBondContact O-N 3.34Å; Y22-L24 PolarHBondContact O-N 2.9Å; L24-I27 PolarHBondContact O-N 2.91Å; L24-S28 VanDerWaalsContact O-CB 3.29Å; L24-S28 WeakPolarHBondContact O-CB 3.48Å; L24-S28 PolarHBondContact O-N 2.59Å; L24-S28 PolarHBondContact O-OG 3Å
25Q97.6Very high95.2Very high117 Ų11766.7 Ų66.755%0.54735%0.347SS..Hα-helixtrans-61.1-50.5175.2-175.3179.68.100111D21 Y22 R23 S28 L29D21-Q25 VanDerWaalsContact O-CB 3.23Å; D21-Q25 WeakPolarHBondContact O-CB 3.47Å; D21-Q25 PolarHBondContact O-N 3.49Å; Y22-Q25 PolarHBondContact O-N 3.5Å; R23-Q25 VanDerWaalsContact C-N 3.35Å; R23-Q25 PolarHBondContact O-N 3.5Å; Q25-S28 PolarHBondContact O-N 3.02Å; Q25-L29 HydrophobicContact CG-CD1 4.13Å; Q25-L29 WeakPolarHBondContact O-CB 3.23Å; Q25-L29 VanDerWaalsContact O-CG 3.3Å; Q25-L29 WeakPolarHBondContact O-CG 3.3Å; Q25-L29 PolarHBondContact O-N 2.98Å
26L97.4Very high95.8Very high22 Ų2263.9 Ų63.912%0.11533%0.333CS..Hα-helixtrans-66-38.3178.8-78.7-178.3000113.1Y22 R23 S28 L29 G30 F104 L107Y22-L26 HydrophobicContact CD1-CD1 4.11Å; Y22-L26 HydrophobicContact CE1-CD1 3.41Å; Y22-L26 VanDerWaalsContact CE1-CD1 3.41Å; Y22-L26 HydrophobicContact CE1-CG 4.34Å; Y22-L26 HydrophobicContact CE2-CD1 4.14Å; Y22-L26 HydrophobicContact CE2-CG 4.39Å; Y22-L26 VanDerWaalsContact CZ-CD1 3.43Å; Y22-L26 PolarHBondContact O-N 2.75Å; R23-L26 PolarHBondContact O-N 2.85Å; L26-S28 VanDerWaalsContact C-N 3.32Å; L26-S28 PolarHBondContact O-N 2.99Å; L26-L29 HydrophobicContact CD2-CD1 4.31Å; L26-L29 PolarHBondContact O-N 2.61Å; L26-G30 PolarHBondContact O-N 2.73Å; L26-F104 HydrophobicContact CD2-CD2 4.49Å; L26-L107 HydrophobicContact CB-CB 3.94Å; L26-L107 HydrophobicContact CB-CD1 4.08Å; L26-L107 HydrophobicContact CD1-CB 4.46Å; L26-L107 HydrophobicContact CD1-CD1 3.61Å; L26-L107 HydrophobicContact CG-CD1 4.49Å
27I98.5Very high96.4Very high25 Ų2559.1 Ų59.113%0.12831%0.313CS..Hα-helixtrans-60.2-45.6173.4-71.9163.9000110.3R23 L24 G30 F31 L107 T110 G111 V149R23-I27 WeakPolarHBondContact O-CB 3.33Å; R23-I27 WeakPolarHBondContact O-CD1 3.3Å; R23-I27 WeakPolarHBondContact O-CG1 3.43Å; R23-I27 PolarHBondContact O-N 3.29Å; L24-I27 PolarHBondContact O-N 2.91Å; I27-G30 PolarHBondContact O-N 3.25Å; I27-F31 PolarHBondContact O-N 3.39Å; I27-L107 HydrophobicContact CD1-CD2 3.9Å; I27-L107 HydrophobicContact CG1-CB 4.29Å; I27-L107 HydrophobicContact CG1-CD2 3.92Å; I27-T110 HydrophobicContact CD1-CG2 4.1Å; I27-T110 HydrophobicContact CG1-CG2 4.19Å; I27-T110 HydrophobicContact CG2-CG2 4.46Å; I27-G111 WeakPolarHBondContact O-CA 3.43Å; I27-V149 HydrophobicContact CD1-CG1 4.05Å; I27-V149 HydrophobicContact CD1-CG2 4.41Å
28S98.5Very high97.1Very high76 Ų7660.7 Ų60.753%0.53132%0.32SS..Hα-helixtrans-64.8-40.1178.8-58.30000111.8L24 Q25 L26 F31 G32L24-S28 VanDerWaalsContact O-CB 3.29Å; L24-S28 WeakPolarHBondContact O-CB 3.48Å; L24-S28 PolarHBondContact O-N 2.59Å; L24-S28 PolarHBondContact O-OG 3Å; Q25-S28 PolarHBondContact O-N 3.02Å; L26-S28 VanDerWaalsContact C-N 3.32Å; L26-S28 PolarHBondContact O-N 2.99Å; S28-F31 PolarHBondContact O-N 2.99Å; S28-G32 PolarHBondContact O-N 3.31Å
29L98.4Very high97.6Very high104 Ų10461.4 Ų61.455%0.54533%0.327SS..Hα-helixtrans-65.1-41.8174-72.7171.6000111.7Q25 L26 G32 F33Q25-L29 HydrophobicContact CG-CD1 4.13Å; Q25-L29 WeakPolarHBondContact O-CB 3.23Å; Q25-L29 VanDerWaalsContact O-CG 3.3Å; Q25-L29 WeakPolarHBondContact O-CG 3.3Å; Q25-L29 PolarHBondContact O-N 2.98Å; L26-L29 HydrophobicContact CD2-CD1 4.31Å; L26-L29 PolarHBondContact O-N 2.61Å; L29-G32 PolarHBondContact O-N 2.87Å; L29-F33 VanDerWaalsContact O-CB 3.27Å; L29-F33 WeakPolarHBondContact O-CB 3.48Å; L29-F33 PolarHBondContact O-N 2.73Å
30G98.3Very high97.8Very high3 Ų363.7 Ų63.73%0.03134%0.335CS..Hα-helixtrans-60.5-46.7174.200000112.1L26 I27 F33 Y34L26-G30 PolarHBondContact O-N 2.73Å; I27-G30 PolarHBondContact O-N 3.25Å; G30-F33 PolarHBondContact O-N 2.91Å; G30-Y34 VanDerWaalsContact O-CD2 3.26Å; G30-Y34 WeakPolarHBondContact O-CD2 3.35Å; G30-Y34 PolarHBondContact O-N 3.28Å; G30-Y34 VanDerWaalsContact O-N 3.13Å
31F98.8Very high97.9Very high67 Ų6758.3 Ų58.329%0.29432%0.316SS..Hα-helixtrans-57.8-49.2173.4179-80.2000111.6I27 S28 F33 Y34 T35 V114 F115 V118I27-F31 PolarHBondContact O-N 3.39Å; S28-F31 PolarHBondContact O-N 2.99Å; F31-F33 PolarHBondContact O-N 2.74Å; F31-Y34 PolarHBondContact O-N 3.35Å; F31-T35 WeakPolarHBondContact CE1-OG1 2.88Å; F31-T35 WeakPolarHBondContact O-CB 3.45Å; F31-T35 PolarHBondContact O-N 3.44Å; F31-T35 PolarHBondContact O-OG1 3.29Å; F31-V114 HydrophobicContact CD2-CB 4.15Å; F31-V114 HydrophobicContact CD2-CG1 3.78Å; F31-V114 HydrophobicContact CE2-CG1 3.98Å; F31-F115 HydrophobicContact CD2-CB 3.64Å; F31-F115 VanDerWaalsContact CE2-CA 3.4Å; F31-F115 HydrophobicContact CE2-CB 3.84Å; F31-F115 HydrophobicContact CG-CB 4.28Å; F31-V118 HydrophobicContact CE2-CG2 4.42Å
32G98.7Very high98Very high35 Ų3555.2 Ų55.236%0.36130%0.298SS..Hα-helixtrans-62.7-41.7-179.800000112.5S28 L29 T35 A36S28-G32 PolarHBondContact O-N 3.31Å; L29-G32 PolarHBondContact O-N 2.87Å; G32-T35 WeakPolarHBondContact O-CB 3.42Å; G32-T35 PolarHBondContact O-N 3.49Å; G32-A36 WeakPolarHBondContact O-CB 3.33Å; G32-A36 PolarHBondContact O-N 2.96Å
33F98.6Very high98.2Very high118 Ų11857 Ų5752%0.51831%0.311SS..Hα-helixtrans-59.7-50.7176.9175.6-98.5000111.6L29 G30 F31 T35 A36 V37L29-F33 VanDerWaalsContact O-CB 3.27Å; L29-F33 WeakPolarHBondContact O-CB 3.48Å; L29-F33 PolarHBondContact O-N 2.73Å; G30-F33 PolarHBondContact O-N 2.91Å; F31-F33 PolarHBondContact O-N 2.74Å; F33-T35 VanDerWaalsContact C-N 3.33Å; F33-T35 PolarHBondContact O-N 3.5Å; F33-A36 WeakPolarHBondContact O-CB 3.48Å; F33-A36 PolarHBondContact O-N 3.45Å; F33-A36 VanDerWaalsContact O-N 3.12Å; F33-V37 HydrophobicContact CD1-CG2 4.34Å; F33-V37 HydrophobicContact CE1-CG2 3.92Å; F33-V37 HydrophobicContact CE2-CG2 4.48Å; F33-V37 HydrophobicContact CZ-CG2 4.01Å; F33-V37 WeakPolarHBondContact O-CG2 3.29Å; F33-V37 PolarHBondContact O-N 2.91Å
34Y98.6Very high98.3Very high3 Ų361.1 Ų61.11%0.01233%0.333CS..Hα-helixtrans-72-27.8-179.9-73.9-69.5000113.3G30 F31 V37 F38 T68 F72 H75 T108 F112G30-Y34 VanDerWaalsContact O-CD2 3.26Å; G30-Y34 WeakPolarHBondContact O-CD2 3.35Å; G30-Y34 PolarHBondContact O-N 3.28Å; G30-Y34 VanDerWaalsContact O-N 3.13Å; F31-Y34 PolarHBondContact O-N 3.35Å; Y34-V37 PolarHBondContact O-N 2.92Å; Y34-F38 WeakPolarHBondContact O-CB 3.25Å; Y34-F38 PolarHBondContact O-N 3.26Å; Y34-T68 HydrophobicContact CD1-CG2 3.81Å; Y34-T68 HydrophobicContact CG-CG2 4.36Å; Y34-T68 WeakPolarHBondContact O-CG2 3.38Å; Y34-F72 HydrophobicContact CD1-CB 4.49Å; Y34-F72 HydrophobicContact CE1-CB 3.77Å; Y34-F72 HydrophobicContact CE1-CD2 4.28Å; Y34-F72 AromaticContact CE2-CD2 3.95Å; Y34-F72 HydrophobicContact CE2-CD2 3.95Å; Y34-F72 AromaticContact CZ-CD2 3.64Å; Y34-F72 WeakPolarHBondContact OH-CD2 3.22Å; Y34-H75 PolarHBondContact OH-ND1 3.17Å; Y34-T108 HydrophobicContact CE2-CG2 4.07Å; Y34-F112 AromaticContact CD1-CD2 3.79Å; Y34-F112 HydrophobicContact CD1-CD2 3.79Å; Y34-F112 HydrophobicContact CD1-CE2 4.3Å; Y34-F112 HydrophobicContact CD2-CB 3.58Å; Y34-F112 AromaticContact CD2-CD2 3.67Å; Y34-F112 HydrophobicContact CD2-CD2 3.67Å; Y34-F112 HydrophobicContact CD2-CG 4.08Å; Y34-F112 HydrophobicContact CE1-CD2 4.14Å; Y34-F112 HydrophobicContact CE2-CB 3.72Å; Y34-F112 HydrophobicContact CE2-CD2 4.04Å; Y34-F112 HydrophobicContact CE2-CG 4.23Å; Y34-F112 HydrophobicContact CG-CB 4.34Å; Y34-F112 AromaticContact CG-CD2 3.55Å; Y34-F112 HydrophobicContact CG-CD2 3.55Å; Y34-F112 HydrophobicContact CG-CE2 4.41Å; Y34-F112 HydrophobicContact CG-CG 4.41Å
35T98.7Very high98.3Very high37 Ų3757.5 Ų57.523%0.22732%0.315CS..Hα-helixtrans-61.8-44.4166.6-57.30000111F31 G32 F33 F38 L39 F115F31-T35 WeakPolarHBondContact CE1-OG1 2.88Å; F31-T35 WeakPolarHBondContact O-CB 3.45Å; F31-T35 PolarHBondContact O-N 3.44Å; F31-T35 PolarHBondContact O-OG1 3.29Å; G32-T35 WeakPolarHBondContact O-CB 3.42Å; G32-T35 PolarHBondContact O-N 3.49Å; F33-T35 VanDerWaalsContact C-N 3.33Å; F33-T35 PolarHBondContact O-N 3.5Å; T35-F38 WeakPolarHBondContact O-CB 3.49Å; T35-F38 PolarHBondContact O-N 2.93Å; T35-L39 HydrophobicContact CG2-CD1 4.23Å; T35-L39 WeakPolarHBondContact O-CG 3.48Å; T35-L39 PolarHBondContact O-N 3.13Å; T35-F115 VanDerWaalsContact OG1-CD2 3.31Å; T35-F115 WeakPolarHBondContact OG1-CD2 3.43Å
36A98.6Very high98.3Very high54 Ų5455.7 Ų55.745%0.44631%0.309SS..Hα-helixtrans-64-40.5176.500000112G32 F33 F38 L39 L40G32-A36 WeakPolarHBondContact O-CB 3.33Å; G32-A36 PolarHBondContact O-N 2.96Å; F33-A36 WeakPolarHBondContact O-CB 3.48Å; F33-A36 PolarHBondContact O-N 3.45Å; F33-A36 VanDerWaalsContact O-N 3.12Å; A36-F38 VanDerWaalsContact C-N 3.34Å; A36-F38 PolarHBondContact O-N 3.25Å; A36-L39 PolarHBondContact O-N 2.83Å; A36-L40 VanDerWaalsContact O-CB 3.23Å; A36-L40 WeakPolarHBondContact O-CB 3.27Å; A36-L40 PolarHBondContact O-N 3.27Å
37V98.6Very high98.2Very high32 Ų3258.4 Ų58.419%0.19433%0.334CS..Hα-helixtrans-60.1-44173.6174.40000111.2F33 Y34 L40 S41 T68 A71F33-V37 HydrophobicContact CD1-CG2 4.34Å; F33-V37 HydrophobicContact CE1-CG2 3.92Å; F33-V37 HydrophobicContact CE2-CG2 4.48Å; F33-V37 HydrophobicContact CZ-CG2 4.01Å; F33-V37 WeakPolarHBondContact O-CG2 3.29Å; F33-V37 PolarHBondContact O-N 2.91Å; Y34-V37 PolarHBondContact O-N 2.92Å; V37-L40 PolarHBondContact O-N 3.34Å; V37-S41 WeakPolarHBondContact O-CB 3.32Å; V37-S41 PolarHBondContact O-N 3.32Å; V37-T68 HydrophobicContact CB-CG2 4.35Å; V37-T68 HydrophobicContact CG1-CG2 4.22Å; V37-A71 HydrophobicContact CG1-CB 4.21Å
38F98.6Very high98.1Very high36 Ų3664.1 Ų64.116%0.15837%0.365CS..Hα-helixtrans-60.5-46.7176.4177-83.9000112.2Y34 T35 A36 S41 H42 V61 N64 L65 T68 F115Y34-F38 WeakPolarHBondContact O-CB 3.25Å; Y34-F38 PolarHBondContact O-N 3.26Å; T35-F38 WeakPolarHBondContact O-CB 3.49Å; T35-F38 PolarHBondContact O-N 2.93Å; A36-F38 VanDerWaalsContact C-N 3.34Å; A36-F38 PolarHBondContact O-N 3.25Å; F38-S41 WeakPolarHBondContact O-CB 3.4Å; F38-S41 PolarHBondContact O-N 3.1Å; F38-H42 PolarHBondContact O-N 3.43Å; F38-V61 HydrophobicContact CE2-CG1 4.44Å; F38-V61 HydrophobicContact CZ-CG1 4.32Å; F38-N64 HydrophobicContact CD1-CB 4.44Å; F38-N64 HydrophobicContact CD2-CB 3.5Å; F38-N64 VanDerWaalsContact CD2-CB 3.5Å; F38-N64 HydrophobicContact CE1-CB 4.25Å; F38-N64 HydrophobicContact CE2-CB 3.26Å; F38-N64 HydrophobicContact CG-CB 4.09Å; F38-N64 HydrophobicContact CZ-CB 3.67Å; F38-L65 HydrophobicContact CD2-CD2 4.24Å; F38-L65 HydrophobicContact CD2-CG 4.3Å; F38-L65 HydrophobicContact CE2-CD2 4.26Å; F38-L65 HydrophobicContact CE2-CG 3.95Å; F38-T68 VanDerWaalsContact CA-OG1 3.27Å; F38-T68 WeakPolarHBondContact CA-OG1 3.27Å; F38-T68 WeakPolarHBondContact CB-OG1 3.37Å; F38-T68 PolarHBondContact N-OG1 2.91Å; F38-F115 HydrophobicContact CB-CE2 4.19Å; F38-F115 HydrophobicContact CB-CZ 3.73Å; F38-F115 AromaticContact CD2-CZ 3.98Å; F38-F115 HydrophobicContact CD2-CZ 3.98Å; F38-F115 HydrophobicContact CG-CE2 4.48Å; F38-F115 HydrophobicContact CG-CZ 4.01Å
39L98.4Very high98Very high91 Ų9161.9 Ų61.948%0.47635%0.349SS..Hα-helixtrans-67.5-40.8178.6-67.8174.9000111.8T35 A36 S41 H42 L43T35-L39 HydrophobicContact CG2-CD1 4.23Å; T35-L39 WeakPolarHBondContact O-CG 3.48Å; T35-L39 PolarHBondContact O-N 3.13Å; A36-L39 PolarHBondContact O-N 2.83Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 2.8Å; L39-H42 VanDerWaalsContact O-CB 3.32Å; L39-H42 WeakPolarHBondContact O-CB 3.45Å; L39-H42 PolarHBondContact O-N 2.73Å; L39-L43 WeakPolarHBondContact O-CG 3.31Å; L39-L43 PolarHBondContact O-N 2.91Å
40L98.3Very high97.8Very high97 Ų9766.4 Ų66.451%0.50836%0.36SS..Hα-helixtrans-63-42.2175.5-178.362000110.9A36 V37 H42 L43 L44A36-L40 VanDerWaalsContact O-CB 3.23Å; A36-L40 WeakPolarHBondContact O-CB 3.27Å; A36-L40 PolarHBondContact O-N 3.27Å; V37-L40 PolarHBondContact O-N 3.34Å; L40-H42 VanDerWaalsContact C-N 3.29Å; L40-H42 PolarHBondContact O-N 2.74Å; L40-L43 PolarHBondContact O-N 2.74Å; L40-L44 HydrophobicContact CD1-CD1 3.92Å; L40-L44 HydrophobicContact CD1-CG 3.93Å; L40-L44 HydrophobicContact CD2-CD1 4.44Å; L40-L44 HydrophobicContact CG-CD1 3.81Å; L40-L44 HydrophobicContact CG-CG 4.23Å; L40-L44 WeakPolarHBondContact O-CB 3.28Å; L40-L44 VanDerWaalsContact O-CG 3.32Å; L40-L44 WeakPolarHBondContact O-CG 3.23Å; L40-L44 PolarHBondContact O-N 3.29Å
41S98.2Very high97.7Very high15 Ų1568 Ų6811%0.10537%0.369CS..Hα-helixtrans-57.9-42.6173.6-178.40000111.6V37 F38 L39 S45 A67V37-S41 WeakPolarHBondContact O-CB 3.32Å; V37-S41 PolarHBondContact O-N 3.32Å; F38-S41 WeakPolarHBondContact O-CB 3.4Å; F38-S41 PolarHBondContact O-N 3.1Å; L39-S41 VanDerWaalsContact C-N 3.33Å; L39-S41 PolarHBondContact O-N 2.8Å; S41-S45 WeakPolarHBondContact O-CB 3.19Å; S41-S45 PolarHBondContact O-N 2.73Å; S41-S45 PolarHBondContact O-OG 2.88Å; S41-A67 WeakPolarHBondContact OG-CB 3.36Å
42H97.9Very high97.6Very high64 Ų6464.9 Ų64.930%0.29636%0.355SS..Hα-helixtrans-59.6-54.3174.5178.951.9000111.8F38 L39 L40 L44 S45 L46 Y52 N64F38-H42 PolarHBondContact O-N 3.43Å; L39-H42 VanDerWaalsContact O-CB 3.32Å; L39-H42 WeakPolarHBondContact O-CB 3.45Å; L39-H42 PolarHBondContact O-N 2.73Å; L40-H42 VanDerWaalsContact C-N 3.29Å; L40-H42 PolarHBondContact O-N 2.74Å; H42-L44 PolarHBondContact O-N 2.89Å; H42-S45 PolarHBondContact O-N 3.43Å; H42-L46 WeakPolarHBondContact O-CB 3.47Å; H42-L46 PolarHBondContact O-N 2.68Å; H42-Y52 AromaticContact ND1-CE1 3.73Å; H42-Y52 AromaticContact ND1-CZ 3.58Å; H42-Y52 PolarHBondContact ND1-OH 2.99Å; H42-N64 WeakPolarHBondContact CA-OD1 3.48Å; H42-N64 WeakPolarHBondContact CB-ND2 3.36Å; H42-N64 PolarHBondContact N-OD1 2.93Å
43L98.3Very high97.5Very high108 Ų10866.4 Ų66.457%0.56536%0.355SS*.Hα-helixtrans-63-45.1-175.3-67174.2000111.9L39 L40 L46 A47L39-L43 WeakPolarHBondContact O-CG 3.31Å; L39-L43 PolarHBondContact O-N 2.91Å; L40-L43 PolarHBondContact O-N 2.74Å; L43-L46 PolarHBondContact O-N 3.21Å; L43-A47 WeakPolarHBondContact O-CB 3.45Å; L43-A47 PolarHBondContact O-N 3.49Å
44L97.7Very high97.4Very high90 Ų9064.2 Ų64.247%0.47136%0.359SS..Hα-helixtrans-64.9-43.5176.8-69176.1000111.5L40 H42 A47 L48L40-L44 HydrophobicContact CD1-CD1 3.92Å; L40-L44 HydrophobicContact CD1-CG 3.93Å; L40-L44 HydrophobicContact CD2-CD1 4.44Å; L40-L44 HydrophobicContact CG-CD1 3.81Å; L40-L44 HydrophobicContact CG-CG 4.23Å; L40-L44 WeakPolarHBondContact O-CB 3.28Å; L40-L44 VanDerWaalsContact O-CG 3.32Å; L40-L44 WeakPolarHBondContact O-CG 3.23Å; L40-L44 PolarHBondContact O-N 3.29Å; H42-L44 PolarHBondContact O-N 2.89Å; L44-A47 PolarHBondContact O-N 2.93Å; L44-L48 HydrophobicContact CD2-CD1 4.47Å; L44-L48 WeakPolarHBondContact O-CB 3.45Å; L44-L48 PolarHBondContact O-N 2.95Å
45S97.5Very high97.2Very high13 Ų1364.9 Ų64.99%0.09136%0.363CS..Hα-helixtrans-68.6-36.8179.9-55.90000111.7S41 H42 C49 W63S41-S45 WeakPolarHBondContact O-CB 3.19Å; S41-S45 PolarHBondContact O-N 2.73Å; S41-S45 PolarHBondContact O-OG 2.88Å; H42-S45 PolarHBondContact O-N 3.43Å; S45-C49 WeakPolarHBondContact O-CA 3.48Å; S45-C49 VanDerWaalsContact O-CB 3.24Å; S45-C49 WeakPolarHBondContact O-CB 3.42Å; S45-C49 PolarHBondContact O-N 2.89Å; S45-W63 PolarHBondContact OG-NE1 2.99Å; S45-W63 VanDerWaalsContact OG-NE1 3.07Å
46L97.1Very high97Very high79 Ų7966.9 Ų66.941%0.41438%0.376SS..Hα-helixtrans-61.5-44.4174.1-174.271.2000111.1H42 L43 Y52 N53H42-L46 WeakPolarHBondContact O-CB 3.47Å; H42-L46 PolarHBondContact O-N 2.68Å; L43-L46 PolarHBondContact O-N 3.21Å; L46-Y52 HydrophobicContact CB-CE1 4.42Å; L46-N53 WeakPolarHBondContact CD1-OD1 3.18Å; L46-N53 PolarHBondContact O-ND2 3.14Å
47A96.9Very high96.9Very high79 Ų7967.4 Ų67.465%0.65338%0.381SS*.Hα-helixtrans-75-37-178.100000113.8L43 L44L43-A47 WeakPolarHBondContact O-CB 3.45Å; L43-A47 PolarHBondContact O-N 3.49Å; L44-A47 PolarHBondContact O-N 2.93Å
48L95.9Very high96.6Very high145 Ų14569.1 Ų69.176%0.75939%0.386SS*.Hα-helixtrans-117.8-16-164.3-56.3176.3000114.8L44L44-L48 HydrophobicContact CD2-CD1 4.47Å; L44-L48 WeakPolarHBondContact O-CB 3.45Å; L44-L48 PolarHBondContact O-N 2.95Å
49C95.1Very high96.4Very high30 Ų3068.9 Ų68.920%0.20339%0.385CS..  trans-113.4107.1-170.8-170.80000112S45 T51 Y52 N53S45-C49 WeakPolarHBondContact O-CA 3.48Å; S45-C49 VanDerWaalsContact O-CB 3.24Å; S45-C49 WeakPolarHBondContact O-CB 3.42Å; S45-C49 PolarHBondContact O-N 2.89Å; C49-T51 VanDerWaalsContact C-N 3.35Å; C49-T51 PolarHBondContact O-N 3.32Å; C49-Y52 WeakPolarHBondContact O-CB 3.45Å; C49-Y52 PolarHBondContact O-N 2.81Å; C49-Y52 PolarHBondContact SG-N 2.97Å; C49-N53 PolarHBondContact O-N 3.43Å; C49-N53 PolarHBondContact O-ND2 2.88Å
50Y94.9Very high96.4Very high199 Ų19967 Ų6778%0.7837%0.373SS*.Hα-helixtrans-58.1-46.2174.7176.4-98.9000112Y52 N53 A54Y50-Y52 VanDerWaalsContact C-N 3.32Å; Y50-Y52 PolarHBondContact O-N 3.32Å; Y50-N53 WeakPolarHBondContact O-CB 3.34Å; Y50-N53 PolarHBondContact O-N 3.17Å; Y50-N53 VanDerWaalsContact O-N 3.14Å; Y50-A54 PolarHBondContact O-N 3.12Å
51T95.6Very high96.3Very high35 Ų3564.3 Ų64.322%0.21536%0.361CS..Hα-helixtrans-53.4-50.9177.4-54.20000110.9C49 N53 A54 L55 W63 K180 A181C49-T51 VanDerWaalsContact C-N 3.35Å; C49-T51 PolarHBondContact O-N 3.32Å; T51-N53 VanDerWaalsContact C-N 3.29Å; T51-N53 PolarHBondContact O-N 3.03Å; T51-A54 PolarHBondContact O-N 2.81Å; T51-A54 VanDerWaalsContact O-N 3.12Å; T51-L55 WeakPolarHBondContact O-CG 3.26Å; T51-L55 PolarHBondContact O-N 3.32Å; T51-W63 HydrophobicContact CG2-CZ3 4.31Å; T51-K180 HydrophobicContact CG2-CB 4.37Å; T51-K180 VanDerWaalsContact CG2-O 3.25Å; T51-K180 WeakPolarHBondContact CG2-O 3.38Å; T51-A181 HydrophobicContact CG2-CB 4.3Å
52Y97.2Very high96.1Very high2 Ų265.3 Ų65.31%0.00836%0.363CS..Hα-helixtrans-55.5-45.6179.6-178.1-98.4000112H42 L46 C49 Y50 A54 L55 K60 W63 N64H42-Y52 AromaticContact ND1-CE1 3.73Å; H42-Y52 AromaticContact ND1-CZ 3.58Å; H42-Y52 PolarHBondContact ND1-OH 2.99Å; L46-Y52 HydrophobicContact CB-CE1 4.42Å; C49-Y52 WeakPolarHBondContact O-CB 3.45Å; C49-Y52 PolarHBondContact O-N 2.81Å; C49-Y52 PolarHBondContact SG-N 2.97Å; Y50-Y52 VanDerWaalsContact C-N 3.32Å; Y50-Y52 PolarHBondContact O-N 3.32Å; Y52-A54 VanDerWaalsContact C-N 3.25Å; Y52-A54 PolarHBondContact O-N 3.36Å; Y52-L55 HydrophobicContact CD2-CD1 4.39Å; Y52-L55 WeakPolarHBondContact O-CB 3.43Å; Y52-L55 PolarHBondContact O-N 2.96Å; Y52-K60 HydrophobicContact CD2-CG 4.33Å; Y52-K60 HydrophobicContact CE1-CD 4.16Å; Y52-K60 HydrophobicContact CE1-CG 4.13Å; Y52-K60 HydrophobicContact CE2-CB 3.89Å; Y52-K60 HydrophobicContact CE2-CG 3.9Å; Y52-K60 WeakPolarHBondContact O-CE 3.46Å; Y52-W63 HydrophobicContact CD2-CB 4.06Å; Y52-W63 AromaticContact CD2-CD1 3.36Å; Y52-W63 AromaticContact CD2-CD2 3.96Å; Y52-W63 HydrophobicContact CD2-CD2 3.96Å; Y52-W63 AromaticContact CD2-CG 3.55Å; Y52-W63 HydrophobicContact CD2-CG 3.55Å; Y52-W63 AromaticContact CD2-NE1 3.62Å; Y52-W63 HydrophobicContact CE2-CB 3.96Å; Y52-W63 AromaticContact CE2-CD1 3.53Å; Y52-W63 AromaticContact CE2-CG 3.81Å; Y52-W63 HydrophobicContact CE2-CG 3.81Å; Y52-N64 VanDerWaalsContact CE2-OD1 3.31Å; Y52-N64 WeakPolarHBondContact CE2-OD1 3.37Å; Y52-N64 PolarHBondContact OH-ND2 2.89Å; Y52-N64 PolarHBondContact OH-OD1 3.06Å
53N96.6Very high96.1Very high67 Ų6763 Ų6336%0.35835%0.351SS..Hα-helixtrans-60.4-36.3-179.4-81.1-69.4000112.7L46 C49 Y50 T51 L55 K60L46-N53 WeakPolarHBondContact CD1-OD1 3.18Å; L46-N53 PolarHBondContact O-ND2 3.14Å; C49-N53 PolarHBondContact O-N 3.43Å; C49-N53 PolarHBondContact O-ND2 2.88Å; Y50-N53 WeakPolarHBondContact O-CB 3.34Å; Y50-N53 PolarHBondContact O-N 3.17Å; Y50-N53 VanDerWaalsContact O-N 3.14Å; T51-N53 VanDerWaalsContact C-N 3.29Å; T51-N53 PolarHBondContact O-N 3.03Å; N53-L55 VanDerWaalsContact C-N 3.34Å; N53-K60 WeakPolarHBondContact O-CE 3.39Å; N53-K60 PolarHBondContact O-NZ 2.82Å
54A96.3Very high96.1Very high73 Ų7358 Ų5860%0.60333%0.326SS*.Hα-helixtrans-77.2-14.2176.900000114.3Y50 T51 Y52Y50-A54 PolarHBondContact O-N 3.12Å; T51-A54 PolarHBondContact O-N 2.81Å; T51-A54 VanDerWaalsContact O-N 3.12Å; Y52-A54 VanDerWaalsContact C-N 3.25Å; Y52-A54 PolarHBondContact O-N 3.36Å
55L95.4Very high96.1Very high17 Ų1753.9 Ų53.99%0.08930%0.304CS..SBendtrans-68.8143.7-179.2-66.8178.8000112.1T51 Y52 N53 E59 K60 W63 K180T51-L55 WeakPolarHBondContact O-CG 3.26Å; T51-L55 PolarHBondContact O-N 3.32Å; Y52-L55 HydrophobicContact CD2-CD1 4.39Å; Y52-L55 WeakPolarHBondContact O-CB 3.43Å; Y52-L55 PolarHBondContact O-N 2.96Å; N53-L55 VanDerWaalsContact C-N 3.34Å; L55-E59 HydrophobicContact CB-CB 4.11Å; L55-E59 HydrophobicContact CD1-CB 4.36Å; L55-E59 HydrophobicContact CD2-CB 4.35Å; L55-E59 WeakPolarHBondContact CD2-OE2 3.11Å; L55-E59 HydrophobicContact CG-CB 4.49Å; L55-K60 HydrophobicContact CB-CG 3.82Å; L55-K60 WeakPolarHBondContact O-CE 3.36Å; L55-K60 PolarHBondContact O-NZ 2.76Å; L55-W63 HydrophobicContact CD1-CB 4.29Å; L55-W63 HydrophobicContact CD1-CD2 4.17Å; L55-W63 HydrophobicContact CD1-CE3 3.63Å; L55-W63 HydrophobicContact CD1-CG 4.48Å; L55-W63 HydrophobicContact CD1-CZ3 4.31Å; L55-K180 HydrophobicContact CD2-CB 4.48Å; L55-K180 HydrophobicContact CD2-CD 4.11Å
56P94.4Very high96.1Very high78 Ų7853.3 Ų53.351%0.50630%0.3SS..  trans-58.1155.1166.3-22.533000112.1K58 E59 K60P56-K58 VanDerWaalsContact C-N 3.27Å; P56-K58 PolarHBondContact O-N 3.41Å; P56-K58 VanDerWaalsContact O-N 3.15Å; P56-E59 PolarHBondContact O-N 3.25Å; P56-K60 PolarHBondContact O-N 3.27Å
57A95Very high96.1Very high66 Ų6650.7 Ų50.755%0.54529%0.29SS..Hα-helixtrans-53-41.2-176.900000113.7E59 K60 V61 F127A57-E59 PolarHBondContact O-N 3.44Å; A57-K60 WeakPolarHBondContact O-CB 3.21Å; A57-K60 PolarHBondContact O-N 3.49Å; A57-V61 PolarHBondContact O-N 3.03Å; A57-V61 VanDerWaalsContact O-N 3.15Å; A57-F127 HydrophobicContact CB-CE1 4.3Å; A57-F127 HydrophobicContact CB-CZ 4.44Å
58K93.9Very high96.2Very high67 Ų6747 Ų4729%0.29126%0.259SS..Hα-helixtrans-61.6-43.5176.9-171-178.9-173.7-178.10112.5P56 V61 F62 F127 S129 F264P56-K58 VanDerWaalsContact C-N 3.27Å; P56-K58 PolarHBondContact O-N 3.41Å; P56-K58 VanDerWaalsContact O-N 3.15Å; K58-V61 PolarHBondContact O-N 3.44Å; K58-F62 PolarHBondContact O-N 3.06Å; K58-F62 VanDerWaalsContact O-N 3.11Å; K58-F127 HydrophobicContact CB-CD1 3.79Å; K58-F127 HydrophobicContact CB-CD2 4.08Å; K58-F127 HydrophobicContact CB-CE1 3.81Å; K58-F127 HydrophobicContact CB-CE2 4.11Å; K58-F127 HydrophobicContact CB-CG 3.94Å; K58-F127 HydrophobicContact CB-CZ 3.98Å; K58-F127 HydrophobicContact CD-CB 3.85Å; K58-F127 HydrophobicContact CD-CD1 4.42Å; K58-F127 HydrophobicContact CD-CD2 4.33Å; K58-F127 HydrophobicContact CD-CG 3.96Å; K58-F127 HydrophobicContact CG-CB 4.14Å; K58-F127 HydrophobicContact CG-CD1 4.08Å; K58-F127 HydrophobicContact CG-CD2 3.66Å; K58-F127 HydrophobicContact CG-CE1 4.43Å; K58-F127 HydrophobicContact CG-CE2 4.06Å; K58-F127 HydrophobicContact CG-CG 3.69Å; K58-F127 HydrophobicContact CG-CZ 4.43Å; K58-S129 WeakPolarHBondContact CE-OG 3.37Å; K58-S129 PolarHBondContact NZ-OG 3.43Å; K58-F264 HydrophobicContact CD-CD1 4.32Å; K58-F264 HydrophobicContact CD-CE1 3.73Å; K58-F264 HydrophobicContact CG-CE1 3.83Å
59E94.7Very high96.3Very high32 Ų3241.1 Ų41.115%0.1523%0.227CC..Hα-helixtrans-73.3-30.2-179.9-63.4-169.6-168.500111.8L55 P56 A57 F62 W63 K180 F264L55-E59 HydrophobicContact CB-CB 4.11Å; L55-E59 HydrophobicContact CD1-CB 4.36Å; L55-E59 HydrophobicContact CD2-CB 4.35Å; L55-E59 WeakPolarHBondContact CD2-OE2 3.11Å; L55-E59 HydrophobicContact CG-CB 4.49Å; P56-E59 PolarHBondContact O-N 3.25Å; A57-E59 PolarHBondContact O-N 3.44Å; E59-F62 PolarHBondContact O-N 2.99Å; E59-W63 VanDerWaalsContact O-CB 3.31Å; E59-W63 WeakPolarHBondContact O-CB 3.25Å; E59-W63 PolarHBondContact O-N 2.91Å; E59-K180 IonicContact OE1-NZ 2.67Å; E59-K180 PolarHBondContact OE1-NZ 3.48Å; E59-K180 VanDerWaalsContact OE1-NZ 3.16Å; E59-K180 WeakPolarHBondContact OE2-CE 3.27Å; E59-K180 IonicContact OE2-NZ 3.75Å; E59-K180 PolarHBondContact OE2-NZ 2.87Å; E59-F264 HydrophobicContact CG-CD1 4.05Å; E59-F264 HydrophobicContact CG-CD2 4.16Å; E59-F264 HydrophobicContact CG-CE1 4.1Å; E59-F264 HydrophobicContact CG-CE2 4.22Å; E59-F264 HydrophobicContact CG-CG 4.09Å; E59-F264 HydrophobicContact CG-CZ 4.19Å
60K96.7Very high96.4Very high52 Ų5240.4 Ų40.423%0.22622%0.223CC..Hα-helixtrans-61.2-43.4170.4-74.9178.7171.1162.50112.2Y52 N53 L55 P56 A57 W63 N64Y52-K60 HydrophobicContact CD2-CG 4.33Å; Y52-K60 HydrophobicContact CE1-CD 4.16Å; Y52-K60 HydrophobicContact CE1-CG 4.13Å; Y52-K60 HydrophobicContact CE2-CB 3.89Å; Y52-K60 HydrophobicContact CE2-CG 3.9Å; Y52-K60 WeakPolarHBondContact O-CE 3.46Å; N53-K60 WeakPolarHBondContact O-CE 3.39Å; N53-K60 PolarHBondContact O-NZ 2.82Å; L55-K60 HydrophobicContact CB-CG 3.82Å; L55-K60 WeakPolarHBondContact O-CE 3.36Å; L55-K60 PolarHBondContact O-NZ 2.76Å; P56-K60 PolarHBondContact O-N 3.27Å; A57-K60 WeakPolarHBondContact O-CB 3.21Å; A57-K60 PolarHBondContact O-N 3.49Å; K60-W63 PolarHBondContact O-N 2.99Å; K60-N64 VanDerWaalsContact O-CG 3.22Å; K60-N64 PolarHBondContact O-N 2.97Å; K60-N64 VanDerWaalsContact O-N 3.11Å; K60-N64 PolarHBondContact O-ND2 2.86Å; K60-N64 PolarHBondContact O-OD1 3.23Å
61V96.2Very high96.6Very high40 Ų4032.6 Ų32.624%0.24220%0.2CC..Hα-helixtrans-62.6-46.1174.3173.90000110.4F38 A57 K58 W63 N64 L65 F127F38-V61 HydrophobicContact CE2-CG1 4.44Å; F38-V61 HydrophobicContact CZ-CG1 4.32Å; A57-V61 PolarHBondContact O-N 3.03Å; A57-V61 VanDerWaalsContact O-N 3.15Å; K58-V61 PolarHBondContact O-N 3.44Å; V61-W63 VanDerWaalsContact C-N 3.31Å; V61-W63 PolarHBondContact O-N 3.18Å; V61-N64 PolarHBondContact O-N 3.01Å; V61-L65 HydrophobicContact CG1-CD1 4.14Å; V61-L65 PolarHBondContact O-N 3.49Å; V61-F127 HydrophobicContact CB-CE2 4.49Å; V61-F127 HydrophobicContact CG2-CE2 4.17Å; V61-F127 HydrophobicContact CG2-CZ 4.31Å
62F95.1Very high96.7Very high35 Ų3531 Ų3115%0.15419%0.19CC..Hα-helixtrans-64.3-35.2178.4-166.2-89000112.8K58 E59 L65 A66 W176 N263 F264K58-F62 PolarHBondContact O-N 3.06Å; K58-F62 VanDerWaalsContact O-N 3.11Å; E59-F62 PolarHBondContact O-N 2.99Å; F62-L65 PolarHBondContact O-N 3.47Å; F62-A66 WeakPolarHBondContact O-CB 3.33Å; F62-A66 PolarHBondContact O-N 3.41Å; F62-W176 HydrophobicContact CB-CH2 4.3Å; F62-W176 AromaticContact CD1-CD2 3.87Å; F62-W176 HydrophobicContact CD1-CD2 3.87Å; F62-W176 AromaticContact CD1-CE2 3.63Å; F62-W176 AromaticContact CD1-CE3 3.93Å; F62-W176 HydrophobicContact CD1-CE3 3.93Å; F62-W176 AromaticContact CD1-CH2 3.57Å; F62-W176 HydrophobicContact CD1-CH2 3.57Å; F62-W176 AromaticContact CD1-CZ2 3.45Å; F62-W176 HydrophobicContact CD1-CZ2 3.45Å; F62-W176 VanDerWaalsContact CD1-CZ2 3.45Å; F62-W176 AromaticContact CD1-CZ3 3.81Å; F62-W176 HydrophobicContact CD1-CZ3 3.81Å; F62-W176 AromaticContact CE1-CD2 3.74Å; F62-W176 HydrophobicContact CE1-CD2 3.74Å; F62-W176 AromaticContact CE1-CE2 3.71Å; F62-W176 HydrophobicContact CE1-CE3 4.11Å; F62-W176 HydrophobicContact CE1-CG 4.17Å; F62-W176 HydrophobicContact CE1-CH2 4.42Å; F62-W176 HydrophobicContact CE1-CZ2 4.05Å; F62-W176 HydrophobicContact CE1-CZ3 4.46Å; F62-W176 HydrophobicContact CG-CH2 4.39Å; F62-W176 HydrophobicContact CG-CZ2 4.33Å; F62-N263 HydrophobicContact CE1-CB 4.47Å; F62-N263 HydrophobicContact CZ-CB 4.21Å; F62-N263 WeakPolarHBondContact CZ-ND2 3.48Å; F62-F264 HydrophobicContact CB-CE2 3.96Å; F62-F264 HydrophobicContact CB-CZ 3.66Å; F62-F264 AromaticContact CD1-CE2 3.86Å; F62-F264 HydrophobicContact CD1-CE2 3.86Å; F62-F264 HydrophobicContact CD1-CZ 4.35Å; F62-F264 HydrophobicContact CD2-CE2 4.12Å; F62-F264 AromaticContact CD2-CZ 3.93Å; F62-F264 HydrophobicContact CD2-CZ 3.93Å; F62-F264 HydrophobicContact CE1-CE2 4.36Å; F62-F264 AromaticContact CG-CE2 3.71Å; F62-F264 HydrophobicContact CG-CE2 3.71Å; F62-F264 AromaticContact CG-CZ 3.73Å; F62-F264 HydrophobicContact CG-CZ 3.73Å
63W97.5Very high96.8Very high15 Ų1530.9 Ų30.96%0.05719%0.189CC..Hα-helixtrans-61.9-46.6174.2180-76.2000112.1S45 T51 Y52 L55 E59 K60 V61 L65 A66 A67 W176 M177 K180S45-W63 PolarHBondContact OG-NE1 2.99Å; S45-W63 VanDerWaalsContact OG-NE1 3.07Å; T51-W63 HydrophobicContact CG2-CZ3 4.31Å; Y52-W63 HydrophobicContact CD2-CB 4.06Å; Y52-W63 AromaticContact CD2-CD1 3.36Å; Y52-W63 AromaticContact CD2-CD2 3.96Å; Y52-W63 HydrophobicContact CD2-CD2 3.96Å; Y52-W63 AromaticContact CD2-CG 3.55Å; Y52-W63 HydrophobicContact CD2-CG 3.55Å; Y52-W63 AromaticContact CD2-NE1 3.62Å; Y52-W63 HydrophobicContact CE2-CB 3.96Å; Y52-W63 AromaticContact CE2-CD1 3.53Å; Y52-W63 AromaticContact CE2-CG 3.81Å; Y52-W63 HydrophobicContact CE2-CG 3.81Å; L55-W63 HydrophobicContact CD1-CB 4.29Å; L55-W63 HydrophobicContact CD1-CD2 4.17Å; L55-W63 HydrophobicContact CD1-CE3 3.63Å; L55-W63 HydrophobicContact CD1-CG 4.48Å; L55-W63 HydrophobicContact CD1-CZ3 4.31Å; E59-W63 VanDerWaalsContact O-CB 3.31Å; E59-W63 WeakPolarHBondContact O-CB 3.25Å; E59-W63 PolarHBondContact O-N 2.91Å; K60-W63 PolarHBondContact O-N 2.99Å; V61-W63 VanDerWaalsContact C-N 3.31Å; V61-W63 PolarHBondContact O-N 3.18Å; W63-L65 VanDerWaalsContact C-N 3.35Å; W63-A66 WeakPolarHBondContact O-CB 3.46Å; W63-A66 PolarHBondContact O-N 2.85Å; W63-A67 PolarHBondContact O-N 3.38Å; W63-W176 HydrophobicContact CB-CH2 4.17Å; W63-W176 HydrophobicContact CB-CZ3 3.87Å; W63-W176 HydrophobicContact CD2-CZ3 4.3Å; W63-W176 HydrophobicContact CE3-CH2 4.31Å; W63-W176 AromaticContact CE3-CZ3 3.71Å; W63-W176 HydrophobicContact CE3-CZ3 3.71Å; W63-W176 HydrophobicContact CG-CZ3 4.41Å; W63-M177 HydrophobicContact CD2-CE 3.93Å; W63-M177 HydrophobicContact CD2-CG 4.18Å; W63-M177 HydrophobicContact CE3-CB 4.28Å; W63-M177 HydrophobicContact CE3-CG 4.09Å; W63-M177 HydrophobicContact CG-CE 4.35Å; W63-M177 HydrophobicContact CH2-CB 3.94Å; W63-M177 HydrophobicContact CH2-CE 4.23Å; W63-M177 HydrophobicContact CH2-CG 4.41Å; W63-M177 HydrophobicContact CZ2-CB 4.4Å; W63-M177 HydrophobicContact CZ2-CE 3.49Å; W63-M177 VanDerWaalsContact CZ2-CE 3.49Å; W63-M177 HydrophobicContact CZ3-CB 3.9Å; W63-M177 HydrophobicContact CZ3-CG 4.21Å; W63-M177 WeakPolarHBondContact CZ3-O 3.19Å; W63-K180 HydrophobicContact CE3-CB 4.41Å; W63-K180 HydrophobicContact CZ3-CB 3.91Å
64N98.1Very high96.9Very high4 Ų432.6 Ų32.62%0.02120%0.197CC..Hα-helixtrans-66.4-38.3177-61.2-18.6000111.3F38 H42 Y52 K60 V61 A67 T68F38-N64 HydrophobicContact CD1-CB 4.44Å; F38-N64 HydrophobicContact CD2-CB 3.5Å; F38-N64 VanDerWaalsContact CD2-CB 3.5Å; F38-N64 HydrophobicContact CE1-CB 4.25Å; F38-N64 HydrophobicContact CE2-CB 3.26Å; F38-N64 HydrophobicContact CG-CB 4.09Å; F38-N64 HydrophobicContact CZ-CB 3.67Å; H42-N64 WeakPolarHBondContact CA-OD1 3.48Å; H42-N64 WeakPolarHBondContact CB-ND2 3.36Å; H42-N64 PolarHBondContact N-OD1 2.93Å; Y52-N64 VanDerWaalsContact CE2-OD1 3.31Å; Y52-N64 WeakPolarHBondContact CE2-OD1 3.37Å; Y52-N64 PolarHBondContact OH-ND2 2.89Å; Y52-N64 PolarHBondContact OH-OD1 3.06Å; K60-N64 VanDerWaalsContact O-CG 3.22Å; K60-N64 PolarHBondContact O-N 2.97Å; K60-N64 VanDerWaalsContact O-N 3.11Å; K60-N64 PolarHBondContact O-ND2 2.86Å; K60-N64 PolarHBondContact O-OD1 3.23Å; V61-N64 PolarHBondContact O-N 3.01Å; N64-A67 PolarHBondContact O-N 3.37Å; N64-T68 WeakPolarHBondContact O-CB 3.25Å; N64-T68 PolarHBondContact O-N 3.5Å; N64-T68 PolarHBondContact O-OG1 2.94Å
65L97.3Very high97Very high3 Ų331 Ų312%0.01618%0.178CC..Hα-helixtrans-62.7-41.9171.7-78.1168.6000111.5F38 V61 F62 W63 A67 T68 R69 F115 A119F38-L65 HydrophobicContact CD2-CD2 4.24Å; F38-L65 HydrophobicContact CD2-CG 4.3Å; F38-L65 HydrophobicContact CE2-CD2 4.26Å; F38-L65 HydrophobicContact CE2-CG 3.95Å; V61-L65 HydrophobicContact CG1-CD1 4.14Å; V61-L65 PolarHBondContact O-N 3.49Å; F62-L65 PolarHBondContact O-N 3.47Å; W63-L65 VanDerWaalsContact C-N 3.35Å; L65-A67 PolarHBondContact O-N 3.13Å; L65-T68 PolarHBondContact O-N 3.47Å; L65-R69 VanDerWaalsContact O-CB 3.32Å; L65-R69 WeakPolarHBondContact O-CB 3.27Å; L65-R69 WeakPolarHBondContact O-CG 3.38Å; L65-R69 PolarHBondContact O-N 2.92Å; L65-F115 HydrophobicContact CD2-CE1 4.11Å; L65-F115 HydrophobicContact CD2-CZ 4.24Å; L65-A119 HydrophobicContact CD2-CB 3.68Å
66A97.3Very high97.1Very high2 Ų230.3 Ų30.32%0.01717%0.174CC..Hα-helixtrans-60.5-4517800000111.3F62 W63 T68 A70 C173 W176 M177F62-A66 WeakPolarHBondContact O-CB 3.33Å; F62-A66 PolarHBondContact O-N 3.41Å; W63-A66 WeakPolarHBondContact O-CB 3.46Å; W63-A66 PolarHBondContact O-N 2.85Å; A66-T68 PolarHBondContact O-N 2.82Å; A66-A70 WeakPolarHBondContact O-CB 3.35Å; A66-A70 PolarHBondContact O-N 2.99Å; A66-C173 HydrophobicContact CB-CB 3.95Å; A66-C173 VanDerWaalsContact O-CB 3.23Å; A66-C173 WeakPolarHBondContact O-CB 3.26Å; A66-C173 PolarHBondContact O-SG 3.29Å; A66-W176 HydrophobicContact CB-CE3 4.32Å; A66-M177 HydrophobicContact CB-CG 4.33Å; A66-M177 HydrophobicContact CB-SD 4.35Å
67A98.1Very high97.3Very high24 Ų2427.5 Ų27.520%0.19816%0.156CC..Hα-helixtrans-61.9-43.1174.400000112.2S41 W63 N64 L65 A70 A71S41-A67 WeakPolarHBondContact OG-CB 3.36Å; W63-A67 PolarHBondContact O-N 3.38Å; N64-A67 PolarHBondContact O-N 3.37Å; L65-A67 PolarHBondContact O-N 3.13Å; A67-A70 WeakPolarHBondContact O-CB 3.46Å; A67-A70 PolarHBondContact O-N 2.9Å; A67-A71 PolarHBondContact O-N 3.17Å
68T98.4Very high97.4Very high0 Ų028.7 Ų28.70%016%0.156CC..Hα-helixtrans-65.4-45.2-179.9-51.40000111.8Y34 V37 F38 N64 L65 A66 A70 A71 F72 F112 F115Y34-T68 HydrophobicContact CD1-CG2 3.81Å; Y34-T68 HydrophobicContact CG-CG2 4.36Å; Y34-T68 WeakPolarHBondContact O-CG2 3.38Å; V37-T68 HydrophobicContact CB-CG2 4.35Å; V37-T68 HydrophobicContact CG1-CG2 4.22Å; F38-T68 VanDerWaalsContact CA-OG1 3.27Å; F38-T68 WeakPolarHBondContact CA-OG1 3.27Å; F38-T68 WeakPolarHBondContact CB-OG1 3.37Å; F38-T68 PolarHBondContact N-OG1 2.91Å; N64-T68 WeakPolarHBondContact O-CB 3.25Å; N64-T68 PolarHBondContact O-N 3.5Å; N64-T68 PolarHBondContact O-OG1 2.94Å; L65-T68 PolarHBondContact O-N 3.47Å; A66-T68 PolarHBondContact O-N 2.82Å; T68-A70 VanDerWaalsContact C-N 3.32Å; T68-A70 PolarHBondContact O-N 2.92Å; T68-A71 PolarHBondContact O-N 3.07Å; T68-F72 PolarHBondContact O-N 3.26Å; T68-F112 HydrophobicContact CG2-CE2 4.38Å; T68-F115 HydrophobicContact CG2-CD1 4.44Å; T68-F115 HydrophobicContact CG2-CE1 3.69Å; T68-F115 HydrophobicContact CG2-CZ 4.21Å
69R98.2Very high97.6Very high23 Ų2325.5 Ų25.59%0.08714%0.142CC..Hα-helixtrans-63.8-35.4174.8-70.5169.5-174.8174.3-1.1111.9L65 F72 G73 F112 E116 T169L65-R69 VanDerWaalsContact O-CB 3.32Å; L65-R69 WeakPolarHBondContact O-CB 3.27Å; L65-R69 WeakPolarHBondContact O-CG 3.38Å; L65-R69 PolarHBondContact O-N 2.92Å; R69-F72 PolarHBondContact O-N 2.84Å; R69-G73 PolarHBondContact O-N 2.87Å; R69-F112 HydrophobicContact CG-CZ 4.19Å; R69-E116 WeakPolarHBondContact CG-OE2 3.12Å; R69-E116 IonicContact CZ-OE1 2.92Å; R69-E116 VanDerWaalsContact NE-CD 3.32Å; R69-E116 IonicContact NE-OE1 3.31Å; R69-E116 PolarHBondContact NE-OE1 3.06Å; R69-E116 IonicContact NE-OE2 2.73Å; R69-E116 PolarHBondContact NE-OE2 3.19Å; R69-E116 IonicContact NH2-OE1 3.57Å; R69-E116 PolarHBondContact NH2-OE1 3.45Å; R69-T169 HydrophobicContact CB-CG2 3.89Å
70A98.4Very high97.7Very high14 Ų1424 Ų2412%0.11614%0.135CC..Hα-helixtrans-63.7-44.7173.700000111.6A66 A67 T68 G73 I74 P170 C173A66-A70 WeakPolarHBondContact O-CB 3.35Å; A66-A70 PolarHBondContact O-N 2.99Å; A67-A70 WeakPolarHBondContact O-CB 3.46Å; A67-A70 PolarHBondContact O-N 2.9Å; T68-A70 VanDerWaalsContact C-N 3.32Å; T68-A70 PolarHBondContact O-N 2.92Å; A70-G73 PolarHBondContact O-N 3.19Å; A70-I74 WeakPolarHBondContact O-CG1 3.45Å; A70-I74 PolarHBondContact O-N 3.39Å; A70-P170 HydrophobicContact CB-CB 4.27Å; A70-C173 HydrophobicContact CB-CB 3.95Å
71A98.5Very high97.8Very high36 Ų3625.9 Ų25.930%0.29815%0.147SC..Hα-helixtrans-61.8-43.8175.500000111.9V37 A67 T68 I74 H75V37-A71 HydrophobicContact CG1-CB 4.21Å; A67-A71 PolarHBondContact O-N 3.17Å; T68-A71 PolarHBondContact O-N 3.07Å; A71-I74 PolarHBondContact O-N 3.42Å; A71-H75 PolarHBondContact O-N 2.95Å; A71-H75 VanDerWaalsContact O-N 3.12Å
72F98.6Very high97.8Very high1 Ų128 Ų280%0.00415%0.151CC..Hα-helixtrans-62.4-42.8173.6-180-105.4000112.3Y34 T68 R69 I74 H75 S76 A109 F112 F113 L163 E166Y34-F72 HydrophobicContact CD1-CB 4.49Å; Y34-F72 HydrophobicContact CE1-CB 3.77Å; Y34-F72 HydrophobicContact CE1-CD2 4.28Å; Y34-F72 AromaticContact CE2-CD2 3.95Å; Y34-F72 HydrophobicContact CE2-CD2 3.95Å; Y34-F72 AromaticContact CZ-CD2 3.64Å; Y34-F72 WeakPolarHBondContact OH-CD2 3.22Å; T68-F72 PolarHBondContact O-N 3.26Å; R69-F72 PolarHBondContact O-N 2.84Å; F72-I74 VanDerWaalsContact C-N 3.3Å; F72-I74 PolarHBondContact O-N 2.77Å; F72-H75 WeakPolarHBondContact O-CB 3.25Å; F72-H75 PolarHBondContact O-N 3.3Å; F72-S76 VanDerWaalsContact CE1-OG 3.27Å; F72-S76 WeakPolarHBondContact CE1-OG 3.48Å; F72-S76 WeakPolarHBondContact CE2-OG 3.38Å; F72-S76 WeakPolarHBondContact CZ-OG 3.32Å; F72-S76 VanDerWaalsContact O-CB 3.28Å; F72-S76 WeakPolarHBondContact O-CB 3.28Å; F72-S76 PolarHBondContact O-N 2.88Å; F72-S76 PolarHBondContact O-OG 3.23Å; F72-A109 HydrophobicContact CE2-CB 3.98Å; F72-A109 HydrophobicContact CZ-CB 3.97Å; F72-F112 HydrophobicContact CB-CD1 4.33Å; F72-F112 HydrophobicContact CB-CD2 3.75Å; F72-F112 HydrophobicContact CB-CE1 4.11Å; F72-F112 HydrophobicContact CB-CE2 3.48Å; F72-F112 VanDerWaalsContact CB-CE2 3.48Å; F72-F112 HydrophobicContact CB-CG 4.16Å; F72-F112 HydrophobicContact CB-CZ 3.68Å; F72-F112 AromaticContact CD1-CD1 3.43Å; F72-F112 HydrophobicContact CD1-CD1 3.43Å; F72-F112 VanDerWaalsContact CD1-CD1 3.43Å; F72-F112 HydrophobicContact CD1-CD2 4.39Å; F72-F112 AromaticContact CD1-CE1 3.17Å; F72-F112 HydrophobicContact CD1-CE1 3.17Å; F72-F112 HydrophobicContact CD1-CE2 4.19Å; F72-F112 HydrophobicContact CD1-CG 4.05Å; F72-F112 AromaticContact CD1-CZ 3.6Å; F72-F112 HydrophobicContact CD1-CZ 3.6Å; F72-F112 HydrophobicContact CD2-CB 3.69Å; F72-F112 AromaticContact CD2-CD1 3.51Å; F72-F112 HydrophobicContact CD2-CD1 3.51Å; F72-F112 AromaticContact CD2-CD2 3.73Å; F72-F112 HydrophobicContact CD2-CD2 3.73Å; F72-F112 HydrophobicContact CD2-CE1 4.06Å; F72-F112 HydrophobicContact CD2-CE2 4.25Å; F72-F112 AromaticContact CD2-CG 3.31Å; F72-F112 HydrophobicContact CD2-CG 3.31Å; F72-F112 HydrophobicContact CD2-CZ 4.4Å; F72-F112 AromaticContact CE1-CD1 3.41Å; F72-F112 HydrophobicContact CE1-CD1 3.41Å; F72-F112 VanDerWaalsContact CE1-CD1 3.41Å; F72-F112 AromaticContact CE1-CE1 3.45Å; F72-F112 HydrophobicContact CE1-CE1 3.45Å; F72-F112 VanDerWaalsContact CE1-CE1 3.45Å; F72-F112 HydrophobicContact CE1-CG 4.26Å; F72-F112 HydrophobicContact CE1-CZ 4.33Å; F72-F112 HydrophobicContact CE2-CB 3.67Å; F72-F112 AromaticContact CE2-CD1 3.53Å; F72-F112 HydrophobicContact CE2-CD1 3.53Å; F72-F112 HydrophobicContact CE2-CD2 4.46Å; F72-F112 HydrophobicContact CE2-CE1 4.32Å; F72-F112 AromaticContact CE2-CG 3.61Å; F72-F112 HydrophobicContact CE2-CG 3.61Å; F72-F112 HydrophobicContact CG-CB 4.42Å; F72-F112 AromaticContact CG-CD1 3.46Å; F72-F112 HydrophobicContact CG-CD1 3.46Å; F72-F112 VanDerWaalsContact CG-CD1 3.46Å; F72-F112 AromaticContact CG-CD2 3.69Å; F72-F112 HydrophobicContact CG-CD2 3.69Å; F72-F112 AromaticContact CG-CE1 3.5Å; F72-F112 HydrophobicContact CG-CE1 3.5Å; F72-F112 VanDerWaalsContact CG-CE1 3.5Å; F72-F112 AromaticContact CG-CE2 3.72Å; F72-F112 HydrophobicContact CG-CE2 3.72Å; F72-F112 AromaticContact CG-CG 3.56Å; F72-F112 HydrophobicContact CG-CG 3.56Å; F72-F112 AromaticContact CG-CZ 3.62Å; F72-F112 HydrophobicContact CG-CZ 3.62Å; F72-F112 HydrophobicContact CZ-CB 4.36Å; F72-F112 AromaticContact CZ-CD1 3.46Å; F72-F112 HydrophobicContact CZ-CD1 3.46Å; F72-F112 VanDerWaalsContact CZ-CD1 3.46Å; F72-F112 HydrophobicContact CZ-CE1 4.03Å; F72-F112 HydrophobicContact CZ-CG 4.06Å; F72-F113 HydrophobicContact CE1-CE2 4.17Å; F72-F113 AromaticContact CE1-CZ 3.85Å; F72-F113 HydrophobicContact CE1-CZ 3.85Å; F72-F113 AromaticContact CZ-CE2 3.87Å; F72-F113 HydrophobicContact CZ-CE2 3.87Å; F72-F113 HydrophobicContact CZ-CZ 4.04Å; F72-L163 HydrophobicContact CZ-CD2 3.86Å; F72-E166 HydrophobicContact CE1-CG 4.14Å
73G98.3Very high97.9Very high0 Ų026.3 Ų26.30%014%0.144CC..Hα-helixtrans-60.1-38.9178.100000112.8R69 A70 S77R69-G73 PolarHBondContact O-N 2.87Å; A70-G73 PolarHBondContact O-N 3.19Å; G73-S77 WeakPolarHBondContact O-CB 3.36Å; G73-S77 PolarHBondContact O-N 2.9Å; G73-S77 PolarHBondContact O-OG 3.46Å
74I98.4Very high97.8Very high102 Ų10228.4 Ų28.452%0.52316%0.156SC..Hα-helixtrans-64.1-51.3173.7-66.9166.7000110.4A70 A71 F72 S76 S77 V78 P170A70-I74 WeakPolarHBondContact O-CG1 3.45Å; A70-I74 PolarHBondContact O-N 3.39Å; A71-I74 PolarHBondContact O-N 3.42Å; F72-I74 VanDerWaalsContact C-N 3.3Å; F72-I74 PolarHBondContact O-N 2.77Å; I74-S76 VanDerWaalsContact C-N 3.33Å; I74-S76 PolarHBondContact O-N 2.98Å; I74-S77 WeakPolarHBondContact O-CB 3.32Å; I74-S77 PolarHBondContact O-N 3.18Å; I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.34Å; I74-P170 HydrophobicContact CG1-CB 4.25Å; I74-P170 HydrophobicContact CG1-CG 3.86Å
75H97.9Very high97.6Very high41 Ų4133.3 Ų33.319%0.1919%0.186CC..Hα-helixtrans-54.2-49.6177.7173.2-160000111.7Y34 A71 F72 S77 V78 A79 H105Y34-H75 PolarHBondContact OH-ND1 3.17Å; A71-H75 PolarHBondContact O-N 2.95Å; A71-H75 VanDerWaalsContact O-N 3.12Å; F72-H75 WeakPolarHBondContact O-CB 3.25Å; F72-H75 PolarHBondContact O-N 3.3Å; H75-S77 VanDerWaalsContact C-N 3.34Å; H75-S77 PolarHBondContact O-N 3.1Å; H75-V78 PolarHBondContact O-N 3.36Å; H75-A79 PolarHBondContact O-N 3.47Å; H75-A79 VanDerWaalsContact O-N 3.1Å; H75-H105 AromaticContact CD2-CE1 3.71Å; H75-H105 AromaticContact CD2-ND1 3.51Å; H75-H105 AromaticContact CE1-ND1 3.79Å; H75-H105 AromaticContact NE2-CE1 3.3Å; H75-H105 PolarHBondContact NE2-CE1 3.43Å; H75-H105 VanDerWaalsContact NE2-CE1 3.3Å; H75-H105 AromaticContact NE2-ND1 2.77Å; H75-H105 PolarHBondContact NE2-ND1 3.44Å
76S98.1Very high97.5Very high1 Ų137.5 Ų37.51%0.00721%0.205CC..Hα-helixtrans-64.9-35.5179.7-65.50000113F72 I74 G80 L163F72-S76 VanDerWaalsContact CE1-OG 3.27Å; F72-S76 WeakPolarHBondContact CE1-OG 3.48Å; F72-S76 WeakPolarHBondContact CE2-OG 3.38Å; F72-S76 WeakPolarHBondContact CZ-OG 3.32Å; F72-S76 VanDerWaalsContact O-CB 3.28Å; F72-S76 WeakPolarHBondContact O-CB 3.28Å; F72-S76 PolarHBondContact O-N 2.88Å; F72-S76 PolarHBondContact O-OG 3.23Å; I74-S76 VanDerWaalsContact C-N 3.33Å; I74-S76 PolarHBondContact O-N 2.98Å; S76-G80 PolarHBondContact O-N 2.92Å; S76-L163 VanDerWaalsContact CB-O 3.28Å; S76-L163 WeakPolarHBondContact CB-O 3.36Å
77S98.3Very high97.2Very high19 Ų1944.5 Ų44.513%0.13324%0.238CC..Hα-helixtrans-65-42.7174.8-58.90000111.9G73 I74 H75 G80 L81 L164 M167G73-S77 WeakPolarHBondContact O-CB 3.36Å; G73-S77 PolarHBondContact O-N 2.9Å; G73-S77 PolarHBondContact O-OG 3.46Å; I74-S77 WeakPolarHBondContact O-CB 3.32Å; I74-S77 PolarHBondContact O-N 3.18Å; H75-S77 VanDerWaalsContact C-N 3.34Å; H75-S77 PolarHBondContact O-N 3.1Å; S77-G80 PolarHBondContact O-N 3.26Å; S77-L81 VanDerWaalsContact O-CB 3.3Å; S77-L81 WeakPolarHBondContact O-CB 3.23Å; S77-L81 VanDerWaalsContact O-CG 3.29Å; S77-L81 WeakPolarHBondContact O-CG 3.27Å; S77-L81 PolarHBondContact O-N 3.09Å; S77-L164 WeakPolarHBondContact O-CD1 3.07Å; S77-M167 WeakPolarHBondContact OG-CA 3.32Å; S77-M167 WeakPolarHBondContact OG-CB 3.4Å
78V98Very high97Very high91 Ų9143.6 Ų43.655%0.55223%0.23SC*.Hα-helixtrans-63.3-48.9177.81730000110.5I74 H75 G80 L81 R82I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.34Å; H75-V78 PolarHBondContact O-N 3.36Å; V78-G80 VanDerWaalsContact C-N 3.33Å; V78-G80 PolarHBondContact O-N 2.99Å; V78-L81 PolarHBondContact O-N 2.98Å; V78-R82 VanDerWaalsContact O-CB 3.27Å; V78-R82 WeakPolarHBondContact O-CB 3.34Å; V78-R82 PolarHBondContact O-N 2.95Å
79A97.6Very high96.8Very high0 Ų044 Ų440%023%0.233CC..Hα-helixtrans-59.1-44.6178.600000112.3H75 A83 H105 M160 L163H75-A79 PolarHBondContact O-N 3.47Å; H75-A79 VanDerWaalsContact O-N 3.1Å; A79-A83 PolarHBondContact O-N 3.36Å; A79-A83 VanDerWaalsContact O-N 3.09Å; A79-H105 HydrophobicContact CB-CB 4.23Å; A79-M160 HydrophobicContact CB-SD 4.19Å; A79-L163 HydrophobicContact CB-CD1 4.18Å
80G97.8Very high96.6Very high0 Ų042.9 Ų42.90%023%0.229CC..Hα-helixtrans-70.7-41.7-17900000114S76 S77 V78 A83 L84 M160S76-G80 PolarHBondContact O-N 2.92Å; S77-G80 PolarHBondContact O-N 3.26Å; V78-G80 VanDerWaalsContact C-N 3.33Å; V78-G80 PolarHBondContact O-N 2.99Å; G80-A83 PolarHBondContact O-N 3.39Å; G80-L84 PolarHBondContact O-N 3.33Å; G80-M160 VanDerWaalsContact CA-O 3.26Å; G80-M160 WeakPolarHBondContact CA-O 3.47Å
81L97.6Very high96.4Very high92 Ų9244 Ų4448%0.48224%0.236SC..Hα-helixtrans-62.2-45.8174-77.6170.9000110.5S77 V78 A83 L84 T85 L164S77-L81 VanDerWaalsContact O-CB 3.3Å; S77-L81 WeakPolarHBondContact O-CB 3.23Å; S77-L81 VanDerWaalsContact O-CG 3.29Å; S77-L81 WeakPolarHBondContact O-CG 3.27Å; S77-L81 PolarHBondContact O-N 3.09Å; V78-L81 PolarHBondContact O-N 2.98Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 3.38Å; L81-L84 PolarHBondContact O-N 2.97Å; L81-T85 PolarHBondContact O-N 3.27Å; L81-T85 PolarHBondContact O-OG1 3.2Å; L81-L164 HydrophobicContact CD2-CD1 4.23Å; L81-L164 HydrophobicContact CD2-CD2 4.36Å; L81-L164 HydrophobicContact CG-CD1 3.8Å
82R96.9Very high96.1Very high84 Ų8447.9 Ų47.932%0.31725%0.246SC..Hα-helixtrans-52.5-48.9175.1178.7167.3-170.8-148-7.2111.9V78 L84 T85 E86 W101V78-R82 VanDerWaalsContact O-CB 3.27Å; V78-R82 WeakPolarHBondContact O-CB 3.34Å; V78-R82 PolarHBondContact O-N 2.95Å; R82-L84 PolarHBondContact O-N 3.34Å; R82-T85 PolarHBondContact O-N 3.46Å; R82-E86 HydrophobicContact CG-CB 4.41Å; R82-E86 HydrophobicContact CG-CG 4.19Å; R82-E86 WeakPolarHBondContact CG-OE2 3.45Å; R82-E86 IonicContact CZ-OE2 3.47Å; R82-E86 IonicContact NE-OE1 3.27Å; R82-E86 IonicContact NE-OE2 3.06Å; R82-E86 PolarHBondContact NE-OE2 2.82Å; R82-E86 IonicContact NH2-OE2 2.61Å; R82-E86 WeakPolarHBondContact O-CB 3.46Å; R82-E86 PolarHBondContact O-N 2.98Å; R82-W101 HydrophobicContact CG-CH2 4.21Å; R82-W101 HydrophobicContact CG-CZ2 4.48Å; R82-W101 HydrophobicContact CG-CZ3 4.29Å; R82-W101 VanDerWaalsContact NH1-CD2 3.27Å
83A96.5Very high96Very high0 Ų049.4 Ų49.40%025%0.254CS..Hα-helixtrans-61.4-29.8178.200000113.8A79 G80 L81 W101 F157 M160A79-A83 PolarHBondContact O-N 3.36Å; A79-A83 VanDerWaalsContact O-N 3.09Å; G80-A83 PolarHBondContact O-N 3.39Å; L81-A83 VanDerWaalsContact C-N 3.31Å; L81-A83 PolarHBondContact O-N 3.38Å; A83-W101 HydrophobicContact CB-CH2 4.03Å; A83-F157 WeakPolarHBondContact O-CE2 3.42Å; A83-M160 HydrophobicContact CB-CB 3.41Å; A83-M160 VanDerWaalsContact CB-CB 3.41Å; A83-M160 HydrophobicContact CB-CG 3.95Å
84L95.3Very high95.9Very high59 Ų5951.8 Ų51.831%0.30927%0.265SS..Hα-helixtrans-84.6-32.8179.5-73.3-176000113.7G80 L81 R82 F157 V161 L164 L206 Y209G80-L84 PolarHBondContact O-N 3.33Å; L81-L84 PolarHBondContact O-N 2.97Å; R82-L84 PolarHBondContact O-N 3.34Å; L84-F157 HydrophobicContact CD2-CE2 4.4Å; L84-F157 HydrophobicContact CD2-CZ 3.93Å; L84-V161 HydrophobicContact CD2-CG2 3.74Å; L84-V161 HydrophobicContact CG-CG2 4.3Å; L84-L164 HydrophobicContact CD1-CD2 3.32Å; L84-L164 HydrophobicContact CG-CD2 4.24Å; L84-L206 HydrophobicContact CD1-CD2 3.85Å; L84-Y209 HydrophobicContact CD2-CD1 4.49Å; L84-Y209 HydrophobicContact CD2-CE1 3.77Å
85T95.2Very high95.7Very high108 Ų10847 Ų4766%0.66324%0.241SC*.Hα-helixtrans-106.2-25.9-169.360.50000114.1L81 R82L81-T85 PolarHBondContact O-N 3.27Å; L81-T85 PolarHBondContact O-OG1 3.2Å; R82-T85 PolarHBondContact O-N 3.46Å
86E94Very high95.6Very high90 Ų9048.2 Ų48.242%0.42125%0.248SC..SBendtrans-92.2141.4-179.3-66-178.7-163.800112R82 S88 S91R82-E86 HydrophobicContact CG-CB 4.41Å; R82-E86 HydrophobicContact CG-CG 4.19Å; R82-E86 WeakPolarHBondContact CG-OE2 3.45Å; R82-E86 IonicContact CZ-OE2 3.47Å; R82-E86 IonicContact NE-OE1 3.27Å; R82-E86 IonicContact NE-OE2 3.06Å; R82-E86 PolarHBondContact NE-OE2 2.82Å; R82-E86 IonicContact NH2-OE2 2.61Å; R82-E86 WeakPolarHBondContact O-CB 3.46Å; R82-E86 PolarHBondContact O-N 2.98Å; E86-S88 PolarHBondContact O-N 3.46Å; E86-S91 PolarHBondContact O-OG 3.39Å
87E91.8Very high95.5Very high150 Ų15048.5 Ų48.570%0.70125%0.251SS*.  trans-71.2118168.8-166.6-178.816300109K92E87-K92 WeakPolarHBondContact OE1-CE 3.12Å; E87-K92 IonicContact OE1-NZ 2.73Å; E87-K92 PolarHBondContact OE1-NZ 2.91Å
88S93.4Very high95.4Very high4 Ų448.4 Ų48.43%0.02825%0.248CC..SBendtrans-150.1169.7-177.559.40000109.8E86 L90 S91 K92 E99E86-S88 PolarHBondContact O-N 3.46Å; S88-L90 PolarHBondContact O-N 3Å; S88-L90 PolarHBondContact OG-N 2.86Å; S88-S91 PolarHBondContact N-OG 3.15Å; S88-S91 PolarHBondContact O-N 2.9Å; S88-S91 VanDerWaalsContact O-N 3.14Å; S88-S91 PolarHBondContact O-OG 3.43Å; S88-S91 PolarHBondContact OG-N 3.38Å; S88-K92 WeakPolarHBondContact O-CG 3.09Å; S88-K92 PolarHBondContact O-N 3.49Å; S88-E99 WeakPolarHBondContact CB-OE1 3.28Å
89A94Very high95.2Very high9 Ų944.7 Ų44.77%0.07423%0.225CC..Hα-helixtrans-56.9-30.5171.400000111.9L10 D93 E99L10-A89 HydrophobicContact CD1-CB 4.26Å; A89-D93 PolarHBondContact O-N 2.79Å; A89-E99 HydrophobicContact CB-CG 3.8Å; A89-E99 VanDerWaalsContact CB-OE1 3.3Å; A89-E99 WeakPolarHBondContact CB-OE1 3.38Å; A89-E99 PolarHBondContact N-OE1 2.94Å
90L94.6Very high95.1Very high0 Ų047.7 Ų47.70%024%0.241CC..Hα-helixtrans-66.7-42.1175.9-81.168000112.3S88 D93 K94 E99 W101 H156 F157 M160S88-L90 PolarHBondContact O-N 3Å; S88-L90 PolarHBondContact OG-N 2.86Å; L90-D93 CarbonylContact O-C 3.54Å; L90-D93 VanDerWaalsContact O-C 3.28Å; L90-K94 PolarHBondContact O-N 3.42Å; L90-E99 HydrophobicContact CD1-CB 4.04Å; L90-E99 HydrophobicContact CD1-CG 3.83Å; L90-W101 HydrophobicContact CD1-CZ2 4.27Å; L90-W101 HydrophobicContact CD2-CH2 3.75Å; L90-W101 HydrophobicContact CD2-CZ2 3.8Å; L90-H156 HydrophobicContact CD2-CB 4.05Å; L90-H156 HydrophobicContact CG-CB 4.41Å; L90-F157 HydrophobicContact CB-CB 4.29Å; L90-F157 HydrophobicContact CB-CD2 4.26Å; L90-F157 WeakPolarHBondContact O-CD2 3.42Å; L90-M160 HydrophobicContact CD2-CG 3.7Å
91S92.9Very high95Very high37 Ų3749.2 Ų49.226%0.25925%0.247SC..Hα-helixtrans-78-28.4-179.254.10000112.5E86 S88E86-S91 PolarHBondContact O-OG 3.39Å; S88-S91 PolarHBondContact N-OG 3.15Å; S88-S91 PolarHBondContact O-N 2.9Å; S88-S91 VanDerWaalsContact O-N 3.14Å; S88-S91 PolarHBondContact O-OG 3.43Å; S88-S91 PolarHBondContact OG-N 3.38Å
92K93.9Very high95Very high118 Ų11844.9 Ų44.951%0.51322%0.224SC..Hα-helixtrans-74.7-37.5172.7-64-164.3-158.9-1780113.3L10 E87 S88L10-K92 HydrophobicContact CD1-CD 3.45Å; L10-K92 VanDerWaalsContact CD1-CD 3.45Å; L10-K92 HydrophobicContact CD1-CG 4.22Å; E87-K92 WeakPolarHBondContact OE1-CE 3.12Å; E87-K92 IonicContact OE1-NZ 2.73Å; E87-K92 PolarHBondContact OE1-NZ 2.91Å; S88-K92 WeakPolarHBondContact O-CG 3.09Å; S88-K92 PolarHBondContact O-N 3.49Å
93D94.8Very high95Very high32 Ų3240.9 Ų40.917%0.17121%0.209CC..  trans-129.396.9173.5-162.2-41.6000111.7A89 L90 V95 I96 G97 R220A89-D93 PolarHBondContact O-N 2.79Å; L90-D93 CarbonylContact O-C 3.54Å; L90-D93 VanDerWaalsContact O-C 3.28Å; D93-V95 PolarHBondContact O-N 2.86Å; D93-V95 PolarHBondContact OD1-N 2.9Å; D93-I96 HydrophobicContact CB-CG1 4.31Å; D93-I96 WeakPolarHBondContact OD1-CG1 3.37Å; D93-I96 PolarHBondContact OD1-N 2.91Å; D93-I96 VanDerWaalsContact OD2-CG1 3.23Å; D93-I96 WeakPolarHBondContact OD2-CG1 3.27Å; D93-G97 WeakPolarHBondContact O-CA 3.47Å; D93-G97 PolarHBondContact O-N 3.43Å; D93-R220 IonicContact OD1-CZ 2.81Å; D93-R220 IonicContact OD1-NH1 3.85Å; D93-R220 PolarHBondContact OD1-NH1 3.04Å; D93-R220 IonicContact OD1-NH2 3.55Å; D93-R220 IonicContact OD2-CZ 3.69Å; D93-R220 VanDerWaalsContact OD2-CZ 3.27Å; D93-R220 IonicContact OD2-NH1 3.71Å; D93-R220 PolarHBondContact OD2-NH1 3.31Å; D93-R220 IonicContact OD2-NH2 2.68Å; D93-R220 PolarHBondContact OD2-NH2 3.2Å
94K96Very high95Very high50 Ų5045.2 Ų45.222%0.21723%0.228CC..THydrogen-bonded Turntrans-72.8-10.4-176.8-61.3-178.3-179.2-178.80114.1L90 F157 Y209 V213L90-K94 PolarHBondContact O-N 3.42Å; K94-F157 HydrophobicContact CB-CB 4.19Å; K94-F157 HydrophobicContact CB-CD1 3.74Å; K94-F157 HydrophobicContact CB-CE1 4.35Å; K94-F157 HydrophobicContact CB-CG 3.96Å; K94-F157 HydrophobicContact CD-CD1 3.94Å; K94-F157 HydrophobicContact CD-CE1 3.67Å; K94-F157 HydrophobicContact CD-CE2 4.46Å; K94-F157 HydrophobicContact CD-CG 4.46Å; K94-F157 HydrophobicContact CD-CZ 3.96Å; K94-F157 HydrophobicContact CG-CB 4.46Å; K94-F157 HydrophobicContact CG-CD1 3.71Å; K94-F157 HydrophobicContact CG-CD2 4.11Å; K94-F157 HydrophobicContact CG-CE1 3.94Å; K94-F157 HydrophobicContact CG-CE2 4.31Å; K94-F157 HydrophobicContact CG-CG 3.82Å; K94-F157 HydrophobicContact CG-CZ 4.24Å; K94-Y209 PolarHBondContact NZ-OH 3.09Å; K94-V213 HydrophobicContact CB-CG1 4.1Å; K94-V213 HydrophobicContact CD-CG1 3.9Å; K94-V213 HydrophobicContact CD-CG2 4.19Å
95V95.7Very high95.2Very high3 Ų343.4 Ų43.42%0.01822%0.218CC..THydrogen-bonded Turntrans-102.7-40.3-174.6-177.60000111.7D93 G155 H217 R220 M221 H224D93-V95 PolarHBondContact O-N 2.86Å; D93-V95 PolarHBondContact OD1-N 2.9Å; V95-G155 VanDerWaalsContact O-CA 3.28Å; V95-G155 WeakPolarHBondContact O-CA 3.3Å; V95-G155 PolarHBondContact O-N 3.2Å; V95-H217 HydrophobicContact CG2-CB 3.53Å; V95-R220 HydrophobicContact CB-CB 4.4Å; V95-R220 HydrophobicContact CG1-CB 4.06Å; V95-R220 HydrophobicContact CG2-CB 4.05Å; V95-M221 HydrophobicContact CB-SD 4.44Å; V95-M221 HydrophobicContact CG1-CG 4.39Å; V95-M221 HydrophobicContact CG1-SD 3.87Å; V95-M221 HydrophobicContact CG2-CG 4.32Å; V95-M221 HydrophobicContact CG2-SD 4.16Å; V95-H224 HydrophobicContact CG1-CB 4.34Å
96I95.4Very high95.3Very high66 Ų6638.2 Ų38.234%0.33819%0.186SC..THydrogen-bonded Turntrans-125.2-6.8-176.561.7168.1000113.8D93 Q98 G155 H224D93-I96 HydrophobicContact CB-CG1 4.31Å; D93-I96 WeakPolarHBondContact OD1-CG1 3.37Å; D93-I96 PolarHBondContact OD1-N 2.91Å; D93-I96 VanDerWaalsContact OD2-CG1 3.23Å; D93-I96 WeakPolarHBondContact OD2-CG1 3.27Å; I96-Q98 PolarHBondContact O-N 3.4Å; I96-G155 VanDerWaalsContact C-CA 3.45Å; I96-H224 HydrophobicContact CG2-CB 3.75Å
97G95.2Very high95.5Very high7 Ų734 Ų347%0.07217%0.166CC..  trans-63.5131.4-178.400000112.8D93 G155 H156D93-G97 WeakPolarHBondContact O-CA 3.47Å; D93-G97 PolarHBondContact O-N 3.43Å; G97-G155 CarbonylContact O-C 3.56Å; G97-G155 VanDerWaalsContact O-CA 3.27Å; G97-G155 WeakPolarHBondContact O-CA 3.38Å; G97-H156 PolarHBondContact O-N 3.49Å
98Q95.9Very high95.8Very high16 Ų1627.3 Ų27.38%0.07514%0.136CC..  trans-141.8150.5178.8-65.9178-0.300110.1P13 I96 W103 D152 Q154P13-Q98 HydrophobicContact CG-CB 4.16Å; I96-Q98 PolarHBondContact O-N 3.4Å; Q98-W103 VanDerWaalsContact OE1-NE1 3.1Å; Q98-D152 PolarHBondContact NE2-O 3.09Å; Q98-Q154 PolarHBondContact NE2-O 3.42Å
99E95.3Very high96.1Very high13 Ų1327.2 Ų27.26%0.06114%0.135CC..  trans-145.7162.8172.5-66.2-171.3176.900110.3S88 A89 L90 W101 S102 W103S88-E99 WeakPolarHBondContact CB-OE1 3.28Å; A89-E99 HydrophobicContact CB-CG 3.8Å; A89-E99 VanDerWaalsContact CB-OE1 3.3Å; A89-E99 WeakPolarHBondContact CB-OE1 3.38Å; A89-E99 PolarHBondContact N-OE1 2.94Å; L90-E99 HydrophobicContact CD1-CB 4.04Å; L90-E99 HydrophobicContact CD1-CG 3.83Å; E99-W101 VanDerWaalsContact C-N 3.34Å; E99-W101 PolarHBondContact O-N 3.05Å; E99-W101 VanDerWaalsContact OE2-CD1 3.27Å; E99-W101 PolarHBondContact OE2-NE1 2.68Å; E99-S102 PolarHBondContact N-OG 3.14Å; E99-S102 WeakPolarHBondContact O-CA 3.44Å; E99-S102 WeakPolarHBondContact O-CB 3.28Å; E99-S102 PolarHBondContact O-N 3.29Å; E99-S102 PolarHBondContact O-OG 3.24Å; E99-W103 PolarHBondContact O-N 2.96Å
100D95.3Very high96.3Very high63 Ų6327.1 Ų27.134%0.33713%0.133SC..Hα-helixtrans-58.5-41.3-176.7-72.1-18.6000113.8P13 S14 C17 S102 W103 F104P13-D100 VanDerWaalsContact CA-OD1 3.3Å; P13-D100 WeakPolarHBondContact CA-OD1 3.35Å; S14-D100 WeakPolarHBondContact CB-OD1 3.35Å; S14-D100 WeakPolarHBondContact CB-OD2 3.19Å; S14-D100 PolarHBondContact N-OD1 3.01Å; S14-D100 PolarHBondContact OG-OD2 2.94Å; C17-D100 PolarHBondContact SG-OD1 3.44Å; D100-S102 VanDerWaalsContact C-N 3.27Å; D100-S102 PolarHBondContact O-N 2.9Å; D100-W103 WeakPolarHBondContact O-CB 3.33Å; D100-W103 PolarHBondContact O-N 3.29Å; D100-F104 PolarHBondContact O-N 3.4Å
101W95.8Very high96.5Very high33 Ų3327.1 Ų27.113%0.12513%0.133CC..Hα-helixtrans-66.4-32.6177.169.7-92.6000111.7R82 A83 L90 E99 F104 H105 M160R82-W101 HydrophobicContact CG-CH2 4.21Å; R82-W101 HydrophobicContact CG-CZ2 4.48Å; R82-W101 HydrophobicContact CG-CZ3 4.29Å; R82-W101 VanDerWaalsContact NH1-CD2 3.27Å; A83-W101 HydrophobicContact CB-CH2 4.03Å; L90-W101 HydrophobicContact CD1-CZ2 4.27Å; L90-W101 HydrophobicContact CD2-CH2 3.75Å; L90-W101 HydrophobicContact CD2-CZ2 3.8Å; E99-W101 VanDerWaalsContact C-N 3.34Å; E99-W101 PolarHBondContact O-N 3.05Å; E99-W101 VanDerWaalsContact OE2-CD1 3.27Å; E99-W101 PolarHBondContact OE2-NE1 2.68Å; W101-F104 WeakPolarHBondContact O-CB 3.37Å; W101-F104 PolarHBondContact O-N 3.43Å; W101-H105 AromaticContact CE3-CD2 3.4Å; W101-H105 VanDerWaalsContact CE3-CD2 3.4Å; W101-H105 AromaticContact CE3-NE2 3.73Å; W101-H105 AromaticContact CZ3-CD2 3.81Å; W101-H105 PolarHBondContact O-CD2 3.19Å; W101-H105 PolarHBondContact O-N 2.8Å; W101-H105 VanDerWaalsContact O-N 3.1Å; W101-M160 HydrophobicContact CH2-CG 4.15Å; W101-M160 HydrophobicContact CH2-SD 4.43Å; W101-M160 HydrophobicContact CZ3-CG 4.2Å; W101-M160 HydrophobicContact CZ3-SD 3.88Å
102S97Very high96.8Very high0 Ų025.5 Ų25.50%012%0.122CC..Hα-helixtrans-70.4-38.4175.7760000111.3E99 D100 H105 V106 H156E99-S102 PolarHBondContact N-OG 3.14Å; E99-S102 WeakPolarHBondContact O-CA 3.44Å; E99-S102 WeakPolarHBondContact O-CB 3.28Å; E99-S102 PolarHBondContact O-N 3.29Å; E99-S102 PolarHBondContact O-OG 3.24Å; D100-S102 VanDerWaalsContact C-N 3.27Å; D100-S102 PolarHBondContact O-N 2.9Å; S102-H105 PolarHBondContact O-N 3.48Å; S102-V106 WeakPolarHBondContact O-CG2 3.34Å; S102-V106 PolarHBondContact O-N 3.48Å; S102-H156 PolarHBondContact OG-ND1 3.02Å
103W97.3Very high97Very high0 Ų020.2 Ų20.20%010%0.099CC..Hα-helixtrans-59.9-47.1171.2-88105.6000111.2C17 F18 R23 Q98 E99 D100 H105 V106 L107 D152 H156C17-W103 HydrophobicContact CB-CB 4.27Å; C17-W103 HydrophobicContact CB-CD2 3.94Å; C17-W103 HydrophobicContact CB-CG 3.71Å; F18-W103 HydrophobicContact CD1-CZ2 4.4Å; F18-W103 HydrophobicContact CE1-CZ2 4.07Å; R23-W103 VanDerWaalsContact NH2-CH2 3.31Å; Q98-W103 VanDerWaalsContact OE1-NE1 3.1Å; E99-W103 PolarHBondContact O-N 2.96Å; D100-W103 WeakPolarHBondContact O-CB 3.33Å; D100-W103 PolarHBondContact O-N 3.29Å; W103-H105 VanDerWaalsContact C-N 3.31Å; W103-H105 PolarHBondContact O-N 2.86Å; W103-V106 PolarHBondContact O-N 3.39Å; W103-L107 HydrophobicContact CE3-CD1 4.09Å; W103-L107 HydrophobicContact CE3-CG 4.2Å; W103-L107 WeakPolarHBondContact O-CB 3.12Å; W103-L107 VanDerWaalsContact O-CG 3.25Å; W103-L107 WeakPolarHBondContact O-CG 3.44Å; W103-L107 PolarHBondContact O-N 2.96Å; W103-D152 HydrophobicContact CH2-CB 3.9Å; W103-D152 HydrophobicContact CZ2-CB 4.05Å; W103-H156 AromaticContact CD1-CE1 3.83Å; W103-H156 AromaticContact CD2-CE1 3.46Å; W103-H156 VanDerWaalsContact CD2-CE1 3.46Å; W103-H156 AromaticContact CE2-CE1 3.43Å; W103-H156 VanDerWaalsContact CE2-CE1 3.43Å; W103-H156 AromaticContact CE3-CE1 3.9Å; W103-H156 AromaticContact CG-CE1 3.72Å; W103-H156 AromaticContact CZ2-CE1 3.85Å; W103-H156 AromaticContact NE1-CE1 3.66Å
104F97.4Very high97.1Very high92 Ų9221.1 Ų21.140%0.40411%0.106SC..Hα-helixtrans-53.9-46.9175.6172.9-98.2000112.1L26 D100 W101 T108L26-F104 HydrophobicContact CD2-CD2 4.49Å; D100-F104 PolarHBondContact O-N 3.4Å; W101-F104 WeakPolarHBondContact O-CB 3.37Å; W101-F104 PolarHBondContact O-N 3.43Å; F104-T108 WeakPolarHBondContact O-CB 3.35Å; F104-T108 PolarHBondContact O-N 3.4Å; F104-T108 PolarHBondContact O-OG1 3.35Å
105H98Very high97.2Very high20 Ų2019.3 Ų19.39%0.09310%0.098CC..Hα-helixtrans-69.6-41.4178.5-67.7-59.5000113.3H75 A79 W101 S102 W103 A109 M160 L163H75-H105 AromaticContact CD2-CE1 3.71Å; H75-H105 AromaticContact CD2-ND1 3.51Å; H75-H105 AromaticContact CE1-ND1 3.79Å; H75-H105 AromaticContact NE2-CE1 3.3Å; H75-H105 PolarHBondContact NE2-CE1 3.43Å; H75-H105 VanDerWaalsContact NE2-CE1 3.3Å; H75-H105 AromaticContact NE2-ND1 2.77Å; H75-H105 PolarHBondContact NE2-ND1 3.44Å; A79-H105 HydrophobicContact CB-CB 4.23Å; W101-H105 AromaticContact CE3-CD2 3.4Å; W101-H105 VanDerWaalsContact CE3-CD2 3.4Å; W101-H105 AromaticContact CE3-NE2 3.73Å; W101-H105 AromaticContact CZ3-CD2 3.81Å; W101-H105 PolarHBondContact O-CD2 3.19Å; W101-H105 PolarHBondContact O-N 2.8Å; W101-H105 VanDerWaalsContact O-N 3.1Å; S102-H105 PolarHBondContact O-N 3.48Å; W103-H105 VanDerWaalsContact C-N 3.31Å; W103-H105 PolarHBondContact O-N 2.86Å; H105-A109 WeakPolarHBondContact O-CB 3.48Å; H105-A109 PolarHBondContact O-N 3.5Å; H105-M160 HydrophobicContact CB-CE 3.89Å; H105-M160 HydrophobicContact CB-SD 3.87Å; H105-L163 HydrophobicContact CB-CD1 4Å
106V98.1Very high97.3Very high0 Ų019.2 Ų19.20%010%0.097CC..Hα-helixtrans-60-47.3176.5167.40000110.8S102 W103 A109 T110 F145 A148 V149 H156 A159 M160S102-V106 WeakPolarHBondContact O-CG2 3.34Å; S102-V106 PolarHBondContact O-N 3.48Å; W103-V106 PolarHBondContact O-N 3.39Å; V106-A109 PolarHBondContact O-N 3.28Å; V106-T110 WeakPolarHBondContact O-CB 3.46Å; V106-T110 PolarHBondContact O-N 3.45Å; V106-T110 PolarHBondContact O-OG1 3Å; V106-F145 HydrophobicContact CG1-CD1 4.39Å; V106-A148 HydrophobicContact CG1-CB 3.86Å; V106-V149 HydrophobicContact CG1-CG2 3.85Å; V106-H156 HydrophobicContact CG2-CB 4.46Å; V106-A159 HydrophobicContact CG2-CB 4.29Å; V106-M160 HydrophobicContact CG2-CE 3.5Å
107L98.3Very high97.4Very high0 Ų016.8 Ų16.80%09%0.085CC..Hα-helixtrans-68.5-43.6-178.6-66.4168.3000111.5R23 L26 I27 W103 A109 T110 G111 V149R23-L107 HydrophobicContact CB-CD2 3.76Å; R23-L107 HydrophobicContact CG-CD1 4.25Å; R23-L107 HydrophobicContact CG-CD2 3.86Å; L26-L107 HydrophobicContact CB-CB 3.94Å; L26-L107 HydrophobicContact CB-CD1 4.08Å; L26-L107 HydrophobicContact CD1-CB 4.46Å; L26-L107 HydrophobicContact CD1-CD1 3.61Å; L26-L107 HydrophobicContact CG-CD1 4.49Å; I27-L107 HydrophobicContact CD1-CD2 3.9Å; I27-L107 HydrophobicContact CG1-CB 4.29Å; I27-L107 HydrophobicContact CG1-CD2 3.92Å; W103-L107 HydrophobicContact CE3-CD1 4.09Å; W103-L107 HydrophobicContact CE3-CG 4.2Å; W103-L107 WeakPolarHBondContact O-CB 3.12Å; W103-L107 VanDerWaalsContact O-CG 3.25Å; W103-L107 WeakPolarHBondContact O-CG 3.44Å; W103-L107 PolarHBondContact O-N 2.96Å; L107-A109 PolarHBondContact O-N 3.02Å; L107-T110 WeakPolarHBondContact O-CB 3.26Å; L107-T110 PolarHBondContact O-N 2.97Å; L107-G111 PolarHBondContact O-N 2.83Å; L107-V149 HydrophobicContact CD2-CG1 4Å; L107-V149 HydrophobicContact CD2-CG2 3.7Å
108T98.4Very high97.4Very high11 Ų1120 Ų207%0.06710%0.103CC..Hα-helixtrans-64.5-41.3176.5-57.20000111.7Y34 F104 G111 F112Y34-T108 HydrophobicContact CE2-CG2 4.07Å; F104-T108 WeakPolarHBondContact O-CB 3.35Å; F104-T108 PolarHBondContact O-N 3.4Å; F104-T108 PolarHBondContact O-OG1 3.35Å; T108-G111 PolarHBondContact O-N 3.21Å; T108-F112 PolarHBondContact O-N 2.71Å
109A98.4Very high97.4Very high1 Ų120.2 Ų20.21%0.00811%0.107CC..Hα-helixtrans-64.9-39175.500000112.1F72 H105 V106 L107 G111 F112 F113 F145 L163F72-A109 HydrophobicContact CE2-CB 3.98Å; F72-A109 HydrophobicContact CZ-CB 3.97Å; H105-A109 WeakPolarHBondContact O-CB 3.48Å; H105-A109 PolarHBondContact O-N 3.5Å; V106-A109 PolarHBondContact O-N 3.28Å; L107-A109 PolarHBondContact O-N 3.02Å; A109-G111 VanDerWaalsContact C-N 3.34Å; A109-G111 PolarHBondContact O-N 3.36Å; A109-F112 WeakPolarHBondContact O-CB 3.41Å; A109-F112 PolarHBondContact O-N 3.19Å; A109-F113 HydrophobicContact CB-CE2 4.43Å; A109-F113 WeakPolarHBondContact O-CD2 3.33Å; A109-F113 PolarHBondContact O-N 3.36Å; A109-F145 HydrophobicContact CB-CD1 4.12Å; A109-F145 HydrophobicContact CB-CE1 4.18Å; A109-F145 HydrophobicContact CB-CG 4.41Å; A109-L163 HydrophobicContact CB-CD1 4.45Å; A109-L163 HydrophobicContact CB-CD2 3.65Å
110T98.6Very high97.3Very high7 Ų720.1 Ų20.14%0.04311%0.107CC..Hα-helixtrans-58.7-47.7172.6-56.30000110.4I27 V106 L107 F112 F113 V114 V149I27-T110 HydrophobicContact CD1-CG2 4.1Å; I27-T110 HydrophobicContact CG1-CG2 4.19Å; I27-T110 HydrophobicContact CG2-CG2 4.46Å; V106-T110 WeakPolarHBondContact O-CB 3.46Å; V106-T110 PolarHBondContact O-N 3.45Å; V106-T110 PolarHBondContact O-OG1 3Å; L107-T110 WeakPolarHBondContact O-CB 3.26Å; L107-T110 PolarHBondContact O-N 2.97Å; T110-F112 PolarHBondContact O-N 2.91Å; T110-F113 PolarHBondContact O-N 3.12Å; T110-V114 WeakPolarHBondContact O-CG2 3.37Å; T110-V114 PolarHBondContact O-N 3.41Å; T110-V149 HydrophobicContact CG2-CG2 4.41Å; T110-V149 WeakPolarHBondContact OG1-CG2 3.34Å
111G98.6Very high97.3Very high0 Ų021 Ų210%011%0.109CC..Hα-helixtrans-57.8-43.9174.400000113.5I27 L107 T108 A109 V114 F115I27-G111 WeakPolarHBondContact O-CA 3.43Å; L107-G111 PolarHBondContact O-N 2.83Å; T108-G111 PolarHBondContact O-N 3.21Å; A109-G111 VanDerWaalsContact C-N 3.34Å; A109-G111 PolarHBondContact O-N 3.36Å; G111-V114 PolarHBondContact O-N 3.18Å; G111-F115 PolarHBondContact O-N 2.94Å
112F98.6Very high97.3Very high4 Ų422.4 Ų22.42%0.01812%0.124CC..Hα-helixtrans-59.3-48.9173.3171.1-99.8000112.3Y34 T68 R69 F72 T108 A109 T110 V114 F115 E116Y34-F112 AromaticContact CD1-CD2 3.79Å; Y34-F112 HydrophobicContact CD1-CD2 3.79Å; Y34-F112 HydrophobicContact CD1-CE2 4.3Å; Y34-F112 HydrophobicContact CD2-CB 3.58Å; Y34-F112 AromaticContact CD2-CD2 3.67Å; Y34-F112 HydrophobicContact CD2-CD2 3.67Å; Y34-F112 HydrophobicContact CD2-CG 4.08Å; Y34-F112 HydrophobicContact CE1-CD2 4.14Å; Y34-F112 HydrophobicContact CE2-CB 3.72Å; Y34-F112 HydrophobicContact CE2-CD2 4.04Å; Y34-F112 HydrophobicContact CE2-CG 4.23Å; Y34-F112 HydrophobicContact CG-CB 4.34Å; Y34-F112 AromaticContact CG-CD2 3.55Å; Y34-F112 HydrophobicContact CG-CD2 3.55Å; Y34-F112 HydrophobicContact CG-CE2 4.41Å; Y34-F112 HydrophobicContact CG-CG 4.41Å; T68-F112 HydrophobicContact CG2-CE2 4.38Å; R69-F112 HydrophobicContact CG-CZ 4.19Å; F72-F112 HydrophobicContact CB-CD1 4.33Å; F72-F112 HydrophobicContact CB-CD2 3.75Å; F72-F112 HydrophobicContact CB-CE1 4.11Å; F72-F112 HydrophobicContact CB-CE2 3.48Å; F72-F112 VanDerWaalsContact CB-CE2 3.48Å; F72-F112 HydrophobicContact CB-CG 4.16Å; F72-F112 HydrophobicContact CB-CZ 3.68Å; F72-F112 AromaticContact CD1-CD1 3.43Å; F72-F112 HydrophobicContact CD1-CD1 3.43Å; F72-F112 VanDerWaalsContact CD1-CD1 3.43Å; F72-F112 HydrophobicContact CD1-CD2 4.39Å; F72-F112 AromaticContact CD1-CE1 3.17Å; F72-F112 HydrophobicContact CD1-CE1 3.17Å; F72-F112 HydrophobicContact CD1-CE2 4.19Å; F72-F112 HydrophobicContact CD1-CG 4.05Å; F72-F112 AromaticContact CD1-CZ 3.6Å; F72-F112 HydrophobicContact CD1-CZ 3.6Å; F72-F112 HydrophobicContact CD2-CB 3.69Å; F72-F112 AromaticContact CD2-CD1 3.51Å; F72-F112 HydrophobicContact CD2-CD1 3.51Å; F72-F112 AromaticContact CD2-CD2 3.73Å; F72-F112 HydrophobicContact CD2-CD2 3.73Å; F72-F112 HydrophobicContact CD2-CE1 4.06Å; F72-F112 HydrophobicContact CD2-CE2 4.25Å; F72-F112 AromaticContact CD2-CG 3.31Å; F72-F112 HydrophobicContact CD2-CG 3.31Å; F72-F112 HydrophobicContact CD2-CZ 4.4Å; F72-F112 AromaticContact CE1-CD1 3.41Å; F72-F112 HydrophobicContact CE1-CD1 3.41Å; F72-F112 VanDerWaalsContact CE1-CD1 3.41Å; F72-F112 AromaticContact CE1-CE1 3.45Å; F72-F112 HydrophobicContact CE1-CE1 3.45Å; F72-F112 VanDerWaalsContact CE1-CE1 3.45Å; F72-F112 HydrophobicContact CE1-CG 4.26Å; F72-F112 HydrophobicContact CE1-CZ 4.33Å; F72-F112 HydrophobicContact CE2-CB 3.67Å; F72-F112 AromaticContact CE2-CD1 3.53Å; F72-F112 HydrophobicContact CE2-CD1 3.53Å; F72-F112 HydrophobicContact CE2-CD2 4.46Å; F72-F112 HydrophobicContact CE2-CE1 4.32Å; F72-F112 AromaticContact CE2-CG 3.61Å; F72-F112 HydrophobicContact CE2-CG 3.61Å; F72-F112 HydrophobicContact CG-CB 4.42Å; F72-F112 AromaticContact CG-CD1 3.46Å; F72-F112 HydrophobicContact CG-CD1 3.46Å; F72-F112 VanDerWaalsContact CG-CD1 3.46Å; F72-F112 AromaticContact CG-CD2 3.69Å; F72-F112 HydrophobicContact CG-CD2 3.69Å; F72-F112 AromaticContact CG-CE1 3.5Å; F72-F112 HydrophobicContact CG-CE1 3.5Å; F72-F112 VanDerWaalsContact CG-CE1 3.5Å; F72-F112 AromaticContact CG-CE2 3.72Å; F72-F112 HydrophobicContact CG-CE2 3.72Å; F72-F112 AromaticContact CG-CG 3.56Å; F72-F112 HydrophobicContact CG-CG 3.56Å; F72-F112 AromaticContact CG-CZ 3.62Å; F72-F112 HydrophobicContact CG-CZ 3.62Å; F72-F112 HydrophobicContact CZ-CB 4.36Å; F72-F112 AromaticContact CZ-CD1 3.46Å; F72-F112 HydrophobicContact CZ-CD1 3.46Å; F72-F112 VanDerWaalsContact CZ-CD1 3.46Å; F72-F112 HydrophobicContact CZ-CE1 4.03Å; F72-F112 HydrophobicContact CZ-CG 4.06Å; T108-F112 PolarHBondContact O-N 2.71Å; A109-F112 WeakPolarHBondContact O-CB 3.41Å; A109-F112 PolarHBondContact O-N 3.19Å; T110-F112 PolarHBondContact O-N 2.91Å; F112-V114 VanDerWaalsContact C-N 3.29Å; F112-V114 PolarHBondContact O-N 3.39Å; F112-F115 HydrophobicContact CD2-CD1 4.45Å; F112-F115 WeakPolarHBondContact O-CB 3.48Å; F112-F115 PolarHBondContact O-N 3.29Å; F112-F115 VanDerWaalsContact O-N 3.15Å; F112-E116 HydrophobicContact CE1-CB 4.26Å; F112-E116 HydrophobicContact CE1-CG 4.38Å; F112-E116 HydrophobicContact CZ-CB 4.22Å; F112-E116 HydrophobicContact CZ-CG 4.21Å; F112-E116 WeakPolarHBondContact O-CB 3.45Å; F112-E116 PolarHBondContact O-N 3.27Å
113F98.2Very high97.1Very high6 Ų623.5 Ų23.53%0.02613%0.132CC..Hα-helixtrans-66.9-31-178.3-77-62.3000112.3F72 A109 T110 N117 H138 A141 L142 F145F72-F113 HydrophobicContact CE1-CE2 4.17Å; F72-F113 AromaticContact CE1-CZ 3.85Å; F72-F113 HydrophobicContact CE1-CZ 3.85Å; F72-F113 AromaticContact CZ-CE2 3.87Å; F72-F113 HydrophobicContact CZ-CE2 3.87Å; F72-F113 HydrophobicContact CZ-CZ 4.04Å; A109-F113 HydrophobicContact CB-CE2 4.43Å; A109-F113 WeakPolarHBondContact O-CD2 3.33Å; A109-F113 PolarHBondContact O-N 3.36Å; T110-F113 PolarHBondContact O-N 3.12Å; F113-N117 WeakPolarHBondContact O-CB 3.37Å; F113-N117 PolarHBondContact O-N 2.95Å; F113-N117 PolarHBondContact O-ND2 3.31Å; F113-H138 AromaticContact CD1-ND1 3.84Å; F113-H138 AromaticContact CE1-ND1 3.92Å; F113-A141 HydrophobicContact CD1-CB 3.76Å; F113-A141 HydrophobicContact CD2-CB 4.39Å; F113-A141 HydrophobicContact CE1-CB 3.38Å; F113-A141 HydrophobicContact CE2-CB 4.08Å; F113-A141 HydrophobicContact CG-CB 4.27Å; F113-A141 HydrophobicContact CZ-CB 3.57Å; F113-L142 HydrophobicContact CB-CB 4Å; F113-L142 HydrophobicContact CB-CD1 3.83Å; F113-L142 HydrophobicContact CB-CG 4.47Å; F113-F145 AromaticContact CD2-CD2 3.64Å; F113-F145 HydrophobicContact CD2-CD2 3.64Å; F113-F145 HydrophobicContact CD2-CE2 4.22Å; F113-F145 HydrophobicContact CD2-CG 4.34Å; F113-F145 AromaticContact CE2-CD2 3.39Å; F113-F145 HydrophobicContact CE2-CD2 3.39Å; F113-F145 AromaticContact CE2-CE2 3.49Å; F113-F145 HydrophobicContact CE2-CE2 3.49Å; F113-F145 VanDerWaalsContact CE2-CE2 3.49Å; F113-F145 HydrophobicContact CE2-CG 4.38Å; F113-F145 HydrophobicContact CZ-CD2 4.44Å; F113-F145 HydrophobicContact CZ-CE2 4.29Å
114V98.4Very high96.8Very high52 Ų5224.1 Ų24.132%0.31514%0.136SC..Hα-helixtrans-63.5-50.1169.61750000110.4F31 T110 G111 F112 E116 N117 V118 L142F31-V114 HydrophobicContact CD2-CB 4.15Å; F31-V114 HydrophobicContact CD2-CG1 3.78Å; F31-V114 HydrophobicContact CE2-CG1 3.98Å; T110-V114 WeakPolarHBondContact O-CG2 3.37Å; T110-V114 PolarHBondContact O-N 3.41Å; G111-V114 PolarHBondContact O-N 3.18Å; F112-V114 VanDerWaalsContact C-N 3.29Å; F112-V114 PolarHBondContact O-N 3.39Å; V114-E116 VanDerWaalsContact C-N 3.32Å; V114-E116 PolarHBondContact O-N 3.2Å; V114-N117 PolarHBondContact O-N 3.4Å; V114-V118 WeakPolarHBondContact O-CG2 3.41Å; V114-V118 PolarHBondContact O-N 3.13Å; V114-L142 HydrophobicContact CG2-CD1 3.77Å
115F98.4Very high96.7Very high12 Ų1225.2 Ų25.25%0.05315%0.15CC..Hα-helixtrans-54-49.6175.5160.6-93.9000111.6F31 T35 F38 L65 T68 G111 F112 N117 V118 A119F31-F115 HydrophobicContact CD2-CB 3.64Å; F31-F115 VanDerWaalsContact CE2-CA 3.4Å; F31-F115 HydrophobicContact CE2-CB 3.84Å; F31-F115 HydrophobicContact CG-CB 4.28Å; T35-F115 VanDerWaalsContact OG1-CD2 3.31Å; T35-F115 WeakPolarHBondContact OG1-CD2 3.43Å; F38-F115 HydrophobicContact CB-CE2 4.19Å; F38-F115 HydrophobicContact CB-CZ 3.73Å; F38-F115 AromaticContact CD2-CZ 3.98Å; F38-F115 HydrophobicContact CD2-CZ 3.98Å; F38-F115 HydrophobicContact CG-CE2 4.48Å; F38-F115 HydrophobicContact CG-CZ 4.01Å; L65-F115 HydrophobicContact CD2-CE1 4.11Å; L65-F115 HydrophobicContact CD2-CZ 4.24Å; T68-F115 HydrophobicContact CG2-CD1 4.44Å; T68-F115 HydrophobicContact CG2-CE1 3.69Å; T68-F115 HydrophobicContact CG2-CZ 4.21Å; G111-F115 PolarHBondContact O-N 2.94Å; F112-F115 HydrophobicContact CD2-CD1 4.45Å; F112-F115 WeakPolarHBondContact O-CB 3.48Å; F112-F115 PolarHBondContact O-N 3.29Å; F112-F115 VanDerWaalsContact O-N 3.15Å; F115-N117 PolarHBondContact O-N 3.35Å; F115-V118 PolarHBondContact O-N 3.24Å; F115-A119 HydrophobicContact CZ-CB 4.39Å; F115-A119 WeakPolarHBondContact O-CB 3.23Å; F115-A119 PolarHBondContact O-N 2.97Å
116E96.6Very high96.6Very high0 Ų029.2 Ų29.20%018%0.176CC..Hα-helixtrans-65.2-41-175.1-172.158.1-136.300111.7R69 F112 V114 A119 L120 H138R69-E116 WeakPolarHBondContact CG-OE2 3.12Å; R69-E116 IonicContact CZ-OE1 2.92Å; R69-E116 VanDerWaalsContact NE-CD 3.32Å; R69-E116 IonicContact NE-OE1 3.31Å; R69-E116 PolarHBondContact NE-OE1 3.06Å; R69-E116 IonicContact NE-OE2 2.73Å; R69-E116 PolarHBondContact NE-OE2 3.19Å; R69-E116 IonicContact NH2-OE1 3.57Å; R69-E116 PolarHBondContact NH2-OE1 3.45Å; F112-E116 HydrophobicContact CE1-CB 4.26Å; F112-E116 HydrophobicContact CE1-CG 4.38Å; F112-E116 HydrophobicContact CZ-CB 4.22Å; F112-E116 HydrophobicContact CZ-CG 4.21Å; F112-E116 WeakPolarHBondContact O-CB 3.45Å; F112-E116 PolarHBondContact O-N 3.27Å; V114-E116 VanDerWaalsContact C-N 3.32Å; V114-E116 PolarHBondContact O-N 3.2Å; E116-A119 PolarHBondContact O-N 3.41Å; E116-L120 WeakPolarHBondContact O-CB 3.32Å; E116-L120 PolarHBondContact O-N 3.13Å; E116-H138 WeakPolarHBondContact CG-CE1 3.3Å; E116-H138 WeakPolarHBondContact CG-ND1 3.29Å
117N96.8Very high96.4Very high16 Ų1632.2 Ų32.29%0.08619%0.189CC..Hα-helixtrans-66.3-42.6174.5-84.1-87.3000111.7F113 V114 F115 A119 L120 H121 H138 L142F113-N117 WeakPolarHBondContact O-CB 3.37Å; F113-N117 PolarHBondContact O-N 2.95Å; F113-N117 PolarHBondContact O-ND2 3.31Å; V114-N117 PolarHBondContact O-N 3.4Å; F115-N117 PolarHBondContact O-N 3.35Å; N117-A119 PolarHBondContact O-N 3.49Å; N117-L120 PolarHBondContact O-N 3.49Å; N117-H121 WeakPolarHBondContact O-CB 3.35Å; N117-H121 PolarHBondContact O-CD2 3.38Å; N117-H121 PolarHBondContact O-N 2.92Å; N117-H138 PolarHBondContact ND2-O 3.01Å; N117-L142 HydrophobicContact CB-CD2 4.42Å
118V97.1Very high96.1Very high75 Ų7543.5 Ų43.546%0.45523%0.231SC..Hα-helixtrans-59.7-48.1175.4169.40000110.4F31 V114 F115 S122F31-V118 HydrophobicContact CE2-CG2 4.42Å; V114-V118 WeakPolarHBondContact O-CG2 3.41Å; V114-V118 PolarHBondContact O-N 3.13Å; F115-V118 PolarHBondContact O-N 3.24Å; V118-S122 WeakPolarHBondContact O-CB 3.32Å; V118-S122 PolarHBondContact O-N 2.91Å; V118-S122 PolarHBondContact O-OG 2.92Å
119A95.4Very high95.6Very high19 Ų1944.8 Ų44.816%0.15724%0.241CC..Hα-helixtrans-64.1-46.8179.600000112L65 F115 E116 N117 S123L65-A119 HydrophobicContact CD2-CB 3.68Å; F115-A119 HydrophobicContact CZ-CB 4.39Å; F115-A119 WeakPolarHBondContact O-CB 3.23Å; F115-A119 PolarHBondContact O-N 2.97Å; E116-A119 PolarHBondContact O-N 3.41Å; N117-A119 PolarHBondContact O-N 3.49Å; A119-S123 VanDerWaalsContact O-CB 3.23Å; A119-S123 WeakPolarHBondContact O-CB 3.39Å; A119-S123 PolarHBondContact O-N 2.97Å; A119-S123 PolarHBondContact O-OG 2.87Å; A119-S123 VanDerWaalsContact O-OG 3.05Å
120L93.8Very high95.1Very high11 Ų1151 Ų516%0.05827%0.268CS..Hα-helixtrans-59.2-55.3178.3179.463.4000110.9E116 N117 S123 S124 L134 A135E116-L120 WeakPolarHBondContact O-CB 3.32Å; E116-L120 PolarHBondContact O-N 3.13Å; N117-L120 PolarHBondContact O-N 3.49Å; L120-S123 PolarHBondContact O-N 2.67Å; L120-S123 PolarHBondContact O-OG 2.84Å; L120-S124 WeakPolarHBondContact O-CB 3.41Å; L120-S124 PolarHBondContact O-N 3.05Å; L120-S124 PolarHBondContact O-OG 2.96Å; L120-L134 HydrophobicContact CD1-CD2 3.94Å; L120-L134 HydrophobicContact CD2-CG 4.33Å; L120-A135 HydrophobicContact CD2-CB 4.24Å
121H94.8Very high94.5Very high81 Ų8154 Ų5438%0.37528%0.284SS..Hα-helixtrans-69.6-38.5-175.9-68.4-57.5000112.8N117 S124 V125N117-H121 WeakPolarHBondContact O-CB 3.35Å; N117-H121 PolarHBondContact O-CD2 3.38Å; N117-H121 PolarHBondContact O-N 2.92Å; H121-S124 WeakPolarHBondContact O-CB 3.45Å; H121-S124 PolarHBondContact O-N 2.94Å; H121-V125 WeakPolarHBondContact O-CG2 3.14Å; H121-V125 PolarHBondContact O-N 3.5Å
122S95.2Very high94Very high64 Ų6459 Ų5945%0.44831%0.309SS..Hα-helixtrans-62.3-46174.9-57.70000111V118 S124 V125 V126V118-S122 WeakPolarHBondContact O-CB 3.32Å; V118-S122 PolarHBondContact O-N 2.91Å; V118-S122 PolarHBondContact O-OG 2.92Å; S122-S124 VanDerWaalsContact C-N 3.32Å; S122-S124 PolarHBondContact O-N 2.89Å; S122-V125 PolarHBondContact O-N 2.99Å; S122-V126 WeakPolarHBondContact O-CB 3.48Å; S122-V126 VanDerWaalsContact O-CG2 3.27Å; S122-V126 WeakPolarHBondContact O-CG2 3.41Å; S122-V126 PolarHBondContact O-N 3.24Å
123S92.4Very high93.5Very high23 Ų2362.2 Ų62.216%0.16133%0.331CS..Hα-helixtrans-64.3-37.7176.473.80000112A119 L120 V125 V126 F127A119-S123 VanDerWaalsContact O-CB 3.23Å; A119-S123 WeakPolarHBondContact O-CB 3.39Å; A119-S123 PolarHBondContact O-N 2.97Å; A119-S123 PolarHBondContact O-OG 2.87Å; A119-S123 VanDerWaalsContact O-OG 3.05Å; L120-S123 PolarHBondContact O-N 2.67Å; L120-S123 PolarHBondContact O-OG 2.84Å; S123-V125 PolarHBondContact O-N 2.93Å; S123-V126 PolarHBondContact O-N 2.9Å; S123-F127 WeakPolarHBondContact O-CB 3.41Å; S123-F127 WeakPolarHBondContact O-CD2 3.5Å; S123-F127 PolarHBondContact O-N 3.47Å
124S92Very high93Very high13 Ų1363.1 Ų63.19%0.09134%0.336CS..Hα-helixtrans-58.2-45174.1-89.30000112.8L120 H121 S122 R128 S129L120-S124 WeakPolarHBondContact O-CB 3.41Å; L120-S124 PolarHBondContact O-N 3.05Å; L120-S124 PolarHBondContact O-OG 2.96Å; H121-S124 WeakPolarHBondContact O-CB 3.45Å; H121-S124 PolarHBondContact O-N 2.94Å; S122-S124 VanDerWaalsContact C-N 3.32Å; S122-S124 PolarHBondContact O-N 2.89Å; S124-R128 CarbonylContact O-C 3.57Å; S124-R128 VanDerWaalsContact O-CA 3.25Å; S124-R128 WeakPolarHBondContact O-CA 3.22Å; S124-R128 PolarHBondContact O-N 2.75Å; S124-S129 CarbonylContact C-O 3.56Å; S124-S129 WeakPolarHBondContact CA-O 3.31Å; S124-S129 WeakPolarHBondContact CB-O 3.25Å; S124-S129 PolarHBondContact O-N 2.73Å; S124-S129 PolarHBondContact OG-O 3.31Å
125V94.6Very high92.7Very high115 Ų11561 Ų6170%0.69732%0.324SS*.Hα-helixtrans-66.9-50.9176.9172.10000110.7H121 S122 S123 F127 R128H121-V125 WeakPolarHBondContact O-CG2 3.14Å; H121-V125 PolarHBondContact O-N 3.5Å; S122-V125 PolarHBondContact O-N 2.99Å; S123-V125 PolarHBondContact O-N 2.93Å; V125-F127 PolarHBondContact O-N 3.46Å; V125-R128 PolarHBondContact O-N 2.86Å
126V95.9Very high92.4Very high104 Ų10462.4 Ų62.463%0.6333%0.333SS*.Hα-helixtrans-60-44.3-177.2169.80000111.7S122 S123S122-V126 WeakPolarHBondContact O-CB 3.48Å; S122-V126 VanDerWaalsContact O-CG2 3.27Å; S122-V126 WeakPolarHBondContact O-CG2 3.41Å; S122-V126 PolarHBondContact O-N 3.24Å; S123-V126 PolarHBondContact O-N 2.9Å
127F93.3Very high92.3Very high63 Ų6363.2 Ų63.228%0.27634%0.337SS..THydrogen-bonded Turntrans-96.78.1-177.6-58.8-64.2000113.9A57 K58 V61 S123 V125 S129A57-F127 HydrophobicContact CB-CE1 4.3Å; A57-F127 HydrophobicContact CB-CZ 4.44Å; K58-F127 HydrophobicContact CB-CD1 3.79Å; K58-F127 HydrophobicContact CB-CD2 4.08Å; K58-F127 HydrophobicContact CB-CE1 3.81Å; K58-F127 HydrophobicContact CB-CE2 4.11Å; K58-F127 HydrophobicContact CB-CG 3.94Å; K58-F127 HydrophobicContact CB-CZ 3.98Å; K58-F127 HydrophobicContact CD-CB 3.85Å; K58-F127 HydrophobicContact CD-CD1 4.42Å; K58-F127 HydrophobicContact CD-CD2 4.33Å; K58-F127 HydrophobicContact CD-CG 3.96Å; K58-F127 HydrophobicContact CG-CB 4.14Å; K58-F127 HydrophobicContact CG-CD1 4.08Å; K58-F127 HydrophobicContact CG-CD2 3.66Å; K58-F127 HydrophobicContact CG-CE1 4.43Å; K58-F127 HydrophobicContact CG-CE2 4.06Å; K58-F127 HydrophobicContact CG-CG 3.69Å; K58-F127 HydrophobicContact CG-CZ 4.43Å; V61-F127 HydrophobicContact CB-CE2 4.49Å; V61-F127 HydrophobicContact CG2-CE2 4.17Å; V61-F127 HydrophobicContact CG2-CZ 4.31Å; S123-F127 WeakPolarHBondContact O-CB 3.41Å; S123-F127 WeakPolarHBondContact O-CD2 3.5Å; S123-F127 PolarHBondContact O-N 3.47Å; V125-F127 PolarHBondContact O-N 3.46Å; F127-S129 VanDerWaalsContact C-N 3.3Å; F127-S129 PolarHBondContact O-N 3.09Å
128R92Very high92.2Very high237 Ų23762.9 Ų62.989%0.89434%0.335SS*.THydrogen-bonded Turntrans46.951.2-179.3-59.4-177.6179.6174.7-0.9112.7S124 V125S124-R128 CarbonylContact O-C 3.57Å; S124-R128 VanDerWaalsContact O-CA 3.25Å; S124-R128 WeakPolarHBondContact O-CA 3.22Å; S124-R128 PolarHBondContact O-N 2.75Å; V125-R128 PolarHBondContact O-N 2.86Å
129S89.1Confident92Very high38 Ų3865 Ų6527%0.26634%0.338SS..  trans-137.7153.6-179.564.60000111.4K58 S124 F127K58-S129 WeakPolarHBondContact CE-OG 3.37Å; K58-S129 PolarHBondContact NZ-OG 3.43Å; S124-S129 CarbonylContact C-O 3.56Å; S124-S129 WeakPolarHBondContact CA-O 3.31Å; S124-S129 WeakPolarHBondContact CB-O 3.25Å; S124-S129 PolarHBondContact O-N 2.73Å; S124-S129 PolarHBondContact OG-O 3.31Å; F127-S129 VanDerWaalsContact C-N 3.3Å; F127-S129 PolarHBondContact O-N 3.09Å
130F87.4Confident92.1Very high132 Ų13266.4 Ų66.458%0.57934%0.341SS*.  trans-143.9119-179.3-173-112.3000110.7L132 A135F130-L132 HydrophobicContact CD1-CB 4.06Å; F130-L132 HydrophobicContact CE1-CB 3.7Å; F130-L132 HydrophobicContact CE1-CD1 3.74Å; F130-L132 HydrophobicContact CE1-CG 4.31Å; F130-L132 HydrophobicContact CZ-CD1 4.23Å; F130-A135 HydrophobicContact CE2-CB 3.95Å; F130-A135 HydrophobicContact CZ-CB 3.91Å
131D86.6Confident92.2Very high70 Ų7066.6 Ų66.637%0.37434%0.344SS..  trans-98.491.4174.2-172.8-24.8000108.4P133 L134 A135D131-P133 VanDerWaalsContact OD1-CD 3.28Å; D131-P133 WeakPolarHBondContact OD1-CD 3.45Å; D131-L134 HydrophobicContact CB-CB 3.98Å; D131-L134 VanDerWaalsContact CG-CB 3.4Å; D131-L134 PolarHBondContact O-N 3.01Å; D131-L134 WeakPolarHBondContact OD1-CB 3.31Å; D131-L134 PolarHBondContact OD1-N 3.45Å; D131-L134 VanDerWaalsContact OD1-N 3.1Å; D131-A135 VanDerWaalsContact O-CB 3.32Å; D131-A135 WeakPolarHBondContact O-CB 3.46Å; D131-A135 PolarHBondContact O-N 3.47Å
132L88.3Confident92.3Very high103 Ų10364.8 Ų64.854%0.53934%0.337SS..Hα-helixtrans-60.9-47-176.3173.266.1000113F130 L134 A135 T136F130-L132 HydrophobicContact CD1-CB 4.06Å; F130-L132 HydrophobicContact CE1-CB 3.7Å; F130-L132 HydrophobicContact CE1-CD1 3.74Å; F130-L132 HydrophobicContact CE1-CG 4.31Å; F130-L132 HydrophobicContact CZ-CD1 4.23Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.61Å; L132-A135 PolarHBondContact O-N 2.73Å; L132-T136 WeakPolarHBondContact O-CB 3.15Å; L132-T136 PolarHBondContact O-N 3.48Å; L132-T136 PolarHBondContact O-OG1 3.36Å
133P87.3Confident92.4Very high72 Ų7262.9 Ų62.947%0.46832%0.324SS..Hα-helixtrans-55.8-45.1175.6-27.734.4000113.1D131 T136 H137D131-P133 VanDerWaalsContact OD1-CD 3.28Å; D131-P133 WeakPolarHBondContact OD1-CD 3.45Å; P133-T136 PolarHBondContact O-N 3.34Å; P133-H137 WeakPolarHBondContact O-CB 3.21Å; P133-H137 PolarHBondContact O-N 2.93Å
134L88.3Confident92.6Very high25 Ų2562.8 Ų62.813%0.13133%0.326CS..Hα-helixtrans-67.4-47.4179.4-170.261.7000111.2L120 D131 L132 T136 H137 H138L120-L134 HydrophobicContact CD1-CD2 3.94Å; L120-L134 HydrophobicContact CD2-CG 4.33Å; D131-L134 HydrophobicContact CB-CB 3.98Å; D131-L134 VanDerWaalsContact CG-CB 3.4Å; D131-L134 PolarHBondContact O-N 3.01Å; D131-L134 WeakPolarHBondContact OD1-CB 3.31Å; D131-L134 PolarHBondContact OD1-N 3.45Å; D131-L134 VanDerWaalsContact OD1-N 3.1Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.61Å; L134-T136 VanDerWaalsContact C-N 3.28Å; L134-T136 PolarHBondContact O-N 3.45Å; L134-H137 WeakPolarHBondContact O-CB 3.2Å; L134-H137 PolarHBondContact O-N 3.49Å; L134-H138 VanDerWaalsContact CD1-CD2 3.49Å; L134-H138 WeakPolarHBondContact CD1-CD2 3.24Å; L134-H138 WeakPolarHBondContact CD1-NE2 3.33Å; L134-H138 PolarHBondContact O-CD2 2.95Å; L134-H138 PolarHBondContact O-N 3.01Å
135A91.9Very high92.9Very high8 Ų862.4 Ų62.47%0.06632%0.323CS..Hα-helixtrans-58.1-41.317700000112.1L120 F130 D131 L132 H138 F139L120-A135 HydrophobicContact CD2-CB 4.24Å; F130-A135 HydrophobicContact CE2-CB 3.95Å; F130-A135 HydrophobicContact CZ-CB 3.91Å; D131-A135 VanDerWaalsContact O-CB 3.32Å; D131-A135 WeakPolarHBondContact O-CB 3.46Å; D131-A135 PolarHBondContact O-N 3.47Å; L132-A135 PolarHBondContact O-N 2.73Å; A135-H138 PolarHBondContact O-N 3.4Å; A135-F139 WeakPolarHBondContact O-CB 3.48Å; A135-F139 PolarHBondContact O-N 3.13Å
136T92.6Very high93Very high41 Ų4158.6 Ų58.625%0.25230%0.304SS..Hα-helixtrans-64.7-45.5178-55.20000110.9L132 P133 L134 H138 F139 F140 L239L132-T136 WeakPolarHBondContact O-CB 3.15Å; L132-T136 PolarHBondContact O-N 3.48Å; L132-T136 PolarHBondContact O-OG1 3.36Å; P133-T136 PolarHBondContact O-N 3.34Å; L134-T136 VanDerWaalsContact C-N 3.28Å; L134-T136 PolarHBondContact O-N 3.45Å; T136-H138 PolarHBondContact O-N 3.03Å; T136-F139 PolarHBondContact O-N 2.88Å; T136-F140 HydrophobicContact CG2-CD2 3.99Å; T136-F140 HydrophobicContact CG2-CE2 3.9Å; T136-F140 WeakPolarHBondContact O-CD2 3.47Å; T136-F140 PolarHBondContact O-N 3.35Å; T136-F140 VanDerWaalsContact O-N 3.13Å; T136-L239 HydrophobicContact CG2-CD2 3.66Å
137H93.2Very high92.9Very high17 Ų1754 Ų548%0.07928%0.278CS..Hα-helixtrans-58.2-48.7176.2172.669000112P133 L134 F139 F140 A141 E166 I244 W248P133-H137 WeakPolarHBondContact O-CB 3.21Å; P133-H137 PolarHBondContact O-N 2.93Å; L134-H137 WeakPolarHBondContact O-CB 3.2Å; L134-H137 PolarHBondContact O-N 3.49Å; H137-F139 VanDerWaalsContact C-N 3.35Å; H137-F139 PolarHBondContact O-N 3.04Å; H137-F140 PolarHBondContact O-N 3.48Å; H137-A141 WeakPolarHBondContact O-CB 3.32Å; H137-A141 PolarHBondContact O-N 2.83Å; H137-E166 IonicContact NE2-OE1 2.95Å; H137-I244 HydrophobicContact CB-CD1 4.32Å; H137-W248 HydrophobicContact CB-CH2 4.21Å; H137-W248 AromaticContact CD2-CH2 3.97Å; H137-W248 AromaticContact CG-CH2 3.77Å; H137-W248 AromaticContact ND1-CH2 3.94Å
138H94.2Very high93Very high10 Ų1051.1 Ų51.15%0.04627%0.265CS..Hα-helixtrans-70.5-28.5-180-76.8-80.4000113.4F113 E116 N117 L134 A135 T136 L142F113-H138 AromaticContact CD1-ND1 3.84Å; F113-H138 AromaticContact CE1-ND1 3.92Å; E116-H138 WeakPolarHBondContact CG-CE1 3.3Å; E116-H138 WeakPolarHBondContact CG-ND1 3.29Å; N117-H138 PolarHBondContact ND2-O 3.01Å; L134-H138 VanDerWaalsContact CD1-CD2 3.49Å; L134-H138 WeakPolarHBondContact CD1-CD2 3.24Å; L134-H138 WeakPolarHBondContact CD1-NE2 3.33Å; L134-H138 PolarHBondContact O-CD2 2.95Å; L134-H138 PolarHBondContact O-N 3.01Å; A135-H138 PolarHBondContact O-N 3.4Å; T136-H138 PolarHBondContact O-N 3.03Å; H138-L142 VanDerWaalsContact O-CB 3.31Å; H138-L142 WeakPolarHBondContact O-CB 3.43Å; H138-L142 PolarHBondContact O-N 2.95Å
139F94.7Very high93.2Very high118 Ų11840 Ų4052%0.51822%0.224SC..Hα-helixtrans-63.4-50.1171.6170.2-98.2000111.6A135 T136 H137 A141 L142 S143A135-F139 WeakPolarHBondContact O-CB 3.48Å; A135-F139 PolarHBondContact O-N 3.13Å; T136-F139 PolarHBondContact O-N 2.88Å; H137-F139 VanDerWaalsContact C-N 3.35Å; H137-F139 PolarHBondContact O-N 3.04Å; F139-A141 VanDerWaalsContact C-N 3.33Å; F139-A141 PolarHBondContact O-N 2.68Å; F139-L142 PolarHBondContact O-N 3.5Å; F139-S143 VanDerWaalsContact O-CB 3.25Å; F139-S143 WeakPolarHBondContact O-CB 3.38Å; F139-S143 PolarHBondContact O-N 2.74Å; F139-S143 PolarHBondContact O-OG 3.02Å
140F96.2Very high93.4Very high50 Ų5042 Ų4222%0.21923%0.234CC..Hα-helixtrans-64.3-39.9177.6-83.9-74.1000111.8T136 H137 G144 I232 L239T136-F140 HydrophobicContact CG2-CD2 3.99Å; T136-F140 HydrophobicContact CG2-CE2 3.9Å; T136-F140 WeakPolarHBondContact O-CD2 3.47Å; T136-F140 PolarHBondContact O-N 3.35Å; T136-F140 VanDerWaalsContact O-N 3.13Å; H137-F140 PolarHBondContact O-N 3.48Å; F140-G144 PolarHBondContact O-N 3.48Å; F140-I232 HydrophobicContact CD1-CG2 4.17Å; F140-L239 HydrophobicContact CD2-CD2 4.01Å; F140-L239 HydrophobicContact CE2-CD2 3.94Å
141A95.8Very high93.7Very high15 Ų1539.1 Ų39.112%0.12422%0.221CC..Hα-helixtrans-62.3-52.7176.900000111.4F113 H137 F139 S143 G144 F145F113-A141 HydrophobicContact CD1-CB 3.76Å; F113-A141 HydrophobicContact CD2-CB 4.39Å; F113-A141 HydrophobicContact CE1-CB 3.38Å; F113-A141 HydrophobicContact CE2-CB 4.08Å; F113-A141 HydrophobicContact CG-CB 4.27Å; F113-A141 HydrophobicContact CZ-CB 3.57Å; H137-A141 WeakPolarHBondContact O-CB 3.32Å; H137-A141 PolarHBondContact O-N 2.83Å; F139-A141 VanDerWaalsContact C-N 3.33Å; F139-A141 PolarHBondContact O-N 2.68Å; A141-S143 PolarHBondContact O-N 3.2Å; A141-G144 PolarHBondContact O-N 3.07Å; A141-F145 VanDerWaalsContact O-CD2 3.25Å; A141-F145 WeakPolarHBondContact O-CD2 3.36Å; A141-F145 PolarHBondContact O-N 3.32Å
142L97.6Very high93.5Very high42 Ų4238.8 Ų38.822%0.2222%0.219CC..Hα-helixtrans-59.2-46.9177.8178.656.8000111.6F113 V114 N117 H138 F139 G144 F145 A146F113-L142 HydrophobicContact CB-CB 4Å; F113-L142 HydrophobicContact CB-CD1 3.83Å; F113-L142 HydrophobicContact CB-CG 4.47Å; V114-L142 HydrophobicContact CG2-CD1 3.77Å; N117-L142 HydrophobicContact CB-CD2 4.42Å; H138-L142 VanDerWaalsContact O-CB 3.31Å; H138-L142 WeakPolarHBondContact O-CB 3.43Å; H138-L142 PolarHBondContact O-N 2.95Å; F139-L142 PolarHBondContact O-N 3.5Å; L142-G144 VanDerWaalsContact C-N 3.33Å; L142-G144 PolarHBondContact O-N 3.46Å; L142-F145 PolarHBondContact O-N 3.03Å; L142-A146 WeakPolarHBondContact O-CB 3.29Å; L142-A146 PolarHBondContact O-N 2.8Å
143S97.5Very high93.3Very high25 Ų2537 Ų3718%0.17522%0.216CC..Hα-helixtrans-63.1-40.3-178.8-56.80000111.8F139 A141 G147F139-S143 VanDerWaalsContact O-CB 3.25Å; F139-S143 WeakPolarHBondContact O-CB 3.38Å; F139-S143 PolarHBondContact O-N 2.74Å; F139-S143 PolarHBondContact O-OG 3.02Å; A141-S143 PolarHBondContact O-N 3.2Å; S143-G147 PolarHBondContact O-N 3.37Å
144G96.4Very high93.4Very high20 Ų2034.4 Ų34.421%0.20620%0.197CC..Hα-helixtrans-63.6-48.5176.800000112.5F140 A141 L142 G147 A148 Q229F140-G144 PolarHBondContact O-N 3.48Å; A141-G144 PolarHBondContact O-N 3.07Å; L142-G144 VanDerWaalsContact C-N 3.33Å; L142-G144 PolarHBondContact O-N 3.46Å; G144-G147 PolarHBondContact O-N 3.45Å; G144-A148 PolarHBondContact O-N 3.06Å; G144-Q229 PolarHBondContact O-NE2 3.46Å
145F97.1Very high93.7Very high6 Ų633.7 Ų33.73%0.02620%0.196CC..Hα-helixtrans-70.5-39.8178.6-77.7-75.3000112.7V106 A109 F113 A141 L142 G147 A148 V149 A159 T162 L163V106-F145 HydrophobicContact CG1-CD1 4.39Å; A109-F145 HydrophobicContact CB-CD1 4.12Å; A109-F145 HydrophobicContact CB-CE1 4.18Å; A109-F145 HydrophobicContact CB-CG 4.41Å; F113-F145 AromaticContact CD2-CD2 3.64Å; F113-F145 HydrophobicContact CD2-CD2 3.64Å; F113-F145 HydrophobicContact CD2-CE2 4.22Å; F113-F145 HydrophobicContact CD2-CG 4.34Å; F113-F145 AromaticContact CE2-CD2 3.39Å; F113-F145 HydrophobicContact CE2-CD2 3.39Å; F113-F145 AromaticContact CE2-CE2 3.49Å; F113-F145 HydrophobicContact CE2-CE2 3.49Å; F113-F145 VanDerWaalsContact CE2-CE2 3.49Å; F113-F145 HydrophobicContact CE2-CG 4.38Å; F113-F145 HydrophobicContact CZ-CD2 4.44Å; F113-F145 HydrophobicContact CZ-CE2 4.29Å; A141-F145 VanDerWaalsContact O-CD2 3.25Å; A141-F145 WeakPolarHBondContact O-CD2 3.36Å; A141-F145 PolarHBondContact O-N 3.32Å; L142-F145 PolarHBondContact O-N 3.03Å; F145-G147 VanDerWaalsContact C-N 3.27Å; F145-G147 PolarHBondContact O-N 2.81Å; F145-A148 WeakPolarHBondContact O-CA 3.32Å; F145-A148 WeakPolarHBondContact O-CB 3.27Å; F145-A148 PolarHBondContact O-N 3.24Å; F145-V149 WeakPolarHBondContact O-CG2 3.17Å; F145-V149 PolarHBondContact O-N 3.26Å; F145-A159 HydrophobicContact CE1-CB 4.04Å; F145-T162 HydrophobicContact CE2-CG2 4.18Å; F145-T162 HydrophobicContact CZ-CG2 4.28Å; F145-L163 HydrophobicContact CE1-CD1 4.35Å; F145-L163 HydrophobicContact CE1-CD2 3.76Å; F145-L163 HydrophobicContact CE1-CG 3.87Å; F145-L163 HydrophobicContact CE2-CD2 3.89Å; F145-L163 HydrophobicContact CZ-CD1 4.48Å; F145-L163 HydrophobicContact CZ-CD2 3.24Å; F145-L163 HydrophobicContact CZ-CG 3.54Å
146A96.8Very high94Very high35 Ų3533.3 Ų33.329%0.28919%0.193SC..Hα-helixtrans-60.4-39.7172.500000111.3L142 A148 V149 V150L142-A146 WeakPolarHBondContact O-CB 3.29Å; L142-A146 PolarHBondContact O-N 2.8Å; A146-A148 VanDerWaalsContact C-N 3.34Å; A146-A148 PolarHBondContact O-N 3.31Å; A146-V149 WeakPolarHBondContact O-CB 3.39Å; A146-V149 PolarHBondContact O-N 2.8Å; A146-V150 WeakPolarHBondContact O-CG2 3.24Å; A146-V150 PolarHBondContact O-N 3.45Å
147G95.4Very high94.2Very high8 Ų831.5 Ų31.58%0.08218%0.181CC..Hα-helixtrans-62.1-38.9172.100000113S143 G144 F145 V149 V150 F151 Q154S143-G147 PolarHBondContact O-N 3.37Å; G144-G147 PolarHBondContact O-N 3.45Å; F145-G147 VanDerWaalsContact C-N 3.27Å; F145-G147 PolarHBondContact O-N 2.81Å; G147-V149 VanDerWaalsContact C-N 3.28Å; G147-V149 PolarHBondContact O-N 3.04Å; G147-V150 PolarHBondContact O-N 2.93Å; G147-F151 WeakPolarHBondContact O-CD2 3.49Å; G147-F151 PolarHBondContact O-N 2.6Å; G147-Q154 PolarHBondContact O-NE2 2.91Å
148A94.5Very high94.4Very high2 Ų231.4 Ų31.42%0.01718%0.181CC..Hα-helixtrans-61.1-35172.300000113V106 G144 F145 A146 Q154V106-A148 HydrophobicContact CG1-CB 3.86Å; G144-A148 PolarHBondContact O-N 3.06Å; F145-A148 WeakPolarHBondContact O-CA 3.32Å; F145-A148 WeakPolarHBondContact O-CB 3.27Å; F145-A148 PolarHBondContact O-N 3.24Å; A146-A148 VanDerWaalsContact C-N 3.34Å; A146-A148 PolarHBondContact O-N 3.31Å; A148-Q154 VanDerWaalsContact CA-NE2 3.28Å
149V95.5Very high94.5Very high4 Ų431.6 Ų31.62%0.02419%0.185CC..Hα-helixtrans-73.8-37.2175.3176.20000112.3W20 R23 I27 V106 L107 T110 F145 A146 G147W20-V149 HydrophobicContact CH2-CG1 4.28Å; W20-V149 HydrophobicContact CZ3-CG1 4.02Å; R23-V149 HydrophobicContact CB-CG1 4.45Å; R23-V149 PolarHBondContact NH1-O 2.97Å; I27-V149 HydrophobicContact CD1-CG1 4.05Å; I27-V149 HydrophobicContact CD1-CG2 4.41Å; V106-V149 HydrophobicContact CG1-CG2 3.85Å; L107-V149 HydrophobicContact CD2-CG1 4Å; L107-V149 HydrophobicContact CD2-CG2 3.7Å; T110-V149 HydrophobicContact CG2-CG2 4.41Å; T110-V149 WeakPolarHBondContact OG1-CG2 3.34Å; F145-V149 WeakPolarHBondContact O-CG2 3.17Å; F145-V149 PolarHBondContact O-N 3.26Å; A146-V149 WeakPolarHBondContact O-CB 3.39Å; A146-V149 PolarHBondContact O-N 2.8Å; G147-V149 VanDerWaalsContact C-N 3.28Å; G147-V149 PolarHBondContact O-N 3.04Å
150V94.7Very high94.7Very high78 Ų7826 Ų2647%0.47316%0.16SC..Hα-helixtrans-80.1-46.3-176172.50000112W20 A146 G147 D152W20-V150 HydrophobicContact CH2-CG2 4.02Å; A146-V150 WeakPolarHBondContact O-CG2 3.24Å; A146-V150 PolarHBondContact O-N 3.45Å; G147-V150 PolarHBondContact O-N 2.93Å; V150-D152 PolarHBondContact O-N 3.09Å
151F92.4Very high94.8Very high72 Ų7223.6 Ų23.632%0.31615%0.15SC..  trans-98.386.7-179.6-53.3-80.5000109.7G147 S153 Q154 A226 Q229G147-F151 WeakPolarHBondContact O-CD2 3.49Å; G147-F151 PolarHBondContact O-N 2.6Å; F151-S153 PolarHBondContact O-N 2.92Å; F151-Q154 VanDerWaalsContact O-CG 3.32Å; F151-Q154 WeakPolarHBondContact O-CG 3.5Å; F151-Q154 PolarHBondContact O-N 3.31Å; F151-Q154 PolarHBondContact O-NE2 2.93Å; F151-A226 HydrophobicContact CD1-CB 3.67Å; F151-A226 HydrophobicContact CD2-CB 4.15Å; F151-A226 HydrophobicContact CE1-CB 3.65Å; F151-A226 HydrophobicContact CE2-CB 4.13Å; F151-A226 HydrophobicContact CG-CB 3.93Å; F151-A226 HydrophobicContact CZ-CB 3.89Å; F151-Q229 HydrophobicContact CD2-CB 4.27Å; F151-Q229 HydrophobicContact CE2-CB 4.47Å
152D83.6Confident94.9Very high63 Ų6324.6 Ų24.634%0.33716%0.155SC..THydrogen-bonded Turntrans-76.2-0-17659.211.3000115F18 R23 Q98 W103 V150 Q154F18-D152 HydrophobicContact CD1-CB 4.05Å; F18-D152 HydrophobicContact CE1-CB 4.12Å; R23-D152 IonicContact CZ-OD2 3.83Å; R23-D152 IonicContact NH1-OD2 3.71Å; R23-D152 IonicContact NH2-OD2 2.98Å; R23-D152 PolarHBondContact NH2-OD2 3.39Å; Q98-D152 PolarHBondContact NE2-O 3.09Å; W103-D152 HydrophobicContact CH2-CB 3.9Å; W103-D152 HydrophobicContact CZ2-CB 4.05Å; V150-D152 PolarHBondContact O-N 3.09Å; D152-Q154 VanDerWaalsContact C-N 3.28Å
153S83.3Confident94.9Very high66 Ų6622.8 Ų22.846%0.46215%0.145SC..THydrogen-bonded Turntrans-77.3-14.1167.966.50000113.2F151 H224F151-S153 PolarHBondContact O-N 2.92Å; S153-H224 PolarHBondContact OG-O 3.12Å; S153-H224 VanDerWaalsContact OG-O 3.13Å
154Q90.4Very high94.9Very high18 Ų1821.8 Ų21.88%0.08414%0.138CC..SBendtrans-88137.7-17888.5-167.4-92.700111.4Q98 G147 A148 F151 D152 V225Q98-Q154 PolarHBondContact NE2-O 3.42Å; G147-Q154 PolarHBondContact O-NE2 2.91Å; A148-Q154 VanDerWaalsContact CA-NE2 3.28Å; F151-Q154 VanDerWaalsContact O-CG 3.32Å; F151-Q154 WeakPolarHBondContact O-CG 3.5Å; F151-Q154 PolarHBondContact O-N 3.31Å; F151-Q154 PolarHBondContact O-NE2 2.93Å; D152-Q154 VanDerWaalsContact C-N 3.28Å; Q154-V225 HydrophobicContact CB-CG2 4.38Å
155G94.2Very high95Very high10 Ų1020.9 Ų20.910%0.10313%0.128CC..  trans-71.6159.2177.100000112.8V95 I96 G97V95-G155 VanDerWaalsContact O-CA 3.28Å; V95-G155 WeakPolarHBondContact O-CA 3.3Å; V95-G155 PolarHBondContact O-N 3.2Å; I96-G155 VanDerWaalsContact C-CA 3.45Å; G97-G155 CarbonylContact O-C 3.56Å; G97-G155 VanDerWaalsContact O-CA 3.27Å; G97-G155 WeakPolarHBondContact O-CA 3.38Å
156H97.1Very high95Very high0 Ų021.5 Ų21.50%013%0.131CC..SBendtrans-96.4-4.2-174.9-67164.8000114.5L90 G97 S102 W103 V106 L158 A159 M160L90-H156 HydrophobicContact CD2-CB 4.05Å; L90-H156 HydrophobicContact CG-CB 4.41Å; G97-H156 PolarHBondContact O-N 3.49Å; S102-H156 PolarHBondContact OG-ND1 3.02Å; W103-H156 AromaticContact CD1-CE1 3.83Å; W103-H156 AromaticContact CD2-CE1 3.46Å; W103-H156 VanDerWaalsContact CD2-CE1 3.46Å; W103-H156 AromaticContact CE2-CE1 3.43Å; W103-H156 VanDerWaalsContact CE2-CE1 3.43Å; W103-H156 AromaticContact CE3-CE1 3.9Å; W103-H156 AromaticContact CG-CE1 3.72Å; W103-H156 AromaticContact CZ2-CE1 3.85Å; W103-H156 AromaticContact NE1-CE1 3.66Å; V106-H156 HydrophobicContact CG2-CB 4.46Å; H156-L158 PolarHBondContact O-N 2.77Å; H156-A159 WeakPolarHBondContact O-CB 3.27Å; H156-A159 PolarHBondContact O-N 3.33Å; H156-A159 VanDerWaalsContact O-N 3.17Å; H156-M160 WeakPolarHBondContact O-CG 3.27Å; H156-M160 PolarHBondContact O-N 3.47Å
157F97.6Very high95Very high2 Ų220.8 Ų20.81%0.00912%0.122CC..Hα-helixtrans-55.6-53.5-177.8-178.2-94.3000112.7A83 L84 L90 K94 A159 M160 V161 Y209 V213A83-F157 WeakPolarHBondContact O-CE2 3.42Å; L84-F157 HydrophobicContact CD2-CE2 4.4Å; L84-F157 HydrophobicContact CD2-CZ 3.93Å; L90-F157 HydrophobicContact CB-CB 4.29Å; L90-F157 HydrophobicContact CB-CD2 4.26Å; L90-F157 WeakPolarHBondContact O-CD2 3.42Å; K94-F157 HydrophobicContact CB-CB 4.19Å; K94-F157 HydrophobicContact CB-CD1 3.74Å; K94-F157 HydrophobicContact CB-CE1 4.35Å; K94-F157 HydrophobicContact CB-CG 3.96Å; K94-F157 HydrophobicContact CD-CD1 3.94Å; K94-F157 HydrophobicContact CD-CE1 3.67Å; K94-F157 HydrophobicContact CD-CE2 4.46Å; K94-F157 HydrophobicContact CD-CG 4.46Å; K94-F157 HydrophobicContact CD-CZ 3.96Å; K94-F157 HydrophobicContact CG-CB 4.46Å; K94-F157 HydrophobicContact CG-CD1 3.71Å; K94-F157 HydrophobicContact CG-CD2 4.11Å; K94-F157 HydrophobicContact CG-CE1 3.94Å; K94-F157 HydrophobicContact CG-CE2 4.31Å; K94-F157 HydrophobicContact CG-CG 3.82Å; K94-F157 HydrophobicContact CG-CZ 4.24Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.34Å; F157-M160 PolarHBondContact O-N 3.24Å; F157-V161 HydrophobicContact CD1-CG2 4.3Å; F157-V161 HydrophobicContact CE1-CG2 3.87Å; F157-V161 HydrophobicContact CE2-CG2 4.49Å; F157-V161 HydrophobicContact CZ-CG2 3.97Å; F157-V161 WeakPolarHBondContact O-CG2 3.39Å; F157-V161 PolarHBondContact O-N 2.94Å; F157-Y209 AromaticContact CE1-CE1 3.92Å; F157-Y209 HydrophobicContact CE1-CE1 3.92Å; F157-Y209 AromaticContact CZ-CE1 3.91Å; F157-Y209 HydrophobicContact CZ-CE1 3.91Å; F157-Y209 WeakPolarHBondContact CZ-OH 3.49Å; F157-V213 HydrophobicContact CE1-CG1 4.4Å; F157-V213 HydrophobicContact CE1-CG2 4.31Å
158L97.1Very high95.1Very high15 Ų1520.4 Ų20.48%0.07912%0.118CC..Hα-helixtrans-65.8-31.1179.4-70.6174.8000112.6H156 T162 M210 V213 T214 M221 F233H156-L158 PolarHBondContact O-N 2.77Å; L158-T162 WeakPolarHBondContact O-CB 3.16Å; L158-T162 PolarHBondContact O-N 3.02Å; L158-T162 PolarHBondContact O-OG1 3.37Å; L158-M210 HydrophobicContact CD2-CB 4.41Å; L158-M210 HydrophobicContact CD2-CG 4.32Å; L158-V213 HydrophobicContact CD2-CB 4.31Å; L158-V213 HydrophobicContact CD2-CG1 3.94Å; L158-T214 HydrophobicContact CD1-CG2 3.67Å; L158-T214 HydrophobicContact CD2-CG2 4.28Å; L158-M221 HydrophobicContact CD1-CE 3.91Å; L158-M221 HydrophobicContact CD1-SD 4.22Å; L158-F233 HydrophobicContact CB-CE2 4.25Å; L158-F233 HydrophobicContact CB-CZ 4.46Å; L158-F233 HydrophobicContact CD1-CE1 4.41Å; L158-F233 HydrophobicContact CD1-CE2 4.43Å; L158-F233 HydrophobicContact CD1-CZ 3.97Å; L158-F233 HydrophobicContact CD2-CZ 4.37Å
159A97.4Very high95.2Very high15 Ų1521.1 Ų21.112%0.12412%0.122CC..Hα-helixtrans-66.6-42.6173.500000111.4V106 F145 H156 F157 T162 L163V106-A159 HydrophobicContact CG2-CB 4.29Å; F145-A159 HydrophobicContact CE1-CB 4.04Å; H156-A159 WeakPolarHBondContact O-CB 3.27Å; H156-A159 PolarHBondContact O-N 3.33Å; H156-A159 VanDerWaalsContact O-N 3.17Å; F157-A159 VanDerWaalsContact C-N 3.28Å; F157-A159 PolarHBondContact O-N 3.34Å; A159-T162 WeakPolarHBondContact O-CB 3.4Å; A159-T162 PolarHBondContact O-N 3.02Å; A159-L163 PolarHBondContact O-N 2.85Å
160M98.2Very high95.3Very high0 Ų021.3 Ų21.30%012%0.124CC..Hα-helixtrans-65.3-41.1175.1-65.2-56.4100.300112.1A79 G80 A83 L90 W101 H105 V106 H156 F157 T162 L163 L164A79-M160 HydrophobicContact CB-SD 4.19Å; G80-M160 VanDerWaalsContact CA-O 3.26Å; G80-M160 WeakPolarHBondContact CA-O 3.47Å; A83-M160 HydrophobicContact CB-CB 3.41Å; A83-M160 VanDerWaalsContact CB-CB 3.41Å; A83-M160 HydrophobicContact CB-CG 3.95Å; L90-M160 HydrophobicContact CD2-CG 3.7Å; W101-M160 HydrophobicContact CH2-CG 4.15Å; W101-M160 HydrophobicContact CH2-SD 4.43Å; W101-M160 HydrophobicContact CZ3-CG 4.2Å; W101-M160 HydrophobicContact CZ3-SD 3.88Å; H105-M160 HydrophobicContact CB-CE 3.89Å; H105-M160 HydrophobicContact CB-SD 3.87Å; V106-M160 HydrophobicContact CG2-CE 3.5Å; H156-M160 WeakPolarHBondContact O-CG 3.27Å; H156-M160 PolarHBondContact O-N 3.47Å; F157-M160 PolarHBondContact O-N 3.24Å; M160-T162 PolarHBondContact O-N 2.96Å; M160-L163 HydrophobicContact CE-CD1 3.76Å; M160-L163 WeakPolarHBondContact O-CB 2.95Å; M160-L163 PolarHBondContact O-N 3.32Å; M160-L163 HydrophobicContact SD-CD1 4.06Å; M160-L164 PolarHBondContact O-N 3.2Å
161V97.8Very high95.5Very high0 Ų020.4 Ų20.40%011%0.114CC..Hα-helixtrans-65.6-31.8174.3-179.90000111.1L84 F157 L164 L165 L206 Y209 M210L84-V161 HydrophobicContact CD2-CG2 3.74Å; L84-V161 HydrophobicContact CG-CG2 4.3Å; F157-V161 HydrophobicContact CD1-CG2 4.3Å; F157-V161 HydrophobicContact CE1-CG2 3.87Å; F157-V161 HydrophobicContact CE2-CG2 4.49Å; F157-V161 HydrophobicContact CZ-CG2 3.97Å; F157-V161 WeakPolarHBondContact O-CG2 3.39Å; F157-V161 PolarHBondContact O-N 2.94Å; V161-L164 VanDerWaalsContact O-CB 3.3Å; V161-L164 WeakPolarHBondContact O-CB 3.38Å; V161-L164 PolarHBondContact O-N 3.45Å; V161-L165 PolarHBondContact O-N 3.43Å; V161-L206 HydrophobicContact CG1-CD2 4.37Å; V161-Y209 HydrophobicContact CG1-CD1 4.43Å; V161-M210 HydrophobicContact CB-CG 4.37Å; V161-M210 HydrophobicContact CG1-CG 3.62Å; V161-M210 HydrophobicContact CG1-SD 3.87Å
162T97.6Very high95.6Very high36 Ų3618.4 Ų18.422%0.22111%0.107CC..Hα-helixtrans-66.5-40.9172.7-59.60000111.4F145 L158 A159 M160 L164 L165 M210F145-T162 HydrophobicContact CE2-CG2 4.18Å; F145-T162 HydrophobicContact CZ-CG2 4.28Å; L158-T162 WeakPolarHBondContact O-CB 3.16Å; L158-T162 PolarHBondContact O-N 3.02Å; L158-T162 PolarHBondContact O-OG1 3.37Å; A159-T162 WeakPolarHBondContact O-CB 3.4Å; A159-T162 PolarHBondContact O-N 3.02Å; M160-T162 PolarHBondContact O-N 2.96Å; T162-L164 VanDerWaalsContact C-N 3.27Å; T162-L164 PolarHBondContact O-N 3.15Å; T162-L165 VanDerWaalsContact O-CB 3.27Å; T162-L165 WeakPolarHBondContact O-CB 3.47Å; T162-L165 PolarHBondContact O-N 2.64Å; T162-L165 VanDerWaalsContact O-N 3.12Å; T162-M210 WeakPolarHBondContact OG1-CE 3.36Å
163L98Very high96.2Very high3 Ų315.9 Ų15.92%0.0169%0.094CC..Hα-helixtrans-58.2-41.2170.6-69.5-178.9000111.3F72 S76 A79 H105 A109 F145 A159 M160 L165 E166F72-L163 HydrophobicContact CZ-CD2 3.86Å; S76-L163 VanDerWaalsContact CB-O 3.28Å; S76-L163 WeakPolarHBondContact CB-O 3.36Å; A79-L163 HydrophobicContact CB-CD1 4.18Å; H105-L163 HydrophobicContact CB-CD1 4Å; A109-L163 HydrophobicContact CB-CD1 4.45Å; A109-L163 HydrophobicContact CB-CD2 3.65Å; F145-L163 HydrophobicContact CE1-CD1 4.35Å; F145-L163 HydrophobicContact CE1-CD2 3.76Å; F145-L163 HydrophobicContact CE1-CG 3.87Å; F145-L163 HydrophobicContact CE2-CD2 3.89Å; F145-L163 HydrophobicContact CZ-CD1 4.48Å; F145-L163 HydrophobicContact CZ-CD2 3.24Å; F145-L163 HydrophobicContact CZ-CG 3.54Å; A159-L163 PolarHBondContact O-N 2.85Å; M160-L163 HydrophobicContact CE-CD1 3.76Å; M160-L163 WeakPolarHBondContact O-CB 2.95Å; M160-L163 PolarHBondContact O-N 3.32Å; M160-L163 HydrophobicContact SD-CD1 4.06Å; L163-L165 PolarHBondContact O-N 3.49Å; L163-L165 VanDerWaalsContact O-N 3.09Å; L163-E166 WeakPolarHBondContact O-CB 3.16Å; L163-E166 PolarHBondContact O-N 2.86Å
164L98.3Very high96.8Very high4 Ų415.6 Ų15.62%0.0219%0.087CC..Hα-helixtrans-58.5-27178-168.550.2000113.2S77 L81 L84 M160 V161 T162 E166 M167 L206S77-L164 WeakPolarHBondContact O-CD1 3.07Å; L81-L164 HydrophobicContact CD2-CD1 4.23Å; L81-L164 HydrophobicContact CD2-CD2 4.36Å; L81-L164 HydrophobicContact CG-CD1 3.8Å; L84-L164 HydrophobicContact CD1-CD2 3.32Å; L84-L164 HydrophobicContact CG-CD2 4.24Å; M160-L164 PolarHBondContact O-N 3.2Å; V161-L164 VanDerWaalsContact O-CB 3.3Å; V161-L164 WeakPolarHBondContact O-CB 3.38Å; V161-L164 PolarHBondContact O-N 3.45Å; T162-L164 VanDerWaalsContact C-N 3.27Å; T162-L164 PolarHBondContact O-N 3.15Å; L164-E166 PolarHBondContact O-N 3.28Å; L164-E166 VanDerWaalsContact O-N 3.09Å; L164-M167 HydrophobicContact CD1-CB 4.38Å; L164-M167 HydrophobicContact CD1-SD 4.29Å; L164-M167 HydrophobicContact CG-SD 4.34Å; L164-M167 WeakPolarHBondContact O-CB 3.38Å; L164-M167 VanDerWaalsContact O-CG 3.24Å; L164-M167 WeakPolarHBondContact O-CG 3.48Å; L164-M167 PolarHBondContact O-N 3.44Å; L164-L206 HydrophobicContact CB-CD1 4.01Å; L164-L206 HydrophobicContact CD2-CD1 3.57Å; L164-L206 HydrophobicContact CD2-CD2 4.09Å; L164-L206 HydrophobicContact CD2-CG 4.5Å; L164-L206 HydrophobicContact CG-CD1 3.55Å
165L97.5Very high97.1Very high2 Ų214.7 Ų14.71%0.018%0.083CC..G310 helixtrans-56.6-29176.3-60.1177.5000110.7V161 T162 L163 M167 R203 L206 T207 M210 L240V161-L165 PolarHBondContact O-N 3.43Å; T162-L165 VanDerWaalsContact O-CB 3.27Å; T162-L165 WeakPolarHBondContact O-CB 3.47Å; T162-L165 PolarHBondContact O-N 2.64Å; T162-L165 VanDerWaalsContact O-N 3.12Å; L163-L165 PolarHBondContact O-N 3.49Å; L163-L165 VanDerWaalsContact O-N 3.09Å; L165-M167 PolarHBondContact O-N 3.29Å; L165-R203 VanDerWaalsContact C-CZ 3.48Å; L165-R203 HydrophobicContact CB-CG 4.4Å; L165-R203 HydrophobicContact CD2-CB 4.26Å; L165-R203 HydrophobicContact CD2-CG 4.35Å; L165-R203 WeakPolarHBondContact O-CD 3.4Å; L165-R203 WeakPolarHBondContact O-CG 3.47Å; L165-R203 PolarHBondContact O-NE 3.38Å; L165-R203 PolarHBondContact O-NH1 2.88Å; L165-L206 HydrophobicContact CD2-CB 3.66Å; L165-L206 HydrophobicContact CD2-CD1 4.1Å; L165-T207 HydrophobicContact CD1-CG2 4.31Å; L165-T207 HydrophobicContact CD2-CG2 4.11Å; L165-M210 HydrophobicContact CD1-SD 4.24Å; L165-L240 HydrophobicContact CD1-CD1 4Å
166E97.1Very high97.1Very high19 Ų1914.4 Ų14.49%0.0898%0.079CC..G310 helixtrans-70.23.8177.7-62.1-55.9114.100115.3F72 H137 L163 L164 S168 T169 P170 R203F72-E166 HydrophobicContact CE1-CG 4.14Å; H137-E166 IonicContact NE2-OE1 2.95Å; L163-E166 WeakPolarHBondContact O-CB 3.16Å; L163-E166 PolarHBondContact O-N 2.86Å; L164-E166 PolarHBondContact O-N 3.28Å; L164-E166 VanDerWaalsContact O-N 3.09Å; E166-S168 PolarHBondContact O-N 2.89Å; E166-S168 VanDerWaalsContact O-N 3.15Å; E166-T169 WeakPolarHBondContact O-CB 3.34Å; E166-T169 PolarHBondContact O-N 3.41Å; E166-T169 PolarHBondContact O-OG1 3.34Å; E166-T169 PolarHBondContact OE2-OG1 3.46Å; E166-P170 VanDerWaalsContact O-CD 3.32Å; E166-P170 WeakPolarHBondContact O-CD 3.49Å; E166-R203 IonicContact OE1-CZ 3.79Å; E166-R203 IonicContact OE1-NH1 2.71Å; E166-R203 PolarHBondContact OE1-NH1 2.95Å; E166-R203 IonicContact OE1-NH2 3.16Å; E166-R203 PolarHBondContact OE1-NH2 2.88Å
167M97.3Very high97Very high19 Ų1916.4 Ų16.49%0.0949%0.088CC..G310 helixtrans-60.2-22.3176.167.2-176.1159.400115.4S77 L164 L165 F171 M199 C202 R203 L206S77-M167 WeakPolarHBondContact OG-CA 3.32Å; S77-M167 WeakPolarHBondContact OG-CB 3.4Å; L164-M167 HydrophobicContact CD1-CB 4.38Å; L164-M167 HydrophobicContact CD1-SD 4.29Å; L164-M167 HydrophobicContact CG-SD 4.34Å; L164-M167 WeakPolarHBondContact O-CB 3.38Å; L164-M167 VanDerWaalsContact O-CG 3.24Å; L164-M167 WeakPolarHBondContact O-CG 3.48Å; L164-M167 PolarHBondContact O-N 3.44Å; L165-M167 PolarHBondContact O-N 3.29Å; M167-F171 WeakPolarHBondContact O-CD2 3.46Å; M167-F171 WeakPolarHBondContact O-CE2 3.49Å; M167-M199 HydrophobicContact CB-SD 4.34Å; M167-M199 HydrophobicContact CG-CB 4.27Å; M167-M199 HydrophobicContact CG-SD 4.08Å; M167-M199 HydrophobicContact SD-SD 3.99Å; M167-C202 HydrophobicContact CE-CB 3.28Å; M167-C202 HydrophobicContact SD-CB 3.97Å; M167-R203 HydrophobicContact CE-CB 4.3Å; M167-R203 HydrophobicContact CE-CG 3.77Å; M167-L206 HydrophobicContact CE-CD1 3.42Å; M167-L206 VanDerWaalsContact CE-CD1 3.42Å; M167-L206 HydrophobicContact CE-CG 4.31Å; M167-L206 HydrophobicContact SD-CD1 4.33Å
168S96.9Very high96.8Very high0 Ų017 Ų170%09%0.092CC..G310 helixtrans-83.4-15.917471.50000113.5E166 F171 T172 F200 R203E166-S168 PolarHBondContact O-N 2.89Å; E166-S168 VanDerWaalsContact O-N 3.15Å; S168-F171 PolarHBondContact O-N 3.48Å; S168-T172 WeakPolarHBondContact O-CB 3.33Å; S168-T172 PolarHBondContact O-N 3.15Å; S168-T172 PolarHBondContact O-OG1 3.38Å; S168-F200 WeakPolarHBondContact OG-CZ 3.41Å; S168-R203 WeakPolarHBondContact OG-CD 3.45Å; S168-R203 PolarHBondContact OG-NH1 2.74Å; S168-R203 VanDerWaalsContact OG-NH1 3.17Å
169T96.8Very high96.6Very high18 Ų1816.5 Ų16.511%0.119%0.089CC..Hα-helixtrans-66-44.2-171.3-60.30000112.9R69 E166 F171 T172 C173R69-T169 HydrophobicContact CB-CG2 3.89Å; E166-T169 WeakPolarHBondContact O-CB 3.34Å; E166-T169 PolarHBondContact O-N 3.41Å; E166-T169 PolarHBondContact O-OG1 3.34Å; E166-T169 PolarHBondContact OE2-OG1 3.46Å; T169-F171 VanDerWaalsContact C-N 3.34Å; T169-F171 PolarHBondContact O-N 2.99Å; T169-T172 WeakPolarHBondContact O-CB 3.36Å; T169-T172 PolarHBondContact O-N 3.27Å; T169-C173 PolarHBondContact O-N 2.88Å; T169-C173 PolarHBondContact O-SG 3.33Å
170P98.1Very high96.4Very high8 Ų817.4 Ų17.45%0.0529%0.09CC..Hα-helixtrans-57.4-46.9177.2-23.733.6000112.3A70 I74 E166 T172 C173 I174A70-P170 HydrophobicContact CB-CB 4.27Å; I74-P170 HydrophobicContact CG1-CB 4.25Å; I74-P170 HydrophobicContact CG1-CG 3.86Å; E166-P170 VanDerWaalsContact O-CD 3.32Å; E166-P170 WeakPolarHBondContact O-CD 3.49Å; P170-T172 VanDerWaalsContact C-N 3.33Å; P170-T172 PolarHBondContact O-N 2.83Å; P170-C173 PolarHBondContact O-N 2.87Å; P170-I174 VanDerWaalsContact O-CG1 3.27Å; P170-I174 WeakPolarHBondContact O-CG1 3.4Å; P170-I174 PolarHBondContact O-N 3.44Å
171F97.7Very high96.1Very high59 Ų5918.7 Ų18.726%0.25910%0.101SC..Hα-helixtrans-69.4-31.9-179.4-52.6-76.1000112.5M167 S168 T169 S175 N192 V195 M196 M199M167-F171 WeakPolarHBondContact O-CD2 3.46Å; M167-F171 WeakPolarHBondContact O-CE2 3.49Å; S168-F171 PolarHBondContact O-N 3.48Å; T169-F171 VanDerWaalsContact C-N 3.34Å; T169-F171 PolarHBondContact O-N 2.99Å; F171-S175 WeakPolarHBondContact O-CB 3.23Å; F171-S175 PolarHBondContact O-N 2.88Å; F171-N192 WeakPolarHBondContact CA-OD1 3.43Å; F171-N192 WeakPolarHBondContact CD1-OD1 3.24Å; F171-N192 PolarHBondContact O-ND2 3.07Å; F171-V195 HydrophobicContact CD1-CB 4.17Å; F171-V195 HydrophobicContact CD1-CG1 3.8Å; F171-V195 HydrophobicContact CD2-CG1 4.09Å; F171-V195 HydrophobicContact CE1-CB 4.17Å; F171-V195 HydrophobicContact CE1-CG1 3.46Å; F171-V195 VanDerWaalsContact CE1-CG1 3.46Å; F171-V195 HydrophobicContact CE2-CG1 3.77Å; F171-V195 HydrophobicContact CG-CG1 4.1Å; F171-V195 HydrophobicContact CZ-CG1 3.44Å; F171-V195 VanDerWaalsContact CZ-CG1 3.44Å; F171-M196 HydrophobicContact CB-CB 3.63Å; F171-M196 HydrophobicContact CB-CG 4.03Å; F171-M199 HydrophobicContact CD2-CG 3.92Å; F171-M199 HydrophobicContact CE2-CG 3.82Å
172T95.7Very high95.8Very high30 Ų3019.1 Ų19.118%0.18411%0.105CC..Hα-helixtrans-64.3-43.4172.1-64.70000111.8S168 T169 P170 S175 W176 M196 F200S168-T172 WeakPolarHBondContact O-CB 3.33Å; S168-T172 PolarHBondContact O-N 3.15Å; S168-T172 PolarHBondContact O-OG1 3.38Å; T169-T172 WeakPolarHBondContact O-CB 3.36Å; T169-T172 PolarHBondContact O-N 3.27Å; P170-T172 VanDerWaalsContact C-N 3.33Å; P170-T172 PolarHBondContact O-N 2.83Å; T172-S175 WeakPolarHBondContact O-CB 3.34Å; T172-W176 PolarHBondContact O-N 3.11Å; T172-M196 VanDerWaalsContact CA-SD 3.53Å; T172-M196 PolarHBondContact OG1-SD 3.37Å; T172-F200 WeakPolarHBondContact OG1-CE2 3.45Å
173C96.9Very high95.6Very high9 Ų924 Ų246%0.06112%0.119CC..Hα-helixtrans-68.3-47.7179.4-650000111.1A66 A70 T169 P170 S175 W176 M177A66-C173 HydrophobicContact CB-CB 3.95Å; A66-C173 VanDerWaalsContact O-CB 3.23Å; A66-C173 WeakPolarHBondContact O-CB 3.26Å; A66-C173 PolarHBondContact O-SG 3.29Å; A70-C173 HydrophobicContact CB-CB 3.95Å; T169-C173 PolarHBondContact O-N 2.88Å; T169-C173 PolarHBondContact O-SG 3.33Å; P170-C173 PolarHBondContact O-N 2.87Å; C173-S175 VanDerWaalsContact C-N 3.33Å; C173-S175 PolarHBondContact O-N 3.5Å; C173-W176 PolarHBondContact O-N 3.39Å; C173-M177 WeakPolarHBondContact O-CG 3.45Å; C173-M177 PolarHBondContact O-N 3.2Å
174I95.7Very high95.1Very high60 Ų6024 Ų2431%0.30812%0.12SC..Hα-helixtrans-58.1-45.5175.1-67.5165000110.7P170 W176 M177 L178 N192P170-I174 VanDerWaalsContact O-CG1 3.27Å; P170-I174 WeakPolarHBondContact O-CG1 3.4Å; P170-I174 PolarHBondContact O-N 3.44Å; I174-W176 VanDerWaalsContact C-N 3.3Å; I174-W176 PolarHBondContact O-N 3.48Å; I174-M177 PolarHBondContact O-N 2.96Å; I174-L178 HydrophobicContact CG2-CD1 3.66Å; I174-L178 HydrophobicContact CG2-CG 4.11Å; I174-L178 WeakPolarHBondContact O-CB 3.28Å; I174-L178 VanDerWaalsContact O-CG 3.24Å; I174-L178 WeakPolarHBondContact O-CG 3.45Å; I174-L178 PolarHBondContact O-N 3.37Å; I174-N192 WeakPolarHBondContact CG2-OD1 3.32Å
175S94.9Very high94.5Very high0 Ų032.4 Ų32.40%015%0.151CC..Hα-helixtrans-52.2-48.5176.5173.40000111.9F171 T172 C173 L179 W189 N192 Q193 Q255F171-S175 WeakPolarHBondContact O-CB 3.23Å; F171-S175 PolarHBondContact O-N 2.88Å; T172-S175 WeakPolarHBondContact O-CB 3.34Å; C173-S175 VanDerWaalsContact C-N 3.33Å; C173-S175 PolarHBondContact O-N 3.5Å; S175-L179 WeakPolarHBondContact O-CB 3.47Å; S175-L179 PolarHBondContact O-N 3.01Å; S175-W189 PolarHBondContact O-NE1 3.4Å; S175-W189 VanDerWaalsContact O-NE1 3.16Å; S175-N192 PolarHBondContact N-ND2 3.16Å; S175-Q193 VanDerWaalsContact CB-NE2 3.25Å; S175-Q193 PolarHBondContact OG-NE2 2.92Å; S175-Q193 PolarHBondContact OG-OE1 3.28Å; S175-Q255 PolarHBondContact OG-OE1 3.23Å
176W94.6Very high94.3Very high4 Ų434.1 Ų34.12%0.01516%0.162CC..Hα-helixtrans-70.6-43.5-178.1-179.883.8000112.3F62 W63 A66 T172 C173 I174 L178 L179 K180 D261 N263 F264F62-W176 HydrophobicContact CB-CH2 4.3Å; F62-W176 AromaticContact CD1-CD2 3.87Å; F62-W176 HydrophobicContact CD1-CD2 3.87Å; F62-W176 AromaticContact CD1-CE2 3.63Å; F62-W176 AromaticContact CD1-CE3 3.93Å; F62-W176 HydrophobicContact CD1-CE3 3.93Å; F62-W176 AromaticContact CD1-CH2 3.57Å; F62-W176 HydrophobicContact CD1-CH2 3.57Å; F62-W176 AromaticContact CD1-CZ2 3.45Å; F62-W176 HydrophobicContact CD1-CZ2 3.45Å; F62-W176 VanDerWaalsContact CD1-CZ2 3.45Å; F62-W176 AromaticContact CD1-CZ3 3.81Å; F62-W176 HydrophobicContact CD1-CZ3 3.81Å; F62-W176 AromaticContact CE1-CD2 3.74Å; F62-W176 HydrophobicContact CE1-CD2 3.74Å; F62-W176 AromaticContact CE1-CE2 3.71Å; F62-W176 HydrophobicContact CE1-CE3 4.11Å; F62-W176 HydrophobicContact CE1-CG 4.17Å; F62-W176 HydrophobicContact CE1-CH2 4.42Å; F62-W176 HydrophobicContact CE1-CZ2 4.05Å; F62-W176 HydrophobicContact CE1-CZ3 4.46Å; F62-W176 HydrophobicContact CG-CH2 4.39Å; F62-W176 HydrophobicContact CG-CZ2 4.33Å; W63-W176 HydrophobicContact CB-CH2 4.17Å; W63-W176 HydrophobicContact CB-CZ3 3.87Å; W63-W176 HydrophobicContact CD2-CZ3 4.3Å; W63-W176 HydrophobicContact CE3-CH2 4.31Å; W63-W176 AromaticContact CE3-CZ3 3.71Å; W63-W176 HydrophobicContact CE3-CZ3 3.71Å; W63-W176 HydrophobicContact CG-CZ3 4.41Å; A66-W176 HydrophobicContact CB-CE3 4.32Å; T172-W176 PolarHBondContact O-N 3.11Å; C173-W176 PolarHBondContact O-N 3.39Å; I174-W176 VanDerWaalsContact C-N 3.3Å; I174-W176 PolarHBondContact O-N 3.48Å; W176-L178 VanDerWaalsContact C-N 3.35Å; W176-L178 PolarHBondContact O-N 3.31Å; W176-L179 WeakPolarHBondContact O-CB 3.46Å; W176-L179 PolarHBondContact O-N 3.11Å; W176-L179 VanDerWaalsContact O-N 3.15Å; W176-K180 HydrophobicContact CD2-CG 4.18Å; W176-K180 HydrophobicContact CE3-CG 4.35Å; W176-K180 HydrophobicContact CH2-CG 3.89Å; W176-K180 HydrophobicContact CZ2-CD 4.13Å; W176-K180 HydrophobicContact CZ2-CG 3.71Å; W176-K180 HydrophobicContact CZ3-CG 4.19Å; W176-K180 PolarHBondContact O-N 2.93Å; W176-D261 PolarHBondContact NE1-OD1 3.29Å; W176-D261 VanDerWaalsContact NE1-OD1 3.09Å; W176-N263 PolarHBondContact NE1-ND2 3.41Å; W176-F264 HydrophobicContact CZ2-CD2 4Å; W176-F264 AromaticContact CZ2-CE2 3.65Å; W176-F264 HydrophobicContact CZ2-CE2 3.65Å
177M95.4Very high94.2Very high41 Ų4140.1 Ų40.120%0.20219%0.193CC..Hα-helixtrans-61.9-43.3178.2-67.117179.700111.4W63 A66 C173 I174 L179 K180 A181W63-M177 HydrophobicContact CD2-CE 3.93Å; W63-M177 HydrophobicContact CD2-CG 4.18Å; W63-M177 HydrophobicContact CE3-CB 4.28Å; W63-M177 HydrophobicContact CE3-CG 4.09Å; W63-M177 HydrophobicContact CG-CE 4.35Å; W63-M177 HydrophobicContact CH2-CB 3.94Å; W63-M177 HydrophobicContact CH2-CE 4.23Å; W63-M177 HydrophobicContact CH2-CG 4.41Å; W63-M177 HydrophobicContact CZ2-CB 4.4Å; W63-M177 HydrophobicContact CZ2-CE 3.49Å; W63-M177 VanDerWaalsContact CZ2-CE 3.49Å; W63-M177 HydrophobicContact CZ3-CB 3.9Å; W63-M177 HydrophobicContact CZ3-CG 4.21Å; W63-M177 WeakPolarHBondContact CZ3-O 3.19Å; A66-M177 HydrophobicContact CB-CG 4.33Å; A66-M177 HydrophobicContact CB-SD 4.35Å; C173-M177 WeakPolarHBondContact O-CG 3.45Å; C173-M177 PolarHBondContact O-N 3.2Å; I174-M177 PolarHBondContact O-N 2.96Å; M177-L179 VanDerWaalsContact C-N 3.34Å; M177-L179 PolarHBondContact O-N 3.2Å; M177-K180 PolarHBondContact O-N 3.49Å; M177-A181 PolarHBondContact O-N 3.03Å
178L94.3Very high94Very high16 Ų1645.4 Ų45.48%0.08422%0.216CC..Hα-helixtrans-64.9-36.9174.3-71.5175.8000112.4I174 W176 K180 A181 G182 W183 F188 W189I174-L178 HydrophobicContact CG2-CD1 3.66Å; I174-L178 HydrophobicContact CG2-CG 4.11Å; I174-L178 WeakPolarHBondContact O-CB 3.28Å; I174-L178 VanDerWaalsContact O-CG 3.24Å; I174-L178 WeakPolarHBondContact O-CG 3.45Å; I174-L178 PolarHBondContact O-N 3.37Å; W176-L178 VanDerWaalsContact C-N 3.35Å; W176-L178 PolarHBondContact O-N 3.31Å; L178-K180 VanDerWaalsContact C-N 3.33Å; L178-A181 CarbonylContact O-C 3.35Å; L178-A181 PolarHBondContact O-N 3.2Å; L178-G182 PolarHBondContact O-N 2.94Å; L178-W183 HydrophobicContact CB-CB 4.4Å; L178-W183 HydrophobicContact CD2-CB 4.22Å; L178-W183 HydrophobicContact CD2-CD2 4.4Å; L178-W183 HydrophobicContact CD2-CE3 3.67Å; L178-W183 HydrophobicContact CD2-CZ3 4.4Å; L178-W183 PolarHBondContact O-N 2.9Å; L178-F188 HydrophobicContact CD1-CD1 3.65Å; L178-F188 HydrophobicContact CD1-CE1 3.66Å; L178-F188 HydrophobicContact CD2-CD1 4.12Å; L178-F188 HydrophobicContact CD2-CE1 4.09Å; L178-F188 HydrophobicContact CG-CE1 4.42Å; L178-W189 HydrophobicContact CD1-CB 4.18Å; L178-W189 HydrophobicContact CD1-CG 4.4Å
179L92.8Very high93.9Very high3 Ų345.5 Ų45.52%0.01622%0.217CC..Hα-helixtrans-62.3-42.9175-175.9148.9000111S175 W176 M177 A181 G182 A184 P259 D261 A269S175-L179 WeakPolarHBondContact O-CB 3.47Å; S175-L179 PolarHBondContact O-N 3.01Å; W176-L179 WeakPolarHBondContact O-CB 3.46Å; W176-L179 PolarHBondContact O-N 3.11Å; W176-L179 VanDerWaalsContact O-N 3.15Å; M177-L179 VanDerWaalsContact C-N 3.34Å; M177-L179 PolarHBondContact O-N 3.2Å; L179-A181 VanDerWaalsContact C-N 3.29Å; L179-A181 PolarHBondContact O-N 3.45Å; L179-G182 PolarHBondContact O-N 3.05Å; L179-G182 VanDerWaalsContact O-N 3.12Å; L179-A184 HydrophobicContact CB-CB 4.44Å; L179-A184 HydrophobicContact CG-CB 4.33Å; L179-P259 HydrophobicContact CD1-CB 4.33Å; L179-D261 HydrophobicContact CD2-CB 3.79Å; L179-A269 HydrophobicContact CD1-CB 4.46Å; L179-A269 HydrophobicContact CD2-CB 4.45Å; L179-A269 HydrophobicContact CG-CB 4.02Å
180K92.2Very high93.8Very high35 Ų3550.8 Ų50.815%0.15223%0.234CC..Hα-helixtrans-64.9-32.3174-72.3-63.9-177.9-178.50113.1T51 L55 E59 W63 W176 M177 L178 G182 D261T51-K180 HydrophobicContact CG2-CB 4.37Å; T51-K180 VanDerWaalsContact CG2-O 3.25Å; T51-K180 WeakPolarHBondContact CG2-O 3.38Å; L55-K180 HydrophobicContact CD2-CB 4.48Å; L55-K180 HydrophobicContact CD2-CD 4.11Å; E59-K180 IonicContact OE1-NZ 2.67Å; E59-K180 PolarHBondContact OE1-NZ 3.48Å; E59-K180 VanDerWaalsContact OE1-NZ 3.16Å; E59-K180 WeakPolarHBondContact OE2-CE 3.27Å; E59-K180 IonicContact OE2-NZ 3.75Å; E59-K180 PolarHBondContact OE2-NZ 2.87Å; W63-K180 HydrophobicContact CE3-CB 4.41Å; W63-K180 HydrophobicContact CZ3-CB 3.91Å; W176-K180 HydrophobicContact CD2-CG 4.18Å; W176-K180 HydrophobicContact CE3-CG 4.35Å; W176-K180 HydrophobicContact CH2-CG 3.89Å; W176-K180 HydrophobicContact CZ2-CD 4.13Å; W176-K180 HydrophobicContact CZ2-CG 3.71Å; W176-K180 HydrophobicContact CZ3-CG 4.19Å; W176-K180 PolarHBondContact O-N 2.93Å; M177-K180 PolarHBondContact O-N 3.49Å; L178-K180 VanDerWaalsContact C-N 3.33Å; K180-G182 PolarHBondContact O-N 3.22Å; K180-D261 WeakPolarHBondContact CE-OD2 3.39Å; K180-D261 IonicContact NZ-OD2 3.32Å; K180-D261 PolarHBondContact NZ-OD2 2.89Å
181A92.9Very high93.7Very high27 Ų2753 Ų5322%0.22325%0.254CS..THydrogen-bonded Turntrans-76.11.1173.900000114.3T51 M177 L178 L179 W183T51-A181 HydrophobicContact CG2-CB 4.3Å; M177-A181 PolarHBondContact O-N 3.03Å; L178-A181 CarbonylContact O-C 3.35Å; L178-A181 PolarHBondContact O-N 3.2Å; L179-A181 VanDerWaalsContact C-N 3.29Å; L179-A181 PolarHBondContact O-N 3.45Å; A181-W183 HydrophobicContact CB-CG 4.36Å; A181-W183 PolarHBondContact O-N 3.31Å
182G90.5Very high93.6Very high8 Ų850.9 Ų50.98%0.08225%0.245CC..THydrogen-bonded Turntrans78.80.5-176.500000114.1L178 L179 K180 A184 N272L178-G182 PolarHBondContact O-N 2.94Å; L179-G182 PolarHBondContact O-N 3.05Å; L179-G182 VanDerWaalsContact O-N 3.12Å; K180-G182 PolarHBondContact O-N 3.22Å; G182-A184 PolarHBondContact O-N 3.27Å; G182-A184 VanDerWaalsContact O-N 3.13Å; G182-N272 PolarHBondContact O-OD1 2.79Å
183W93Very high93.6Very high139 Ų13949.4 Ų49.453%0.52724%0.236SC..  trans-85.314.7-171.5-68.811.7000114.1L178 A181 R185 T186 W189L178-W183 HydrophobicContact CB-CB 4.4Å; L178-W183 HydrophobicContact CD2-CB 4.22Å; L178-W183 HydrophobicContact CD2-CD2 4.4Å; L178-W183 HydrophobicContact CD2-CE3 3.67Å; L178-W183 HydrophobicContact CD2-CZ3 4.4Å; L178-W183 PolarHBondContact O-N 2.9Å; A181-W183 HydrophobicContact CB-CG 4.36Å; A181-W183 PolarHBondContact O-N 3.31Å; W183-R185 PolarHBondContact O-N 3.44Å; W183-T186 HydrophobicContact CB-CG2 3.95Å; W183-T186 HydrophobicContact CG-CG2 4.32Å; W183-T186 WeakPolarHBondContact O-CB 3.2Å; W183-T186 WeakPolarHBondContact O-CG2 3.43Å; W183-T186 PolarHBondContact O-N 3.34Å; W183-T186 VanDerWaalsContact O-N 3.07Å; W183-T186 PolarHBondContact O-OG1 2.9Å; W183-W189 VanDerWaalsContact O-CB 3.23Å; W183-W189 WeakPolarHBondContact O-CB 3.49Å
184A88.4Confident93.5Very high3 Ų356.1 Ų56.13%0.02526%0.26CS..THydrogen-bonded Turntrans-65.7-7.5-173.600000114.8L179 G182 W189 P259 A269L179-A184 HydrophobicContact CB-CB 4.44Å; L179-A184 HydrophobicContact CG-CB 4.33Å; G182-A184 PolarHBondContact O-N 3.27Å; G182-A184 VanDerWaalsContact O-N 3.13Å; A184-W189 HydrophobicContact CB-CD2 4.33Å; A184-W189 HydrophobicContact CB-CZ2 4.39Å; A184-W189 VanDerWaalsContact O-CD2 3.26Å; A184-W189 VanDerWaalsContact O-CZ3 3.27Å; A184-W189 WeakPolarHBondContact O-CZ3 3.41Å; A184-P259 HydrophobicContact CB-CB 3.64Å; A184-P259 HydrophobicContact CB-CG 4.27Å; A184-A269 HydrophobicContact CB-CB 3.85Å
185R86.1Confident93.6Very high181 Ų18156.1 Ų56.168%0.68326%0.263SS*.THydrogen-bonded Turntrans-109.10.8176.9-63.4-174.8179.4-173.10.7113.9W183W183-R185 PolarHBondContact O-N 3.44Å
186T93.3Very high93.6Very high38 Ų3856.1 Ų56.123%0.23326%0.263CS..SBendtrans-73.3156.3-179.363.10000111.9W183 F188 W189 R190W183-T186 HydrophobicContact CB-CG2 3.95Å; W183-T186 HydrophobicContact CG-CG2 4.32Å; W183-T186 WeakPolarHBondContact O-CB 3.2Å; W183-T186 WeakPolarHBondContact O-CG2 3.43Å; W183-T186 PolarHBondContact O-N 3.34Å; W183-T186 VanDerWaalsContact O-N 3.07Å; W183-T186 PolarHBondContact O-OG1 2.9Å; T186-F188 PolarHBondContact O-N 3.47Å; T186-W189 PolarHBondContact O-N 3.16Å; T186-W189 WeakPolarHBondContact OG1-CB 2.92Å; T186-W189 PolarHBondContact OG1-N 2.83Å; T186-W189 VanDerWaalsContact OG1-N 3.11Å; T186-R190 WeakPolarHBondContact O-CG 3.16Å; T186-R190 PolarHBondContact O-N 3.22Å; T186-R190 VanDerWaalsContact O-N 3.08Å
187L93.9Very high93.7Very high144 Ų14456.5 Ų56.575%0.75427%0.265SS*.Hα-helixtrans-59.2-39.1171.8-69.5177.2000111.6W189 R190 A191L187-W189 PolarHBondContact O-N 2.95Å; L187-R190 PolarHBondContact O-N 3.2Å; L187-A191 WeakPolarHBondContact O-CB 3.47Å; L187-A191 PolarHBondContact O-N 3.37Å
188F94.6Very high93.7Very high130 Ų13059.4 Ų59.457%0.5728%0.278SS*.Hα-helixtrans-59.1-47.4176.6-178.1-112.6000111.9L178 T186 R190 A191 N192L178-F188 HydrophobicContact CD1-CD1 3.65Å; L178-F188 HydrophobicContact CD1-CE1 3.66Å; L178-F188 HydrophobicContact CD2-CD1 4.12Å; L178-F188 HydrophobicContact CD2-CE1 4.09Å; L178-F188 HydrophobicContact CG-CE1 4.42Å; T186-F188 PolarHBondContact O-N 3.47Å; F188-R190 PolarHBondContact O-N 2.99Å; F188-A191 PolarHBondContact O-N 3.19Å; F188-N192 PolarHBondContact O-N 2.84Å
189W94.7Very high93.9Very high2 Ų260.9 Ų60.91%0.00829%0.285CS..Hα-helixtrans-63.2-42.1177.1-176.188.3000112.4S175 L178 W183 A184 T186 L187 N192 Q193 Q255 P259S175-W189 PolarHBondContact O-NE1 3.4Å; S175-W189 VanDerWaalsContact O-NE1 3.16Å; L178-W189 HydrophobicContact CD1-CB 4.18Å; L178-W189 HydrophobicContact CD1-CG 4.4Å; W183-W189 VanDerWaalsContact O-CB 3.23Å; W183-W189 WeakPolarHBondContact O-CB 3.49Å; A184-W189 HydrophobicContact CB-CD2 4.33Å; A184-W189 HydrophobicContact CB-CZ2 4.39Å; A184-W189 VanDerWaalsContact O-CD2 3.26Å; A184-W189 VanDerWaalsContact O-CZ3 3.27Å; A184-W189 WeakPolarHBondContact O-CZ3 3.41Å; T186-W189 PolarHBondContact O-N 3.16Å; T186-W189 WeakPolarHBondContact OG1-CB 2.92Å; T186-W189 PolarHBondContact OG1-N 2.83Å; T186-W189 VanDerWaalsContact OG1-N 3.11Å; L187-W189 PolarHBondContact O-N 2.95Å; W189-N192 WeakPolarHBondContact O-CB 3.25Å; W189-N192 PolarHBondContact O-N 3.17Å; W189-Q193 HydrophobicContact CD2-CG 3.85Å; W189-Q193 HydrophobicContact CE3-CG 3.54Å; W189-Q193 HydrophobicContact CH2-CG 3.44Å; W189-Q193 VanDerWaalsContact CH2-CG 3.44Å; W189-Q193 HydrophobicContact CZ2-CG 3.73Å; W189-Q193 HydrophobicContact CZ3-CG 3.33Å; W189-Q193 WeakPolarHBondContact O-CG 3.46Å; W189-Q193 PolarHBondContact O-N 2.77Å; W189-Q255 HydrophobicContact CH2-CG 4.42Å; W189-Q255 WeakPolarHBondContact CH2-O 3.11Å; W189-Q255 HydrophobicContact CZ2-CG 4.15Å; W189-P259 HydrophobicContact CH2-CB 4.05Å; W189-P259 HydrophobicContact CH2-CG 4.02Å; W189-P259 HydrophobicContact CZ2-CB 4.24Å; W189-P259 HydrophobicContact CZ3-CG 4.35Å
190R93.7Very high94Very high129 Ų12961 Ų6149%0.48729%0.286SS..Hα-helixtrans-63.6-42.8176.9-70.5179.1-179.3-179.80.7112T186 L187 F188 N192 Q193 W194T186-R190 WeakPolarHBondContact O-CG 3.16Å; T186-R190 PolarHBondContact O-N 3.22Å; T186-R190 VanDerWaalsContact O-N 3.08Å; L187-R190 PolarHBondContact O-N 3.2Å; F188-R190 PolarHBondContact O-N 2.99Å; R190-N192 VanDerWaalsContact C-N 3.33Å; R190-N192 PolarHBondContact O-N 2.96Å; R190-Q193 WeakPolarHBondContact O-CB 3.33Å; R190-Q193 PolarHBondContact O-N 2.9Å; R190-W194 VanDerWaalsContact O-CD1 3.22Å; R190-W194 PolarHBondContact O-N 3.37Å
191A95.8Very high94.2Very high56 Ų5664 Ų6446%0.46330%0.3SS..Hα-helixtrans-60.3-44.6174.800000111.1L187 F188 Q193 W194 V195L187-A191 WeakPolarHBondContact O-CB 3.47Å; L187-A191 PolarHBondContact O-N 3.37Å; F188-A191 PolarHBondContact O-N 3.19Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.43Å; A191-W194 PolarHBondContact O-N 3.31Å; A191-V195 WeakPolarHBondContact O-CG2 3.33Å; A191-V195 PolarHBondContact O-N 2.98Å; A191-V195 VanDerWaalsContact O-N 3.07Å
192N96.6Very high94.4Very high13 Ų1365.2 Ų65.27%0.0731%0.306CS..Hα-helixtrans-59.5-42173.2178.188.5000112.3F171 I174 S175 F188 W189 R190 W194 V195 M196F171-N192 WeakPolarHBondContact CA-OD1 3.43Å; F171-N192 WeakPolarHBondContact CD1-OD1 3.24Å; F171-N192 PolarHBondContact O-ND2 3.07Å; I174-N192 WeakPolarHBondContact CG2-OD1 3.32Å; S175-N192 PolarHBondContact N-ND2 3.16Å; F188-N192 PolarHBondContact O-N 2.84Å; W189-N192 WeakPolarHBondContact O-CB 3.25Å; W189-N192 PolarHBondContact O-N 3.17Å; R190-N192 VanDerWaalsContact C-N 3.33Å; R190-N192 PolarHBondContact O-N 2.96Å; N192-W194 VanDerWaalsContact C-N 3.35Å; N192-W194 PolarHBondContact O-N 3.28Å; N192-V195 PolarHBondContact O-N 3.43Å; N192-M196 VanDerWaalsContact O-CB 3.27Å; N192-M196 WeakPolarHBondContact O-CB 3.45Å; N192-M196 PolarHBondContact O-N 3.27Å
193Q94.7Very high94.7Very high0 Ų065 Ų650%030%0.303CS..Hα-helixtrans-60.2-44.9176-66.6-42.8-76.200111.9S175 W189 R190 A191 V195 M196 I197 L256S175-Q193 VanDerWaalsContact CB-NE2 3.25Å; S175-Q193 PolarHBondContact OG-NE2 2.92Å; S175-Q193 PolarHBondContact OG-OE1 3.28Å; W189-Q193 HydrophobicContact CD2-CG 3.85Å; W189-Q193 HydrophobicContact CE3-CG 3.54Å; W189-Q193 HydrophobicContact CH2-CG 3.44Å; W189-Q193 VanDerWaalsContact CH2-CG 3.44Å; W189-Q193 HydrophobicContact CZ2-CG 3.73Å; W189-Q193 HydrophobicContact CZ3-CG 3.33Å; W189-Q193 WeakPolarHBondContact O-CG 3.46Å; W189-Q193 PolarHBondContact O-N 2.77Å; R190-Q193 WeakPolarHBondContact O-CB 3.33Å; R190-Q193 PolarHBondContact O-N 2.9Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.43Å; Q193-V195 PolarHBondContact O-N 3.11Å; Q193-M196 WeakPolarHBondContact O-CB 3.07Å; Q193-M196 PolarHBondContact O-N 3.02Å; Q193-I197 VanDerWaalsContact O-CG1 3.29Å; Q193-I197 WeakPolarHBondContact O-CG1 3.33Å; Q193-I197 PolarHBondContact O-N 3.47Å; Q193-L256 HydrophobicContact CB-CB 4.31Å; Q193-L256 HydrophobicContact CB-CD1 3.64Å; Q193-L256 HydrophobicContact CB-CG 4.49Å; Q193-L256 HydrophobicContact CG-CB 4.43Å; Q193-L256 HydrophobicContact CG-CD1 3.94Å
194W95.4Very high94.8Very high149 Ų14959.7 Ų59.756%0.56428%0.284SS*.Hα-helixtrans-57.9-51.3177.9-84112000110.8R190 A191 N192 M196 I197 H198 L256R190-W194 VanDerWaalsContact O-CD1 3.22Å; R190-W194 PolarHBondContact O-N 3.37Å; A191-W194 PolarHBondContact O-N 3.31Å; N192-W194 VanDerWaalsContact C-N 3.35Å; N192-W194 PolarHBondContact O-N 3.28Å; W194-M196 VanDerWaalsContact C-N 3.35Å; W194-M196 PolarHBondContact O-N 3.3Å; W194-I197 PolarHBondContact O-N 3.1Å; W194-H198 AromaticContact CE3-CE1 3.73Å; W194-H198 PolarHBondContact O-N 3.19Å; W194-H198 VanDerWaalsContact O-N 3.11Å; W194-H198 PolarHBondContact O-ND1 3.35Å; W194-L256 HydrophobicContact CZ2-CD2 4.46Å
195V97.1Very high95.2Very high60 Ų6064.1 Ų64.136%0.36431%0.311SS..Hα-helixtrans-60.6-45.6177.7179.60000110.9F171 A191 N192 Q193 I197 H198 M199F171-V195 HydrophobicContact CD1-CB 4.17Å; F171-V195 HydrophobicContact CD1-CG1 3.8Å; F171-V195 HydrophobicContact CD2-CG1 4.09Å; F171-V195 HydrophobicContact CE1-CB 4.17Å; F171-V195 HydrophobicContact CE1-CG1 3.46Å; F171-V195 VanDerWaalsContact CE1-CG1 3.46Å; F171-V195 HydrophobicContact CE2-CG1 3.77Å; F171-V195 HydrophobicContact CG-CG1 4.1Å; F171-V195 HydrophobicContact CZ-CG1 3.44Å; F171-V195 VanDerWaalsContact CZ-CG1 3.44Å; A191-V195 WeakPolarHBondContact O-CG2 3.33Å; A191-V195 PolarHBondContact O-N 2.98Å; A191-V195 VanDerWaalsContact O-N 3.07Å; N192-V195 PolarHBondContact O-N 3.43Å; Q193-V195 PolarHBondContact O-N 3.11Å; V195-I197 PolarHBondContact O-N 3.38Å; V195-H198 PolarHBondContact O-N 2.9Å; V195-M199 HydrophobicContact CG1-CG 4.23Å; V195-M199 WeakPolarHBondContact O-CG 2.82Å; V195-M199 PolarHBondContact O-N 3.22Å
196M96.5Very high95.8Very high0 Ų056.4 Ų56.40%028%0.283CS..Hα-helixtrans-54.3-49.9177.6-175.2-178.45500111.9F171 T172 N192 Q193 W194 H198 M199 F200 K252F171-M196 HydrophobicContact CB-CB 3.63Å; F171-M196 HydrophobicContact CB-CG 4.03Å; T172-M196 VanDerWaalsContact CA-SD 3.53Å; T172-M196 PolarHBondContact OG1-SD 3.37Å; N192-M196 VanDerWaalsContact O-CB 3.27Å; N192-M196 WeakPolarHBondContact O-CB 3.45Å; N192-M196 PolarHBondContact O-N 3.27Å; Q193-M196 WeakPolarHBondContact O-CB 3.07Å; Q193-M196 PolarHBondContact O-N 3.02Å; W194-M196 VanDerWaalsContact C-N 3.35Å; W194-M196 PolarHBondContact O-N 3.3Å; M196-H198 PolarHBondContact O-N 2.92Å; M196-M199 PolarHBondContact O-N 3.37Å; M196-F200 HydrophobicContact CG-CD2 3.93Å; M196-F200 HydrophobicContact CG-CE2 3.8Å; M196-F200 VanDerWaalsContact O-CD2 3.28Å; M196-F200 WeakPolarHBondContact O-CD2 3.31Å; M196-F200 PolarHBondContact O-N 3.23Å; M196-F200 HydrophobicContact SD-CE2 4.34Å; M196-K252 HydrophobicContact CE-CB 3.87Å; M196-K252 HydrophobicContact CE-CD 3.85Å; M196-K252 HydrophobicContact CE-CG 4.04Å; M196-K252 HydrophobicContact SD-CB 4.49Å; M196-K252 HydrophobicContact SD-CD 3.86Å; M196-K252 HydrophobicContact SD-CG 4.07Å
197I95.7Very high96Very high13 Ų1354.6 Ų54.67%0.06727%0.272CS..Hα-helixtrans-61.6-44.4-179.6-68.9163000110.6Q193 W194 V195 M199 F200 H201 L256Q193-I197 VanDerWaalsContact O-CG1 3.29Å; Q193-I197 WeakPolarHBondContact O-CG1 3.33Å; Q193-I197 PolarHBondContact O-N 3.47Å; W194-I197 PolarHBondContact O-N 3.1Å; V195-I197 PolarHBondContact O-N 3.38Å; I197-M199 VanDerWaalsContact C-N 3.32Å; I197-M199 PolarHBondContact O-N 3.15Å; I197-F200 WeakPolarHBondContact O-CB 3.38Å; I197-F200 PolarHBondContact O-N 2.87Å; I197-F200 VanDerWaalsContact O-N 3.14Å; I197-H201 PolarHBondContact O-CD2 3.1Å; I197-H201 PolarHBondContact O-N 3.39Å; I197-L256 HydrophobicContact CD1-CB 4.04Å; I197-L256 HydrophobicContact CD1-CD2 3.88Å
198H96.5Very high96.2Very high102 Ų10253.7 Ų53.747%0.47226%0.259SS..Hα-helixtrans-60.1-43.4175.4-73.385.1000111.5W194 V195 M196 F200 H201 C202W194-H198 AromaticContact CE3-CE1 3.73Å; W194-H198 PolarHBondContact O-N 3.19Å; W194-H198 VanDerWaalsContact O-N 3.11Å; W194-H198 PolarHBondContact O-ND1 3.35Å; V195-H198 PolarHBondContact O-N 2.9Å; M196-H198 PolarHBondContact O-N 2.92Å; H198-F200 VanDerWaalsContact C-N 3.29Å; H198-F200 PolarHBondContact O-N 3.27Å; H198-H201 PolarHBondContact O-N 2.96Å; H198-H201 VanDerWaalsContact O-N 3.12Å; H198-C202 PolarHBondContact O-N 3.28Å; H198-C202 PolarHBondContact O-SG 2.73Å
199M97.4Very high96.4Very high46 Ų4650.8 Ų50.823%0.22725%0.245CC..Hα-helixtrans-62.6-34.8176.1-66-56.695.400112.4M167 F171 V195 M196 I197 C202 R203M167-M199 HydrophobicContact CB-SD 4.34Å; M167-M199 HydrophobicContact CG-CB 4.27Å; M167-M199 HydrophobicContact CG-SD 4.08Å; M167-M199 HydrophobicContact SD-SD 3.99Å; F171-M199 HydrophobicContact CD2-CG 3.92Å; F171-M199 HydrophobicContact CE2-CG 3.82Å; V195-M199 HydrophobicContact CG1-CG 4.23Å; V195-M199 WeakPolarHBondContact O-CG 2.82Å; V195-M199 PolarHBondContact O-N 3.22Å; M196-M199 PolarHBondContact O-N 3.37Å; I197-M199 VanDerWaalsContact C-N 3.32Å; I197-M199 PolarHBondContact O-N 3.15Å; M199-C202 PolarHBondContact O-N 3.32Å; M199-R203 WeakPolarHBondContact O-CG 3.4Å; M199-R203 PolarHBondContact O-N 2.92Å
200F96Very high96.5Very high6 Ų650.9 Ų50.93%0.02625%0.246CC..Hα-helixtrans-64.7-40.1171.9-89.6-78000112.7S168 T172 M196 I197 H198 R203 M204 W248 T249 K252S168-F200 WeakPolarHBondContact OG-CZ 3.41Å; T172-F200 WeakPolarHBondContact OG1-CE2 3.45Å; M196-F200 HydrophobicContact CG-CD2 3.93Å; M196-F200 HydrophobicContact CG-CE2 3.8Å; M196-F200 VanDerWaalsContact O-CD2 3.28Å; M196-F200 WeakPolarHBondContact O-CD2 3.31Å; M196-F200 PolarHBondContact O-N 3.23Å; M196-F200 HydrophobicContact SD-CE2 4.34Å; I197-F200 WeakPolarHBondContact O-CB 3.38Å; I197-F200 PolarHBondContact O-N 2.87Å; I197-F200 VanDerWaalsContact O-N 3.14Å; H198-F200 VanDerWaalsContact C-N 3.29Å; H198-F200 PolarHBondContact O-N 3.27Å; F200-R203 WeakPolarHBondContact O-CB 3.28Å; F200-R203 PolarHBondContact O-N 3.15Å; F200-M204 PolarHBondContact O-N 3.4Å; F200-W248 HydrophobicContact CD1-CB 4.21Å; F200-W248 HydrophobicContact CE1-CB 3.6Å; F200-W248 HydrophobicContact CE1-CE3 4.04Å; F200-W248 HydrophobicContact CE1-CG 4.44Å; F200-W248 HydrophobicContact CZ-CB 4.29Å; F200-T249 HydrophobicContact CB-CG2 4.34Å; F200-K252 HydrophobicContact CD2-CB 4.29Å; F200-K252 HydrophobicContact CD2-CG 3.97Å; F200-K252 HydrophobicContact CE2-CB 4.32Å; F200-K252 HydrophobicContact CE2-CG 3.52Å; F200-K252 HydrophobicContact CZ-CG 3.94Å
201H96.1Very high96.8Very high98 Ų9847.4 Ų47.445%0.45423%0.232SC..Hα-helixtrans-65.3-41.2172.4-74.4-71.2000112.1I197 H198 R203 M204 V205I197-H201 PolarHBondContact O-CD2 3.1Å; I197-H201 PolarHBondContact O-N 3.39Å; H198-H201 PolarHBondContact O-N 2.96Å; H198-H201 VanDerWaalsContact O-N 3.12Å; H201-R203 VanDerWaalsContact C-N 3.28Å; H201-R203 PolarHBondContact O-N 2.87Å; H201-M204 WeakPolarHBondContact O-CB 3.49Å; H201-M204 PolarHBondContact O-N 3.38Å; H201-M204 VanDerWaalsContact O-N 3.1Å; H201-V205 PolarHBondContact O-N 3.4Å; H201-V205 VanDerWaalsContact O-N 3.1Å
202C96.8Very high96.9Very high52 Ų5252.7 Ų52.735%0.35124%0.241SC..Hα-helixtrans-59.6-39173.6-65.90000111.4M167 H198 M199 M204 V205 L206M167-C202 HydrophobicContact CE-CB 3.28Å; M167-C202 HydrophobicContact SD-CB 3.97Å; H198-C202 PolarHBondContact O-N 3.28Å; H198-C202 PolarHBondContact O-SG 2.73Å; M199-C202 PolarHBondContact O-N 3.32Å; C202-M204 VanDerWaalsContact C-N 3.3Å; C202-M204 PolarHBondContact O-N 2.91Å; C202-V205 PolarHBondContact O-N 2.95Å; C202-L206 WeakPolarHBondContact O-CG 3.25Å; C202-L206 PolarHBondContact O-N 2.8Å
203R95.8Very high96.9Very high3 Ų352.3 Ų52.31%0.01124%0.239CC..Hα-helixtrans-57.9-43.3173.8-75.9178.579.5127.313.2111.3L165 E166 M167 S168 M199 F200 H201 L206 T207L165-R203 VanDerWaalsContact C-CZ 3.48Å; L165-R203 HydrophobicContact CB-CG 4.4Å; L165-R203 HydrophobicContact CD2-CB 4.26Å; L165-R203 HydrophobicContact CD2-CG 4.35Å; L165-R203 WeakPolarHBondContact O-CD 3.4Å; L165-R203 WeakPolarHBondContact O-CG 3.47Å; L165-R203 PolarHBondContact O-NE 3.38Å; L165-R203 PolarHBondContact O-NH1 2.88Å; E166-R203 IonicContact OE1-CZ 3.79Å; E166-R203 IonicContact OE1-NH1 2.71Å; E166-R203 PolarHBondContact OE1-NH1 2.95Å; E166-R203 IonicContact OE1-NH2 3.16Å; E166-R203 PolarHBondContact OE1-NH2 2.88Å; M167-R203 HydrophobicContact CE-CB 4.3Å; M167-R203 HydrophobicContact CE-CG 3.77Å; S168-R203 WeakPolarHBondContact OG-CD 3.45Å; S168-R203 PolarHBondContact OG-NH1 2.74Å; S168-R203 VanDerWaalsContact OG-NH1 3.17Å; M199-R203 WeakPolarHBondContact O-CG 3.4Å; M199-R203 PolarHBondContact O-N 2.92Å; F200-R203 WeakPolarHBondContact O-CB 3.28Å; F200-R203 PolarHBondContact O-N 3.15Å; H201-R203 VanDerWaalsContact C-N 3.28Å; H201-R203 PolarHBondContact O-N 2.87Å; R203-L206 PolarHBondContact O-N 2.97Å; R203-T207 WeakPolarHBondContact O-CG2 3.48Å; R203-T207 PolarHBondContact O-N 3.12Å
204M95.4Very high97.1Very high28 Ų2852.3 Ų52.314%0.13824%0.239CC..Hα-helixtrans-59-49.9176.7-68.5-65.9-67.500111.3F200 H201 C202 L206 T207 Y208 N245 P246F200-M204 PolarHBondContact O-N 3.4Å; H201-M204 WeakPolarHBondContact O-CB 3.49Å; H201-M204 PolarHBondContact O-N 3.38Å; H201-M204 VanDerWaalsContact O-N 3.1Å; C202-M204 VanDerWaalsContact C-N 3.3Å; C202-M204 PolarHBondContact O-N 2.91Å; M204-L206 VanDerWaalsContact C-N 3.29Å; M204-L206 PolarHBondContact O-N 3.1Å; M204-T207 PolarHBondContact O-N 3.14Å; M204-T207 VanDerWaalsContact O-N 3.11Å; M204-T207 PolarHBondContact O-OG1 3.35Å; M204-Y208 HydrophobicContact CB-CE2 4.5Å; M204-Y208 HydrophobicContact CE-CE2 4.32Å; M204-Y208 WeakPolarHBondContact O-CD2 3.45Å; M204-Y208 PolarHBondContact O-N 3.06Å; M204-Y208 VanDerWaalsContact O-N 3.15Å; M204-N245 HydrophobicContact CG-CB 4.27Å; M204-N245 HydrophobicContact SD-CB 3.17Å; M204-N245 WeakPolarHBondContact SD-CB 3.33Å; M204-P246 HydrophobicContact CE-CG 3.98Å; M204-P246 HydrophobicContact SD-CG 4.34Å
205V97.2Very high97.2Very high97 Ų9750.4 Ų50.459%0.58824%0.239SC*.Hα-helixtrans-57.1-44.2177.4176.70000111H201 C202 T207 Y208 Y209H201-V205 PolarHBondContact O-N 3.4Å; H201-V205 VanDerWaalsContact O-N 3.1Å; C202-V205 PolarHBondContact O-N 2.95Å; V205-T207 VanDerWaalsContact C-N 3.34Å; V205-T207 PolarHBondContact O-N 3.32Å; V205-Y208 PolarHBondContact O-N 3.21Å; V205-Y209 PolarHBondContact O-N 3.46Å
206L97.9Very high97.2Very high19 Ų1951.2 Ų51.210%0.09924%0.244CC..Hα-helixtrans-62.4-39177-70.7177.3000112.5L84 V161 L164 L165 M167 C202 R203 M204 Y208 Y209 M210L84-L206 HydrophobicContact CD1-CD2 3.85Å; V161-L206 HydrophobicContact CG1-CD2 4.37Å; L164-L206 HydrophobicContact CB-CD1 4.01Å; L164-L206 HydrophobicContact CD2-CD1 3.57Å; L164-L206 HydrophobicContact CD2-CD2 4.09Å; L164-L206 HydrophobicContact CD2-CG 4.5Å; L164-L206 HydrophobicContact CG-CD1 3.55Å; L165-L206 HydrophobicContact CD2-CB 3.66Å; L165-L206 HydrophobicContact CD2-CD1 4.1Å; M167-L206 HydrophobicContact CE-CD1 3.42Å; M167-L206 VanDerWaalsContact CE-CD1 3.42Å; M167-L206 HydrophobicContact CE-CG 4.31Å; M167-L206 HydrophobicContact SD-CD1 4.33Å; C202-L206 WeakPolarHBondContact O-CG 3.25Å; C202-L206 PolarHBondContact O-N 2.8Å; R203-L206 PolarHBondContact O-N 2.97Å; M204-L206 VanDerWaalsContact C-N 3.29Å; M204-L206 PolarHBondContact O-N 3.1Å; L206-Y208 VanDerWaalsContact C-N 3.33Å; L206-Y208 PolarHBondContact O-N 3.19Å; L206-Y209 WeakPolarHBondContact O-CB 3.25Å; L206-Y209 PolarHBondContact O-N 3.32Å; L206-M210 VanDerWaalsContact O-CG 3.27Å; L206-M210 WeakPolarHBondContact O-CG 3.47Å; L206-M210 PolarHBondContact O-N 3.35Å
207T98Very high97.2Very high0 Ų053.8 Ų53.80%026%0.256CS..Hα-helixtrans-64.7-38176.163.90000112.4L165 R203 M204 V205 M210 W211 L237 L240 T241L165-T207 HydrophobicContact CD1-CG2 4.31Å; L165-T207 HydrophobicContact CD2-CG2 4.11Å; R203-T207 WeakPolarHBondContact O-CG2 3.48Å; R203-T207 PolarHBondContact O-N 3.12Å; M204-T207 PolarHBondContact O-N 3.14Å; M204-T207 VanDerWaalsContact O-N 3.11Å; M204-T207 PolarHBondContact O-OG1 3.35Å; V205-T207 VanDerWaalsContact C-N 3.34Å; V205-T207 PolarHBondContact O-N 3.32Å; T207-M210 PolarHBondContact O-N 2.85Å; T207-W211 PolarHBondContact O-N 2.99Å; T207-L237 HydrophobicContact CG2-CD1 4.11Å; T207-L240 HydrophobicContact CG2-CB 4.34Å; T207-T241 VanDerWaalsContact CB-OG1 3.28Å; T207-T241 WeakPolarHBondContact CB-OG1 3.41Å; T207-T241 PolarHBondContact OG1-OG1 3.37Å
208Y98.1Very high97.3Very high124 Ų12459.1 Ų59.149%0.48628%0.275SS..Hα-helixtrans-66.2-38.3172.4-64.6-57.1000112.2M204 V205 L206 M210 W211 W212 T241M204-Y208 HydrophobicContact CB-CE2 4.5Å; M204-Y208 HydrophobicContact CE-CE2 4.32Å; M204-Y208 WeakPolarHBondContact O-CD2 3.45Å; M204-Y208 PolarHBondContact O-N 3.06Å; M204-Y208 VanDerWaalsContact O-N 3.15Å; V205-Y208 PolarHBondContact O-N 3.21Å; L206-Y208 VanDerWaalsContact C-N 3.33Å; L206-Y208 PolarHBondContact O-N 3.19Å; Y208-M210 VanDerWaalsContact C-N 3.33Å; Y208-M210 PolarHBondContact O-N 3.11Å; Y208-W211 WeakPolarHBondContact O-CB 3.43Å; Y208-W211 PolarHBondContact O-N 3.29Å; Y208-W212 WeakPolarHBondContact O-CB 3.45Å; Y208-W212 PolarHBondContact O-N 3.5Å; Y208-T241 HydrophobicContact CD1-CG2 4.22Å; Y208-T241 HydrophobicContact CE1-CG2 3.7Å
209Y98.1Very high97.3Very high70 Ų7061.8 Ų61.828%0.27529%0.288SS..Hα-helixtrans-62-40.8173.4175.1-105.1000112L84 K94 F157 V161 V205 L206 W212 V213L84-Y209 HydrophobicContact CD2-CD1 4.49Å; L84-Y209 HydrophobicContact CD2-CE1 3.77Å; K94-Y209 PolarHBondContact NZ-OH 3.09Å; F157-Y209 AromaticContact CE1-CE1 3.92Å; F157-Y209 HydrophobicContact CE1-CE1 3.92Å; F157-Y209 AromaticContact CZ-CE1 3.91Å; F157-Y209 HydrophobicContact CZ-CE1 3.91Å; F157-Y209 WeakPolarHBondContact CZ-OH 3.49Å; V161-Y209 HydrophobicContact CG1-CD1 4.43Å; V205-Y209 PolarHBondContact O-N 3.46Å; L206-Y209 WeakPolarHBondContact O-CB 3.25Å; L206-Y209 PolarHBondContact O-N 3.32Å; Y209-W212 WeakPolarHBondContact O-CB 3.49Å; Y209-W212 PolarHBondContact O-N 2.96Å; Y209-V213 HydrophobicContact CD1-CG2 4.23Å; Y209-V213 HydrophobicContact CD2-CG2 4.33Å; Y209-V213 HydrophobicContact CE1-CG2 3.75Å; Y209-V213 HydrophobicContact CE2-CG2 3.88Å; Y209-V213 WeakPolarHBondContact O-CG2 3.49Å; Y209-V213 PolarHBondContact O-N 3.31Å
210M98.3Very high97.2Very high3 Ų363.9 Ų63.92%0.01529%0.293CS..Hα-helixtrans-63.3-44.4175.2-68.9169.772.100111.4L158 V161 T162 L165 L206 T207 Y208 W212 V213 T214 F233 L237L158-M210 HydrophobicContact CD2-CB 4.41Å; L158-M210 HydrophobicContact CD2-CG 4.32Å; V161-M210 HydrophobicContact CB-CG 4.37Å; V161-M210 HydrophobicContact CG1-CG 3.62Å; V161-M210 HydrophobicContact CG1-SD 3.87Å; T162-M210 WeakPolarHBondContact OG1-CE 3.36Å; L165-M210 HydrophobicContact CD1-SD 4.24Å; L206-M210 VanDerWaalsContact O-CG 3.27Å; L206-M210 WeakPolarHBondContact O-CG 3.47Å; L206-M210 PolarHBondContact O-N 3.35Å; T207-M210 PolarHBondContact O-N 2.85Å; Y208-M210 VanDerWaalsContact C-N 3.33Å; Y208-M210 PolarHBondContact O-N 3.11Å; M210-W212 VanDerWaalsContact C-N 3.35Å; M210-W212 PolarHBondContact O-N 2.96Å; M210-V213 PolarHBondContact O-N 3.44Å; M210-T214 WeakPolarHBondContact O-CG2 3.46Å; M210-T214 PolarHBondContact O-N 3.2Å; M210-T214 PolarHBondContact O-OG1 3.41Å; M210-F233 HydrophobicContact CE-CE2 3.53Å; M210-F233 HydrophobicContact CE-CZ 3.7Å; M210-L237 HydrophobicContact CB-CD1 4.16Å; M210-L237 HydrophobicContact CB-CD2 4.19Å; M210-L237 HydrophobicContact CE-CD1 4.26Å; M210-L237 HydrophobicContact SD-CD1 4.25Å
211W98.5Very high97.1Very high56 Ų5664.1 Ų64.121%0.21230%0.295CS..Hα-helixtrans-54.6-51.6171.2-80.3113.7000111.2T207 Y208 V213 T214 L215 F234 L237 A238 T241 F242T207-W211 PolarHBondContact O-N 2.99Å; Y208-W211 WeakPolarHBondContact O-CB 3.43Å; Y208-W211 PolarHBondContact O-N 3.29Å; W211-V213 PolarHBondContact O-N 2.95Å; W211-T214 PolarHBondContact O-N 3.32Å; W211-T214 PolarHBondContact O-OG1 2.95Å; W211-L215 WeakPolarHBondContact O-CB 3.38Å; W211-L215 VanDerWaalsContact O-CG 3.29Å; W211-L215 WeakPolarHBondContact O-CG 3.25Å; W211-L215 PolarHBondContact O-N 3.46Å; W211-F234 HydrophobicContact CE3-CD1 4.31Å; W211-F234 HydrophobicContact CE3-CE1 4.27Å; W211-F234 AromaticContact CH2-CD1 3.78Å; W211-F234 HydrophobicContact CH2-CD1 3.78Å; W211-F234 AromaticContact CZ3-CD1 3.49Å; W211-F234 HydrophobicContact CZ3-CD1 3.49Å; W211-F234 VanDerWaalsContact CZ3-CD1 3.49Å; W211-F234 AromaticContact CZ3-CE1 3.79Å; W211-F234 HydrophobicContact CZ3-CE1 3.79Å; W211-L237 HydrophobicContact CD2-CD2 3.6Å; W211-L237 HydrophobicContact CD2-CG 4.2Å; W211-L237 HydrophobicContact CE3-CD2 4.1Å; W211-L237 HydrophobicContact CG-CD2 3.88Å; W211-L237 HydrophobicContact CG-CG 4.46Å; W211-L237 HydrophobicContact CH2-CD2 4.42Å; W211-L237 HydrophobicContact CZ2-CB 4.29Å; W211-L237 HydrophobicContact CZ2-CD2 3.96Å; W211-L237 HydrophobicContact CZ2-CG 3.87Å; W211-L237 HydrophobicContact CZ3-CD2 4.49Å; W211-A238 HydrophobicContact CZ2-CB 4.13Å; W211-T241 PolarHBondContact NE1-OG1 3Å; W211-F242 HydrophobicContact CZ2-CE2 4.41Å
212W98.4Very high97Very high168 Ų16861.8 Ų61.864%0.63629%0.286SS*.Hα-helixtrans-53.7-53.3177.1172.2-102.9000112Y208 Y209 M210 T214 L215 T216Y208-W212 WeakPolarHBondContact O-CB 3.45Å; Y208-W212 PolarHBondContact O-N 3.5Å; Y209-W212 WeakPolarHBondContact O-CB 3.49Å; Y209-W212 PolarHBondContact O-N 2.96Å; M210-W212 VanDerWaalsContact C-N 3.35Å; M210-W212 PolarHBondContact O-N 2.96Å; W212-T214 VanDerWaalsContact C-N 3.3Å; W212-T214 PolarHBondContact O-N 3.19Å; W212-L215 PolarHBondContact O-N 2.82Å; W212-T216 WeakPolarHBondContact O-CB 3.41Å; W212-T216 PolarHBondContact O-N 2.68Å; W212-T216 PolarHBondContact O-OG1 3.47Å
213V97.8Very high96.9Very high4 Ų464.1 Ų64.12%0.02430%0.298CS..Hα-helixtrans-56.3-45179169.60000111.5K94 F157 L158 Y209 M210 W211 T216 H217K94-V213 HydrophobicContact CB-CG1 4.1Å; K94-V213 HydrophobicContact CD-CG1 3.9Å; K94-V213 HydrophobicContact CD-CG2 4.19Å; F157-V213 HydrophobicContact CE1-CG1 4.4Å; F157-V213 HydrophobicContact CE1-CG2 4.31Å; L158-V213 HydrophobicContact CD2-CB 4.31Å; L158-V213 HydrophobicContact CD2-CG1 3.94Å; Y209-V213 HydrophobicContact CD1-CG2 4.23Å; Y209-V213 HydrophobicContact CD2-CG2 4.33Å; Y209-V213 HydrophobicContact CE1-CG2 3.75Å; Y209-V213 HydrophobicContact CE2-CG2 3.88Å; Y209-V213 WeakPolarHBondContact O-CG2 3.49Å; Y209-V213 PolarHBondContact O-N 3.31Å; M210-V213 PolarHBondContact O-N 3.44Å; W211-V213 PolarHBondContact O-N 2.95Å; V213-T216 PolarHBondContact O-N 3.15Å; V213-H217 PolarHBondContact O-N 3.45Å; V213-H217 VanDerWaalsContact O-N 3.13Å; V213-H217 PolarHBondContact O-ND1 3.34Å
214T97.3Very high96.7Very high1 Ų167.4 Ų67.41%0.00631%0.314CS..Hα-helixtrans-68.3-37-177.862.60000112.9L158 M210 W211 W212 H217 W218 F233 F234L158-T214 HydrophobicContact CD1-CG2 3.67Å; L158-T214 HydrophobicContact CD2-CG2 4.28Å; M210-T214 WeakPolarHBondContact O-CG2 3.46Å; M210-T214 PolarHBondContact O-N 3.2Å; M210-T214 PolarHBondContact O-OG1 3.41Å; W211-T214 PolarHBondContact O-N 3.32Å; W211-T214 PolarHBondContact O-OG1 2.95Å; W212-T214 VanDerWaalsContact C-N 3.3Å; W212-T214 PolarHBondContact O-N 3.19Å; T214-H217 CarbonylContact O-C 3.48Å; T214-W218 WeakPolarHBondContact O-CA 3.16Å; T214-W218 PolarHBondContact O-N 3.02Å; T214-W218 VanDerWaalsContact O-N 3.13Å; T214-F233 HydrophobicContact CG2-CE1 3.51Å; T214-F233 HydrophobicContact CG2-CZ 3.91Å; T214-F234 HydrophobicContact CG2-CE1 4.18Å; T214-F234 HydrophobicContact CG2-CZ 4.31Å
215L97.7Very high96.7Very high108 Ų10866.7 Ų66.757%0.56531%0.311SS*.Hα-helixtrans-72.5-40.5177.1-67.9172.7000111.4W211 W212 H217 W218W211-L215 WeakPolarHBondContact O-CB 3.38Å; W211-L215 VanDerWaalsContact O-CG 3.29Å; W211-L215 WeakPolarHBondContact O-CG 3.25Å; W211-L215 PolarHBondContact O-N 3.46Å; W212-L215 PolarHBondContact O-N 2.82Å; L215-H217 PolarHBondContact O-N 3.4Å; L215-W218 WeakPolarHBondContact O-CB 3.17Å; L215-W218 PolarHBondContact O-N 2.93Å
216T98.1Very high96.5Very high78 Ų7863.3 Ų63.348%0.47929%0.294SS..Hα-helixtrans-63.3-32176.1-55.30000112.3W212 V213W212-T216 WeakPolarHBondContact O-CB 3.41Å; W212-T216 PolarHBondContact O-N 2.68Å; W212-T216 PolarHBondContact O-OG1 3.47Å; V213-T216 PolarHBondContact O-N 3.15Å
217H96.6Very high96.4Very high53 Ų5367.5 Ų67.525%0.24532%0.316CS..THydrogen-bonded Turntrans-109.625.6-178.1-57.381000113V95 V213 T214 L215 E219 R220 M221V95-H217 HydrophobicContact CG2-CB 3.53Å; V213-H217 PolarHBondContact O-N 3.45Å; V213-H217 VanDerWaalsContact O-N 3.13Å; V213-H217 PolarHBondContact O-ND1 3.34Å; T214-H217 CarbonylContact O-C 3.48Å; L215-H217 PolarHBondContact O-N 3.4Å; H217-E219 PolarHBondContact O-N 2.88Å; H217-R220 PolarHBondContact O-N 2.89Å; H217-M221 HydrophobicContact CB-CG 4.43Å; H217-M221 WeakPolarHBondContact O-CG 3.39Å; H217-M221 PolarHBondContact O-N 3.48Å
218W96.7Very high96.3Very high125 Ų12570.3 Ų70.347%0.47334%0.335SS..Hα-helixtrans-54.3-46.7-169.3-179-113000114.3T214 L215 R220 M221 N222 F234T214-W218 WeakPolarHBondContact O-CA 3.16Å; T214-W218 PolarHBondContact O-N 3.02Å; T214-W218 VanDerWaalsContact O-N 3.13Å; L215-W218 WeakPolarHBondContact O-CB 3.17Å; L215-W218 PolarHBondContact O-N 2.93Å; W218-R220 PolarHBondContact O-N 3.16Å; W218-M221 PolarHBondContact O-N 3.5Å; W218-N222 PolarHBondContact NE1-ND2 3.14Å; W218-N222 VanDerWaalsContact O-CG 3.23Å; W218-N222 PolarHBondContact O-N 2.97Å; W218-N222 PolarHBondContact O-ND2 2.89Å; W218-F234 HydrophobicContact CE3-CZ 4.29Å; W218-F234 HydrophobicContact CH2-CE2 4.33Å; W218-F234 HydrophobicContact CZ3-CE1 4.45Å; W218-F234 AromaticContact CZ3-CE2 3.69Å; W218-F234 HydrophobicContact CZ3-CE2 3.69Å; W218-F234 AromaticContact CZ3-CZ 3.58Å; W218-F234 HydrophobicContact CZ3-CZ 3.58Å
219E96.6Very high96.1Very high158 Ų15864.9 Ų64.974%0.73831%0.314SS*.Hα-helixtrans-62.1-45.9180-175.8179.7-179.100112H217 N222 T223H217-E219 PolarHBondContact O-N 2.88Å; E219-N222 PolarHBondContact O-N 3.12Å; E219-T223 PolarHBondContact O-N 2.98Å; E219-T223 VanDerWaalsContact O-N 3.07Å; E219-T223 PolarHBondContact O-OG1 3.47Å
220R95.1Very high96Very high90 Ų9063.8 Ų63.834%0.3431%0.309SS..Hα-helixtrans-65.1-41.9177.7-63.4-17070.6-160.3-2.7111.3D93 V95 H217 W218 N222 T223 H224D93-R220 IonicContact OD1-CZ 2.81Å; D93-R220 IonicContact OD1-NH1 3.85Å; D93-R220 PolarHBondContact OD1-NH1 3.04Å; D93-R220 IonicContact OD1-NH2 3.55Å; D93-R220 IonicContact OD2-CZ 3.69Å; D93-R220 VanDerWaalsContact OD2-CZ 3.27Å; D93-R220 IonicContact OD2-NH1 3.71Å; D93-R220 PolarHBondContact OD2-NH1 3.31Å; D93-R220 IonicContact OD2-NH2 2.68Å; D93-R220 PolarHBondContact OD2-NH2 3.2Å; V95-R220 HydrophobicContact CB-CB 4.4Å; V95-R220 HydrophobicContact CG1-CB 4.06Å; V95-R220 HydrophobicContact CG2-CB 4.05Å; H217-R220 PolarHBondContact O-N 2.89Å; W218-R220 PolarHBondContact O-N 3.16Å; R220-N222 VanDerWaalsContact C-N 3.31Å; R220-N222 PolarHBondContact O-N 3.05Å; R220-T223 PolarHBondContact O-N 3.3Å; R220-H224 PolarHBondContact O-CD2 3.5Å; R220-H224 VanDerWaalsContact O-CD2 3.29Å; R220-H224 PolarHBondContact O-N 3.37Å
221M94.1Very high95.9Very high11 Ų1168.5 Ų68.55%0.05433%0.334CS..Hα-helixtrans-58.7-43174.7-72.7-68.3-65.300111.4V95 L158 H217 W218 T223 V225V95-M221 HydrophobicContact CB-SD 4.44Å; V95-M221 HydrophobicContact CG1-CG 4.39Å; V95-M221 HydrophobicContact CG1-SD 3.87Å; V95-M221 HydrophobicContact CG2-CG 4.32Å; V95-M221 HydrophobicContact CG2-SD 4.16Å; L158-M221 HydrophobicContact CD1-CE 3.91Å; L158-M221 HydrophobicContact CD1-SD 4.22Å; H217-M221 HydrophobicContact CB-CG 4.43Å; H217-M221 WeakPolarHBondContact O-CG 3.39Å; H217-M221 PolarHBondContact O-N 3.48Å; W218-M221 PolarHBondContact O-N 3.5Å; M221-T223 VanDerWaalsContact C-N 3.26Å; M221-T223 PolarHBondContact O-N 3.49Å; M221-V225 HydrophobicContact CE-CB 4.42Å; M221-V225 HydrophobicContact CE-CG2 3.81Å; M221-V225 VanDerWaalsContact O-CB 3.25Å; M221-V225 WeakPolarHBondContact O-CB 3.24Å; M221-V225 PolarHBondContact O-N 3.4Å; M221-V225 HydrophobicContact SD-CG2 3.84Å
222N94.9Very high95.9Very high49 Ų4968.2 Ų68.226%0.26234%0.336SS..Hα-helixtrans-67.3-29178.6-69.7-25.3000113.4W218 E219 R220 R230W218-N222 PolarHBondContact NE1-ND2 3.14Å; W218-N222 VanDerWaalsContact O-CG 3.23Å; W218-N222 PolarHBondContact O-N 2.97Å; W218-N222 PolarHBondContact O-ND2 2.89Å; E219-N222 PolarHBondContact O-N 3.12Å; R220-N222 VanDerWaalsContact C-N 3.31Å; R220-N222 PolarHBondContact O-N 3.05Å; N222-R230 PolarHBondContact O-NH2 3.37Å; N222-R230 PolarHBondContact OD1-NH1 3.37Å
223T94Very high95.8Very high101 Ų10161.9 Ų61.962%0.6231%0.313SS*.Hα-helixtrans-81.7-42.6-178.8-55.40000112E219 R220 M221E219-T223 PolarHBondContact O-N 2.98Å; E219-T223 VanDerWaalsContact O-N 3.07Å; E219-T223 PolarHBondContact O-OG1 3.47Å; R220-T223 PolarHBondContact O-N 3.3Å; M221-T223 VanDerWaalsContact C-N 3.26Å; M221-T223 PolarHBondContact O-N 3.49Å
224H92.4Very high95.8Very high72 Ų7263.4 Ų63.433%0.33332%0.32SS..Hα-helixtrans-105.4-17.7-169.1-63.2-68.3000114.9V95 I96 S153 R220V95-H224 HydrophobicContact CG1-CB 4.34Å; I96-H224 HydrophobicContact CG2-CB 3.75Å; S153-H224 PolarHBondContact OG-O 3.12Å; S153-H224 VanDerWaalsContact OG-O 3.13Å; R220-H224 PolarHBondContact O-CD2 3.5Å; R220-H224 VanDerWaalsContact O-CD2 3.29Å; R220-H224 PolarHBondContact O-N 3.37Å
225V94Very high95.8Very high13 Ų1366.4 Ų66.48%0.07934%0.341CS..SBendtrans-104.6123.4-179.4-170.50000109.8Q154 M221 Q229 R230Q154-V225 HydrophobicContact CB-CG2 4.38Å; M221-V225 HydrophobicContact CE-CB 4.42Å; M221-V225 HydrophobicContact CE-CG2 3.81Å; M221-V225 VanDerWaalsContact O-CB 3.25Å; M221-V225 WeakPolarHBondContact O-CB 3.24Å; M221-V225 PolarHBondContact O-N 3.4Å; M221-V225 HydrophobicContact SD-CG2 3.84Å; V225-Q229 HydrophobicContact CG1-CB 4.09Å; V225-Q229 HydrophobicContact CG1-CG 3.96Å; V225-R230 HydrophobicContact CB-CG 3.88Å; V225-R230 HydrophobicContact CG1-CG 3.71Å; V225-R230 PolarHBondContact O-NE 3.07Å
226A94.2Very high95.8Very high27 Ų2761.7 Ų61.722%0.22332%0.318CS..  trans-51.9142.1178.200000111.5F151 S228 Q229 R230F151-A226 HydrophobicContact CD1-CB 3.67Å; F151-A226 HydrophobicContact CD2-CB 4.15Å; F151-A226 HydrophobicContact CE1-CB 3.65Å; F151-A226 HydrophobicContact CE2-CB 4.13Å; F151-A226 HydrophobicContact CG-CB 3.93Å; F151-A226 HydrophobicContact CZ-CB 3.89Å; A226-S228 VanDerWaalsContact C-N 3.31Å; A226-S228 PolarHBondContact O-N 3.29Å; A226-Q229 HydrophobicContact CB-CB 4.35Å; A226-Q229 PolarHBondContact O-N 2.9Å; A226-Q229 VanDerWaalsContact O-N 3.14Å; A226-R230 PolarHBondContact O-N 3.42Å
227L95.2Very high95.8Very high107 Ų10758.2 Ų58.256%0.5630%0.297SS*.Hα-helixtrans-58.3-43.4-176.8178.361.9000112Q229 R230 L231L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 3.48Å; L227-R230 PolarHBondContact O-N 3.22Å; L227-L231 HydrophobicContact CD1-CG 4.34Å; L227-L231 HydrophobicContact CG-CD1 4.3Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 2.91Å
228S95.3Very high95.8Very high58 Ų5857.2 Ų57.241%0.40630%0.298SS..Hα-helixtrans-56.8-45.6176.950.10000111.9A226 L231 I232A226-S228 VanDerWaalsContact C-N 3.31Å; A226-S228 PolarHBondContact O-N 3.29Å; S228-L231 PolarHBondContact O-N 3.43Å; S228-I232 WeakPolarHBondContact O-CG1 3.45Å; S228-I232 PolarHBondContact O-N 3.19Å
229Q95.3Very high95.8Very high11 Ų1153.1 Ų53.15%0.05129%0.285CS..Hα-helixtrans-66.9-39.7179-176.165-5.900112.1G144 F151 V225 A226 L227 L231 I232 F233G144-Q229 PolarHBondContact O-NE2 3.46Å; F151-Q229 HydrophobicContact CD2-CB 4.27Å; F151-Q229 HydrophobicContact CE2-CB 4.47Å; V225-Q229 HydrophobicContact CG1-CB 4.09Å; V225-Q229 HydrophobicContact CG1-CG 3.96Å; A226-Q229 HydrophobicContact CB-CB 4.35Å; A226-Q229 PolarHBondContact O-N 2.9Å; A226-Q229 VanDerWaalsContact O-N 3.14Å; L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 3.48Å; Q229-L231 PolarHBondContact O-N 2.85Å; Q229-I232 PolarHBondContact O-N 3.25Å; Q229-F233 VanDerWaalsContact O-CB 3.28Å; Q229-F233 WeakPolarHBondContact O-CB 3.34Å; Q229-F233 PolarHBondContact O-N 2.9Å
230R95.8Very high95.7Very high46 Ų4646.6 Ų46.617%0.17426%0.255CS..Hα-helixtrans-59.7-44.9172.8-74.5-174.5-80.3147.6-1.6111.6N222 V225 A226 L227 F233 F234N222-R230 PolarHBondContact O-NH2 3.37Å; N222-R230 PolarHBondContact OD1-NH1 3.37Å; V225-R230 HydrophobicContact CB-CG 3.88Å; V225-R230 HydrophobicContact CG1-CG 3.71Å; V225-R230 PolarHBondContact O-NE 3.07Å; A226-R230 PolarHBondContact O-N 3.42Å; L227-R230 PolarHBondContact O-N 3.22Å; R230-F233 PolarHBondContact O-N 3.21Å; R230-F234 HydrophobicContact CB-CD2 4.25Å; R230-F234 HydrophobicContact CB-CE2 4.3Å; R230-F234 HydrophobicContact CG-CE2 4.5Å; R230-F234 WeakPolarHBondContact O-CB 3.47Å; R230-F234 WeakPolarHBondContact O-CD2 3.27Å; R230-F234 PolarHBondContact O-N 3.11Å
231L97Very high95.8Very high102 Ų10242.4 Ų42.453%0.53424%0.239SC..Hα-helixtrans-61.4-48.2178.7-68.8174.2000111.4L227 S228 Q229 F233 S235L227-L231 HydrophobicContact CD1-CG 4.34Å; L227-L231 HydrophobicContact CG-CD1 4.3Å; L227-L231 WeakPolarHBondContact O-CG 3.28Å; L227-L231 PolarHBondContact O-N 2.91Å; S228-L231 PolarHBondContact O-N 3.43Å; Q229-L231 PolarHBondContact O-N 2.85Å; L231-F233 VanDerWaalsContact C-N 3.35Å; L231-F233 PolarHBondContact O-N 3.16Å; L231-S235 VanDerWaalsContact O-CB 3.25Å; L231-S235 WeakPolarHBondContact O-CB 3.16Å; L231-S235 PolarHBondContact O-N 3.34Å; L231-S235 PolarHBondContact O-OG 3.45Å
232I96.9Very high95.9Very high50 Ų5048.3 Ų48.326%0.25627%0.265SS..Hα-helixtrans-58.3-48.9176.8-67.2165.3000110.5F140 S228 Q229 G236F140-I232 HydrophobicContact CD1-CG2 4.17Å; S228-I232 WeakPolarHBondContact O-CG1 3.45Å; S228-I232 PolarHBondContact O-N 3.19Å; Q229-I232 PolarHBondContact O-N 3.25Å; I232-G236 PolarHBondContact O-N 2.73Å
233F96.6Very high95.8Very high36 Ų3650.1 Ų50.116%0.15827%0.274CS..Hα-helixtrans-61.4-51.4-178.8176.3-95.5000112.3L158 M210 T214 Q229 R230 L231 G236 L237L158-F233 HydrophobicContact CB-CE2 4.25Å; L158-F233 HydrophobicContact CB-CZ 4.46Å; L158-F233 HydrophobicContact CD1-CE1 4.41Å; L158-F233 HydrophobicContact CD1-CE2 4.43Å; L158-F233 HydrophobicContact CD1-CZ 3.97Å; L158-F233 HydrophobicContact CD2-CZ 4.37Å; M210-F233 HydrophobicContact CE-CE2 3.53Å; M210-F233 HydrophobicContact CE-CZ 3.7Å; T214-F233 HydrophobicContact CG2-CE1 3.51Å; T214-F233 HydrophobicContact CG2-CZ 3.91Å; Q229-F233 VanDerWaalsContact O-CB 3.28Å; Q229-F233 WeakPolarHBondContact O-CB 3.34Å; Q229-F233 PolarHBondContact O-N 2.9Å; R230-F233 PolarHBondContact O-N 3.21Å; L231-F233 VanDerWaalsContact C-N 3.35Å; L231-F233 PolarHBondContact O-N 3.16Å; F233-G236 PolarHBondContact O-N 2.67Å; F233-L237 HydrophobicContact CE1-CD2 3.86Å; F233-L237 HydrophobicContact CZ-CD2 4.01Å; F233-L237 VanDerWaalsContact O-CB 3.24Å; F233-L237 WeakPolarHBondContact O-CB 3.34Å; F233-L237 PolarHBondContact O-N 3.45Å
234F97.8Very high95.7Very high35 Ų3546 Ų4615%0.15425%0.247CC..Hα-helixtrans-70.5-36.1-177.5-74.7-61.6000112.9W211 T214 W218 R230 A238W211-F234 HydrophobicContact CE3-CD1 4.31Å; W211-F234 HydrophobicContact CE3-CE1 4.27Å; W211-F234 AromaticContact CH2-CD1 3.78Å; W211-F234 HydrophobicContact CH2-CD1 3.78Å; W211-F234 AromaticContact CZ3-CD1 3.49Å; W211-F234 HydrophobicContact CZ3-CD1 3.49Å; W211-F234 VanDerWaalsContact CZ3-CD1 3.49Å; W211-F234 AromaticContact CZ3-CE1 3.79Å; W211-F234 HydrophobicContact CZ3-CE1 3.79Å; T214-F234 HydrophobicContact CG2-CE1 4.18Å; T214-F234 HydrophobicContact CG2-CZ 4.31Å; W218-F234 HydrophobicContact CE3-CZ 4.29Å; W218-F234 HydrophobicContact CH2-CE2 4.33Å; W218-F234 HydrophobicContact CZ3-CE1 4.45Å; W218-F234 AromaticContact CZ3-CE2 3.69Å; W218-F234 HydrophobicContact CZ3-CE2 3.69Å; W218-F234 AromaticContact CZ3-CZ 3.58Å; W218-F234 HydrophobicContact CZ3-CZ 3.58Å; R230-F234 HydrophobicContact CB-CD2 4.25Å; R230-F234 HydrophobicContact CB-CE2 4.3Å; R230-F234 HydrophobicContact CG-CE2 4.5Å; R230-F234 WeakPolarHBondContact O-CB 3.47Å; R230-F234 WeakPolarHBondContact O-CD2 3.27Å; R230-F234 PolarHBondContact O-N 3.11Å; F234-A238 VanDerWaalsContact O-CB 3.26Å; F234-A238 WeakPolarHBondContact O-CB 3.29Å; F234-A238 PolarHBondContact O-N 3.15Å
235S97.8Very high95.8Very high64 Ų6442.5 Ų42.545%0.44823%0.232SC..Hα-helixtrans-63.5-45.7172.4-66.10000111.5L231 L239L231-S235 VanDerWaalsContact O-CB 3.25Å; L231-S235 WeakPolarHBondContact O-CB 3.16Å; L231-S235 PolarHBondContact O-N 3.34Å; L231-S235 PolarHBondContact O-OG 3.45Å; S235-L239 WeakPolarHBondContact O-CB 3.5Å; S235-L239 PolarHBondContact O-N 2.71Å
236G96.8Very high95.8Very high9 Ų944.3 Ų44.39%0.09324%0.244CC..Hα-helixtrans-63.7-44176.400000112.6I232 F233 L239 L240I232-G236 PolarHBondContact O-N 2.73Å; F233-G236 PolarHBondContact O-N 2.67Å; G236-L239 PolarHBondContact O-N 3.06Å; G236-L240 WeakPolarHBondContact O-CB 3.42Å; G236-L240 WeakPolarHBondContact O-CG 3.12Å; G236-L240 PolarHBondContact O-N 3.45Å
237L97.7Very high95.7Very high5 Ų547 Ų473%0.02625%0.254CS..Hα-helixtrans-64.3-44.3178.2-17761.1000111.5T207 M210 W211 F233 L239 L240 T241T207-L237 HydrophobicContact CG2-CD1 4.11Å; M210-L237 HydrophobicContact CB-CD1 4.16Å; M210-L237 HydrophobicContact CB-CD2 4.19Å; M210-L237 HydrophobicContact CE-CD1 4.26Å; M210-L237 HydrophobicContact SD-CD1 4.25Å; W211-L237 HydrophobicContact CD2-CD2 3.6Å; W211-L237 HydrophobicContact CD2-CG 4.2Å; W211-L237 HydrophobicContact CE3-CD2 4.1Å; W211-L237 HydrophobicContact CG-CD2 3.88Å; W211-L237 HydrophobicContact CG-CG 4.46Å; W211-L237 HydrophobicContact CH2-CD2 4.42Å; W211-L237 HydrophobicContact CZ2-CB 4.29Å; W211-L237 HydrophobicContact CZ2-CD2 3.96Å; W211-L237 HydrophobicContact CZ2-CG 3.87Å; W211-L237 HydrophobicContact CZ3-CD2 4.49Å; F233-L237 HydrophobicContact CE1-CD2 3.86Å; F233-L237 HydrophobicContact CZ-CD2 4.01Å; F233-L237 VanDerWaalsContact O-CB 3.24Å; F233-L237 WeakPolarHBondContact O-CB 3.34Å; F233-L237 PolarHBondContact O-N 3.45Å; L237-L239 VanDerWaalsContact C-N 3.35Å; L237-L239 PolarHBondContact O-N 3.12Å; L237-L240 PolarHBondContact O-N 3.21Å; L237-T241 WeakPolarHBondContact O-CB 3.47Å; L237-T241 PolarHBondContact O-N 3.01Å; L237-T241 PolarHBondContact O-OG1 3.3Å
238A97.6Very high95.5Very high33 Ų3344.4 Ų44.427%0.27324%0.236SC..Hα-helixtrans-60.6-44.8175.100000111.7W211 F234 L240 T241 F242W211-A238 HydrophobicContact CZ2-CB 4.13Å; F234-A238 VanDerWaalsContact O-CB 3.26Å; F234-A238 WeakPolarHBondContact O-CB 3.29Å; F234-A238 PolarHBondContact O-N 3.15Å; A238-L240 VanDerWaalsContact C-N 3.33Å; A238-L240 PolarHBondContact O-N 2.99Å; A238-T241 PolarHBondContact O-N 3.32Å; A238-F242 HydrophobicContact CB-CD2 4.24Å; A238-F242 HydrophobicContact CB-CE2 4.49Å; A238-F242 WeakPolarHBondContact O-CB 3.4Å; A238-F242 VanDerWaalsContact O-CD2 3.25Å; A238-F242 WeakPolarHBondContact O-CD2 3.39Å; A238-F242 PolarHBondContact O-N 3.28Å
239L95.8Very high95.5Very high38 Ų3842.4 Ų42.420%0.19922%0.221CC..Hα-helixtrans-60.3-43.6176.6-175.767.9000111.5T136 F140 S235 G236 L237 I243 I244T136-L239 HydrophobicContact CG2-CD2 3.66Å; F140-L239 HydrophobicContact CD2-CD2 4.01Å; F140-L239 HydrophobicContact CE2-CD2 3.94Å; S235-L239 WeakPolarHBondContact O-CB 3.5Å; S235-L239 PolarHBondContact O-N 2.71Å; G236-L239 PolarHBondContact O-N 3.06Å; L237-L239 VanDerWaalsContact C-N 3.35Å; L237-L239 PolarHBondContact O-N 3.12Å; L239-I243 HydrophobicContact CD1-CB 4.09Å; L239-I243 HydrophobicContact CD1-CD1 3.99Å; L239-I243 HydrophobicContact CD1-CG1 4.45Å; L239-I243 HydrophobicContact CD1-CG2 4.37Å; L239-I243 WeakPolarHBondContact O-CB 3.19Å; L239-I243 PolarHBondContact O-N 2.86Å; L239-I243 VanDerWaalsContact O-N 3.11Å; L239-I244 HydrophobicContact CD1-CD1 4.36Å; L239-I244 HydrophobicContact CD1-CG1 4.3Å; L239-I244 HydrophobicContact CD2-CD1 3.55Å; L239-I244 HydrophobicContact CD2-CG1 4.37Å; L239-I244 HydrophobicContact CG-CD1 3.55Å; L239-I244 HydrophobicContact CG-CG1 3.88Å; L239-I244 PolarHBondContact O-N 3.29Å
240L95.1Very high95.3Very high22 Ų2247.4 Ų47.412%0.11525%0.245CC..Iπ-helixtrans-65.3-49.6177.1-75.3172.1000112.3L165 T207 G236 L237 A238 I244 N245L165-L240 HydrophobicContact CD1-CD1 4Å; T207-L240 HydrophobicContact CG2-CB 4.34Å; G236-L240 WeakPolarHBondContact O-CB 3.42Å; G236-L240 WeakPolarHBondContact O-CG 3.12Å; G236-L240 PolarHBondContact O-N 3.45Å; L237-L240 PolarHBondContact O-N 3.21Å; A238-L240 VanDerWaalsContact C-N 3.33Å; A238-L240 PolarHBondContact O-N 2.99Å; L240-I244 HydrophobicContact CD2-CB 4.25Å; L240-I244 HydrophobicContact CD2-CD1 4.43Å; L240-I244 HydrophobicContact CD2-CG2 4.03Å; L240-N245 WeakPolarHBondContact O-CB 3.32Å; L240-N245 VanDerWaalsContact O-CG 3.25Å; L240-N245 PolarHBondContact O-N 2.94Å; L240-N245 PolarHBondContact O-ND2 3.39Å
241T96.8Very high95.1Very high1 Ų149.2 Ų49.21%0.00625%0.254CS..Iπ-helixtrans-65.1-47.1-176.6-60.10000112.1T207 Y208 W211 L237 A238 P246T207-T241 VanDerWaalsContact CB-OG1 3.28Å; T207-T241 WeakPolarHBondContact CB-OG1 3.41Å; T207-T241 PolarHBondContact OG1-OG1 3.37Å; Y208-T241 HydrophobicContact CD1-CG2 4.22Å; Y208-T241 HydrophobicContact CE1-CG2 3.7Å; W211-T241 PolarHBondContact NE1-OG1 3Å; L237-T241 WeakPolarHBondContact O-CB 3.47Å; L237-T241 PolarHBondContact O-N 3.01Å; L237-T241 PolarHBondContact O-OG1 3.3Å; A238-T241 PolarHBondContact O-N 3.32Å; T241-P246 WeakPolarHBondContact O-CD 3.42Å; T241-P246 WeakPolarHBondContact O-CG 2.96Å
242F96.2Very high94.8Very high135 Ų13545.8 Ų45.859%0.59224%0.235SC*.Iπ-helixtrans-100.4-20.8-166.4-59.7-63.9000114.4W211 A238W211-F242 HydrophobicContact CZ2-CE2 4.41Å; A238-F242 HydrophobicContact CB-CD2 4.24Å; A238-F242 HydrophobicContact CB-CE2 4.49Å; A238-F242 WeakPolarHBondContact O-CB 3.4Å; A238-F242 VanDerWaalsContact O-CD2 3.25Å; A238-F242 WeakPolarHBondContact O-CD2 3.39Å; A238-F242 PolarHBondContact O-N 3.28Å
243I94.1Very high94.5Very high88 Ų8845.6 Ų45.645%0.45124%0.236SC..Iπ-helixtrans-123.3-65.6-172-54.5-174.5000111.1L239 P246 I247L239-I243 HydrophobicContact CD1-CB 4.09Å; L239-I243 HydrophobicContact CD1-CD1 3.99Å; L239-I243 HydrophobicContact CD1-CG1 4.45Å; L239-I243 HydrophobicContact CD1-CG2 4.37Å; L239-I243 WeakPolarHBondContact O-CB 3.19Å; L239-I243 PolarHBondContact O-N 2.86Å; L239-I243 VanDerWaalsContact O-N 3.11Å; I243-P246 WeakPolarHBondContact O-CD 3.5Å; I243-I247 HydrophobicContact CG2-CD1 3.8Å; I243-I247 WeakPolarHBondContact O-CB 3.27Å; I243-I247 WeakPolarHBondContact O-CD1 3.42Å; I243-I247 WeakPolarHBondContact O-CG1 3.33Å; I243-I247 PolarHBondContact O-N 3.36Å; I243-I247 VanDerWaalsContact O-N 3.15Å
244I91.9Very high94.2Very high13 Ų1346.9 Ų46.97%0.06724%0.243CC..Iπ-helixtrans-66.2-54.2-168.8-71.2179000111.4H137 L239 L240 I247 W248H137-I244 HydrophobicContact CB-CD1 4.32Å; L239-I244 HydrophobicContact CD1-CD1 4.36Å; L239-I244 HydrophobicContact CD1-CG1 4.3Å; L239-I244 HydrophobicContact CD2-CD1 3.55Å; L239-I244 HydrophobicContact CD2-CG1 4.37Å; L239-I244 HydrophobicContact CG-CD1 3.55Å; L239-I244 HydrophobicContact CG-CG1 3.88Å; L239-I244 PolarHBondContact O-N 3.29Å; L240-I244 HydrophobicContact CD2-CB 4.25Å; L240-I244 HydrophobicContact CD2-CD1 4.43Å; L240-I244 HydrophobicContact CD2-CG2 4.03Å; I244-I247 PolarHBondContact O-N 3.23Å; I244-W248 HydrophobicContact CG2-CD2 3.42Å; I244-W248 VanDerWaalsContact CG2-CD2 3.42Å; I244-W248 VanDerWaalsContact CG2-CE2 3.44Å; I244-W248 HydrophobicContact CG2-CE3 3.37Å; I244-W248 HydrophobicContact CG2-CG 4.22Å; I244-W248 HydrophobicContact CG2-CH2 3.47Å; I244-W248 VanDerWaalsContact CG2-CH2 3.47Å; I244-W248 HydrophobicContact CG2-CZ2 3.48Å; I244-W248 VanDerWaalsContact CG2-CZ2 3.48Å; I244-W248 HydrophobicContact CG2-CZ3 3.4Å; I244-W248 VanDerWaalsContact CG2-CZ3 3.4Å; I244-W248 WeakPolarHBondContact O-CB 3.43Å; I244-W248 VanDerWaalsContact O-CG 3.31Å; I244-W248 PolarHBondContact O-N 3.46Å
245N93.3Very high93.7Very high0 Ų045.4 Ų45.40%024%0.236CC..Hα-helixtrans-65.7-42.5-176.1-69.5-24.3000112.5M204 L240 I247 W248 T249M204-N245 HydrophobicContact CG-CB 4.27Å; M204-N245 HydrophobicContact SD-CB 3.17Å; M204-N245 WeakPolarHBondContact SD-CB 3.33Å; L240-N245 WeakPolarHBondContact O-CB 3.32Å; L240-N245 VanDerWaalsContact O-CG 3.25Å; L240-N245 PolarHBondContact O-N 2.94Å; L240-N245 PolarHBondContact O-ND2 3.39Å; N245-I247 PolarHBondContact O-N 3.44Å; N245-W248 PolarHBondContact O-N 3.41Å; N245-T249 VanDerWaalsContact O-CB 3.25Å; N245-T249 WeakPolarHBondContact O-CB 3.44Å; N245-T249 PolarHBondContact O-N 2.95Å; N245-T249 PolarHBondContact O-OG1 3.47Å
246P93.9Very high93.2Very high51 Ų5144.2 Ų44.233%0.33123%0.225SC..Hα-helixtrans-57.5-46.2173.5-28.736.8000113.2M204 T241 I243 T249 H250M204-P246 HydrophobicContact CE-CG 3.98Å; M204-P246 HydrophobicContact SD-CG 4.34Å; T241-P246 WeakPolarHBondContact O-CD 3.42Å; T241-P246 WeakPolarHBondContact O-CG 2.96Å; I243-P246 WeakPolarHBondContact O-CD 3.5Å; P246-T249 PolarHBondContact O-N 2.88Å; P246-H250 WeakPolarHBondContact O-CB 3.45Å; P246-H250 PolarHBondContact O-N 2.85Å
247I92.1Very high92.6Very high84 Ų8449.3 Ų49.343%0.43125%0.25SC..Hα-helixtrans-63.8-46.4178.9-69.3169.9000110.8I243 I244 N245 H250 K251I243-I247 HydrophobicContact CG2-CD1 3.8Å; I243-I247 WeakPolarHBondContact O-CB 3.27Å; I243-I247 WeakPolarHBondContact O-CD1 3.42Å; I243-I247 WeakPolarHBondContact O-CG1 3.33Å; I243-I247 PolarHBondContact O-N 3.36Å; I243-I247 VanDerWaalsContact O-N 3.15Å; I244-I247 PolarHBondContact O-N 3.23Å; N245-I247 PolarHBondContact O-N 3.44Å; I247-H250 PolarHBondContact O-N 3.46Å; I247-K251 HydrophobicContact CG2-CD 4.36Å; I247-K251 WeakPolarHBondContact O-CG 3.48Å; I247-K251 PolarHBondContact O-N 3.36Å
248W92.2Very high92.1Very high51 Ų5153.5 Ų53.519%0.19327%0.272CS..Hα-helixtrans-65.3-43.2179.4-71.6-7.2000112H137 F200 I244 N245 H250 K251 K252H137-W248 HydrophobicContact CB-CH2 4.21Å; H137-W248 AromaticContact CD2-CH2 3.97Å; H137-W248 AromaticContact CG-CH2 3.77Å; H137-W248 AromaticContact ND1-CH2 3.94Å; F200-W248 HydrophobicContact CD1-CB 4.21Å; F200-W248 HydrophobicContact CE1-CB 3.6Å; F200-W248 HydrophobicContact CE1-CE3 4.04Å; F200-W248 HydrophobicContact CE1-CG 4.44Å; F200-W248 HydrophobicContact CZ-CB 4.29Å; I244-W248 HydrophobicContact CG2-CD2 3.42Å; I244-W248 VanDerWaalsContact CG2-CD2 3.42Å; I244-W248 VanDerWaalsContact CG2-CE2 3.44Å; I244-W248 HydrophobicContact CG2-CE3 3.37Å; I244-W248 HydrophobicContact CG2-CG 4.22Å; I244-W248 HydrophobicContact CG2-CH2 3.47Å; I244-W248 VanDerWaalsContact CG2-CH2 3.47Å; I244-W248 HydrophobicContact CG2-CZ2 3.48Å; I244-W248 VanDerWaalsContact CG2-CZ2 3.48Å; I244-W248 HydrophobicContact CG2-CZ3 3.4Å; I244-W248 VanDerWaalsContact CG2-CZ3 3.4Å; I244-W248 WeakPolarHBondContact O-CB 3.43Å; I244-W248 VanDerWaalsContact O-CG 3.31Å; I244-W248 PolarHBondContact O-N 3.46Å; N245-W248 PolarHBondContact O-N 3.41Å; W248-H250 VanDerWaalsContact C-N 3.33Å; W248-H250 PolarHBondContact O-N 3.13Å; W248-K251 PolarHBondContact O-N 3.23Å; W248-K252 WeakPolarHBondContact O-CB 3.35Å; W248-K252 WeakPolarHBondContact O-CG 3.38Å; W248-K252 PolarHBondContact O-N 3.07Å
249T94Very high91.4Very high16 Ų1653 Ų5310%0.09827%0.266CS..Hα-helixtrans-58.4-47.9175.7-55.90000110.1F200 N245 P246 K251 K252 T253F200-T249 HydrophobicContact CB-CG2 4.34Å; N245-T249 VanDerWaalsContact O-CB 3.25Å; N245-T249 WeakPolarHBondContact O-CB 3.44Å; N245-T249 PolarHBondContact O-N 2.95Å; N245-T249 PolarHBondContact O-OG1 3.47Å; P246-T249 PolarHBondContact O-N 2.88Å; T249-K251 PolarHBondContact O-N 2.99Å; T249-K252 PolarHBondContact O-N 2.99Å; T249-T253 WeakPolarHBondContact O-CB 3.39Å; T249-T253 PolarHBondContact O-N 3.49Å; T249-T253 PolarHBondContact O-OG1 3.41Å
250H92.1Very high90.7Very high117 Ų11752.1 Ų52.154%0.54226%0.262SS..Hα-helixtrans-57.7-50.2175.7177.773.9000112P246 I247 W248 K252 T253 M254P246-H250 WeakPolarHBondContact O-CB 3.45Å; P246-H250 PolarHBondContact O-N 2.85Å; I247-H250 PolarHBondContact O-N 3.46Å; W248-H250 VanDerWaalsContact C-N 3.33Å; W248-H250 PolarHBondContact O-N 3.13Å; H250-K252 VanDerWaalsContact C-N 3.32Å; H250-K252 PolarHBondContact O-N 3.08Å; H250-T253 PolarHBondContact O-N 2.8Å; H250-M254 WeakPolarHBondContact O-CG 3.47Å; H250-M254 PolarHBondContact O-N 2.88Å
251K90.5Very high90.1Very high84 Ų8451.5 Ų51.537%0.36526%0.259SS..Hα-helixtrans-57.9-43.1178.3-77.6-175.9174.1-174.90112.2I247 W248 T249 M254 Q255I247-K251 HydrophobicContact CG2-CD 4.36Å; I247-K251 WeakPolarHBondContact O-CG 3.48Å; I247-K251 PolarHBondContact O-N 3.36Å; W248-K251 PolarHBondContact O-N 3.23Å; T249-K251 PolarHBondContact O-N 2.99Å; K251-M254 PolarHBondContact O-N 2.8Å; K251-Q255 WeakPolarHBondContact O-CB 3.23Å; K251-Q255 PolarHBondContact O-N 3.11Å
252K90.6Very high89.1Confident30 Ų3056.7 Ų56.713%0.1328%0.278CS..Hα-helixtrans-71.5-37.7-179.7-68.1-42.1-173.3-179.40112.8M196 F200 W248 T249 H250 M254 Q255 L256M196-K252 HydrophobicContact CE-CB 3.87Å; M196-K252 HydrophobicContact CE-CD 3.85Å; M196-K252 HydrophobicContact CE-CG 4.04Å; M196-K252 HydrophobicContact SD-CB 4.49Å; M196-K252 HydrophobicContact SD-CD 3.86Å; M196-K252 HydrophobicContact SD-CG 4.07Å; F200-K252 HydrophobicContact CD2-CB 4.29Å; F200-K252 HydrophobicContact CD2-CG 3.97Å; F200-K252 HydrophobicContact CE2-CB 4.32Å; F200-K252 HydrophobicContact CE2-CG 3.52Å; F200-K252 HydrophobicContact CZ-CG 3.94Å; W248-K252 WeakPolarHBondContact O-CB 3.35Å; W248-K252 WeakPolarHBondContact O-CG 3.38Å; W248-K252 PolarHBondContact O-N 3.07Å; T249-K252 PolarHBondContact O-N 2.99Å; H250-K252 VanDerWaalsContact C-N 3.32Å; H250-K252 PolarHBondContact O-N 3.08Å; K252-M254 VanDerWaalsContact C-N 3.35Å; K252-Q255 WeakPolarHBondContact O-CB 3.46Å; K252-Q255 PolarHBondContact O-N 3.29Å; K252-L256 PolarHBondContact O-N 3.3Å
253T91.9Very high88.1Confident46 Ų4653.6 Ų53.628%0.28227%0.268SS..Hα-helixtrans-63.6-41.8172.2-59.40000111.4T249 H250 Q255 L256T249-T253 WeakPolarHBondContact O-CB 3.39Å; T249-T253 PolarHBondContact O-N 3.49Å; T249-T253 PolarHBondContact O-OG1 3.41Å; H250-T253 PolarHBondContact O-N 2.8Å; T253-Q255 VanDerWaalsContact C-N 3.3Å; T253-Q255 PolarHBondContact O-N 3Å; T253-L256 WeakPolarHBondContact O-CB 3.44Å; T253-L256 PolarHBondContact O-N 3.49Å
254M89.8Confident86.9Confident62 Ų6252.2 Ų52.231%0.30526%0.259SS..Hα-helixtrans-66.4-33.3175-69.3-58102.200112.4H250 K251 K252 L256 L257 N258H250-M254 WeakPolarHBondContact O-CG 3.47Å; H250-M254 PolarHBondContact O-N 2.88Å; K251-M254 PolarHBondContact O-N 2.8Å; K252-M254 VanDerWaalsContact C-N 3.35Å; M254-L256 VanDerWaalsContact C-N 3.28Å; M254-L256 PolarHBondContact O-N 2.69Å; M254-L257 HydrophobicContact CE-CD1 4.16Å; M254-L257 PolarHBondContact O-N 3.28Å; M254-L257 VanDerWaalsContact O-N 3.15Å; M254-N258 PolarHBondContact O-N 2.83Å
255Q88.1Confident85.4Confident4 Ų453.2 Ų53.22%0.01927%0.272CS..Hα-helixtrans-60.4-36.8177.6-169.7168.647.500111.9S175 W189 K251 K252 T253 L257 N258 V260S175-Q255 PolarHBondContact OG-OE1 3.23Å; W189-Q255 HydrophobicContact CH2-CG 4.42Å; W189-Q255 WeakPolarHBondContact CH2-O 3.11Å; W189-Q255 HydrophobicContact CZ2-CG 4.15Å; K251-Q255 WeakPolarHBondContact O-CB 3.23Å; K251-Q255 PolarHBondContact O-N 3.11Å; K252-Q255 WeakPolarHBondContact O-CB 3.46Å; K252-Q255 PolarHBondContact O-N 3.29Å; T253-Q255 VanDerWaalsContact C-N 3.3Å; T253-Q255 PolarHBondContact O-N 3Å; Q255-L257 VanDerWaalsContact C-N 3.29Å; Q255-L257 PolarHBondContact O-N 3.07Å; Q255-N258 WeakPolarHBondContact CA-O 3.47Å; Q255-N258 CarbonylContact O-C 3.17Å; Q255-N258 PolarHBondContact O-N 3.45Å; Q255-V260 PolarHBondContact NE2-O 2.87Å
256L86.4Confident83.7Confident39 Ų3959.1 Ų59.120%0.20430%0.304CS..Hα-helixtrans-58.1-39.9175.4173.465.5000112.7Q193 W194 I197 K252 T253 M254Q193-L256 HydrophobicContact CB-CB 4.31Å; Q193-L256 HydrophobicContact CB-CD1 3.64Å; Q193-L256 HydrophobicContact CB-CG 4.49Å; Q193-L256 HydrophobicContact CG-CB 4.43Å; Q193-L256 HydrophobicContact CG-CD1 3.94Å; W194-L256 HydrophobicContact CZ2-CD2 4.46Å; I197-L256 HydrophobicContact CD1-CB 4.04Å; I197-L256 HydrophobicContact CD1-CD2 3.88Å; K252-L256 PolarHBondContact O-N 3.3Å; T253-L256 WeakPolarHBondContact O-CB 3.44Å; T253-L256 PolarHBondContact O-N 3.49Å; M254-L256 VanDerWaalsContact C-N 3.28Å; M254-L256 PolarHBondContact O-N 2.69Å
257L85.3Confident81.9Confident117 Ų11764.6 Ų64.661%0.61332%0.323SS*.Hα-helixtrans-81-39.3-179.5-58.7177.5000111.5M254 Q255M254-L257 HydrophobicContact CE-CD1 4.16Å; M254-L257 PolarHBondContact O-N 3.28Å; M254-L257 VanDerWaalsContact O-N 3.15Å; Q255-L257 VanDerWaalsContact C-N 3.29Å; Q255-L257 PolarHBondContact O-N 3.07Å
258N85.6Confident80.3Confident93 Ų9367 Ų6750%0.49734%0.335SS..SBendtrans-129.997.8-175.8-65.1-63.1000109.5M254 Q255 V260M254-N258 PolarHBondContact O-N 2.83Å; Q255-N258 WeakPolarHBondContact CA-O 3.47Å; Q255-N258 CarbonylContact O-C 3.17Å; Q255-N258 PolarHBondContact O-N 3.45Å; N258-V260 HydrophobicContact CB-CG2 4.27Å; N258-V260 PolarHBondContact O-N 2.95Å
259P83Confident78.6Confident23 Ų2365.7 Ų65.715%0.14934%0.335CS..  trans-68.892.8-179.4-15.528.6000111.3L179 A184 W189 A269L179-P259 HydrophobicContact CD1-CB 4.33Å; A184-P259 HydrophobicContact CB-CB 3.64Å; A184-P259 HydrophobicContact CB-CG 4.27Å; W189-P259 HydrophobicContact CH2-CB 4.05Å; W189-P259 HydrophobicContact CH2-CG 4.02Å; W189-P259 HydrophobicContact CZ2-CB 4.24Å; W189-P259 HydrophobicContact CZ3-CG 4.35Å; P259-A269 HydrophobicContact CB-CB 4.16Å; P259-A269 PolarHBondContact O-N 3.37Å; P259-A269 VanDerWaalsContact O-N 3.07Å
260V82.3Confident76.9Confident18 Ų1868.8 Ų68.811%0.10936%0.356CS..BIsolated β-bridgetrans-120.2141.3-176.9176.10000109.7Q255 N258 W262 N266 L268Q255-V260 PolarHBondContact NE2-O 2.87Å; N258-V260 HydrophobicContact CB-CG2 4.27Å; N258-V260 PolarHBondContact O-N 2.95Å; V260-W262 HydrophobicContact CG1-CD2 4.42Å; V260-W262 HydrophobicContact CG1-CG 4.49Å; V260-W262 PolarHBondContact O-N 3.32Å; V260-N266 HydrophobicContact CG1-CB 4.43Å; V260-L268 HydrophobicContact CG2-CD2 4.34Å
261D81.4Confident75.1Confident9 Ų966.3 Ų66.35%0.04836%0.356CS..  trans-86.484.1173.5-173.75.5000112.4W176 L179 K180 N263 F264 G265 K267W176-D261 PolarHBondContact NE1-OD1 3.29Å; W176-D261 VanDerWaalsContact NE1-OD1 3.09Å; L179-D261 HydrophobicContact CD2-CB 3.79Å; K180-D261 WeakPolarHBondContact CE-OD2 3.39Å; K180-D261 IonicContact NZ-OD2 3.32Å; K180-D261 PolarHBondContact NZ-OD2 2.89Å; D261-N263 PolarHBondContact O-N 2.75Å; D261-N263 WeakPolarHBondContact OD1-CB 3.35Å; D261-N263 PolarHBondContact OD1-N 2.92Å; D261-F264 PolarHBondContact O-N 3.1Å; D261-G265 CarbonylContact C-O 3.28Å; D261-G265 CarbonylContact O-C 3.57Å; D261-G265 PolarHBondContact O-N 3.03Å; D261-K267 PolarHBondContact N-O 2.89Å
262W76.5Confident73Confident111 Ų11165.7 Ų65.742%0.4236%0.356SS..THydrogen-bonded Turntrans-64.5-8.4178.6-63.289.1000115V260V260-W262 HydrophobicContact CG1-CD2 4.42Å; V260-W262 HydrophobicContact CG1-CG 4.49Å; V260-W262 PolarHBondContact O-N 3.32Å
263N74.8Confident70.8Confident69 Ų6971.9 Ų71.937%0.36939%0.391SS..THydrogen-bonded Turntrans-89.2-30.6-177.6-62.2-39.2000113.3F62 W176 D261F62-N263 HydrophobicContact CE1-CB 4.47Å; F62-N263 HydrophobicContact CZ-CB 4.21Å; F62-N263 WeakPolarHBondContact CZ-ND2 3.48Å; W176-N263 PolarHBondContact NE1-ND2 3.41Å; D261-N263 PolarHBondContact O-N 2.75Å; D261-N263 WeakPolarHBondContact OD1-CB 3.35Å; D261-N263 PolarHBondContact OD1-N 2.92Å
264F70.1Confident68.3Low59 Ų5975.7 Ų75.726%0.25941%0.414SS..THydrogen-bonded Turntrans-127.89.2-175.1-64.3-81.9000114.3K58 E59 F62 W176 D261K58-F264 HydrophobicContact CD-CD1 4.32Å; K58-F264 HydrophobicContact CD-CE1 3.73Å; K58-F264 HydrophobicContact CG-CE1 3.83Å; E59-F264 HydrophobicContact CG-CD1 4.05Å; E59-F264 HydrophobicContact CG-CD2 4.16Å; E59-F264 HydrophobicContact CG-CE1 4.1Å; E59-F264 HydrophobicContact CG-CE2 4.22Å; E59-F264 HydrophobicContact CG-CG 4.09Å; E59-F264 HydrophobicContact CG-CZ 4.19Å; F62-F264 HydrophobicContact CB-CE2 3.96Å; F62-F264 HydrophobicContact CB-CZ 3.66Å; F62-F264 AromaticContact CD1-CE2 3.86Å; F62-F264 HydrophobicContact CD1-CE2 3.86Å; F62-F264 HydrophobicContact CD1-CZ 4.35Å; F62-F264 HydrophobicContact CD2-CE2 4.12Å; F62-F264 AromaticContact CD2-CZ 3.93Å; F62-F264 HydrophobicContact CD2-CZ 3.93Å; F62-F264 HydrophobicContact CE1-CE2 4.36Å; F62-F264 AromaticContact CG-CE2 3.71Å; F62-F264 HydrophobicContact CG-CE2 3.71Å; F62-F264 AromaticContact CG-CZ 3.73Å; F62-F264 HydrophobicContact CG-CZ 3.73Å; W176-F264 HydrophobicContact CZ2-CD2 4Å; W176-F264 AromaticContact CZ2-CE2 3.65Å; W176-F264 HydrophobicContact CZ2-CE2 3.65Å; D261-F264 PolarHBondContact O-N 3.1Å
265G60.6Low66Low34 Ų3476.6 Ų76.635%0.35143%0.432SS..  trans130.3155.4170.800000112.2D261 K267D261-G265 CarbonylContact C-O 3.28Å; D261-G265 CarbonylContact O-C 3.57Å; D261-G265 PolarHBondContact O-N 3.03Å; G265-K267 PolarHBondContact O-N 3.39Å
266N57Low63.5Low124 Ų12485.6 Ų85.666%0.66347%0.474SS*.SBendtrans-69.943.4-176.5-65.7-14.4000114.1V260V260-N266 HydrophobicContact CG1-CB 4.43Å
267K56.7Low61.2Low167 Ų16790.6 Ų90.673%0.72650%0.501SS*.PPolyproline II helixtrans-85.6135.8173.7-62.9-175.5-178.5-179.70108.6D261 G265D261-K267 PolarHBondContact N-O 2.89Å; G265-K267 PolarHBondContact O-N 3.39Å
268L56.9Low58.8Low133 Ų13394 Ų9470%0.69651%0.514SS*.BIsolated β-bridgetrans-61.7146.8171.6-74.4162.9000109.5V260V260-L268 HydrophobicContact CG2-CD2 4.34Å
269A57.4Low56.4Low24 Ų2494.2 Ų94.220%0.19852%0.522CS..PPolyproline II helixtrans-52.3141.6174.400000110.8L179 A184 P259 A271L179-A269 HydrophobicContact CD1-CB 4.46Å; L179-A269 HydrophobicContact CD2-CB 4.45Å; L179-A269 HydrophobicContact CG-CB 4.02Å; A184-A269 HydrophobicContact CB-CB 3.85Å; P259-A269 HydrophobicContact CB-CB 4.16Å; P259-A269 PolarHBondContact O-N 3.37Å; P259-A269 VanDerWaalsContact O-N 3.07Å; A269-A271 PolarHBondContact O-N 3.15Å
270P58.7Low54.4Low81 Ų8197.3 Ų97.353%0.52656%0.558SS.*PPolyproline II helixtrans-51.5131.1171-20.730.5000109.2
271A53Low52.1Low66 Ų66102.3 Ų102.355%0.54559%0.588SS.*PPolyproline II helixtrans-62.5141.9173.200000108.6A269 D273A269-A271 PolarHBondContact O-N 3.15Å; A271-D273 PolarHBondContact O-N 3.36Å
272N48Very low50.2Low70 Ų70106.9 Ų106.937%0.37462%0.621SS.*  trans-61.4110.8162.5-80.4-30.4000106.3G182 V274G182-N272 PolarHBondContact O-OD1 2.79Å; N272-V274 HydrophobicContact CB-CG2 4.36Å; N272-V274 PolarHBondContact O-N 3.45Å
273D43.8Very low48.2Very low161 Ų161113.2 Ų113.286%0.86165%0.645SS**  trans-67.476.2166.1-73.9-30.9000108.3A271 A275A271-D273 PolarHBondContact O-N 3.36Å; D273-A275 PolarHBondContact O-N 3.36Å; D273-A275 VanDerWaalsContact O-N 3.1Å
274V39.3Very low46.5Very low125 Ų125118.6 Ų118.676%0.75867%0.665SS**  trans-74.890.7155.2-179.80000104.7N272 E276N272-V274 HydrophobicContact CB-CG2 4.36Å; N272-V274 PolarHBondContact O-N 3.45Å; V274-E276 PolarHBondContact O-N 3.09Å; V274-E276 VanDerWaalsContact O-N 3.09Å
275A40.5Very low45.2Very low82 Ų82121.6 Ų121.668%0.67869%0.69SS**  trans8.988.816400000115.1D273 N277D273-A275 PolarHBondContact O-N 3.36Å; D273-A275 VanDerWaalsContact O-N 3.1Å; A275-N277 PolarHBondContact O-N 2.9Å
276E36.7Very low44.1Very low193 Ų193129.1 Ų129.190%0.90272%0.716SS**  trans-76.964.7160.3-149176.5-155.700107.9V274V274-E276 PolarHBondContact O-N 3.09Å; V274-E276 VanDerWaalsContact O-N 3.09Å
277N38.3Very low43.4Very low144 Ų144132 Ų13277%0.7772%0.722SS**  trans-129.670174.4-106.3-11.6000108.3A275A275-N277 PolarHBondContact O-N 2.9Å
278Q35.3Very low42.6Very low189 Ų189135.1 Ų135.188%0.88375%0.747SS**SBendtrans177.2114.7160.6-98.8163.655.600104.4
279S35.2Very low41.8Very low97 Ų97135.3 Ų135.368%0.67875%0.75SS**  cis-161.5138.124.247.80000107.9V281S279-V281 PolarHBondContact O-N 3.04Å
280G39.4Very low41Very low87 Ų87141.1 Ų141.190%0.89778%0.779SS**  trans-57111.6168.700000110.6
281V35.6Very low40Very low124 Ų124144.4 Ų144.475%0.75279%0.793SS**  trans-109.7101.5161.2179.10000106.9S279 R283S279-V281 PolarHBondContact O-N 3.04Å; V281-R283 PolarHBondContact O-N 3.21Å; V281-R283 VanDerWaalsContact O-N 3.13Å
282S40.3Very low39.3Very low104 Ų104149.1 Ų149.173%0.72781%0.807SS**  trans-43109.1170.11660000111.8K284S282-K284 PolarHBondContact O-N 3.13Å
283R34.7Very low38.7Very low245 Ų245154 Ų15493%0.92583%0.834SS**  trans-71.5106.8161.7-86.9-174.8174.3179.9-0.9108.6V281V281-R283 PolarHBondContact O-N 3.21Å; V281-R283 VanDerWaalsContact O-N 3.13Å
284K38.8Very low38.4Very low182 Ų182153.5 Ų153.579%0.79183%0.832SS**PPolyproline II helixtrans-61.7143.8162.2-83.7-177.2174.8178.90109.7S282S282-K284 PolarHBondContact O-N 3.13Å
285P42.3Very low38.3Very low121 Ų121155.6 Ų155.679%0.78684%0.838SS**PPolyproline II helixtrans-81.5126.1172.232.1-28.5000109.1
286H38.6Very low38.2Very low193 Ų193161.2 Ų161.289%0.89485%0.85SS**PPolyproline II helixtrans-85.3118.9162-104.3-73.4000108.8
287K43Very low38.3Very low184 Ų184158.6 Ų158.680%0.885%0.846SS**PPolyproline II helixtrans-79144.9164.7-87.3-179.6170.4-179.80109.7
288N38.3Very low38.3Very low233 Ų233159.9 Ų159.9100%1.24685%0.853SS**  trans67.20162.6-61.94.9000117.7

Retrieved 288 of 288 residues in 671.8 ms (Link to these results)

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