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Elongation of very long chain fatty acids protein 6

Catalyzes the first and rate-limiting reaction of the four reactions that constitute the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process allows the addition of 2 carbons to the chain of long- and very long-chain fatty acids (VLCFAs) per cycle. Condensing enzyme that elongates fatty acids with 12, 14 and 16 carbons with higher activity toward C16:0 acyl-CoAs. Catalyzes the synthesis of unsaturated C16 long chain fatty acids and, to a lesser extent, C18:0 and those with low desaturation degree. May participate to the production of saturated and monounsaturated VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators.

AlphaFold DB , UniProt , Accession A0A060WM54, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ELOVL6, Length 275 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
1M50.9Low71.3Confident146 Ų14695.2 Ų95.272%0.71949%0.487SS*.  0125.50-84.3180-75.500107.6V3 T84 M88M1-V3 PolarHBondContact O-N 3.27Å; M1-T84 HydrophobicContact SD-CG2 3.91Å; M1-M88 HydrophobicContact CE-CB 4.09Å; M1-M88 HydrophobicContact CE-CG 4.26Å; M1-M88 HydrophobicContact CE-SD 3.22Å; M1-M88 WeakPolarHBondContact CE-SD 3.21Å; M1-M88 HydrophobicContact SD-SD 3.75Å
2S50.2Low73Confident75 Ų7587.3 Ų87.352%0.52445%0.446SS..  trans-71.2122.8-179.755.10000109.2L4 A5S2-L4 PolarHBondContact O-N 3.19Å; S2-A5 PolarHBondContact O-N 2.59Å
3V54.6Low74.2Confident130 Ų13087.8 Ų87.879%0.78844%0.443SS*.G310 helixtrans-50.7-27.7173.2176.10000111.5M1 A5 L6 Q7M1-V3 PolarHBondContact O-N 3.27Å; V3-A5 VanDerWaalsContact C-N 3.33Å; V3-A5 PolarHBondContact O-N 3.09Å; V3-L6 PolarHBondContact O-N 3.35Å; V3-Q7 PolarHBondContact O-N 3.15Å
4L58.8Low75.4Confident129 Ų12992.6 Ų92.668%0.67546%0.464SS*.G310 helixtrans-60.9-31.5176.1-62.7172.5000114.5S2 L6 Q7S2-L4 PolarHBondContact O-N 3.19Å; L4-L6 VanDerWaalsContact C-N 3.27Å; L4-L6 PolarHBondContact O-N 3.08Å; L4-Q7 PolarHBondContact O-N 2.91Å
5A61.9Low76.6Confident20 Ų2088.9 Ų88.917%0.16544%0.443CS..G310 helixtrans-76.6-15.5-17600000113.4S2 V3 R78 S81S2-A5 PolarHBondContact O-N 2.59Å; V3-A5 VanDerWaalsContact C-N 3.33Å; V3-A5 PolarHBondContact O-N 3.09Å; A5-R78 PolarHBondContact O-NH1 3.38Å; A5-S81 WeakPolarHBondContact CB-OG 3.5Å
6L72.1Confident77.7Confident54 Ų5487.8 Ų87.828%0.28344%0.439SS..THydrogen-bonded Turntrans-105-5.5175.6-65172.8000112.8V3 L4 E8 Y82 Y85 V106V3-L6 PolarHBondContact O-N 3.35Å; L4-L6 VanDerWaalsContact C-N 3.27Å; L4-L6 PolarHBondContact O-N 3.08Å; L6-E8 PolarHBondContact O-N 3.45Å; L6-Y82 HydrophobicContact CD2-CD2 4.48Å; L6-Y85 HydrophobicContact CD1-CD1 4.46Å; L6-Y85 HydrophobicContact CD1-CD2 3.61Å; L6-Y85 HydrophobicContact CD1-CE2 4.26Å; L6-Y85 HydrophobicContact CD1-CG 3.73Å; L6-V106 WeakPolarHBondContact O-CG2 2.94Å
7Q82.2Confident78.5Confident121 Ų12184.9 Ų84.957%0.56542%0.424SS*.SBendtrans-67.4124.1171.8-176.2173-6.900109V3 L4 R78V3-Q7 PolarHBondContact O-N 3.15Å; L4-Q7 PolarHBondContact O-N 2.91Å; Q7-R78 PolarHBondContact O-NH1 3.46Å; Q7-R78 PolarHBondContact O-NH2 3.43Å
8E84.8Confident79.3Confident60 Ų6085.8 Ų85.828%0.2843%0.431SS..PPolyproline II helixtrans-69.7138.6179.3-64.4169.1-9400111.4L6 E12 K13 P105 V106L6-E8 PolarHBondContact O-N 3.45Å; E8-E12 WeakPolarHBondContact CA-OE2 3.47Å; E8-K13 HydrophobicContact CB-CD 4.33Å; E8-K13 HydrophobicContact CB-CG 3.63Å; E8-K13 HydrophobicContact CG-CG 4.39Å; E8-P105 HydrophobicContact CG-CB 3.65Å; E8-P105 VanDerWaalsContact OE2-CB 3.31Å; E8-P105 WeakPolarHBondContact OE2-CB 3.23Å; E8-V106 HydrophobicContact CG-CG2 4.14Å
9Y89.2Confident80.2Confident108 Ų10887.6 Ų87.642%0.42444%0.437SS..PPolyproline II helixtrans-77.4155.2164.2-60.2-52.3000110.4F11 E12 K13Y9-F11 AromaticContact CD2-CE1 3.59Å; Y9-F11 HydrophobicContact CD2-CE1 3.59Å; Y9-F11 AromaticContact CD2-CZ 3.87Å; Y9-F11 HydrophobicContact CD2-CZ 3.87Å; Y9-F11 HydrophobicContact CG-CD1 4.47Å; Y9-F11 AromaticContact CG-CE1 3.8Å; Y9-F11 HydrophobicContact CG-CE1 3.8Å; Y9-F11 HydrophobicContact CG-CZ 4.46Å; Y9-F11 PolarHBondContact O-N 2.89Å; Y9-E12 PolarHBondContact N-OE2 3.07Å; Y9-E12 WeakPolarHBondContact O-CB 3.39Å; Y9-E12 PolarHBondContact O-N 3.5Å; Y9-K13 PolarHBondContact O-N 3.41Å; Y9-K13 VanDerWaalsContact O-N 3.11Å
10E88.9Confident80.9Confident115 Ų11583.5 Ų83.554%0.53742%0.418SS..Hα-helixtrans-56.6-37.9-177.9-69.3-56.1123.400113.1E12 K13 Q14E10-E12 VanDerWaalsContact C-N 3.33Å; E10-E12 PolarHBondContact O-N 3.05Å; E10-K13 PolarHBondContact O-N 3.19Å; E10-K13 IonicContact OE1-NZ 2.95Å; E10-K13 PolarHBondContact OE1-NZ 3.19Å; E10-Q14 WeakPolarHBondContact O-CB 3.3Å; E10-Q14 VanDerWaalsContact O-CG 3.28Å; E10-Q14 WeakPolarHBondContact O-CG 3.19Å; E10-Q14 PolarHBondContact O-N 3.2Å
11F90.4Very high81.5Confident89 Ų8980.3 Ų80.339%0.3940%0.402SS..Hα-helixtrans-69.8-28.717775.3-93.2000113.2Y9 F15 F109 W110Y9-F11 AromaticContact CD2-CE1 3.59Å; Y9-F11 HydrophobicContact CD2-CE1 3.59Å; Y9-F11 AromaticContact CD2-CZ 3.87Å; Y9-F11 HydrophobicContact CD2-CZ 3.87Å; Y9-F11 HydrophobicContact CG-CD1 4.47Å; Y9-F11 AromaticContact CG-CE1 3.8Å; Y9-F11 HydrophobicContact CG-CE1 3.8Å; Y9-F11 HydrophobicContact CG-CZ 4.46Å; Y9-F11 PolarHBondContact O-N 2.89Å; F11-F15 PolarHBondContact O-N 3.44Å; F11-F109 HydrophobicContact CD2-CD1 4.26Å; F11-F109 HydrophobicContact CD2-CD2 4.21Å; F11-F109 HydrophobicContact CD2-CE1 4.31Å; F11-F109 HydrophobicContact CD2-CE2 4.26Å; F11-F109 HydrophobicContact CD2-CG 4.2Å; F11-F109 HydrophobicContact CD2-CZ 4.31Å; F11-F109 AromaticContact CE2-CD1 3.57Å; F11-F109 HydrophobicContact CE2-CD1 3.57Å; F11-F109 HydrophobicContact CE2-CD2 4.33Å; F11-F109 AromaticContact CE2-CE1 3.63Å; F11-F109 HydrophobicContact CE2-CE1 3.63Å; F11-F109 HydrophobicContact CE2-CE2 4.39Å; F11-F109 AromaticContact CE2-CG 3.92Å; F11-F109 HydrophobicContact CE2-CG 3.92Å; F11-F109 HydrophobicContact CE2-CZ 4.05Å; F11-W110 HydrophobicContact CZ-CZ2 4.27Å
12E91.3Very high83.7Confident0 Ų080 Ų800%039%0.393CS..Hα-helixtrans-72.5-40.6176.4-64.517015500109.7E8 Y9 E10 F15 R78 K108 F109 W110E8-E12 WeakPolarHBondContact CA-OE2 3.47Å; Y9-E12 PolarHBondContact N-OE2 3.07Å; Y9-E12 WeakPolarHBondContact O-CB 3.39Å; Y9-E12 PolarHBondContact O-N 3.5Å; E10-E12 VanDerWaalsContact C-N 3.33Å; E10-E12 PolarHBondContact O-N 3.05Å; E12-F15 WeakPolarHBondContact O-CB 3.26Å; E12-F15 PolarHBondContact O-N 3.08Å; E12-R78 IonicContact OE1-CZ 2.76Å; E12-R78 IonicContact OE1-NE 3.71Å; E12-R78 PolarHBondContact OE1-NE 3.05Å; E12-R78 IonicContact OE1-NH2 2.91Å; E12-R78 PolarHBondContact OE1-NH2 3.31Å; E12-R78 IonicContact OE2-CZ 3.73Å; E12-R78 IonicContact OE2-NE 3.3Å; E12-R78 IonicContact OE2-NH2 3.91Å; E12-R78 PolarHBondContact OE2-NH2 3.26Å; E12-K108 WeakPolarHBondContact O-CE 3.1Å; E12-F109 HydrophobicContact CG-CB 4.47Å; E12-W110 PolarHBondContact OE1-NE1 2.97Å
13K89.2Confident85.9Confident95 Ų9580.4 Ų80.441%0.41338%0.383SS..Hα-helixtrans-61.5-45.4175.3-63.7178-172.5167.10112.1E8 Y9 E10 F15E8-K13 HydrophobicContact CB-CD 4.33Å; E8-K13 HydrophobicContact CB-CG 3.63Å; E8-K13 HydrophobicContact CG-CG 4.39Å; Y9-K13 PolarHBondContact O-N 3.41Å; Y9-K13 VanDerWaalsContact O-N 3.11Å; E10-K13 PolarHBondContact O-N 3.19Å; E10-K13 IonicContact OE1-NZ 2.95Å; E10-K13 PolarHBondContact OE1-NZ 3.19Å; K13-F15 PolarHBondContact O-N 3.37Å
14Q91.2Very high87.9Confident155 Ų15574.2 Ų74.272%0.72435%0.346SS*.Hα-helixtrans-74.9-12.3-177.8-69.3175.3-100113.5E10 N16E10-Q14 WeakPolarHBondContact O-CB 3.3Å; E10-Q14 VanDerWaalsContact O-CG 3.28Å; E10-Q14 WeakPolarHBondContact O-CG 3.19Å; E10-Q14 PolarHBondContact O-N 3.2Å; Q14-N16 PolarHBondContact O-N 3.28Å
15F93.8Very high89.6Confident36 Ų3672.7 Ų72.716%0.15834%0.335CS..  trans-68.7126.4-179.3-177.4-103.1000111F11 E12 K13 E17 A20 K108 F109 Y112F11-F15 PolarHBondContact O-N 3.44Å; E12-F15 WeakPolarHBondContact O-CB 3.26Å; E12-F15 PolarHBondContact O-N 3.08Å; K13-F15 PolarHBondContact O-N 3.37Å; F15-E17 HydrophobicContact CD1-CB 4.48Å; F15-E17 HydrophobicContact CE1-CB 4.34Å; F15-E17 PolarHBondContact O-N 2.86Å; F15-E17 VanDerWaalsContact O-OE2 3.05Å; F15-A20 HydrophobicContact CE1-CB 3.98Å; F15-A20 HydrophobicContact CE2-CB 4.42Å; F15-A20 HydrophobicContact CZ-CB 3.5Å; F15-A20 VanDerWaalsContact CZ-CB 3.5Å; F15-K108 HydrophobicContact CD1-CB 4.34Å; F15-K108 HydrophobicContact CD1-CD 4.37Å; F15-K108 HydrophobicContact CD1-CG 3.96Å; F15-K108 WeakPolarHBondContact O-CE 2.86Å; F15-K108 PolarHBondContact O-NZ 3.42Å; F15-F109 HydrophobicContact CB-CB 4.3Å; F15-F109 HydrophobicContact CD1-CB 4.16Å; F15-F109 HydrophobicContact CD2-CB 4.47Å; F15-F109 AromaticContact CD2-CD2 3.71Å; F15-F109 HydrophobicContact CD2-CD2 3.71Å; F15-F109 HydrophobicContact CE2-CD2 4.08Å; F15-F109 HydrophobicContact CG-CB 4.05Å; F15-F109 HydrophobicContact CG-CD2 4.11Å; F15-Y112 AromaticContact CE2-CD1 3.77Å; F15-Y112 HydrophobicContact CE2-CD1 3.77Å; F15-Y112 HydrophobicContact CE2-CE1 4.38Å; F15-Y112 HydrophobicContact CE2-CG 4.44Å; F15-Y112 AromaticContact CZ-CD1 3.51Å; F15-Y112 HydrophobicContact CZ-CD1 3.51Å; F15-Y112 HydrophobicContact CZ-CE1 4.34Å; F15-Y112 AromaticContact CZ-CG 3.73Å; F15-Y112 HydrophobicContact CZ-CG 3.73Å
16N93.4Very high91.2Very high71 Ų7178.7 Ų78.738%0.3836%0.36SS..  trans-90.596.6177.1-173.2-20.2000110.5Q14 D18 E19 A20Q14-N16 PolarHBondContact O-N 3.28Å; N16-D18 VanDerWaalsContact C-N 3.33Å; N16-D18 PolarHBondContact O-N 3.42Å; N16-D18 PolarHBondContact OD1-N 3.2Å; N16-D18 VanDerWaalsContact OD1-N 3.16Å; N16-E19 HydrophobicContact CB-CB 4.12Å; N16-E19 PolarHBondContact OD1-N 2.9Å; N16-A20 PolarHBondContact O-N 3.02Å
17E92.3Very high92.4Very high40 Ų4077.3 Ų77.319%0.18735%0.352CS..Hα-helixtrans-64.1-35.1178.362.4-87.1-149.100113.1F15 E19 A20 I21 N103 K108F15-E17 HydrophobicContact CD1-CB 4.48Å; F15-E17 HydrophobicContact CE1-CB 4.34Å; F15-E17 PolarHBondContact O-N 2.86Å; F15-E17 VanDerWaalsContact O-OE2 3.05Å; E17-E19 PolarHBondContact O-N 2.96Å; E17-A20 WeakPolarHBondContact O-CB 3.41Å; E17-A20 PolarHBondContact O-N 3.25Å; E17-I21 WeakPolarHBondContact O-CB 3.12Å; E17-I21 WeakPolarHBondContact O-CD1 3.13Å; E17-I21 VanDerWaalsContact O-CG1 3.23Å; E17-I21 WeakPolarHBondContact O-CG1 3.23Å; E17-I21 PolarHBondContact O-N 3.35Å; E17-N103 HydrophobicContact CG-CB 4.05Å; E17-K108 HydrophobicContact CB-CB 4.19Å; E17-K108 HydrophobicContact CB-CD 4.29Å; E17-K108 HydrophobicContact CG-CD 4.45Å; E17-K108 IonicContact OE1-NZ 3.52Å; E17-K108 WeakPolarHBondContact OE2-CD 3.12Å; E17-K108 IonicContact OE2-NZ 2.96Å; E17-K108 PolarHBondContact OE2-NZ 3.12Å
18D93Very high93Very high101 Ų10173.9 Ų73.954%0.5433%0.334SS..Hα-helixtrans-68.1-37.6-178-69.7-31.4000111.5N16 R22N16-D18 VanDerWaalsContact C-N 3.33Å; N16-D18 PolarHBondContact O-N 3.42Å; N16-D18 PolarHBondContact OD1-N 3.2Å; N16-D18 VanDerWaalsContact OD1-N 3.16Å; D18-R22 WeakPolarHBondContact O-CB 3.41Å; D18-R22 VanDerWaalsContact O-CG 3.28Å; D18-R22 WeakPolarHBondContact O-CG 3.45Å; D18-R22 PolarHBondContact O-N 3.41Å; D18-R22 VanDerWaalsContact O-N 3.07Å; D18-R22 PolarHBondContact O-NE 3.44Å
19E94.9Very high93.6Very high119 Ų11977.4 Ų77.456%0.55635%0.349SS*.Hα-helixtrans-66-44.2171.7-172.8177.5174.400111.4N16 E17 I21 R22 W23N16-E19 HydrophobicContact CB-CB 4.12Å; N16-E19 PolarHBondContact OD1-N 2.9Å; E17-E19 PolarHBondContact O-N 2.96Å; E19-I21 PolarHBondContact O-N 3.04Å; E19-R22 PolarHBondContact O-N 3.46Å; E19-W23 WeakPolarHBondContact O-CB 3.39Å; E19-W23 PolarHBondContact O-N 3.33Å
20A94.6Very high93.9Very high6 Ų676.3 Ų76.35%0.0535%0.346CS..Hα-helixtrans-62.2-43.917800000112.6F15 N16 E17 W23 M24 Y112F15-A20 HydrophobicContact CE1-CB 3.98Å; F15-A20 HydrophobicContact CE2-CB 4.42Å; F15-A20 HydrophobicContact CZ-CB 3.5Å; F15-A20 VanDerWaalsContact CZ-CB 3.5Å; N16-A20 PolarHBondContact O-N 3.02Å; E17-A20 WeakPolarHBondContact O-CB 3.41Å; E17-A20 PolarHBondContact O-N 3.25Å; A20-W23 PolarHBondContact O-N 3.42Å; A20-M24 WeakPolarHBondContact O-CG 3.19Å; A20-M24 PolarHBondContact O-N 2.94Å; A20-Y112 HydrophobicContact CB-CD1 4.2Å; A20-Y112 HydrophobicContact CB-CD2 3.68Å; A20-Y112 HydrophobicContact CB-CE1 4.35Å; A20-Y112 HydrophobicContact CB-CE2 3.87Å; A20-Y112 HydrophobicContact CB-CG 3.85Å
21I94.4Very high94.2Very high16 Ų1670.9 Ų70.98%0.08232%0.321CS..Hα-helixtrans-62.8-48.6176.6-69.3159.6000110.2E17 E19 W23 M24 Q25 Y154 M157E17-I21 WeakPolarHBondContact O-CB 3.12Å; E17-I21 WeakPolarHBondContact O-CD1 3.13Å; E17-I21 VanDerWaalsContact O-CG1 3.23Å; E17-I21 WeakPolarHBondContact O-CG1 3.23Å; E17-I21 PolarHBondContact O-N 3.35Å; E19-I21 PolarHBondContact O-N 3.04Å; I21-W23 VanDerWaalsContact C-N 3.35Å; I21-W23 PolarHBondContact O-N 2.91Å; I21-M24 PolarHBondContact O-N 3.18Å; I21-M24 VanDerWaalsContact O-N 3.16Å; I21-Q25 HydrophobicContact CG2-CG 4.46Å; I21-Q25 WeakPolarHBondContact O-CG 3.49Å; I21-Q25 PolarHBondContact O-N 2.73Å; I21-Y154 HydrophobicContact CG1-CE1 4.28Å; I21-M157 HydrophobicContact CD1-SD 3.51Å; I21-M157 VanDerWaalsContact CD1-SD 3.51Å; I21-M157 HydrophobicContact CG1-SD 4.07Å; I21-M157 HydrophobicContact CG2-SD 4.42Å
22R96.4Very high94.6Very high141 Ų14172.2 Ų72.253%0.53233%0.327SS..Hα-helixtrans-59.1-45.7176.9-77.3-176.8-67.6172.60.8111.8D18 E19 M24 Q25 E26D18-R22 WeakPolarHBondContact O-CB 3.41Å; D18-R22 VanDerWaalsContact O-CG 3.28Å; D18-R22 WeakPolarHBondContact O-CG 3.45Å; D18-R22 PolarHBondContact O-N 3.41Å; D18-R22 VanDerWaalsContact O-N 3.07Å; D18-R22 PolarHBondContact O-NE 3.44Å; E19-R22 PolarHBondContact O-N 3.46Å; R22-M24 VanDerWaalsContact C-N 3.29Å; R22-M24 PolarHBondContact O-N 3.37Å; R22-Q25 WeakPolarHBondContact O-CB 3.17Å; R22-Q25 PolarHBondContact O-N 3.05Å; R22-Q25 VanDerWaalsContact O-N 3.14Å; R22-E26 WeakPolarHBondContact O-CG 3.29Å; R22-E26 PolarHBondContact O-N 3.08Å
23W96.6Very high94.8Very high83 Ų8377.1 Ų77.131%0.31435%0.352SS..Hα-helixtrans-58.4-43.3176.7-172.594.7000111.3E19 A20 I21 E26 N27 Y112 L116 W151E19-W23 WeakPolarHBondContact O-CB 3.39Å; E19-W23 PolarHBondContact O-N 3.33Å; A20-W23 PolarHBondContact O-N 3.42Å; I21-W23 VanDerWaalsContact C-N 3.35Å; I21-W23 PolarHBondContact O-N 2.91Å; W23-E26 PolarHBondContact O-N 2.88Å; W23-N27 HydrophobicContact CD2-CB 4.1Å; W23-N27 HydrophobicContact CE3-CB 4.14Å; W23-N27 HydrophobicContact CH2-CB 4.15Å; W23-N27 HydrophobicContact CZ2-CB 4.1Å; W23-N27 HydrophobicContact CZ3-CB 4.17Å; W23-N27 WeakPolarHBondContact O-CB 3.15Å; W23-N27 PolarHBondContact O-N 3.26Å; W23-N27 PolarHBondContact O-ND2 3.12Å; W23-Y112 HydrophobicContact CE3-CE2 4.29Å; W23-L116 HydrophobicContact CH2-CD2 4.2Å; W23-L116 HydrophobicContact CZ3-CD2 3.87Å; W23-W151 AromaticContact CH2-CH2 3.71Å; W23-W151 HydrophobicContact CH2-CH2 3.71Å; W23-W151 AromaticContact CH2-CZ3 3.98Å; W23-W151 HydrophobicContact CH2-CZ3 3.98Å; W23-W151 AromaticContact CZ3-CH2 3.93Å; W23-W151 HydrophobicContact CZ3-CH2 3.93Å; W23-W151 HydrophobicContact CZ3-CZ3 4.02Å
24M95.6Very high95.2Very high0 Ų076 Ų760%035%0.347CS..Hα-helixtrans-65.2-40.2176.7-72.5-61.2-51.500112.3A20 I21 R22 E26 N27 W28 Y112 V115 L116 W151 Y154A20-M24 WeakPolarHBondContact O-CG 3.19Å; A20-M24 PolarHBondContact O-N 2.94Å; I21-M24 PolarHBondContact O-N 3.18Å; I21-M24 VanDerWaalsContact O-N 3.16Å; R22-M24 VanDerWaalsContact C-N 3.29Å; R22-M24 PolarHBondContact O-N 3.37Å; M24-E26 VanDerWaalsContact C-N 3.31Å; M24-E26 PolarHBondContact O-N 2.83Å; M24-N27 PolarHBondContact O-N 3.42Å; M24-W28 VanDerWaalsContact O-CB 3.25Å; M24-W28 WeakPolarHBondContact O-CB 3.29Å; M24-W28 PolarHBondContact O-N 3.3Å; M24-Y112 HydrophobicContact CG-CD2 4.08Å; M24-Y112 HydrophobicContact CG-CE2 3.76Å; M24-Y112 HydrophobicContact SD-CE2 4.01Å; M24-V115 HydrophobicContact CE-CG1 3.51Å; M24-V115 HydrophobicContact SD-CG1 4.27Å; M24-L116 HydrophobicContact SD-CD2 4.47Å; M24-W151 HydrophobicContact CE-CB 4Å; M24-W151 HydrophobicContact CE-CD2 3.96Å; M24-W151 HydrophobicContact CE-CE3 4.2Å; M24-W151 HydrophobicContact CE-CG 3.92Å; M24-Y154 HydrophobicContact CB-CD1 3.67Å; M24-Y154 HydrophobicContact CB-CE1 4.04Å; M24-Y154 HydrophobicContact CE-CD1 4.44Å; M24-Y154 HydrophobicContact CG-CD1 3.46Å; M24-Y154 VanDerWaalsContact CG-CD1 3.46Å; M24-Y154 HydrophobicContact CG-CE1 3.61Å; M24-Y154 HydrophobicContact CG-CG 4.46Å
25Q94.8Very high95.5Very high96 Ų9669 Ų6945%0.44932%0.316SS..Hα-helixtrans-61.6-37.7175.9-72.1172.7-14.700112.8I21 R22 W28 K155I21-Q25 HydrophobicContact CG2-CG 4.46Å; I21-Q25 WeakPolarHBondContact O-CG 3.49Å; I21-Q25 PolarHBondContact O-N 2.73Å; R22-Q25 WeakPolarHBondContact O-CB 3.17Å; R22-Q25 PolarHBondContact O-N 3.05Å; R22-Q25 VanDerWaalsContact O-N 3.14Å; Q25-W28 VanDerWaalsContact O-CD1 3.24Å; Q25-K155 HydrophobicContact CG-CB 4.13Å; Q25-K155 WeakPolarHBondContact CG-O 3.24Å; Q25-K155 PolarHBondContact NE2-O 2.83Å
26E96.5Very high95.7Very high147 Ų14770.2 Ų70.269%0.68733%0.332SS*.Hα-helixtrans-78-34.7177.7-69.5173.7-179.100112.6R22 W23 M24R22-E26 WeakPolarHBondContact O-CG 3.29Å; R22-E26 PolarHBondContact O-N 3.08Å; W23-E26 PolarHBondContact O-N 2.88Å; M24-E26 VanDerWaalsContact C-N 3.31Å; M24-E26 PolarHBondContact O-N 2.83Å
27N96.7Very high95.9Very high24 Ų2471.7 Ų71.713%0.12834%0.34CS..Hα-helixtrans-114-1.4-163.7-61.4-77.9000115W23 M24 K29 K30W23-N27 HydrophobicContact CD2-CB 4.1Å; W23-N27 HydrophobicContact CE3-CB 4.14Å; W23-N27 HydrophobicContact CH2-CB 4.15Å; W23-N27 HydrophobicContact CZ2-CB 4.1Å; W23-N27 HydrophobicContact CZ3-CB 4.17Å; W23-N27 WeakPolarHBondContact O-CB 3.15Å; W23-N27 PolarHBondContact O-N 3.26Å; W23-N27 PolarHBondContact O-ND2 3.12Å; M24-N27 PolarHBondContact O-N 3.42Å; N27-K29 PolarHBondContact O-N 3.47Å; N27-K30 HydrophobicContact CB-CD 4.03Å; N27-K30 HydrophobicContact CB-CG 4.44Å; N27-K30 VanDerWaalsContact O-CB 3.29Å; N27-K30 WeakPolarHBondContact O-CB 3.27Å; N27-K30 WeakPolarHBondContact O-CG 3.43Å; N27-K30 PolarHBondContact O-N 3.4Å; N27-K30 WeakPolarHBondContact OD1-CE 3.36Å; N27-K30 PolarHBondContact OD1-NZ 3.48Å
28W95.3Very high96.1Very high49 Ų4970.2 Ų70.219%0.18633%0.333CS..THydrogen-bonded Turntrans-53.9-31.7-177.870.4-87.6000113.2M24 Q25 K30 S31 F32 W151 Y152 K155M24-W28 VanDerWaalsContact O-CB 3.25Å; M24-W28 WeakPolarHBondContact O-CB 3.29Å; M24-W28 PolarHBondContact O-N 3.3Å; Q25-W28 VanDerWaalsContact O-CD1 3.24Å; W28-K30 PolarHBondContact O-N 3.45Å; W28-S31 VanDerWaalsContact O-CB 3.31Å; W28-S31 WeakPolarHBondContact O-CB 3.42Å; W28-S31 PolarHBondContact O-N 3.12Å; W28-S31 VanDerWaalsContact O-N 3.16Å; W28-S31 PolarHBondContact O-OG 3.45Å; W28-F32 HydrophobicContact CE3-CE2 4.36Å; W28-F32 HydrophobicContact CH2-CE2 4.17Å; W28-F32 AromaticContact CZ3-CE2 3.6Å; W28-F32 HydrophobicContact CZ3-CE2 3.6Å; W28-F32 HydrophobicContact CZ3-CZ 4.2Å; W28-W151 HydrophobicContact CB-CB 4.35Å; W28-W151 WeakPolarHBondContact CB-O 3.31Å; W28-Y152 HydrophobicContact CE3-CD2 4.1Å; W28-Y152 HydrophobicContact CH2-CD2 4.08Å; W28-Y152 AromaticContact CZ3-CD2 3.79Å; W28-Y152 HydrophobicContact CZ3-CD2 3.79Å; W28-K155 HydrophobicContact CD2-CD 4.03Å; W28-K155 HydrophobicContact CG-CD 3.83Å
29K96.3Very high96.3Very high134 Ų13467.2 Ų67.258%0.58332%0.322SS*.THydrogen-bonded Turntrans-64.5-19.4178.1-63.4-179.8-176.5172.60113.4N27 S31 F32N27-K29 PolarHBondContact O-N 3.47Å; K29-S31 PolarHBondContact O-N 3.37Å; K29-F32 HydrophobicContact CB-CD2 4.43Å; K29-F32 WeakPolarHBondContact O-CB 3.21Å; K29-F32 WeakPolarHBondContact O-CD2 3.41Å; K29-F32 PolarHBondContact O-N 3.07Å
30K95.8Very high96.4Very high86 Ų8664.4 Ų64.437%0.37432%0.319SS..Hα-helixtrans-61.1-22.6174-65.8-178.4-175.5162.90112.3N27 W28 F32 L33 F34 W151N27-K30 HydrophobicContact CB-CD 4.03Å; N27-K30 HydrophobicContact CB-CG 4.44Å; N27-K30 VanDerWaalsContact O-CB 3.29Å; N27-K30 WeakPolarHBondContact O-CB 3.27Å; N27-K30 WeakPolarHBondContact O-CG 3.43Å; N27-K30 PolarHBondContact O-N 3.4Å; N27-K30 WeakPolarHBondContact OD1-CE 3.36Å; N27-K30 PolarHBondContact OD1-NZ 3.48Å; W28-K30 PolarHBondContact O-N 3.45Å; K30-F32 PolarHBondContact O-N 3.02Å; K30-L33 WeakPolarHBondContact O-CB 3.42Å; K30-L33 PolarHBondContact O-N 2.87Å; K30-F34 HydrophobicContact CB-CE2 4.49Å; K30-F34 PolarHBondContact O-N 3.2Å; K30-W151 HydrophobicContact CB-CZ3 3.97Å
31S96.6Very high96.5Very high1 Ų167.4 Ų67.41%0.00733%0.331CS..Hα-helixtrans-56.8-32.4172.362.70000113.1W28 K29 S35W28-S31 VanDerWaalsContact O-CB 3.31Å; W28-S31 WeakPolarHBondContact O-CB 3.42Å; W28-S31 PolarHBondContact O-N 3.12Å; W28-S31 VanDerWaalsContact O-N 3.16Å; W28-S31 PolarHBondContact O-OG 3.45Å; K29-S31 PolarHBondContact O-N 3.37Å; S31-S35 WeakPolarHBondContact O-CB 3.24Å; S31-S35 PolarHBondContact O-N 3.05Å; S31-S35 PolarHBondContact O-OG 3.08Å
32F97.5Very high96.6Very high117 Ų11767.3 Ų67.351%0.51333%0.33SS..Hα-helixtrans-67.3-42.7173.8-68.2-72000111.9W28 K29 K30 S35 A36 L148W28-F32 HydrophobicContact CE3-CE2 4.36Å; W28-F32 HydrophobicContact CH2-CE2 4.17Å; W28-F32 AromaticContact CZ3-CE2 3.6Å; W28-F32 HydrophobicContact CZ3-CE2 3.6Å; W28-F32 HydrophobicContact CZ3-CZ 4.2Å; K29-F32 HydrophobicContact CB-CD2 4.43Å; K29-F32 WeakPolarHBondContact O-CB 3.21Å; K29-F32 WeakPolarHBondContact O-CD2 3.41Å; K29-F32 PolarHBondContact O-N 3.07Å; K30-F32 PolarHBondContact O-N 3.02Å; F32-S35 PolarHBondContact O-N 3.1Å; F32-A36 WeakPolarHBondContact O-CB 3.41Å; F32-A36 PolarHBondContact O-N 2.82Å; F32-L148 HydrophobicContact CD1-CD2 3.61Å; F32-L148 HydrophobicContact CE1-CD2 3.86Å; F32-L148 HydrophobicContact CG-CD2 4.04Å; F32-L148 HydrophobicContact CZ-CD2 4.5Å
33L96.9Very high96.5Very high103 Ų10366.7 Ų66.754%0.53934%0.337SS..Hα-helixtrans-62.1-47.6175.7176.561.9000110.7K30 S35 A36 L37K30-L33 WeakPolarHBondContact O-CB 3.42Å; K30-L33 PolarHBondContact O-N 2.87Å; L33-S35 VanDerWaalsContact C-N 3.31Å; L33-S35 PolarHBondContact O-N 2.89Å; L33-A36 PolarHBondContact O-N 2.85Å; L33-L37 HydrophobicContact CD1-CD1 4.31Å; L33-L37 HydrophobicContact CD1-CG 4.27Å; L33-L37 HydrophobicContact CG-CD1 4.18Å; L33-L37 WeakPolarHBondContact O-CG 3.34Å; L33-L37 PolarHBondContact O-N 2.93Å
34F97.3Very high96.5Very high70 Ų7064.4 Ų64.431%0.30734%0.339SS..Hα-helixtrans-60.2-40.3175.9-64.7-26.4000112.4K30 L37 Y38 A119 L147 W151K30-F34 HydrophobicContact CB-CE2 4.49Å; K30-F34 PolarHBondContact O-N 3.2Å; F34-L37 PolarHBondContact O-N 3.29Å; F34-Y38 WeakPolarHBondContact O-CB 3.26Å; F34-Y38 PolarHBondContact O-N 3.43Å; F34-A119 HydrophobicContact CD2-CB 4.1Å; F34-A119 HydrophobicContact CE2-CB 4.26Å; F34-L147 HydrophobicContact CB-CD2 3.84Å; F34-W151 HydrophobicContact CD2-CH2 4.34Å; F34-W151 HydrophobicContact CD2-CZ2 4.49Å; F34-W151 AromaticContact CE2-CH2 3.66Å; F34-W151 HydrophobicContact CE2-CH2 3.66Å; F34-W151 HydrophobicContact CE2-CZ2 4.08Å; F34-W151 HydrophobicContact CE2-CZ3 4.27Å
35S97.4Very high96.4Very high9 Ų965 Ų656%0.06335%0.345CS..Hα-helixtrans-64.9-40.3175.7-620000112.6S31 F32 L33 Y38 A39 L148S31-S35 WeakPolarHBondContact O-CB 3.24Å; S31-S35 PolarHBondContact O-N 3.05Å; S31-S35 PolarHBondContact O-OG 3.08Å; F32-S35 PolarHBondContact O-N 3.1Å; L33-S35 VanDerWaalsContact C-N 3.31Å; L33-S35 PolarHBondContact O-N 2.89Å; S35-Y38 WeakPolarHBondContact O-CB 3.27Å; S35-Y38 PolarHBondContact O-N 3.29Å; S35-A39 WeakPolarHBondContact O-CB 3.5Å; S35-A39 PolarHBondContact O-N 3.4Å; S35-L148 WeakPolarHBondContact OG-CD2 3.29Å; S35-L148 WeakPolarHBondContact OG-CG 3.37Å
36A97.4Very high96.4Very high61 Ų6167.1 Ų67.150%0.50435%0.349SS..Hα-helixtrans-65.5-45.617600000111.6F32 L33 Y38 A39 A40F32-A36 WeakPolarHBondContact O-CB 3.41Å; F32-A36 PolarHBondContact O-N 2.82Å; L33-A36 PolarHBondContact O-N 2.85Å; A36-Y38 VanDerWaalsContact C-N 3.3Å; A36-Y38 PolarHBondContact O-N 2.89Å; A36-A39 PolarHBondContact O-N 3.23Å; A36-A40 WeakPolarHBondContact O-CB 3.07Å; A36-A40 PolarHBondContact O-N 2.86Å
37L97.1Very high96.3Very high103 Ų10367.1 Ų67.154%0.53934%0.343SS..Hα-helixtrans-60.9-41.1174.9-70.4174.8000111.5L33 F34 A40 F41L33-L37 HydrophobicContact CD1-CD1 4.31Å; L33-L37 HydrophobicContact CD1-CG 4.27Å; L33-L37 HydrophobicContact CG-CD1 4.18Å; L33-L37 WeakPolarHBondContact O-CG 3.34Å; L33-L37 PolarHBondContact O-N 2.93Å; F34-L37 PolarHBondContact O-N 3.29Å; L37-A40 PolarHBondContact O-N 3.07Å; L37-F41 VanDerWaalsContact O-CB 3.29Å; L37-F41 WeakPolarHBondContact O-CB 3.38Å; L37-F41 PolarHBondContact O-N 2.81Å
38Y97.5Very high96.2Very high9 Ų969.6 Ų69.64%0.03536%0.359CS..Hα-helixtrans-62.2-45.9175.9174.7-110.6000112.6F34 S35 A36 F41 I42 L122 T125 W140 M144F34-Y38 WeakPolarHBondContact O-CB 3.26Å; F34-Y38 PolarHBondContact O-N 3.43Å; S35-Y38 WeakPolarHBondContact O-CB 3.27Å; S35-Y38 PolarHBondContact O-N 3.29Å; A36-Y38 VanDerWaalsContact C-N 3.3Å; A36-Y38 PolarHBondContact O-N 2.89Å; Y38-F41 WeakPolarHBondContact O-CB 3.36Å; Y38-F41 PolarHBondContact O-N 3.23Å; Y38-I42 HydrophobicContact CD1-CD1 3.98Å; Y38-I42 HydrophobicContact CD2-CD1 4.44Å; Y38-I42 HydrophobicContact CE1-CD1 3.52Å; Y38-I42 HydrophobicContact CE2-CD1 4.03Å; Y38-I42 HydrophobicContact CE2-CG1 4.45Å; Y38-I42 HydrophobicContact CG-CD1 4.42Å; Y38-I42 WeakPolarHBondContact O-CG1 3.46Å; Y38-I42 PolarHBondContact O-N 3.12Å; Y38-L122 HydrophobicContact CD1-CD2 4.34Å; Y38-L122 HydrophobicContact CD2-CB 3.86Å; Y38-L122 HydrophobicContact CD2-CD1 4.14Å; Y38-L122 HydrophobicContact CD2-CD2 3.86Å; Y38-L122 HydrophobicContact CD2-CG 4.17Å; Y38-L122 HydrophobicContact CE1-CD2 4.38Å; Y38-L122 HydrophobicContact CE2-CB 4.06Å; Y38-L122 HydrophobicContact CE2-CD2 3.9Å; Y38-L122 HydrophobicContact CE2-CG 4.49Å; Y38-L122 HydrophobicContact CG-CD1 4.21Å; Y38-L122 HydrophobicContact CG-CD2 4.07Å; Y38-T125 HydrophobicContact CE2-CG2 3.86Å; Y38-T125 WeakPolarHBondContact CE2-OG1 3.33Å; Y38-T125 PolarHBondContact OH-OG1 3.45Å; Y38-W140 HydrophobicContact CE1-CB 4.26Å; Y38-W140 VanDerWaalsContact OH-CA 3.28Å; Y38-W140 WeakPolarHBondContact OH-CA 3.39Å; Y38-W140 WeakPolarHBondContact OH-CB 3.48Å; Y38-M144 HydrophobicContact CD1-CB 4.3Å; Y38-M144 HydrophobicContact CE1-CB 4.18Å
39A96.8Very high96.2Very high37 Ų3767.7 Ų67.731%0.30635%0.352SS..Hα-helixtrans-63.1-45175.300000111.8S35 A36 F41 I42 L43S35-A39 WeakPolarHBondContact O-CB 3.5Å; S35-A39 PolarHBondContact O-N 3.4Å; A36-A39 PolarHBondContact O-N 3.23Å; A39-F41 VanDerWaalsContact C-N 3.3Å; A39-F41 PolarHBondContact O-N 3.39Å; A39-I42 PolarHBondContact O-N 3.15Å; A39-L43 WeakPolarHBondContact O-CG 3.45Å; A39-L43 PolarHBondContact O-N 3.24Å
40A97Very high96.1Very high60 Ų6068.5 Ų68.550%0.49636%0.356SS..Hα-helixtrans-59.4-42.4175.100000111.5A36 L37 L43 G44A36-A40 WeakPolarHBondContact O-CB 3.07Å; A36-A40 PolarHBondContact O-N 2.86Å; L37-A40 PolarHBondContact O-N 3.07Å; A40-L43 PolarHBondContact O-N 3.12Å; A40-G44 PolarHBondContact O-N 3Å
41F96.3Very high96Very high70 Ų7074.4 Ų74.431%0.30738%0.375SS..Hα-helixtrans-61.8-44.3175.1170.2-94.7000112.1L37 Y38 A39 L43 G45 L126 V129L37-F41 VanDerWaalsContact O-CB 3.29Å; L37-F41 WeakPolarHBondContact O-CB 3.38Å; L37-F41 PolarHBondContact O-N 2.81Å; Y38-F41 WeakPolarHBondContact O-CB 3.36Å; Y38-F41 PolarHBondContact O-N 3.23Å; A39-F41 VanDerWaalsContact C-N 3.3Å; A39-F41 PolarHBondContact O-N 3.39Å; F41-L43 PolarHBondContact O-N 2.81Å; F41-G45 VanDerWaalsContact O-CA 3.24Å; F41-G45 WeakPolarHBondContact O-CA 3.39Å; F41-G45 PolarHBondContact O-N 3.35Å; F41-L126 HydrophobicContact CE1-CB 4.15Å; F41-L126 HydrophobicContact CE1-CD1 4.1Å; F41-L126 HydrophobicContact CE2-CD1 3.45Å; F41-L126 VanDerWaalsContact CE2-CD1 3.45Å; F41-L126 HydrophobicContact CZ-CB 4.06Å; F41-L126 HydrophobicContact CZ-CD1 3.19Å; F41-L126 HydrophobicContact CZ-CG 4.22Å; F41-V129 HydrophobicContact CE1-CB 4.25Å; F41-V129 HydrophobicContact CE1-CG2 4.21Å; F41-V129 HydrophobicContact CZ-CB 4.25Å; F41-V129 HydrophobicContact CZ-CG1 4.3Å
42I96.1Very high95.8Very high13 Ų1381.5 Ų81.57%0.06740%0.402CS..Hα-helixtrans-60.1-48.3177.2-71.3165.9000110.7Y38 A39 R46 T125 L135 W140Y38-I42 HydrophobicContact CD1-CD1 3.98Å; Y38-I42 HydrophobicContact CD2-CD1 4.44Å; Y38-I42 HydrophobicContact CE1-CD1 3.52Å; Y38-I42 HydrophobicContact CE2-CD1 4.03Å; Y38-I42 HydrophobicContact CE2-CG1 4.45Å; Y38-I42 HydrophobicContact CG-CD1 4.42Å; Y38-I42 WeakPolarHBondContact O-CG1 3.46Å; Y38-I42 PolarHBondContact O-N 3.12Å; A39-I42 PolarHBondContact O-N 3.15Å; I42-R46 VanDerWaalsContact O-CB 3.27Å; I42-R46 WeakPolarHBondContact O-CB 3.46Å; I42-R46 WeakPolarHBondContact O-CG 3.47Å; I42-R46 PolarHBondContact O-N 3.31Å; I42-R46 VanDerWaalsContact O-N 3.07Å; I42-T125 HydrophobicContact CD1-CG2 4.06Å; I42-T125 HydrophobicContact CG1-CG2 3.77Å; I42-L135 HydrophobicContact CD1-CD2 4.28Å; I42-L135 HydrophobicContact CG1-CD2 4.11Å; I42-L135 HydrophobicContact CG2-CD2 3.62Å; I42-W140 HydrophobicContact CD1-CB 3.73Å; I42-W140 HydrophobicContact CD1-CG 4.34Å
43L95.5Very high95.6Very high129 Ų12984 Ų8468%0.67542%0.415SS*.Hα-helixtrans-67.4-52.1-177.1-65.3174.7000111.4A39 A40 F41 R47A39-L43 WeakPolarHBondContact O-CG 3.45Å; A39-L43 PolarHBondContact O-N 3.24Å; A40-L43 PolarHBondContact O-N 3.12Å; F41-L43 PolarHBondContact O-N 2.81Å; L43-R47 PolarHBondContact O-N 3.16Å; L43-R47 VanDerWaalsContact O-N 3.12Å
44G95.7Very high95.4Very high34 Ų3485 Ų8535%0.35142%0.415SS..Hα-helixtrans-65.3-47.8179.500000112.3A40 R46 R47 V48A40-G44 PolarHBondContact O-N 3Å; G44-R46 PolarHBondContact O-N 3.12Å; G44-R47 WeakPolarHBondContact O-CB 3.17Å; G44-R47 PolarHBondContact O-N 2.88Å; G44-V48 WeakPolarHBondContact O-CG2 3.4Å; G44-V48 PolarHBondContact O-N 3.32Å
45G94Very high95.3Very high13 Ų1385.8 Ų85.813%0.13442%0.419CS..Hα-helixtrans-58.7-44.7178.400000112.1F41 R47 V48 M49F41-G45 VanDerWaalsContact O-CA 3.24Å; F41-G45 WeakPolarHBondContact O-CA 3.39Å; F41-G45 PolarHBondContact O-N 3.35Å; G45-R47 VanDerWaalsContact C-N 3.34Å; G45-R47 PolarHBondContact O-N 2.78Å; G45-V48 PolarHBondContact O-N 3.19Å; G45-M49 VanDerWaalsContact O-CB 3.26Å; G45-M49 WeakPolarHBondContact O-CB 3.42Å; G45-M49 WeakPolarHBondContact O-CG 3.34Å; G45-M49 PolarHBondContact O-N 2.86Å
46R94.1Very high95Very high141 Ų14191 Ų9153%0.53244%0.442SS..Hα-helixtrans-63.4-38.3174-72.9178.675.1-177.73.2112.2I42 G44 K50 V129I42-R46 VanDerWaalsContact O-CB 3.27Å; I42-R46 WeakPolarHBondContact O-CB 3.46Å; I42-R46 WeakPolarHBondContact O-CG 3.47Å; I42-R46 PolarHBondContact O-N 3.31Å; I42-R46 VanDerWaalsContact O-N 3.07Å; G44-R46 PolarHBondContact O-N 3.12Å; R46-K50 WeakPolarHBondContact O-CG 3.41Å; R46-K50 PolarHBondContact O-N 3.4Å; R46-V129 HydrophobicContact CG-CG1 4.34Å; R46-V129 HydrophobicContact CG-CG2 4.36Å
47R94.7Very high94.8Very high147 Ų14789.9 Ų89.956%0.55543%0.427SS*.Hα-helixtrans-66.7-44.3178.8-175.660.5171.1147.8-8.4112L43 G44 G45 K50L43-R47 PolarHBondContact O-N 3.16Å; L43-R47 VanDerWaalsContact O-N 3.12Å; G44-R47 WeakPolarHBondContact O-CB 3.17Å; G44-R47 PolarHBondContact O-N 2.88Å; G45-R47 VanDerWaalsContact C-N 3.34Å; G45-R47 PolarHBondContact O-N 2.78Å; R47-K50 PolarHBondContact O-N 3.05Å
48V95.6Very high94.5Very high76 Ų7691.8 Ų91.846%0.46143%0.428SS..Hα-helixtrans-66.2-47.4177.6172.90000110.6G44 G45 K50 R51G44-V48 WeakPolarHBondContact O-CG2 3.4Å; G44-V48 PolarHBondContact O-N 3.32Å; G45-V48 PolarHBondContact O-N 3.19Å; V48-K50 PolarHBondContact O-N 3.03Å; V48-R51 PolarHBondContact O-N 3.23Å; V48-R51 VanDerWaalsContact O-N 3.09Å
49M95.4Very high94.4Very high9 Ų9100.1 Ų100.14%0.04446%0.464CS..Hα-helixtrans-65.7-20.8-178.5-70.1-58.5-60.200113.3G45 R51 R52 E53 F55 V129 L130 K132G45-M49 VanDerWaalsContact O-CB 3.26Å; G45-M49 WeakPolarHBondContact O-CB 3.42Å; G45-M49 WeakPolarHBondContact O-CG 3.34Å; G45-M49 PolarHBondContact O-N 2.86Å; M49-R51 PolarHBondContact O-N 3.44Å; M49-R52 PolarHBondContact O-N 2.92Å; M49-R52 VanDerWaalsContact O-O 3.08Å; M49-R52 HydrophobicContact SD-CB 4.39Å; M49-E53 WeakPolarHBondContact CE-O 3.49Å; M49-F55 HydrophobicContact CE-CD2 3.72Å; M49-F55 HydrophobicContact CE-CE2 3.85Å; M49-F55 HydrophobicContact SD-CD2 4Å; M49-F55 HydrophobicContact SD-CE2 3.6Å; M49-F55 VanDerWaalsContact SD-CE2 3.6Å; M49-V129 HydrophobicContact CG-CG1 4.25Å; M49-L130 WeakPolarHBondContact CE-O 3.19Å; M49-L130 HydrophobicContact CG-CD2 4.44Å; M49-L130 HydrophobicContact SD-CD2 3.98Å; M49-K132 HydrophobicContact CE-CG 4.02Å; M49-K132 WeakPolarHBondContact O-CE 3.48Å; M49-K132 PolarHBondContact O-NZ 2.86Å; M49-K132 VanDerWaalsContact O-NZ 3.07Å
50K92.3Very high94.4Very high151 Ų151101.4 Ų101.466%0.65747%0.469SS*.THydrogen-bonded Turntrans-55.7-34171.7-81.1175.7-179.1-173.10112.5R46 R47 V48R46-K50 WeakPolarHBondContact O-CG 3.41Å; R46-K50 PolarHBondContact O-N 3.4Å; R47-K50 PolarHBondContact O-N 3.05Å; V48-K50 PolarHBondContact O-N 3.03Å
51R93.9Very high94.3Very high210 Ų21099.7 Ų99.779%0.79245%0.451SS*.THydrogen-bonded Turntrans-97.3-5.5-176.8-63.5-176.7176.8-179.2-1.3114.4V48 M49V48-R51 PolarHBondContact O-N 3.23Å; V48-R51 VanDerWaalsContact O-N 3.09Å; M49-R51 PolarHBondContact O-N 3.44Å
52R93Very high94.3Very high149 Ų14996.8 Ų96.856%0.56244%0.441SS*.SBendtrans-112.3162.2-178.1-65.3-168.3176-163.2-1110.9M49 K132M49-R52 PolarHBondContact O-N 2.92Å; M49-R52 VanDerWaalsContact O-O 3.08Å; M49-R52 HydrophobicContact SD-CB 4.39Å; R52-K132 WeakPolarHBondContact O-CE 3.38Å; R52-K132 PolarHBondContact O-NZ 3.41Å
53E92.8Very high94.3Very high171 Ų171101.7 Ų101.780%0.79947%0.466SS*.PPolyproline II helixtrans-73.9165.8170-62.8-166.8152.500111.8M49M49-E53 WeakPolarHBondContact CE-O 3.49Å
54K94.4Very high94.4Very high124 Ų12499.1 Ų99.154%0.53945%0.448SS..PPolyproline II helixtrans-69.2142.1174.962.7177.8-178162.90109.4E56 K132K54-E56 VanDerWaalsContact CE-OE1 3.23Å; K54-E56 WeakPolarHBondContact CE-OE1 3.3Å; K54-E56 IonicContact NZ-OE1 2.62Å; K54-E56 PolarHBondContact NZ-OE1 2.92Å; K54-K132 HydrophobicContact CB-CB 4.33Å; K54-K132 HydrophobicContact CB-CD 4.18Å; K54-K132 HydrophobicContact CB-CG 4.17Å
55F93.4Very high94.5Very high85 Ų8597.7 Ų97.737%0.37343%0.432SS..PPolyproline II helixtrans-85.1139.4172.3-67.6-79.9000111.4M49 L57 L130M49-F55 HydrophobicContact CE-CD2 3.72Å; M49-F55 HydrophobicContact CE-CE2 3.85Å; M49-F55 HydrophobicContact SD-CD2 4Å; M49-F55 HydrophobicContact SD-CE2 3.6Å; M49-F55 VanDerWaalsContact SD-CE2 3.6Å; F55-L57 HydrophobicContact CB-CD1 4.03Å; F55-L57 HydrophobicContact CB-CD2 4.18Å; F55-L57 HydrophobicContact CB-CG 3.72Å; F55-L57 PolarHBondContact O-N 3.32Å; F55-L57 VanDerWaalsContact O-N 3.15Å; F55-L130 HydrophobicContact CD2-CB 4.07Å; F55-L130 HydrophobicContact CD2-CD2 4.12Å; F55-L130 HydrophobicContact CE2-CD2 4.14Å; F55-L130 PolarHBondContact N-O 3.21Å; F55-L130 VanDerWaalsContact N-O 3.08Å
56E92.6Very high94.7Very high119 Ų119101.4 Ų101.456%0.55645%0.449SS*.  trans-87.374.2174-70.4-60.9149.400110.9K54 R58K54-E56 VanDerWaalsContact CE-OE1 3.23Å; K54-E56 WeakPolarHBondContact CE-OE1 3.3Å; K54-E56 IonicContact NZ-OE1 2.62Å; K54-E56 PolarHBondContact NZ-OE1 2.92Å; E56-R58 VanDerWaalsContact C-N 3.32Å; E56-R58 PolarHBondContact O-N 2.93Å
57L93Very high94.9Very high37 Ų3798.7 Ų98.719%0.19445%0.448CS..  trans-9230.4-176.1-59.9175.9000113.8F55 P60 L61 F127 L130 R131F55-L57 HydrophobicContact CB-CD1 4.03Å; F55-L57 HydrophobicContact CB-CD2 4.18Å; F55-L57 HydrophobicContact CB-CG 3.72Å; F55-L57 PolarHBondContact O-N 3.32Å; F55-L57 VanDerWaalsContact O-N 3.15Å; L57-P60 WeakPolarHBondContact O-CD 3.49Å; L57-L61 WeakPolarHBondContact O-CB 3.2Å; L57-L61 PolarHBondContact O-N 3.44Å; L57-F127 HydrophobicContact CB-CD1 3.99Å; L57-F127 HydrophobicContact CB-CE1 4.15Å; L57-F127 HydrophobicContact CD1-CD1 4.01Å; L57-F127 HydrophobicContact CD1-CE1 4.33Å; L57-L130 HydrophobicContact CD1-CB 3.68Å; L57-L130 HydrophobicContact CD1-CD1 3.74Å; L57-L130 HydrophobicContact CD1-CG 4.39Å; L57-R131 HydrophobicContact CB-CG 4.16Å; L57-R131 HydrophobicContact CD1-CG 4.4Å
58R91.1Very high95.1Very high144 Ų14492.3 Ų92.354%0.54343%0.425SS..Hα-helixtrans-62.4-47.9-175.5-83-175.5166.7173.4-1.5113.5E56 L61 A62E56-R58 VanDerWaalsContact C-N 3.32Å; E56-R58 PolarHBondContact O-N 2.93Å; R58-L61 PolarHBondContact O-N 3.4Å; R58-A62 WeakPolarHBondContact O-CB 3.47Å; R58-A62 PolarHBondContact O-N 3.23Å
59K94.2Very high95.2Very high183 Ų18388.8 Ų88.880%0.79640%0.403SS*.Hα-helixtrans-66.1-48-179.3-57179.7-179.8-179.90111.9L61 A62 L63K59-L61 VanDerWaalsContact C-N 3.32Å; K59-L61 PolarHBondContact O-N 3.05Å; K59-A62 PolarHBondContact O-N 2.93Å; K59-L63 PolarHBondContact O-N 3.03Å
60P96.3Very high95.3Very high64 Ų6491.5 Ų91.542%0.41642%0.42SS..Hα-helixtrans-60.8-39.5174.9-25.136000112.9L57 L63 W64 F127L57-P60 WeakPolarHBondContact O-CD 3.49Å; P60-L63 PolarHBondContact O-N 3.19Å; P60-W64 WeakPolarHBondContact O-CB 3.29Å; P60-W64 PolarHBondContact O-N 3.29Å; P60-F127 HydrophobicContact CB-CE1 4Å; P60-F127 HydrophobicContact CB-CZ 4.3Å
61L95.5Very high95.6Very high24 Ų2486.6 Ų86.613%0.12640%0.399CS..Hα-helixtrans-63.3-41.6175.4176.662.1000112L57 R58 K59 W64 S65 F127 A183L57-L61 WeakPolarHBondContact O-CB 3.2Å; L57-L61 PolarHBondContact O-N 3.44Å; R58-L61 PolarHBondContact O-N 3.4Å; K59-L61 VanDerWaalsContact C-N 3.32Å; K59-L61 PolarHBondContact O-N 3.05Å; L61-W64 PolarHBondContact O-N 3.4Å; L61-S65 WeakPolarHBondContact O-CB 3.21Å; L61-S65 PolarHBondContact O-N 3.04Å; L61-S65 PolarHBondContact O-OG 3.41Å; L61-S65 VanDerWaalsContact O-OG 3.12Å; L61-F127 HydrophobicContact CB-CD1 4Å; L61-F127 HydrophobicContact CB-CE1 4.15Å; L61-F127 HydrophobicContact CB-CG 4.42Å; L61-F127 HydrophobicContact CD1-CB 4.01Å; L61-F127 HydrophobicContact CD1-CD1 4.26Å; L61-F127 HydrophobicContact CD1-CD2 3.93Å; L61-F127 HydrophobicContact CD1-CE2 4.5Å; L61-F127 HydrophobicContact CD1-CG 3.8Å; L61-A183 HydrophobicContact CD2-CB 4.32Å; L61-A183 HydrophobicContact CG-CB 4.11Å
62A96.2Very high95.8Very high10 Ų1076.7 Ų76.78%0.08336%0.362CS..Hα-helixtrans-62.1-46.9177.200000111.6R58 K59 L66 A183 V184R58-A62 WeakPolarHBondContact O-CB 3.47Å; R58-A62 PolarHBondContact O-N 3.23Å; K59-A62 PolarHBondContact O-N 2.93Å; A62-L66 VanDerWaalsContact O-CB 3.24Å; A62-L66 WeakPolarHBondContact O-CB 3.33Å; A62-L66 PolarHBondContact O-N 2.94Å; A62-A183 HydrophobicContact CB-CB 3.68Å; A62-V184 HydrophobicContact CB-CG1 3.71Å
63L97.3Very high96Very high116 Ų11673.1 Ų73.161%0.60735%0.353SS*.Hα-helixtrans-61.8-46.4176.2179.760.9000111.2K59 P60 L66 T67K59-L63 PolarHBondContact O-N 3.03Å; P60-L63 PolarHBondContact O-N 3.19Å; L63-L66 PolarHBondContact O-N 3.27Å; L63-T67 PolarHBondContact O-N 2.88Å; L63-T67 PolarHBondContact O-OG1 3.15Å; L63-T67 VanDerWaalsContact O-OG1 3.08Å
64W97.8Very high96.2Very high75 Ų7570 Ų7028%0.28434%0.337SS..Hα-helixtrans-57.6-52.4177.5177.4-96.3000112.5P60 L61 L66 T67 L68 P120 D124 F127P60-W64 WeakPolarHBondContact O-CB 3.29Å; P60-W64 PolarHBondContact O-N 3.29Å; L61-W64 PolarHBondContact O-N 3.4Å; W64-L66 VanDerWaalsContact C-N 3.3Å; W64-L66 PolarHBondContact O-N 2.66Å; W64-T67 PolarHBondContact O-N 2.66Å; W64-L68 HydrophobicContact CZ2-CD1 4.09Å; W64-L68 PolarHBondContact O-N 2.83Å; W64-L68 VanDerWaalsContact O-N 3.07Å; W64-P120 HydrophobicContact CH2-CB 4.11Å; W64-P120 WeakPolarHBondContact CH2-O 3.28Å; W64-P120 WeakPolarHBondContact CZ2-O 3.23Å; W64-D124 PolarHBondContact NE1-OD1 3.19Å; W64-F127 HydrophobicContact CB-CE2 3.81Å; W64-F127 HydrophobicContact CB-CZ 4.03Å; W64-F127 AromaticContact CD1-CE2 3.7Å; W64-F127 AromaticContact CD2-CE2 3.9Å; W64-F127 HydrophobicContact CD2-CE2 3.9Å; W64-F127 HydrophobicContact CG-CD2 4.33Å; W64-F127 AromaticContact CG-CE2 3.51Å; W64-F127 HydrophobicContact CG-CE2 3.51Å; W64-F127 HydrophobicContact CG-CZ 4.2Å
65S97.5Very high96.3Very high3 Ų364 Ų642%0.02131%0.311CS..Hα-helixtrans-63-36.1177-640000112L61 A69L61-S65 WeakPolarHBondContact O-CB 3.21Å; L61-S65 PolarHBondContact O-N 3.04Å; L61-S65 PolarHBondContact O-OG 3.41Å; L61-S65 VanDerWaalsContact O-OG 3.12Å; S65-A69 VanDerWaalsContact O-CB 3.28Å; S65-A69 WeakPolarHBondContact O-CB 3.36Å; S65-A69 PolarHBondContact O-N 3.04Å
66L97.8Very high96.5Very high92 Ų9260.7 Ų60.748%0.48230%0.299SS..Hα-helixtrans-65.9-43.9176.4-179.262.5000111.5A62 L63 W64 L68 A69 V70 A180A62-L66 VanDerWaalsContact O-CB 3.24Å; A62-L66 WeakPolarHBondContact O-CB 3.33Å; A62-L66 PolarHBondContact O-N 2.94Å; L63-L66 PolarHBondContact O-N 3.27Å; W64-L66 VanDerWaalsContact C-N 3.3Å; W64-L66 PolarHBondContact O-N 2.66Å; L66-L68 PolarHBondContact O-N 3.19Å; L66-A69 WeakPolarHBondContact O-CB 3.32Å; L66-A69 PolarHBondContact O-N 3.48Å; L66-V70 HydrophobicContact CD1-CG2 4.25Å; L66-V70 HydrophobicContact CG-CG2 4.49Å; L66-V70 WeakPolarHBondContact O-CG2 3.33Å; L66-V70 PolarHBondContact O-N 3.46Å; L66-A180 HydrophobicContact CB-CB 4.25Å
67T98.1Very high96.7Very high84 Ų8459 Ų5952%0.51530%0.297SS..Hα-helixtrans-59.6-46.8176.4-60.90000111.3L63 W64 A69 V70 F71L63-T67 PolarHBondContact O-N 2.88Å; L63-T67 PolarHBondContact O-OG1 3.15Å; L63-T67 VanDerWaalsContact O-OG1 3.08Å; W64-T67 PolarHBondContact O-N 2.66Å; T67-A69 VanDerWaalsContact C-N 3.32Å; T67-A69 PolarHBondContact O-N 2.95Å; T67-V70 PolarHBondContact O-N 3.06Å; T67-F71 WeakPolarHBondContact O-CB 3.21Å; T67-F71 PolarHBondContact O-N 2.57Å
68L98.1Very high96.7Very high13 Ų1357.4 Ų57.47%0.06829%0.288CS..Hα-helixtrans-66.4-33.8176.8-67.7178.3000112.4W64 L66 S72 E121 Y176W64-L68 HydrophobicContact CZ2-CD1 4.09Å; W64-L68 PolarHBondContact O-N 2.83Å; W64-L68 VanDerWaalsContact O-N 3.07Å; L66-L68 PolarHBondContact O-N 3.19Å; L68-S72 VanDerWaalsContact O-CB 3.23Å; L68-S72 WeakPolarHBondContact O-CB 3.23Å; L68-S72 PolarHBondContact O-N 2.84Å; L68-S72 PolarHBondContact O-OG 2.97Å; L68-E121 HydrophobicContact CD2-CG 4.44Å; L68-Y176 HydrophobicContact CB-CD1 3.9Å; L68-Y176 HydrophobicContact CB-CD2 3.71Å; L68-Y176 HydrophobicContact CB-CE1 4.11Å; L68-Y176 HydrophobicContact CB-CE2 3.92Å; L68-Y176 HydrophobicContact CB-CG 3.72Å; L68-Y176 HydrophobicContact CD1-CD1 4.06Å; L68-Y176 HydrophobicContact CD1-CE1 3.47Å; L68-Y176 VanDerWaalsContact CD1-CE1 3.47Å; L68-Y176 HydrophobicContact CD1-CE2 4.05Å; L68-Y176 VanDerWaalsContact CD1-CZ 3.48Å; L68-Y176 HydrophobicContact CG-CE1 4.45Å
69A98.1Very high96.9Very high2 Ų250.6 Ų50.62%0.01726%0.263CS..Hα-helixtrans-64.3-50.9173.900000111.3S65 L66 T67 S72 I73S65-A69 VanDerWaalsContact O-CB 3.28Å; S65-A69 WeakPolarHBondContact O-CB 3.36Å; S65-A69 PolarHBondContact O-N 3.04Å; L66-A69 WeakPolarHBondContact O-CB 3.32Å; L66-A69 PolarHBondContact O-N 3.48Å; T67-A69 VanDerWaalsContact C-N 3.32Å; T67-A69 PolarHBondContact O-N 2.95Å; A69-S72 PolarHBondContact O-N 3.41Å; A69-I73 WeakPolarHBondContact O-CB 3.34Å; A69-I73 WeakPolarHBondContact O-CD1 3.4Å; A69-I73 WeakPolarHBondContact O-CG1 3.47Å; A69-I73 PolarHBondContact O-N 3.1Å
70V98.3Very high96.9Very high65 Ų6542.7 Ų42.739%0.39423%0.234SC..Hα-helixtrans-59.1-51.2178.7171.30000110.3L66 T67 S72 I73 F74L66-V70 HydrophobicContact CD1-CG2 4.25Å; L66-V70 HydrophobicContact CG-CG2 4.49Å; L66-V70 WeakPolarHBondContact O-CG2 3.33Å; L66-V70 PolarHBondContact O-N 3.46Å; T67-V70 PolarHBondContact O-N 3.06Å; V70-S72 VanDerWaalsContact C-N 3.27Å; V70-S72 PolarHBondContact O-N 2.89Å; V70-I73 PolarHBondContact O-N 3.46Å; V70-F74 HydrophobicContact CG1-CD2 3.71Å; V70-F74 HydrophobicContact CG1-CE2 3.68Å; V70-F74 VanDerWaalsContact O-CD2 3.29Å; V70-F74 WeakPolarHBondContact O-CD2 3.46Å; V70-F74 PolarHBondContact O-N 3.31Å
71F98.2Very high96.7Very high48 Ų4841.1 Ų41.121%0.21122%0.224CC..Hα-helixtrans-52-47.2175171.4-108000111.9T67 G75 W110 A113 S117 Y169T67-F71 WeakPolarHBondContact O-CB 3.21Å; T67-F71 PolarHBondContact O-N 2.57Å; F71-G75 PolarHBondContact O-N 3.46Å; F71-W110 HydrophobicContact CD2-CZ3 4.23Å; F71-W110 HydrophobicContact CE2-CZ3 4.17Å; F71-A113 HydrophobicContact CE2-CB 3.92Å; F71-A113 HydrophobicContact CZ-CB 4.04Å; F71-S117 VanDerWaalsContact CE1-CB 3.41Å; F71-Y169 HydrophobicContact CD1-CE1 4.12Å; F71-Y169 AromaticContact CE1-CE1 3.55Å; F71-Y169 HydrophobicContact CE1-CE1 3.55Å; F71-Y169 AromaticContact CZ-CE1 3.82Å; F71-Y169 HydrophobicContact CZ-CE1 3.82Å; F71-Y169 VanDerWaalsContact CZ-OH 3.25Å; F71-Y169 WeakPolarHBondContact CZ-OH 3.45Å
72S98.2Very high96.6Very high2 Ų240.9 Ų40.91%0.01422%0.222CC..Hα-helixtrans-71.6-33.5-177.7-54.90000113.2L68 A69 V70 A76L68-S72 VanDerWaalsContact O-CB 3.23Å; L68-S72 WeakPolarHBondContact O-CB 3.23Å; L68-S72 PolarHBondContact O-N 2.84Å; L68-S72 PolarHBondContact O-OG 2.97Å; A69-S72 PolarHBondContact O-N 3.41Å; V70-S72 VanDerWaalsContact C-N 3.27Å; V70-S72 PolarHBondContact O-N 2.89Å; S72-A76 WeakPolarHBondContact O-CB 3.3Å; S72-A76 PolarHBondContact O-N 3.19Å
73I98.2Very high96.4Very high74 Ų7440.9 Ų40.938%0.37922%0.22SC..Hα-helixtrans-64.7-49.7175.6-71.7162.7000109.8A69 V70 A76 V77 A173A69-I73 WeakPolarHBondContact O-CB 3.34Å; A69-I73 WeakPolarHBondContact O-CD1 3.4Å; A69-I73 WeakPolarHBondContact O-CG1 3.47Å; A69-I73 PolarHBondContact O-N 3.1Å; V70-I73 PolarHBondContact O-N 3.46Å; I73-A76 PolarHBondContact O-N 3.11Å; I73-V77 WeakPolarHBondContact O-CG2 3.39Å; I73-V77 PolarHBondContact O-N 3.27Å; I73-A173 HydrophobicContact CB-CB 4.47Å; I73-A173 HydrophobicContact CG1-CB 3.7Å
74F96.5Very high96.2Very high105 Ų10538 Ų3846%0.46121%0.207SC..Hα-helixtrans-62-45.9177.4-80.7-79.6000111.1V70 A76 V77 R78 W110V70-F74 HydrophobicContact CG1-CD2 3.71Å; V70-F74 HydrophobicContact CG1-CE2 3.68Å; V70-F74 VanDerWaalsContact O-CD2 3.29Å; V70-F74 WeakPolarHBondContact O-CD2 3.46Å; V70-F74 PolarHBondContact O-N 3.31Å; F74-A76 PolarHBondContact O-N 3.45Å; F74-V77 PolarHBondContact O-N 2.95Å; F74-R78 WeakPolarHBondContact O-CB 2.99Å; F74-R78 VanDerWaalsContact O-CG 3.23Å; F74-R78 WeakPolarHBondContact O-CG 3.26Å; F74-R78 PolarHBondContact O-N 3.08Å; F74-W110 HydrophobicContact CB-CH2 3.38Å; F74-W110 HydrophobicContact CB-CZ2 4.01Å; F74-W110 HydrophobicContact CB-CZ3 4.01Å; F74-W110 HydrophobicContact CG-CH2 4.43Å
75G96.8Very high95.9Very high0 Ų039.2 Ų39.20%021%0.212CC..Hα-helixtrans-55.1-49.517400000112.4F71 V77 R78 T79F71-G75 PolarHBondContact O-N 3.46Å; G75-V77 PolarHBondContact O-N 3.22Å; G75-R78 PolarHBondContact O-N 3.19Å; G75-T79 WeakPolarHBondContact O-CB 3.46Å; G75-T79 WeakPolarHBondContact O-CG2 3.39Å; G75-T79 PolarHBondContact O-N 3.43Å; G75-T79 PolarHBondContact O-OG1 2.64Å; G75-T79 VanDerWaalsContact O-OG1 3.04Å
76A97.1Very high95.6Very high15 Ų1539.3 Ų39.312%0.12421%0.213CC..Hα-helixtrans-61.8-41.9-179.800000112.8S72 I73 F74 G80 L170S72-A76 WeakPolarHBondContact O-CB 3.3Å; S72-A76 PolarHBondContact O-N 3.19Å; I73-A76 PolarHBondContact O-N 3.11Å; F74-A76 PolarHBondContact O-N 3.45Å; A76-G80 WeakPolarHBondContact O-CA 3.16Å; A76-G80 PolarHBondContact O-N 3.31Å; A76-L170 HydrophobicContact CB-CB 4.37Å
77V95.8Very high95.4Very high83 Ų8337.8 Ų37.850%0.50321%0.205SC..Hα-helixtrans-66.2-46.5178.5170.40000110.5I73 F74 G75 S81I73-V77 WeakPolarHBondContact O-CG2 3.39Å; I73-V77 PolarHBondContact O-N 3.27Å; F74-V77 PolarHBondContact O-N 2.95Å; G75-V77 PolarHBondContact O-N 3.22Å; V77-S81 VanDerWaalsContact O-CB 3.28Å; V77-S81 WeakPolarHBondContact O-CB 3.45Å; V77-S81 PolarHBondContact O-N 2.81Å; V77-S81 PolarHBondContact O-OG 2.97Å
78R93.9Very high95.1Very high4 Ų439.9 Ų39.92%0.01521%0.21CC..Hα-helixtrans-70.2-53.1-176.1-62.8-61.6-70.3169.9-1.1111.4A5 Q7 E12 F74 G75 S81 Y82 V106 W110A5-R78 PolarHBondContact O-NH1 3.38Å; Q7-R78 PolarHBondContact O-NH1 3.46Å; Q7-R78 PolarHBondContact O-NH2 3.43Å; E12-R78 IonicContact OE1-CZ 2.76Å; E12-R78 IonicContact OE1-NE 3.71Å; E12-R78 PolarHBondContact OE1-NE 3.05Å; E12-R78 IonicContact OE1-NH2 2.91Å; E12-R78 PolarHBondContact OE1-NH2 3.31Å; E12-R78 IonicContact OE2-CZ 3.73Å; E12-R78 IonicContact OE2-NE 3.3Å; E12-R78 IonicContact OE2-NH2 3.91Å; E12-R78 PolarHBondContact OE2-NH2 3.26Å; F74-R78 WeakPolarHBondContact O-CB 2.99Å; F74-R78 VanDerWaalsContact O-CG 3.23Å; F74-R78 WeakPolarHBondContact O-CG 3.26Å; F74-R78 PolarHBondContact O-N 3.08Å; G75-R78 PolarHBondContact O-N 3.19Å; R78-S81 PolarHBondContact O-N 3.16Å; R78-Y82 PolarHBondContact O-N 3.06Å; R78-V106 HydrophobicContact CB-CG1 3.89Å; R78-W110 HydrophobicContact CB-CD2 4.37Å; R78-W110 HydrophobicContact CB-CG 4.23Å; R78-W110 HydrophobicContact CG-CZ2 3.94Å
79T95.2Very high94.8Very high0 Ų043 Ų430%023%0.23CC..Hα-helixtrans-70.7-35179.973.60000111.8G75 Y82 M83 F101 W110 T166 Y169G75-T79 WeakPolarHBondContact O-CB 3.46Å; G75-T79 WeakPolarHBondContact O-CG2 3.39Å; G75-T79 PolarHBondContact O-N 3.43Å; G75-T79 PolarHBondContact O-OG1 2.64Å; G75-T79 VanDerWaalsContact O-OG1 3.04Å; T79-Y82 PolarHBondContact O-N 3.26Å; T79-M83 WeakPolarHBondContact O-CB 2.97Å; T79-M83 VanDerWaalsContact O-CG 3.24Å; T79-M83 WeakPolarHBondContact O-CG 3.34Å; T79-M83 PolarHBondContact O-N 3.07Å; T79-F101 HydrophobicContact CG2-CE2 4.27Å; T79-F101 HydrophobicContact CG2-CZ 3.7Å; T79-W110 HydrophobicContact CG2-CB 3.55Å; T79-W110 HydrophobicContact CG2-CG 4.22Å; T79-T166 VanDerWaalsContact CB-OG1 3.28Å; T79-T166 WeakPolarHBondContact CB-OG1 3.28Å; T79-T166 WeakPolarHBondContact OG1-CA 3.29Å; T79-T166 WeakPolarHBondContact OG1-CB 3.41Å; T79-T166 PolarHBondContact OG1-OG1 3.02Å; T79-Y169 HydrophobicContact CG2-CD2 4.21Å; T79-Y169 HydrophobicContact CG2-CE2 4.2Å
80G94.6Very high94.4Very high18 Ų1848.2 Ų48.219%0.18625%0.252CS..Hα-helixtrans-64.6-39.6176.100000113A76 T84A76-G80 WeakPolarHBondContact O-CA 3.16Å; A76-G80 PolarHBondContact O-N 3.31Å; G80-T84 VanDerWaalsContact O-CB 3.27Å; G80-T84 WeakPolarHBondContact O-CB 3.46Å; G80-T84 PolarHBondContact O-N 2.89Å; G80-T84 PolarHBondContact O-OG1 3.17Å
81S92.8Very high94.2Very high31 Ų3146.5 Ų46.522%0.21725%0.247CC..Hα-helixtrans-65.4-43.4175.1-590000111.3A5 V77 R78 T84 Y85A5-S81 WeakPolarHBondContact CB-OG 3.5Å; V77-S81 VanDerWaalsContact O-CB 3.28Å; V77-S81 WeakPolarHBondContact O-CB 3.45Å; V77-S81 PolarHBondContact O-N 2.81Å; V77-S81 PolarHBondContact O-OG 2.97Å; R78-S81 PolarHBondContact O-N 3.16Å; S81-T84 PolarHBondContact O-N 3.31Å; S81-Y85 WeakPolarHBondContact O-CB 3.23Å; S81-Y85 PolarHBondContact O-N 2.87Å
82Y92.1Very high93.9Very high19 Ų1948.2 Ų48.28%0.07526%0.258CS..Hα-helixtrans-63.1-47.9176.4-174.1-101.1000112.6L6 R78 T79 T84 Y85 I86 S100 F101 S107L6-Y82 HydrophobicContact CD2-CD2 4.48Å; R78-Y82 PolarHBondContact O-N 3.06Å; T79-Y82 PolarHBondContact O-N 3.26Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 2.91Å; Y82-Y85 WeakPolarHBondContact O-CB 3.46Å; Y82-Y85 PolarHBondContact O-N 3.24Å; Y82-I86 HydrophobicContact CD1-CD1 3.83Å; Y82-I86 HydrophobicContact CE1-CD1 3.2Å; Y82-I86 HydrophobicContact CE1-CG1 4.23Å; Y82-I86 HydrophobicContact CE2-CD1 4.36Å; Y82-I86 PolarHBondContact O-N 3.39Å; Y82-S100 PolarHBondContact OH-O 3.22Å; Y82-S100 PolarHBondContact OH-OG 3.39Å; Y82-F101 AromaticContact CD1-CD2 3.77Å; Y82-F101 HydrophobicContact CD1-CD2 3.77Å; Y82-F101 HydrophobicContact CD1-CE2 4.25Å; Y82-F101 HydrophobicContact CE1-CB 4.42Å; Y82-F101 HydrophobicContact CE1-CD2 4.02Å; Y82-S107 WeakPolarHBondContact CE1-OG 3.49Å
83M93.3Very high93.7Very high9 Ų951.8 Ų51.84%0.04427%0.274CS..Hα-helixtrans-62.9-40.5177.8-72.3-58.2-6200112T79 Y85 I86 L87 S95 F101 W163 T166T79-M83 WeakPolarHBondContact O-CB 2.97Å; T79-M83 VanDerWaalsContact O-CG 3.24Å; T79-M83 WeakPolarHBondContact O-CG 3.34Å; T79-M83 PolarHBondContact O-N 3.07Å; M83-Y85 VanDerWaalsContact C-N 3.34Å; M83-I86 PolarHBondContact O-N 3.11Å; M83-L87 VanDerWaalsContact O-CB 3.25Å; M83-L87 WeakPolarHBondContact O-CB 3.45Å; M83-L87 PolarHBondContact O-N 2.8Å; M83-S95 WeakPolarHBondContact CE-O 3.46Å; M83-F101 HydrophobicContact CG-CD2 4.23Å; M83-F101 HydrophobicContact CG-CE2 3.88Å; M83-F101 HydrophobicContact SD-CD2 3.5Å; M83-F101 WeakPolarHBondContact SD-CD2 3.31Å; M83-F101 HydrophobicContact SD-CE2 3.76Å; M83-W163 HydrophobicContact CE-CD2 3.91Å; M83-W163 HydrophobicContact CE-CG 3.73Å; M83-W163 HydrophobicContact CE-CZ2 4.47Å; M83-T166 HydrophobicContact CG-CG2 4.25Å; M83-T166 WeakPolarHBondContact CG-OG1 3.28Å
84T92.8Very high93.3Very high55 Ų5551.7 Ų51.734%0.33727%0.272SS..Hα-helixtrans-63.1-42.9176.2-57.70000111.1M1 G80 S81 Y82 L87 M88M1-T84 HydrophobicContact SD-CG2 3.91Å; G80-T84 VanDerWaalsContact O-CB 3.27Å; G80-T84 WeakPolarHBondContact O-CB 3.46Å; G80-T84 PolarHBondContact O-N 2.89Å; G80-T84 PolarHBondContact O-OG1 3.17Å; S81-T84 PolarHBondContact O-N 3.31Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 2.91Å; T84-L87 PolarHBondContact O-N 2.89Å; T84-M88 HydrophobicContact CG2-CE 3.69Å; T84-M88 HydrophobicContact CG2-CG 4.33Å; T84-M88 HydrophobicContact CG2-SD 3.91Å; T84-M88 WeakPolarHBondContact O-CB 3.47Å; T84-M88 WeakPolarHBondContact O-CG 3.28Å; T84-M88 PolarHBondContact O-N 2.76Å
85Y91.2Very high93.2Very high101 Ų10147 Ų4740%0.39625%0.252SS..Hα-helixtrans-59.2-49.8175.9171.6-99.5000111.8L6 S81 Y82 M83 L87 M88 T89L6-Y85 HydrophobicContact CD1-CD1 4.46Å; L6-Y85 HydrophobicContact CD1-CD2 3.61Å; L6-Y85 HydrophobicContact CD1-CE2 4.26Å; L6-Y85 HydrophobicContact CD1-CG 3.73Å; S81-Y85 WeakPolarHBondContact O-CB 3.23Å; S81-Y85 PolarHBondContact O-N 2.87Å; Y82-Y85 WeakPolarHBondContact O-CB 3.46Å; Y82-Y85 PolarHBondContact O-N 3.24Å; M83-Y85 VanDerWaalsContact C-N 3.34Å; Y85-L87 VanDerWaalsContact C-N 3.35Å; Y85-L87 PolarHBondContact O-N 2.95Å; Y85-M88 PolarHBondContact O-N 3.06Å; Y85-T89 HydrophobicContact CD2-CG2 3.98Å; Y85-T89 HydrophobicContact CE2-CG2 3.69Å; Y85-T89 WeakPolarHBondContact O-CB 3.44Å; Y85-T89 WeakPolarHBondContact O-CG2 3.38Å; Y85-T89 PolarHBondContact O-N 2.97Å; Y85-T89 PolarHBondContact O-OG1 3.42Å
86I91.3Very high93.1Very high5 Ų547.1 Ų47.13%0.02625%0.252CS..Hα-helixtrans-62.6-44.2177.8-65.2178000110.8Y82 M83 M88 T89 K90 G91Y82-I86 HydrophobicContact CD1-CD1 3.83Å; Y82-I86 HydrophobicContact CE1-CD1 3.2Å; Y82-I86 HydrophobicContact CE1-CG1 4.23Å; Y82-I86 HydrophobicContact CE2-CD1 4.36Å; Y82-I86 PolarHBondContact O-N 3.39Å; M83-I86 PolarHBondContact O-N 3.11Å; I86-M88 VanDerWaalsContact C-N 3.32Å; I86-M88 PolarHBondContact O-N 2.82Å; I86-T89 PolarHBondContact O-N 3.31Å; I86-K90 HydrophobicContact CG2-CB 4.25Å; I86-K90 HydrophobicContact CG2-CD 4.35Å; I86-K90 HydrophobicContact CG2-CG 4.47Å; I86-K90 WeakPolarHBondContact O-CA 3.21Å; I86-K90 PolarHBondContact O-N 2.97Å; I86-G91 PolarHBondContact O-N 3.45Å
87L93.1Very high92.8Very high61 Ų6146.5 Ų46.532%0.31925%0.248SC..Hα-helixtrans-60.2-42.4179.9-178.961.9000111.9M83 T84 Y85 G91 L92 W163M83-L87 VanDerWaalsContact O-CB 3.25Å; M83-L87 WeakPolarHBondContact O-CB 3.45Å; M83-L87 PolarHBondContact O-N 2.8Å; T84-L87 PolarHBondContact O-N 2.89Å; Y85-L87 VanDerWaalsContact C-N 3.35Å; Y85-L87 PolarHBondContact O-N 2.95Å; L87-G91 VanDerWaalsContact O-CA 3.22Å; L87-G91 WeakPolarHBondContact O-CA 3.45Å; L87-G91 PolarHBondContact O-N 3.2Å; L87-L92 HydrophobicContact CD1-CB 4.04Å; L87-L92 HydrophobicContact CD1-CD1 3.94Å; L87-W163 HydrophobicContact CD1-CZ2 4.38Å; L87-W163 HydrophobicContact CD2-CH2 4.05Å; L87-W163 HydrophobicContact CD2-CZ2 4.13Å
88M92.6Very high92.2Very high127 Ų12744.1 Ų44.163%0.62623%0.232SC*.Hα-helixtrans-77.6-28.4-178.6-70.2-175175.700113.8M1 T84 Y85 I86M1-M88 HydrophobicContact CE-CB 4.09Å; M1-M88 HydrophobicContact CE-CG 4.26Å; M1-M88 HydrophobicContact CE-SD 3.22Å; M1-M88 WeakPolarHBondContact CE-SD 3.21Å; M1-M88 HydrophobicContact SD-SD 3.75Å; T84-M88 HydrophobicContact CG2-CE 3.69Å; T84-M88 HydrophobicContact CG2-CG 4.33Å; T84-M88 HydrophobicContact CG2-SD 3.91Å; T84-M88 WeakPolarHBondContact O-CB 3.47Å; T84-M88 WeakPolarHBondContact O-CG 3.28Å; T84-M88 PolarHBondContact O-N 2.76Å; Y85-M88 PolarHBondContact O-N 3.06Å; I86-M88 VanDerWaalsContact C-N 3.32Å; I86-M88 PolarHBondContact O-N 2.82Å
89T90.8Very high92Very high78 Ų7846.7 Ų46.748%0.47924%0.244SC..Hα-helixtrans-96.8-38.6-176.5550000113.6Y85 I86Y85-T89 HydrophobicContact CD2-CG2 3.98Å; Y85-T89 HydrophobicContact CE2-CG2 3.69Å; Y85-T89 WeakPolarHBondContact O-CB 3.44Å; Y85-T89 WeakPolarHBondContact O-CG2 3.38Å; Y85-T89 PolarHBondContact O-N 2.97Å; Y85-T89 PolarHBondContact O-OG1 3.42Å; I86-T89 PolarHBondContact O-N 3.31Å
90K89.9Confident91.6Very high112 Ų11247.6 Ų47.649%0.48725%0.251SS..Hα-helixtrans-113.3-7.5-175-50.2-168.9-171.9176.90113.7I86 Q94 D98I86-K90 HydrophobicContact CG2-CB 4.25Å; I86-K90 HydrophobicContact CG2-CD 4.35Å; I86-K90 HydrophobicContact CG2-CG 4.47Å; I86-K90 WeakPolarHBondContact O-CA 3.21Å; I86-K90 PolarHBondContact O-N 2.97Å; K90-Q94 HydrophobicContact CB-CB 3.63Å; K90-Q94 HydrophobicContact CB-CG 3.66Å; K90-Q94 HydrophobicContact CD-CG 3.6Å; K90-Q94 HydrophobicContact CG-CG 4.29Å; K90-D98 IonicContact NZ-OD2 3.56Å; K90-D98 PolarHBondContact NZ-OD2 2.95Å
91G93.2Very high91.5Very high29 Ų2947 Ų4730%0.29924%0.243SC..Hα-helixtrans84176.6177.500000114.7I86 L87 S95I86-G91 PolarHBondContact O-N 3.45Å; L87-G91 VanDerWaalsContact O-CA 3.22Å; L87-G91 WeakPolarHBondContact O-CA 3.45Å; L87-G91 PolarHBondContact O-N 3.2Å; G91-S95 PolarHBondContact O-N 2.84Å
92L93.6Very high91.4Very high84 Ų8445.7 Ų45.744%0.4423%0.233SC..Hα-helixtrans-63.4-48.2-171.7-179.564.6000112.8L87 Q94 S95 V96 W163 L213 W217L87-L92 HydrophobicContact CD1-CB 4.04Å; L87-L92 HydrophobicContact CD1-CD1 3.94Å; L92-Q94 VanDerWaalsContact C-N 3.35Å; L92-Q94 PolarHBondContact O-N 3.32Å; L92-S95 PolarHBondContact O-N 3.34Å; L92-S95 VanDerWaalsContact O-N 3.14Å; L92-S95 PolarHBondContact O-OG 3.31Å; L92-V96 HydrophobicContact CD1-CG2 4.22Å; L92-V96 WeakPolarHBondContact O-CG2 3.37Å; L92-V96 PolarHBondContact O-N 3.21Å; L92-V96 VanDerWaalsContact O-N 3.08Å; L92-W163 HydrophobicContact CD1-CZ2 4.16Å; L92-L213 HydrophobicContact CD2-CD1 4.42Å; L92-W217 HydrophobicContact CG-CH2 4.33Å
93K92.4Very high91.4Very high78 Ų7848.8 Ų48.834%0.33925%0.251SS..Hα-helixtrans-56-50.5-178.9177.4-176.5164.3-172.30111.4S95 V96 C97 W217K93-S95 PolarHBondContact O-N 3.32Å; K93-V96 PolarHBondContact O-N 3.38Å; K93-C97 WeakPolarHBondContact O-CB 3.43Å; K93-C97 PolarHBondContact O-N 3.48Å; K93-W217 VanDerWaalsContact CA-CH2 3.48Å; K93-W217 HydrophobicContact CB-CH2 3.94Å; K93-W217 HydrophobicContact CB-CZ2 3.82Å; K93-W217 HydrophobicContact CB-CZ3 4.32Å; K93-W217 HydrophobicContact CG-CD2 3.94Å; K93-W217 HydrophobicContact CG-CE3 4.12Å; K93-W217 HydrophobicContact CG-CG 4.45Å; K93-W217 HydrophobicContact CG-CH2 4.35Å; K93-W217 HydrophobicContact CG-CZ2 4.17Å; K93-W217 HydrophobicContact CG-CZ3 4.32Å
94Q90.6Very high91.1Very high72 Ų7248.6 Ų48.634%0.33625%0.251SS..Hα-helixtrans-63.5-43178.5-166.565.81800110.7K90 L92 V96 C97 D98K90-Q94 HydrophobicContact CB-CB 3.63Å; K90-Q94 HydrophobicContact CB-CG 3.66Å; K90-Q94 HydrophobicContact CD-CG 3.6Å; K90-Q94 HydrophobicContact CG-CG 4.29Å; L92-Q94 VanDerWaalsContact C-N 3.35Å; L92-Q94 PolarHBondContact O-N 3.32Å; Q94-V96 PolarHBondContact O-N 2.99Å; Q94-V96 VanDerWaalsContact O-N 3.07Å; Q94-C97 PolarHBondContact O-N 3.29Å; Q94-D98 HydrophobicContact CG-CB 4.08Å; Q94-D98 VanDerWaalsContact NE2-CG 3.31Å; Q94-D98 PolarHBondContact NE2-OD2 3.31Å; Q94-D98 WeakPolarHBondContact O-CB 3.44Å; Q94-D98 PolarHBondContact O-N 2.99Å
95S93.5Very high90.7Very high6 Ų648.8 Ų48.84%0.04225%0.253CS..Hα-helixtrans-58.1-27.1177.679.40000114.5M83 G91 L92 K93 W163M83-S95 WeakPolarHBondContact CE-O 3.46Å; G91-S95 PolarHBondContact O-N 2.84Å; L92-S95 PolarHBondContact O-N 3.34Å; L92-S95 VanDerWaalsContact O-N 3.14Å; L92-S95 PolarHBondContact O-OG 3.31Å; K93-S95 PolarHBondContact O-N 3.32Å; S95-W163 PolarHBondContact O-NE1 3.41Å; S95-W163 PolarHBondContact OG-NE1 3.34Å; S95-W163 VanDerWaalsContact OG-NE1 3.09Å
96V94.8Very high90.6Very high2 Ų244 Ų441%0.01224%0.235CC..Hα-helixtrans-90-44.5179.11720000111.3L92 K93 Q94 G160 V210 V214 W217L92-V96 HydrophobicContact CD1-CG2 4.22Å; L92-V96 WeakPolarHBondContact O-CG2 3.37Å; L92-V96 PolarHBondContact O-N 3.21Å; L92-V96 VanDerWaalsContact O-N 3.08Å; K93-V96 PolarHBondContact O-N 3.38Å; Q94-V96 PolarHBondContact O-N 2.99Å; Q94-V96 VanDerWaalsContact O-N 3.07Å; V96-G160 WeakPolarHBondContact O-CA 3.46Å; V96-G160 PolarHBondContact O-N 3.15Å; V96-V210 HydrophobicContact CG1-CG1 4.16Å; V96-V214 HydrophobicContact CG1-CG2 3.47Å; V96-V214 VanDerWaalsContact CG1-CG2 3.47Å; V96-W217 HydrophobicContact CB-CH2 4.49Å; V96-W217 HydrophobicContact CB-CZ3 3.67Å; V96-W217 HydrophobicContact CG1-CE3 4.31Å; V96-W217 HydrophobicContact CG1-CZ3 3.75Å; V96-W217 HydrophobicContact CG2-CH2 4.48Å; V96-W217 HydrophobicContact CG2-CZ3 4.06Å
97C92.3Very high90.7Very high3 Ų343.8 Ų43.82%0.0223%0.233CC..Hα-helixtrans-86.5-17.9-172.7-69.60000114.5K93 Q94 Q99 W217 C224 P225K93-C97 WeakPolarHBondContact O-CB 3.43Å; K93-C97 PolarHBondContact O-N 3.48Å; Q94-C97 PolarHBondContact O-N 3.29Å; C97-Q99 PolarHBondContact O-N 3.27Å; C97-W217 VanDerWaalsContact SG-CE3 3.54Å; C97-C224 VanDerWaalsContact CA-SG 3.57Å; C97-C224 HydrophobicContact CB-CB 3.79Å; C97-C224 WeakPolarHBondContact CB-SG 3.17Å; C97-C224 WeakPolarHBondContact SG-CB 3.28Å; C97-C224 CovalentContact SG-SG 2.05Å; C97-C224 PolarHBondContact SG-SG 3.42Å; C97-P225 WeakPolarHBondContact O-CD 3.24Å
98D82.3Confident90.7Very high32 Ų3241.7 Ų41.717%0.17122%0.222CC..  trans-73.9122.3-174-165-3.3000112.1K90 Q94 S100K90-D98 IonicContact NZ-OD2 3.56Å; K90-D98 PolarHBondContact NZ-OD2 2.95Å; Q94-D98 HydrophobicContact CG-CB 4.08Å; Q94-D98 VanDerWaalsContact NE2-CG 3.31Å; Q94-D98 PolarHBondContact NE2-OD2 3.31Å; Q94-D98 WeakPolarHBondContact O-CB 3.44Å; Q94-D98 PolarHBondContact O-N 2.99Å; D98-S100 VanDerWaalsContact CG-CB 3.46Å; D98-S100 PolarHBondContact O-N 2.99Å; D98-S100 WeakPolarHBondContact OD1-CB 3.25Å; D98-S100 PolarHBondContact OD1-N 3.45Å; D98-S100 PolarHBondContact OD1-OG 3.4Å; D98-S100 WeakPolarHBondContact OD2-CB 3.43Å; D98-S100 PolarHBondContact OD2-OG 3.32Å
99Q89.3Confident90.9Very high58 Ų5838.4 Ų38.427%0.27120%0.204SC..THydrogen-bonded Turntrans-76.8-4.8172.1-60.6-176.2-66.100112.1C97 F101 Y102 D156 M157 P225C97-Q99 PolarHBondContact O-N 3.27Å; Q99-F101 PolarHBondContact O-N 3.21Å; Q99-Y102 HydrophobicContact CB-CD2 4.5Å; Q99-Y102 WeakPolarHBondContact O-CD2 2.96Å; Q99-Y102 PolarHBondContact O-N 3.05Å; Q99-D156 PolarHBondContact NE2-O 3.47Å; Q99-M157 WeakPolarHBondContact CG-O 3.34Å; Q99-M157 PolarHBondContact NE2-O 3.17Å; Q99-P225 HydrophobicContact CG-CB 4.28Å; Q99-P225 HydrophobicContact CG-CG 3.43Å; Q99-P225 VanDerWaalsContact CG-CG 3.43Å; Q99-P225 VanDerWaalsContact OE1-CG 3.3Å
100S87.9Confident91.2Very high20 Ų2035.5 Ų35.514%0.1418%0.184CC..Hα-helixtrans-56.5-14.9177.173.80000113.7Y82 D98 Y102 N103 G104Y82-S100 PolarHBondContact OH-O 3.22Å; Y82-S100 PolarHBondContact OH-OG 3.39Å; D98-S100 VanDerWaalsContact CG-CB 3.46Å; D98-S100 PolarHBondContact O-N 2.99Å; D98-S100 WeakPolarHBondContact OD1-CB 3.25Å; D98-S100 PolarHBondContact OD1-N 3.45Å; D98-S100 PolarHBondContact OD1-OG 3.4Å; D98-S100 WeakPolarHBondContact OD2-CB 3.43Å; D98-S100 PolarHBondContact OD2-OG 3.32Å; S100-Y102 VanDerWaalsContact C-N 3.27Å; S100-Y102 PolarHBondContact O-N 3.18Å; S100-N103 WeakPolarHBondContact CA-OD1 3.3Å; S100-N103 PolarHBondContact O-OD1 2.82Å; S100-G104 WeakPolarHBondContact O-CA 3.32Å; S100-G104 PolarHBondContact O-N 3.36Å
101F91.4Very high91.5Very high4 Ų430.1 Ų30.12%0.01816%0.161CC..Hα-helixtrans-63.1-31.5172.6-170-89.8000113.2T79 Y82 M83 Q99 S107 A111 G162 M165T79-F101 HydrophobicContact CG2-CE2 4.27Å; T79-F101 HydrophobicContact CG2-CZ 3.7Å; Y82-F101 AromaticContact CD1-CD2 3.77Å; Y82-F101 HydrophobicContact CD1-CD2 3.77Å; Y82-F101 HydrophobicContact CD1-CE2 4.25Å; Y82-F101 HydrophobicContact CE1-CB 4.42Å; Y82-F101 HydrophobicContact CE1-CD2 4.02Å; M83-F101 HydrophobicContact CG-CD2 4.23Å; M83-F101 HydrophobicContact CG-CE2 3.88Å; M83-F101 HydrophobicContact SD-CD2 3.5Å; M83-F101 WeakPolarHBondContact SD-CD2 3.31Å; M83-F101 HydrophobicContact SD-CE2 3.76Å; Q99-F101 PolarHBondContact O-N 3.21Å; F101-S107 CarbonylContact O-C 3.58Å; F101-S107 WeakPolarHBondContact O-CB 3.41Å; F101-S107 PolarHBondContact O-OG 3.04Å; F101-A111 HydrophobicContact CD1-CB 4.01Å; F101-A111 HydrophobicContact CE1-CB 3.75Å; F101-G162 VanDerWaalsContact CD2-CA 3.5Å; F101-G162 VanDerWaalsContact CG-CA 3.45Å; F101-M165 HydrophobicContact CD1-CE 3.44Å; F101-M165 VanDerWaalsContact CD1-CE 3.44Å; F101-M165 HydrophobicContact CD1-SD 4.49Å; F101-M165 HydrophobicContact CE1-CB 4.25Å; F101-M165 HydrophobicContact CE1-CE 3.32Å; F101-M165 HydrophobicContact CE1-SD 3.84Å; F101-M165 HydrophobicContact CZ-CB 4.36Å; F101-M165 HydrophobicContact CZ-CE 4.44Å
102Y91.6Very high91.7Very high4 Ų430.6 Ų30.62%0.01615%0.154CC..Hα-helixtrans-83.2-23.6-175.4-64.1-86.3000113.7Q99 S100 K108 A111 Y154 M157 V158 G161 M165Q99-Y102 HydrophobicContact CB-CD2 4.5Å; Q99-Y102 WeakPolarHBondContact O-CD2 2.96Å; Q99-Y102 PolarHBondContact O-N 3.05Å; S100-Y102 VanDerWaalsContact C-N 3.27Å; S100-Y102 PolarHBondContact O-N 3.18Å; Y102-K108 WeakPolarHBondContact O-CA 3.24Å; Y102-K108 VanDerWaalsContact O-CB 3.27Å; Y102-K108 WeakPolarHBondContact O-CB 3.31Å; Y102-A111 HydrophobicContact CD1-CB 4.24Å; Y102-Y154 AromaticContact CD1-CD2 3.78Å; Y102-Y154 HydrophobicContact CD1-CD2 3.78Å; Y102-Y154 AromaticContact CD1-CE2 3.59Å; Y102-Y154 HydrophobicContact CD1-CE2 3.59Å; Y102-Y154 AromaticContact CE1-CD2 3.58Å; Y102-Y154 HydrophobicContact CE1-CD2 3.58Å; Y102-Y154 AromaticContact CE1-CE2 3.9Å; Y102-Y154 HydrophobicContact CE1-CE2 3.9Å; Y102-Y154 HydrophobicContact CE1-CG 4.29Å; Y102-M157 HydrophobicContact CD1-CB 4.4Å; Y102-M157 HydrophobicContact CD1-CG 4.16Å; Y102-M157 HydrophobicContact CD2-CB 3.64Å; Y102-M157 HydrophobicContact CD2-CG 4.11Å; Y102-M157 HydrophobicContact CE2-CB 3.86Å; Y102-M157 VanDerWaalsContact CE2-O 3.31Å; Y102-M157 WeakPolarHBondContact CE2-O 3.22Å; Y102-M157 HydrophobicContact CG-CB 3.92Å; Y102-M157 HydrophobicContact CG-CG 3.85Å; Y102-M157 HydrophobicContact CG-SD 4.42Å; Y102-V158 PolarHBondContact OH-O 3.41Å; Y102-V158 VanDerWaalsContact OH-O 3.06Å; Y102-G161 WeakPolarHBondContact OH-CA 3.46Å; Y102-M165 HydrophobicContact CD1-CE 4.32Å; Y102-M165 HydrophobicContact CE1-CE 3.56Å
103N91.1Very high91.9Very high85 Ų8527.3 Ų27.346%0.45514%0.139SC..Hα-helixtrans-122.67.6179.957.52.9000112.7E17 S100E17-N103 HydrophobicContact CG-CB 4.05Å; S100-N103 WeakPolarHBondContact CA-OD1 3.3Å; S100-N103 PolarHBondContact O-OD1 2.82Å
104G86.8Confident92.1Very high4 Ų424.2 Ų24.24%0.04113%0.125CC..SBendtrans-68.2148.5178.600000111.7S100 V106 S107 K108S100-G104 WeakPolarHBondContact O-CA 3.32Å; S100-G104 PolarHBondContact O-N 3.36Å; G104-V106 VanDerWaalsContact C-N 3.3Å; G104-V106 PolarHBondContact O-N 3.42Å; G104-S107 PolarHBondContact O-N 2.8Å; G104-K108 VanDerWaalsContact O-CB 3.29Å; G104-K108 WeakPolarHBondContact O-CB 3.38Å; G104-K108 WeakPolarHBondContact O-CG 3.45Å; G104-K108 PolarHBondContact O-N 3.42Å
105P85.4Confident92.4Very high59 Ų5920.9 Ų20.938%0.38311%0.11SC..THydrogen-bonded Turntrans-52.9-46.6-170.816.9-30.7000112.7E8E8-P105 HydrophobicContact CG-CB 3.65Å; E8-P105 VanDerWaalsContact OE2-CB 3.31Å; E8-P105 WeakPolarHBondContact OE2-CB 3.23Å
106V89.4Confident92.6Very high1 Ų123.1 Ų23.11%0.00612%0.121CC..THydrogen-bonded Turntrans-87.2-42.9178.8176.90000111.6L6 E8 R78 G104 W110L6-V106 WeakPolarHBondContact O-CG2 2.94Å; E8-V106 HydrophobicContact CG-CG2 4.14Å; R78-V106 HydrophobicContact CB-CG1 3.89Å; G104-V106 VanDerWaalsContact C-N 3.3Å; G104-V106 PolarHBondContact O-N 3.42Å; V106-W110 VanDerWaalsContact O-CD1 3.23Å
107S92.8Very high92.7Very high0 Ų023.5 Ų23.50%012%0.124CC..Hα-helixtrans-79.8-23.4-165.154.60000114.7Y82 F101 G104 F109 W110 A111Y82-S107 WeakPolarHBondContact CE1-OG 3.49Å; F101-S107 CarbonylContact O-C 3.58Å; F101-S107 WeakPolarHBondContact O-CB 3.41Å; F101-S107 PolarHBondContact O-OG 3.04Å; G104-S107 PolarHBondContact O-N 2.8Å; S107-F109 PolarHBondContact O-N 3.11Å; S107-W110 PolarHBondContact O-N 3.21Å; S107-W110 VanDerWaalsContact O-N 3.17Å; S107-A111 WeakPolarHBondContact O-CB 3.34Å; S107-A111 PolarHBondContact O-N 2.89Å
108K93.9Very high93Very high18 Ų1823.4 Ų23.48%0.07812%0.123CC..Hα-helixtrans-56.4-49.5-172.461.2-173.9-171.11640114.6E12 F15 E17 Y102 G104 A111 Y112E12-K108 WeakPolarHBondContact O-CE 3.1Å; F15-K108 HydrophobicContact CD1-CB 4.34Å; F15-K108 HydrophobicContact CD1-CD 4.37Å; F15-K108 HydrophobicContact CD1-CG 3.96Å; F15-K108 WeakPolarHBondContact O-CE 2.86Å; F15-K108 PolarHBondContact O-NZ 3.42Å; E17-K108 HydrophobicContact CB-CB 4.19Å; E17-K108 HydrophobicContact CB-CD 4.29Å; E17-K108 HydrophobicContact CG-CD 4.45Å; E17-K108 IonicContact OE1-NZ 3.52Å; E17-K108 WeakPolarHBondContact OE2-CD 3.12Å; E17-K108 IonicContact OE2-NZ 2.96Å; E17-K108 PolarHBondContact OE2-NZ 3.12Å; Y102-K108 WeakPolarHBondContact O-CA 3.24Å; Y102-K108 VanDerWaalsContact O-CB 3.27Å; Y102-K108 WeakPolarHBondContact O-CB 3.31Å; G104-K108 VanDerWaalsContact O-CB 3.29Å; G104-K108 WeakPolarHBondContact O-CB 3.38Å; G104-K108 WeakPolarHBondContact O-CG 3.45Å; G104-K108 PolarHBondContact O-N 3.42Å; K108-A111 PolarHBondContact O-N 3.15Å; K108-Y112 PolarHBondContact O-N 3.27Å
109F95.9Very high93.7Very high58 Ų5823.1 Ų23.125%0.25413%0.125SC..Hα-helixtrans-62.6-46.1177.3170.2-92.7000111F11 E12 F15 S107 A111 Y112 A113F11-F109 HydrophobicContact CD2-CD1 4.26Å; F11-F109 HydrophobicContact CD2-CD2 4.21Å; F11-F109 HydrophobicContact CD2-CE1 4.31Å; F11-F109 HydrophobicContact CD2-CE2 4.26Å; F11-F109 HydrophobicContact CD2-CG 4.2Å; F11-F109 HydrophobicContact CD2-CZ 4.31Å; F11-F109 AromaticContact CE2-CD1 3.57Å; F11-F109 HydrophobicContact CE2-CD1 3.57Å; F11-F109 HydrophobicContact CE2-CD2 4.33Å; F11-F109 AromaticContact CE2-CE1 3.63Å; F11-F109 HydrophobicContact CE2-CE1 3.63Å; F11-F109 HydrophobicContact CE2-CE2 4.39Å; F11-F109 AromaticContact CE2-CG 3.92Å; F11-F109 HydrophobicContact CE2-CG 3.92Å; F11-F109 HydrophobicContact CE2-CZ 4.05Å; E12-F109 HydrophobicContact CG-CB 4.47Å; F15-F109 HydrophobicContact CB-CB 4.3Å; F15-F109 HydrophobicContact CD1-CB 4.16Å; F15-F109 HydrophobicContact CD2-CB 4.47Å; F15-F109 AromaticContact CD2-CD2 3.71Å; F15-F109 HydrophobicContact CD2-CD2 3.71Å; F15-F109 HydrophobicContact CE2-CD2 4.08Å; F15-F109 HydrophobicContact CG-CB 4.05Å; F15-F109 HydrophobicContact CG-CD2 4.11Å; S107-F109 PolarHBondContact O-N 3.11Å; F109-A111 VanDerWaalsContact C-N 3.34Å; F109-A111 PolarHBondContact O-N 3.38Å; F109-Y112 PolarHBondContact O-N 3.13Å; F109-A113 HydrophobicContact CE1-CB 4.17Å; F109-A113 HydrophobicContact CZ-CB 4.36Å; F109-A113 WeakPolarHBondContact O-CB 3.47Å; F109-A113 PolarHBondContact O-N 3.18Å
110W96.8Very high94Very high16 Ų1623.5 Ų23.56%0.06113%0.132CC..Hα-helixtrans-67.9-33.8-177.4-65.7102000112.5F11 E12 F71 F74 R78 T79 V106 S107 F114 Y169F11-W110 HydrophobicContact CZ-CZ2 4.27Å; E12-W110 PolarHBondContact OE1-NE1 2.97Å; F71-W110 HydrophobicContact CD2-CZ3 4.23Å; F71-W110 HydrophobicContact CE2-CZ3 4.17Å; F74-W110 HydrophobicContact CB-CH2 3.38Å; F74-W110 HydrophobicContact CB-CZ2 4.01Å; F74-W110 HydrophobicContact CB-CZ3 4.01Å; F74-W110 HydrophobicContact CG-CH2 4.43Å; R78-W110 HydrophobicContact CB-CD2 4.37Å; R78-W110 HydrophobicContact CB-CG 4.23Å; R78-W110 HydrophobicContact CG-CZ2 3.94Å; T79-W110 HydrophobicContact CG2-CB 3.55Å; T79-W110 HydrophobicContact CG2-CG 4.22Å; V106-W110 VanDerWaalsContact O-CD1 3.23Å; S107-W110 PolarHBondContact O-N 3.21Å; S107-W110 VanDerWaalsContact O-N 3.17Å; W110-F114 VanDerWaalsContact O-CB 3.24Å; W110-F114 WeakPolarHBondContact O-CB 3.45Å; W110-F114 PolarHBondContact O-N 3.38Å; W110-Y169 HydrophobicContact CB-CE2 4.48Å; W110-Y169 PolarHBondContact O-OH 2.92Å; W110-Y169 VanDerWaalsContact O-OH 3.05Å
111A96.9Very high94.5Very high0 Ų022.6 Ų22.60%013%0.126CC..Hα-helixtrans-62.2-45.1173.600000111F101 Y102 S107 K108 F109 F114 V115 Y154 M165F101-A111 HydrophobicContact CD1-CB 4.01Å; F101-A111 HydrophobicContact CE1-CB 3.75Å; Y102-A111 HydrophobicContact CD1-CB 4.24Å; S107-A111 WeakPolarHBondContact O-CB 3.34Å; S107-A111 PolarHBondContact O-N 2.89Å; K108-A111 PolarHBondContact O-N 3.15Å; F109-A111 VanDerWaalsContact C-N 3.34Å; F109-A111 PolarHBondContact O-N 3.38Å; A111-F114 WeakPolarHBondContact O-CB 3.34Å; A111-V115 PolarHBondContact O-N 2.94Å; A111-Y154 HydrophobicContact CB-CE2 3.88Å; A111-Y154 WeakPolarHBondContact O-CE2 3.41Å; A111-M165 HydrophobicContact CB-CE 4.19Å; A111-M165 HydrophobicContact CB-SD 3.95Å
112Y97.2Very high94.7Very high39 Ų3923.5 Ų23.515%0.15313%0.131CC..Hα-helixtrans-67.1-47.7177-176.6-118.9000112.1F15 A20 W23 M24 K108 F109 F114 V115 L116 Y154F15-Y112 AromaticContact CE2-CD1 3.77Å; F15-Y112 HydrophobicContact CE2-CD1 3.77Å; F15-Y112 HydrophobicContact CE2-CE1 4.38Å; F15-Y112 HydrophobicContact CE2-CG 4.44Å; F15-Y112 AromaticContact CZ-CD1 3.51Å; F15-Y112 HydrophobicContact CZ-CD1 3.51Å; F15-Y112 HydrophobicContact CZ-CE1 4.34Å; F15-Y112 AromaticContact CZ-CG 3.73Å; F15-Y112 HydrophobicContact CZ-CG 3.73Å; A20-Y112 HydrophobicContact CB-CD1 4.2Å; A20-Y112 HydrophobicContact CB-CD2 3.68Å; A20-Y112 HydrophobicContact CB-CE1 4.35Å; A20-Y112 HydrophobicContact CB-CE2 3.87Å; A20-Y112 HydrophobicContact CB-CG 3.85Å; W23-Y112 HydrophobicContact CE3-CE2 4.29Å; M24-Y112 HydrophobicContact CG-CD2 4.08Å; M24-Y112 HydrophobicContact CG-CE2 3.76Å; M24-Y112 HydrophobicContact SD-CE2 4.01Å; K108-Y112 PolarHBondContact O-N 3.27Å; F109-Y112 PolarHBondContact O-N 3.13Å; Y112-F114 VanDerWaalsContact C-N 3.25Å; Y112-F114 PolarHBondContact O-N 2.98Å; Y112-V115 PolarHBondContact O-N 3.17Å; Y112-V115 VanDerWaalsContact O-N 3.16Å; Y112-L116 HydrophobicContact CD1-CD1 3.96Å; Y112-L116 HydrophobicContact CE1-CD1 3.38Å; Y112-L116 HydrophobicContact CE1-CG 4.18Å; Y112-L116 HydrophobicContact CE2-CD1 4.22Å; Y112-L116 HydrophobicContact CE2-CD2 4.37Å; Y112-L116 HydrophobicContact CE2-CG 4.21Å; Y112-L116 PolarHBondContact O-N 3.28Å; Y112-L116 VanDerWaalsContact O-N 3.11Å; Y112-Y154 HydrophobicContact CD2-CE1 4.25Å
113A97.4Very high94.9Very high14 Ų1424.1 Ų24.112%0.11614%0.139CC..Hα-helixtrans-59.7-36.6179.400000112.1F71 F109 L116 S117F71-A113 HydrophobicContact CE2-CB 3.92Å; F71-A113 HydrophobicContact CZ-CB 4.04Å; F109-A113 HydrophobicContact CE1-CB 4.17Å; F109-A113 HydrophobicContact CZ-CB 4.36Å; F109-A113 WeakPolarHBondContact O-CB 3.47Å; F109-A113 PolarHBondContact O-N 3.18Å; A113-L116 PolarHBondContact O-N 3.28Å; A113-S117 WeakPolarHBondContact O-CB 3.47Å; A113-S117 PolarHBondContact O-N 2.93Å
114F98Very high95.2Very high13 Ų1320.8 Ų20.86%0.05712%0.121CC..Hα-helixtrans-57.6-47.6175.1177.6-91.7000112.7W110 A111 Y112 S117 M165 N168 Y169W110-F114 VanDerWaalsContact O-CB 3.24Å; W110-F114 WeakPolarHBondContact O-CB 3.45Å; W110-F114 PolarHBondContact O-N 3.38Å; A111-F114 WeakPolarHBondContact O-CB 3.34Å; Y112-F114 VanDerWaalsContact C-N 3.25Å; Y112-F114 PolarHBondContact O-N 2.98Å; F114-S117 PolarHBondContact O-N 3.07Å; F114-S117 PolarHBondContact O-OG 3.25Å; F114-M165 HydrophobicContact CB-CG 4.48Å; F114-M165 HydrophobicContact CB-SD 4.29Å; F114-M165 HydrophobicContact CD1-CB 4.28Å; F114-M165 HydrophobicContact CD1-CG 3.53Å; F114-M165 HydrophobicContact CD1-SD 3.98Å; F114-M165 HydrophobicContact CD2-CB 4.18Å; F114-M165 HydrophobicContact CD2-CG 4.31Å; F114-M165 HydrophobicContact CE1-CB 4.44Å; F114-M165 HydrophobicContact CE1-CG 3.72Å; F114-M165 HydrophobicContact CE2-CB 4.32Å; F114-M165 HydrophobicContact CE2-CG 4.46Å; F114-M165 HydrophobicContact CG-CB 4.14Å; F114-M165 HydrophobicContact CG-CG 3.84Å; F114-M165 HydrophobicContact CG-SD 4.24Å; F114-M165 HydrophobicContact CZ-CB 4.45Å; F114-M165 HydrophobicContact CZ-CG 4.18Å; F114-N168 HydrophobicContact CE2-CB 3.64Å; F114-N168 WeakPolarHBondContact CE2-OD1 3.49Å; F114-N168 HydrophobicContact CZ-CB 3.8Å; F114-Y169 VanDerWaalsContact CA-OH 3.31Å; F114-Y169 WeakPolarHBondContact CA-OH 3.35Å; F114-Y169 HydrophobicContact CB-CE2 3.78Å; F114-Y169 WeakPolarHBondContact CB-OH 3.48Å; F114-Y169 HydrophobicContact CD2-CD1 4.37Å; F114-Y169 AromaticContact CD2-CD2 3.91Å; F114-Y169 HydrophobicContact CD2-CD2 3.91Å; F114-Y169 HydrophobicContact CD2-CE1 4.14Å; F114-Y169 AromaticContact CD2-CE2 3.63Å; F114-Y169 HydrophobicContact CD2-CE2 3.63Å; F114-Y169 HydrophobicContact CD2-CG 4.28Å; F114-Y169 AromaticContact CD2-CZ 3.76Å; F114-Y169 HydrophobicContact CG-CE2 4.15Å; F114-Y169 PolarHBondContact N-OH 2.61Å
115V96.8Very high95.6Very high2 Ų220.6 Ų20.61%0.01212%0.119CC..Hα-helixtrans-70.7-40-175.9177.30000110.1M24 A111 Y112 S117 K118 W151 Y154M24-V115 HydrophobicContact CE-CG1 3.51Å; M24-V115 HydrophobicContact SD-CG1 4.27Å; A111-V115 PolarHBondContact O-N 2.94Å; Y112-V115 PolarHBondContact O-N 3.17Å; Y112-V115 VanDerWaalsContact O-N 3.16Å; V115-S117 VanDerWaalsContact C-N 3.32Å; V115-S117 PolarHBondContact O-N 2.99Å; V115-K118 PolarHBondContact O-N 3.16Å; V115-W151 HydrophobicContact CG1-CB 4.44Å; V115-W151 HydrophobicContact CG1-CG 3.9Å; V115-W151 PolarHBondContact O-NE1 3.46Å; V115-Y154 HydrophobicContact CB-CD2 4.39Å; V115-Y154 HydrophobicContact CG2-CD2 3.46Å; V115-Y154 VanDerWaalsContact CG2-CD2 3.46Å; V115-Y154 HydrophobicContact CG2-CE2 4.31Å; V115-Y154 HydrophobicContact CG2-CG 3.82Å
116L97.1Very high96.1Very high54 Ų5421 Ų2128%0.28312%0.117SC..Hα-helixtrans-63.8-36.7173.6-67-171.4000112.3W23 M24 Y112 A113 K118 A119 P120 W151W23-L116 HydrophobicContact CH2-CD2 4.2Å; W23-L116 HydrophobicContact CZ3-CD2 3.87Å; M24-L116 HydrophobicContact SD-CD2 4.47Å; Y112-L116 HydrophobicContact CD1-CD1 3.96Å; Y112-L116 HydrophobicContact CE1-CD1 3.38Å; Y112-L116 HydrophobicContact CE1-CG 4.18Å; Y112-L116 HydrophobicContact CE2-CD1 4.22Å; Y112-L116 HydrophobicContact CE2-CD2 4.37Å; Y112-L116 HydrophobicContact CE2-CG 4.21Å; Y112-L116 PolarHBondContact O-N 3.28Å; Y112-L116 VanDerWaalsContact O-N 3.11Å; A113-L116 PolarHBondContact O-N 3.28Å; L116-K118 PolarHBondContact O-N 3Å; L116-K118 VanDerWaalsContact O-N 3.11Å; L116-A119 PolarHBondContact O-N 2.9Å; L116-P120 WeakPolarHBondContact O-CD 3.36Å; L116-W151 HydrophobicContact CD2-CH2 4.31Å; L116-W151 HydrophobicContact CD2-CZ2 3.91Å
117S97.6Very high96.4Very high10 Ų1022.1 Ų22.17%0.0712%0.122CC..Hα-helixtrans-61.1-23.3-177.2850000113.6F71 A113 F114 V115 A119 P120 E121F71-S117 VanDerWaalsContact CE1-CB 3.41Å; A113-S117 WeakPolarHBondContact O-CB 3.47Å; A113-S117 PolarHBondContact O-N 2.93Å; F114-S117 PolarHBondContact O-N 3.07Å; F114-S117 PolarHBondContact O-OG 3.25Å; V115-S117 VanDerWaalsContact C-N 3.32Å; V115-S117 PolarHBondContact O-N 2.99Å; S117-A119 PolarHBondContact O-N 3.21Å; S117-P120 VanDerWaalsContact O-CD 3.26Å; S117-P120 WeakPolarHBondContact O-CD 3.49Å; S117-E121 WeakPolarHBondContact O-CB 3.25Å; S117-E121 WeakPolarHBondContact O-CG 3.44Å; S117-E121 PolarHBondContact O-N 2.9Å; S117-E121 PolarHBondContact OG-OE1 2.86Å
118K97.4Very high96.6Very high1 Ų123.9 Ų23.90%0.00413%0.131CC..Hα-helixtrans-63.8-28.2179.4-57.4-44.4175.9-165.50113.3V115 L116 E121 V146 L147 S150 N168V115-K118 PolarHBondContact O-N 3.16Å; L116-K118 PolarHBondContact O-N 3Å; L116-K118 VanDerWaalsContact O-N 3.11Å; K118-E121 VanDerWaalsContact CD-OE2 3.31Å; K118-E121 WeakPolarHBondContact CD-OE2 3.25Å; K118-E121 IonicContact NZ-OE1 3.69Å; K118-E121 PolarHBondContact NZ-OE1 3.28Å; K118-E121 IonicContact NZ-OE2 3.02Å; K118-E121 PolarHBondContact NZ-OE2 2.92Å; K118-V146 HydrophobicContact CD-CG1 4.3Å; K118-L147 HydrophobicContact CB-CB 4.23Å; K118-L147 HydrophobicContact CB-CD1 3.81Å; K118-S150 WeakPolarHBondContact CG-OG 3.13Å; K118-N168 PolarHBondContact NZ-OD1 3.03Å
119A96.4Very high96.7Very high25 Ų2523.3 Ų23.321%0.20713%0.129CC..Hα-helixtrans-73.7-50.5175.300000112.1F34 L116 S117 E121 L122 L147F34-A119 HydrophobicContact CD2-CB 4.1Å; F34-A119 HydrophobicContact CE2-CB 4.26Å; L116-A119 PolarHBondContact O-N 2.9Å; S117-A119 PolarHBondContact O-N 3.21Å; A119-E121 VanDerWaalsContact C-N 3.31Å; A119-E121 PolarHBondContact O-N 3.48Å; A119-L122 VanDerWaalsContact O-CB 3.27Å; A119-L122 WeakPolarHBondContact O-CB 3.34Å; A119-L122 VanDerWaalsContact O-CG 3.26Å; A119-L122 WeakPolarHBondContact O-CG 3.02Å; A119-L122 PolarHBondContact O-N 3.25Å; A119-L147 HydrophobicContact CB-CD1 4.15Å
120P96.6Very high96.7Very high66 Ų6622.6 Ų22.643%0.42913%0.128SC..Hα-helixtrans-54.1-42.3169.2-3035.9000113.7W64 L116 S117 L122 G123W64-P120 HydrophobicContact CH2-CB 4.11Å; W64-P120 WeakPolarHBondContact CH2-O 3.28Å; W64-P120 WeakPolarHBondContact CZ2-O 3.23Å; L116-P120 WeakPolarHBondContact O-CD 3.36Å; S117-P120 VanDerWaalsContact O-CD 3.26Å; S117-P120 WeakPolarHBondContact O-CD 3.49Å; P120-L122 PolarHBondContact O-N 3.45Å; P120-G123 WeakPolarHBondContact O-CA 3.41Å; P120-G123 PolarHBondContact O-N 3.16Å
121E97.6Very high96.6Very high1 Ų124.4 Ų24.41%0.00514%0.135CC..Hα-helixtrans-55.8-22.2-179.9-75.7170.7-14600113.5L68 S117 K118 A119 G123 D124 H172L68-E121 HydrophobicContact CD2-CG 4.44Å; S117-E121 WeakPolarHBondContact O-CB 3.25Å; S117-E121 WeakPolarHBondContact O-CG 3.44Å; S117-E121 PolarHBondContact O-N 2.9Å; S117-E121 PolarHBondContact OG-OE1 2.86Å; K118-E121 VanDerWaalsContact CD-OE2 3.31Å; K118-E121 WeakPolarHBondContact CD-OE2 3.25Å; K118-E121 IonicContact NZ-OE1 3.69Å; K118-E121 PolarHBondContact NZ-OE1 3.28Å; K118-E121 IonicContact NZ-OE2 3.02Å; K118-E121 PolarHBondContact NZ-OE2 2.92Å; A119-E121 VanDerWaalsContact C-N 3.31Å; A119-E121 PolarHBondContact O-N 3.48Å; E121-G123 PolarHBondContact O-N 2.75Å; E121-G123 VanDerWaalsContact O-N 3.12Å; E121-D124 WeakPolarHBondContact O-CB 3.2Å; E121-D124 PolarHBondContact O-N 2.91Å; E121-H172 IonicContact OE1-ND1 2.8Å; E121-H172 IonicContact OE2-CE1 3.19Å; E121-H172 PolarHBondContact OE2-CE1 3.35Å; E121-H172 VanDerWaalsContact OE2-CE1 3.3Å; E121-H172 IonicContact OE2-ND1 4Å
122L96.4Very high96.5Very high23 Ų2329.1 Ų29.112%0.1216%0.155CC..THydrogen-bonded Turntrans-57.8-23.3170-58.7-178.1000113.2Y38 A119 P120 D124 T125 H143 L147Y38-L122 HydrophobicContact CD1-CD2 4.34Å; Y38-L122 HydrophobicContact CD2-CB 3.86Å; Y38-L122 HydrophobicContact CD2-CD1 4.14Å; Y38-L122 HydrophobicContact CD2-CD2 3.86Å; Y38-L122 HydrophobicContact CD2-CG 4.17Å; Y38-L122 HydrophobicContact CE1-CD2 4.38Å; Y38-L122 HydrophobicContact CE2-CB 4.06Å; Y38-L122 HydrophobicContact CE2-CD2 3.9Å; Y38-L122 HydrophobicContact CE2-CG 4.49Å; Y38-L122 HydrophobicContact CG-CD1 4.21Å; Y38-L122 HydrophobicContact CG-CD2 4.07Å; A119-L122 VanDerWaalsContact O-CB 3.27Å; A119-L122 WeakPolarHBondContact O-CB 3.34Å; A119-L122 VanDerWaalsContact O-CG 3.26Å; A119-L122 WeakPolarHBondContact O-CG 3.02Å; A119-L122 PolarHBondContact O-N 3.25Å; P120-L122 PolarHBondContact O-N 3.45Å; L122-D124 PolarHBondContact O-N 3.48Å; L122-T125 WeakPolarHBondContact O-CB 3.38Å; L122-T125 PolarHBondContact O-N 3.11Å; L122-T125 VanDerWaalsContact O-N 3.15Å; L122-H143 HydrophobicContact CD2-CB 3.94Å; L122-L147 HydrophobicContact CD1-CD2 3.8Å; L122-L147 HydrophobicContact CD2-CD2 4.36Å; L122-L147 HydrophobicContact CG-CD2 4.36Å
123G95.6Very high96.4Very high17 Ų1732.1 Ų32.118%0.17517%0.171CC..Hα-helixtrans-59.2-22.5173.300000113.9P120 E121 T125 L126 F127P120-G123 WeakPolarHBondContact O-CA 3.41Å; P120-G123 PolarHBondContact O-N 3.16Å; E121-G123 PolarHBondContact O-N 2.75Å; E121-G123 VanDerWaalsContact O-N 3.12Å; G123-T125 PolarHBondContact O-N 3.1Å; G123-L126 VanDerWaalsContact O-CB 3.29Å; G123-L126 WeakPolarHBondContact O-CB 3.31Å; G123-L126 PolarHBondContact O-N 3.21Å; G123-L126 VanDerWaalsContact O-N 3.12Å; G123-F127 VanDerWaalsContact O-CD2 3.23Å; G123-F127 WeakPolarHBondContact O-CD2 3.22Å; G123-F127 PolarHBondContact O-N 3.04Å
124D96.4Very high96.1Very high15 Ų1540.3 Ų40.38%0.0820%0.203CC..Hα-helixtrans-59.5-39.4174.2-71.3-13.9000111.4W64 E121 L122 F127 I128 H143 Y176W64-D124 PolarHBondContact NE1-OD1 3.19Å; E121-D124 WeakPolarHBondContact O-CB 3.2Å; E121-D124 PolarHBondContact O-N 2.91Å; L122-D124 PolarHBondContact O-N 3.48Å; D124-F127 PolarHBondContact O-N 3.46Å; D124-I128 WeakPolarHBondContact O-CG1 3.31Å; D124-I128 PolarHBondContact O-N 2.93Å; D124-I128 VanDerWaalsContact O-N 3.16Å; D124-H143 IonicContact OD2-CE1 3.72Å; D124-H143 IonicContact OD2-NE2 3.37Å; D124-Y176 VanDerWaalsContact OD2-CE1 3.3Å; D124-Y176 WeakPolarHBondContact OD2-CE1 3.41Å; D124-Y176 PolarHBondContact OD2-OH 3.2Å
125T96.9Very high96Very high0 Ų040.8 Ų40.80%021%0.207CC..Hα-helixtrans-70.2-33.1178.1-510000112.2Y38 I42 L122 G123 F127 I128 V129 L135 H139Y38-T125 HydrophobicContact CE2-CG2 3.86Å; Y38-T125 WeakPolarHBondContact CE2-OG1 3.33Å; Y38-T125 PolarHBondContact OH-OG1 3.45Å; I42-T125 HydrophobicContact CD1-CG2 4.06Å; I42-T125 HydrophobicContact CG1-CG2 3.77Å; L122-T125 WeakPolarHBondContact O-CB 3.38Å; L122-T125 PolarHBondContact O-N 3.11Å; L122-T125 VanDerWaalsContact O-N 3.15Å; G123-T125 PolarHBondContact O-N 3.1Å; T125-F127 VanDerWaalsContact C-N 3.33Å; T125-F127 PolarHBondContact O-N 2.99Å; T125-I128 PolarHBondContact O-N 3.3Å; T125-V129 HydrophobicContact CG2-CG2 4.27Å; T125-V129 WeakPolarHBondContact O-CG2 3.47Å; T125-V129 PolarHBondContact O-N 3.43Å; T125-L135 HydrophobicContact CG2-CD1 3.84Å; T125-L135 HydrophobicContact CG2-CD2 3.96Å; T125-H139 PolarHBondContact OG1-CD2 2.96Å; T125-H139 PolarHBondContact OG1-NE2 2.89Å
126L95.4Very high96Very high67 Ų6743.3 Ų43.335%0.35122%0.22SC..Hα-helixtrans-56.6-48.6172.5172.668.6000110.2F41 G123 I128 V129 L130F41-L126 HydrophobicContact CE1-CB 4.15Å; F41-L126 HydrophobicContact CE1-CD1 4.1Å; F41-L126 HydrophobicContact CE2-CD1 3.45Å; F41-L126 VanDerWaalsContact CE2-CD1 3.45Å; F41-L126 HydrophobicContact CZ-CB 4.06Å; F41-L126 HydrophobicContact CZ-CD1 3.19Å; F41-L126 HydrophobicContact CZ-CG 4.22Å; G123-L126 VanDerWaalsContact O-CB 3.29Å; G123-L126 WeakPolarHBondContact O-CB 3.31Å; G123-L126 PolarHBondContact O-N 3.21Å; G123-L126 VanDerWaalsContact O-N 3.12Å; L126-I128 VanDerWaalsContact C-N 3.34Å; L126-I128 PolarHBondContact O-N 3.49Å; L126-V129 PolarHBondContact O-N 2.86Å; L126-L130 HydrophobicContact CD1-CD1 3.5Å; L126-L130 HydrophobicContact CD1-CG 3.86Å; L126-L130 HydrophobicContact CG-CD1 3.85Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 WeakPolarHBondContact O-CB 3.37Å; L126-L130 VanDerWaalsContact O-CG 3.3Å; L126-L130 WeakPolarHBondContact O-CG 3.44Å; L126-L130 PolarHBondContact O-N 3.37Å
127F95.9Very high95.9Very high25 Ų2545.6 Ų45.611%0.1123%0.227CC..Hα-helixtrans-62.2-39.5176.3-72.4-71.6000112.8L57 P60 L61 W64 G123 D124 T125 R131L57-F127 HydrophobicContact CB-CD1 3.99Å; L57-F127 HydrophobicContact CB-CE1 4.15Å; L57-F127 HydrophobicContact CD1-CD1 4.01Å; L57-F127 HydrophobicContact CD1-CE1 4.33Å; P60-F127 HydrophobicContact CB-CE1 4Å; P60-F127 HydrophobicContact CB-CZ 4.3Å; L61-F127 HydrophobicContact CB-CD1 4Å; L61-F127 HydrophobicContact CB-CE1 4.15Å; L61-F127 HydrophobicContact CB-CG 4.42Å; L61-F127 HydrophobicContact CD1-CB 4.01Å; L61-F127 HydrophobicContact CD1-CD1 4.26Å; L61-F127 HydrophobicContact CD1-CD2 3.93Å; L61-F127 HydrophobicContact CD1-CE2 4.5Å; L61-F127 HydrophobicContact CD1-CG 3.8Å; W64-F127 HydrophobicContact CB-CE2 3.81Å; W64-F127 HydrophobicContact CB-CZ 4.03Å; W64-F127 AromaticContact CD1-CE2 3.7Å; W64-F127 AromaticContact CD2-CE2 3.9Å; W64-F127 HydrophobicContact CD2-CE2 3.9Å; W64-F127 HydrophobicContact CG-CD2 4.33Å; W64-F127 AromaticContact CG-CE2 3.51Å; W64-F127 HydrophobicContact CG-CE2 3.51Å; W64-F127 HydrophobicContact CG-CZ 4.2Å; G123-F127 VanDerWaalsContact O-CD2 3.23Å; G123-F127 WeakPolarHBondContact O-CD2 3.22Å; G123-F127 PolarHBondContact O-N 3.04Å; D124-F127 PolarHBondContact O-N 3.46Å; T125-F127 VanDerWaalsContact C-N 3.33Å; T125-F127 PolarHBondContact O-N 2.99Å; F127-R131 WeakPolarHBondContact O-CB 3.38Å; F127-R131 WeakPolarHBondContact O-CG 3.28Å; F127-R131 PolarHBondContact O-N 3.5Å
128I96.3Very high95.9Very high37 Ų3745.9 Ų45.919%0.1923%0.228CC..Hα-helixtrans-62.3-48.2177.4-69.9167.8000110.8D124 T125 L126 K132 Q133 L135 H139D124-I128 WeakPolarHBondContact O-CG1 3.31Å; D124-I128 PolarHBondContact O-N 2.93Å; D124-I128 VanDerWaalsContact O-N 3.16Å; T125-I128 PolarHBondContact O-N 3.3Å; L126-I128 VanDerWaalsContact C-N 3.34Å; L126-I128 PolarHBondContact O-N 3.49Å; I128-K132 PolarHBondContact O-N 3.45Å; I128-Q133 HydrophobicContact CG2-CB 4.02Å; I128-Q133 PolarHBondContact O-N 3.47Å; I128-L135 HydrophobicContact CD1-CD1 4.4Å; I128-L135 HydrophobicContact CG2-CB 3.86Å; I128-L135 HydrophobicContact CG2-CD1 4.06Å; I128-H139 WeakPolarHBondContact CD1-NE2 3.44Å
129V96.6Very high95.8Very high6 Ų647.6 Ų47.64%0.03624%0.236CC..Hα-helixtrans-66.5-49-177.9172.70000111.2F41 R46 M49 T125 L126 R131 K132 L135F41-V129 HydrophobicContact CE1-CB 4.25Å; F41-V129 HydrophobicContact CE1-CG2 4.21Å; F41-V129 HydrophobicContact CZ-CB 4.25Å; F41-V129 HydrophobicContact CZ-CG1 4.3Å; R46-V129 HydrophobicContact CG-CG1 4.34Å; R46-V129 HydrophobicContact CG-CG2 4.36Å; M49-V129 HydrophobicContact CG-CG1 4.25Å; T125-V129 HydrophobicContact CG2-CG2 4.27Å; T125-V129 WeakPolarHBondContact O-CG2 3.47Å; T125-V129 PolarHBondContact O-N 3.43Å; L126-V129 PolarHBondContact O-N 2.86Å; V129-R131 VanDerWaalsContact C-N 3.3Å; V129-R131 PolarHBondContact O-N 3.39Å; V129-K132 PolarHBondContact O-N 2.98Å; V129-K132 VanDerWaalsContact O-N 3.08Å; V129-L135 HydrophobicContact CG2-CD2 4.33Å
130L95.8Very high95.9Very high43 Ų4350.3 Ų50.323%0.22524%0.241CC..Hα-helixtrans-66.9-29.8-178.6-67.5-178.8000113.1M49 F55 L57 L126 K132M49-L130 WeakPolarHBondContact CE-O 3.19Å; M49-L130 HydrophobicContact CG-CD2 4.44Å; M49-L130 HydrophobicContact SD-CD2 3.98Å; F55-L130 HydrophobicContact CD2-CB 4.07Å; F55-L130 HydrophobicContact CD2-CD2 4.12Å; F55-L130 HydrophobicContact CE2-CD2 4.14Å; F55-L130 PolarHBondContact N-O 3.21Å; F55-L130 VanDerWaalsContact N-O 3.08Å; L57-L130 HydrophobicContact CD1-CB 3.68Å; L57-L130 HydrophobicContact CD1-CD1 3.74Å; L57-L130 HydrophobicContact CD1-CG 4.39Å; L126-L130 HydrophobicContact CD1-CD1 3.5Å; L126-L130 HydrophobicContact CD1-CG 3.86Å; L126-L130 HydrophobicContact CG-CD1 3.85Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 WeakPolarHBondContact O-CB 3.37Å; L126-L130 VanDerWaalsContact O-CG 3.3Å; L126-L130 WeakPolarHBondContact O-CG 3.44Å; L126-L130 PolarHBondContact O-N 3.37Å; L130-K132 VanDerWaalsContact C-N 3.28Å
131R95.3Very high95.9Very high54 Ų5449.8 Ų49.820%0.20423%0.231CC..THydrogen-bonded Turntrans-88.26.7175.4-62.4178.564.4-140.7-6.5113.3L57 F127 V129 Q133L57-R131 HydrophobicContact CB-CG 4.16Å; L57-R131 HydrophobicContact CD1-CG 4.4Å; F127-R131 WeakPolarHBondContact O-CB 3.38Å; F127-R131 WeakPolarHBondContact O-CG 3.28Å; F127-R131 PolarHBondContact O-N 3.5Å; V129-R131 VanDerWaalsContact C-N 3.3Å; V129-R131 PolarHBondContact O-N 3.39Å; R131-Q133 HydrophobicContact CB-CG 3.96Å; R131-Q133 PolarHBondContact O-N 2.84Å; R131-Q133 PolarHBondContact O-NE2 2.7Å
132K94.1Very high95.9Very high100 Ų10050.7 Ų50.744%0.43524%0.235SC..THydrogen-bonded Turntrans51.734.5-176-63.5-172.1168.8-167.10113.8M49 R52 K54 I128 V129 L130M49-K132 HydrophobicContact CE-CG 4.02Å; M49-K132 WeakPolarHBondContact O-CE 3.48Å; M49-K132 PolarHBondContact O-NZ 2.86Å; M49-K132 VanDerWaalsContact O-NZ 3.07Å; R52-K132 WeakPolarHBondContact O-CE 3.38Å; R52-K132 PolarHBondContact O-NZ 3.41Å; K54-K132 HydrophobicContact CB-CB 4.33Å; K54-K132 HydrophobicContact CB-CD 4.18Å; K54-K132 HydrophobicContact CB-CG 4.17Å; I128-K132 PolarHBondContact O-N 3.45Å; V129-K132 PolarHBondContact O-N 2.98Å; V129-K132 VanDerWaalsContact O-N 3.08Å; L130-K132 VanDerWaalsContact C-N 3.28Å
133Q93.9Very high96Very high102 Ų10250.1 Ų50.148%0.47723%0.231SC..  trans-80157.9175.3-60.8-57-6200110.3I128 R131 L135I128-Q133 HydrophobicContact CG2-CB 4.02Å; I128-Q133 PolarHBondContact O-N 3.47Å; R131-Q133 HydrophobicContact CB-CG 3.96Å; R131-Q133 PolarHBondContact O-N 2.84Å; R131-Q133 PolarHBondContact O-NE2 2.7Å; Q133-L135 PolarHBondContact O-N 3.16Å
134K93.1Very high96.1Very high185 Ų18551.4 Ų51.480%0.80423%0.233SC*.  trans-68105.3178.8-174.5-176.7-179.8-175.30109.6I136K134-I136 HydrophobicContact CD-CG2 4.24Å; K134-I136 HydrophobicContact CG-CG2 4.2Å; K134-I136 PolarHBondContact O-N 3.44Å
135L95.1Very high96.1Very high23 Ų2352 Ų5212%0.1224%0.238CC..  trans-75.7108.1169.5-177.460.5000109.5I42 T125 I128 V129 Q133 H139 W140I42-L135 HydrophobicContact CD1-CD2 4.28Å; I42-L135 HydrophobicContact CG1-CD2 4.11Å; I42-L135 HydrophobicContact CG2-CD2 3.62Å; T125-L135 HydrophobicContact CG2-CD1 3.84Å; T125-L135 HydrophobicContact CG2-CD2 3.96Å; I128-L135 HydrophobicContact CD1-CD1 4.4Å; I128-L135 HydrophobicContact CG2-CB 3.86Å; I128-L135 HydrophobicContact CG2-CD1 4.06Å; V129-L135 HydrophobicContact CG2-CD2 4.33Å; Q133-L135 PolarHBondContact O-N 3.16Å; L135-H139 HydrophobicContact CD1-CB 4.38Å; L135-W140 HydrophobicContact CD1-CB 4.3Å; L135-W140 HydrophobicContact CD2-CB 4.47Å
136I95.7Very high96.1Very high56 Ų5652.5 Ų52.529%0.28724%0.241SC..  trans-86154179.361.2172.9000111.5K134 L138 H139 W140 F248K134-I136 HydrophobicContact CD-CG2 4.24Å; K134-I136 HydrophobicContact CG-CG2 4.2Å; K134-I136 PolarHBondContact O-N 3.44Å; I136-L138 HydrophobicContact CD1-CB 4.18Å; I136-L138 HydrophobicContact CG1-CB 4.47Å; I136-L138 PolarHBondContact O-N 2.98Å; I136-H139 HydrophobicContact CG1-CB 3.86Å; I136-H139 PolarHBondContact O-N 3.14Å; I136-W140 VanDerWaalsContact O-CD1 3.29Å; I136-F248 HydrophobicContact CD1-CD2 4.14Å; I136-F248 HydrophobicContact CD1-CE2 4.17Å
137F96.3Very high96.2Very high102 Ų10249.3 Ų49.345%0.44722%0.224SC..Hα-helixtrans-53.9-51.2178.9175.7-105.7000112.5H139 W140 Y141 L244F137-H139 PolarHBondContact O-N 3.33Å; F137-H139 VanDerWaalsContact O-N 3.13Å; F137-W140 AromaticContact CD2-CE2 3.68Å; F137-W140 HydrophobicContact CD2-CH2 4.12Å; F137-W140 AromaticContact CD2-CZ2 3.33Å; F137-W140 HydrophobicContact CD2-CZ2 3.33Å; F137-W140 AromaticContact CD2-NE1 3.86Å; F137-W140 AromaticContact CE2-CH2 3.76Å; F137-W140 HydrophobicContact CE2-CH2 3.76Å; F137-W140 AromaticContact CE2-CZ2 3.45Å; F137-W140 HydrophobicContact CE2-CZ2 3.45Å; F137-W140 VanDerWaalsContact CE2-CZ2 3.45Å; F137-W140 PolarHBondContact O-N 3.41Å; F137-Y141 HydrophobicContact CE1-CD1 4.36Å; F137-Y141 HydrophobicContact CE1-CG 4.11Å; F137-Y141 HydrophobicContact CE2-CD2 4.43Å; F137-Y141 HydrophobicContact CE2-CG 4.41Å; F137-Y141 HydrophobicContact CZ-CD1 4.47Å; F137-Y141 AromaticContact CZ-CD2 3.89Å; F137-Y141 HydrophobicContact CZ-CD2 3.89Å; F137-Y141 AromaticContact CZ-CG 3.84Å; F137-Y141 HydrophobicContact CZ-CG 3.84Å; F137-Y141 WeakPolarHBondContact O-CB 3.44Å; F137-Y141 PolarHBondContact O-N 2.9Å; F137-L244 HydrophobicContact CD1-CD1 4.35Å; F137-L244 HydrophobicContact CD1-CD2 3.94Å; F137-L244 HydrophobicContact CE1-CD1 3.98Å; F137-L244 HydrophobicContact CE1-CD2 4Å
138L96.4Very high96.3Very high16 Ų1650 Ų508%0.08423%0.229CC..Hα-helixtrans-49.1-43.2179.8172.857.9000112.7I136 H142 L244 F245 F248I136-L138 HydrophobicContact CD1-CB 4.18Å; I136-L138 HydrophobicContact CG1-CB 4.47Å; I136-L138 PolarHBondContact O-N 2.98Å; L138-H142 WeakPolarHBondContact O-CB 3.42Å; L138-H142 PolarHBondContact O-N 3.47Å; L138-L244 HydrophobicContact CD1-CB 3.46Å; L138-L244 VanDerWaalsContact CD1-CB 3.46Å; L138-L244 HydrophobicContact CD1-CD1 4.01Å; L138-L244 HydrophobicContact CD1-CG 4.36Å; L138-L244 HydrophobicContact CG-CB 4.35Å; L138-F245 HydrophobicContact CD1-CD2 4.08Å; L138-F245 HydrophobicContact CD1-CE2 3.97Å; L138-F245 HydrophobicContact CD1-CZ 4.39Å; L138-F245 HydrophobicContact CD2-CD1 3.96Å; L138-F245 HydrophobicContact CD2-CD2 4.44Å; L138-F245 HydrophobicContact CD2-CE1 3.97Å; L138-F245 HydrophobicContact CD2-CE2 4.46Å; L138-F245 HydrophobicContact CD2-CG 4.19Å; L138-F245 HydrophobicContact CD2-CZ 4.24Å; L138-F248 HydrophobicContact CD2-CB 3.88Å; L138-F248 HydrophobicContact CD2-CG 4.19Å
139H97Very high96.4Very high36 Ų3649.3 Ų49.317%0.16722%0.224CC..Hα-helixtrans-66.6-57.4-176.7179.787.3000111.6T125 I128 L135 I136 F137 Y141 H142 H143T125-H139 PolarHBondContact OG1-CD2 2.96Å; T125-H139 PolarHBondContact OG1-NE2 2.89Å; I128-H139 WeakPolarHBondContact CD1-NE2 3.44Å; L135-H139 HydrophobicContact CD1-CB 4.38Å; I136-H139 HydrophobicContact CG1-CB 3.86Å; I136-H139 PolarHBondContact O-N 3.14Å; F137-H139 PolarHBondContact O-N 3.33Å; F137-H139 VanDerWaalsContact O-N 3.13Å; H139-Y141 VanDerWaalsContact C-N 3.35Å; H139-Y141 PolarHBondContact O-N 2.91Å; H139-H142 PolarHBondContact O-N 2.87Å; H139-H143 AromaticContact CD2-CD2 3.77Å; H139-H143 AromaticContact CE1-CD2 3.31Å; H139-H143 PolarHBondContact CE1-CD2 3.45Å; H139-H143 AromaticContact CE1-NE2 3.08Å; H139-H143 PolarHBondContact CE1-NE2 2.88Å; H139-H143 AromaticContact CG-CD2 3.89Å; H139-H143 AromaticContact ND1-CD2 3.6Å; H139-H143 AromaticContact ND1-NE2 3.53Å; H139-H143 AromaticContact NE2-CD2 3.46Å; H139-H143 PolarHBondContact NE2-CD2 3.38Å; H139-H143 AromaticContact NE2-NE2 3.66Å; H139-H143 PolarHBondContact O-CD2 2.94Å; H139-H143 PolarHBondContact O-N 3.34Å
140W96.8Very high96.4Very high82 Ų8249.3 Ų49.331%0.31122%0.224SC..Hα-helixtrans-71.9-33.5-173.671-100000112.6Y38 I42 L135 I136 F137 M144Y38-W140 HydrophobicContact CE1-CB 4.26Å; Y38-W140 VanDerWaalsContact OH-CA 3.28Å; Y38-W140 WeakPolarHBondContact OH-CA 3.39Å; Y38-W140 WeakPolarHBondContact OH-CB 3.48Å; I42-W140 HydrophobicContact CD1-CB 3.73Å; I42-W140 HydrophobicContact CD1-CG 4.34Å; L135-W140 HydrophobicContact CD1-CB 4.3Å; L135-W140 HydrophobicContact CD2-CB 4.47Å; I136-W140 VanDerWaalsContact O-CD1 3.29Å; F137-W140 AromaticContact CD2-CE2 3.68Å; F137-W140 HydrophobicContact CD2-CH2 4.12Å; F137-W140 AromaticContact CD2-CZ2 3.33Å; F137-W140 HydrophobicContact CD2-CZ2 3.33Å; F137-W140 AromaticContact CD2-NE1 3.86Å; F137-W140 AromaticContact CE2-CH2 3.76Å; F137-W140 HydrophobicContact CE2-CH2 3.76Å; F137-W140 AromaticContact CE2-CZ2 3.45Å; F137-W140 HydrophobicContact CE2-CZ2 3.45Å; F137-W140 VanDerWaalsContact CE2-CZ2 3.45Å; F137-W140 PolarHBondContact O-N 3.41Å; W140-M144 HydrophobicContact CZ3-CE 3.96Å; W140-M144 WeakPolarHBondContact O-CB 3.48Å; W140-M144 PolarHBondContact O-N 3.16Å
141Y97.8Very high96.4Very high56 Ų5647.5 Ų47.522%0.2221%0.214CC..Hα-helixtrans-59.1-55172.7173.2-107.3000109.6F137 H139 H143 M144 T145 S240 Y241 L244F137-Y141 HydrophobicContact CE1-CD1 4.36Å; F137-Y141 HydrophobicContact CE1-CG 4.11Å; F137-Y141 HydrophobicContact CE2-CD2 4.43Å; F137-Y141 HydrophobicContact CE2-CG 4.41Å; F137-Y141 HydrophobicContact CZ-CD1 4.47Å; F137-Y141 AromaticContact CZ-CD2 3.89Å; F137-Y141 HydrophobicContact CZ-CD2 3.89Å; F137-Y141 AromaticContact CZ-CG 3.84Å; F137-Y141 HydrophobicContact CZ-CG 3.84Å; F137-Y141 WeakPolarHBondContact O-CB 3.44Å; F137-Y141 PolarHBondContact O-N 2.9Å; H139-Y141 VanDerWaalsContact C-N 3.35Å; H139-Y141 PolarHBondContact O-N 2.91Å; Y141-H143 PolarHBondContact O-N 3.25Å; Y141-M144 PolarHBondContact O-N 3.16Å; Y141-T145 HydrophobicContact CD2-CG2 4.14Å; Y141-T145 HydrophobicContact CE2-CG2 3.75Å; Y141-T145 PolarHBondContact O-N 2.97Å; Y141-T145 PolarHBondContact O-OG1 3.37Å; Y141-S240 PolarHBondContact OH-OG 2.92Å; Y141-Y241 HydrophobicContact CD1-CD1 4.26Å; Y141-Y241 AromaticContact CD1-CE1 3.94Å; Y141-Y241 HydrophobicContact CD1-CE1 3.94Å; Y141-Y241 AromaticContact CE1-CD1 3.89Å; Y141-Y241 HydrophobicContact CE1-CD1 3.89Å; Y141-Y241 AromaticContact CE1-CE1 3.64Å; Y141-Y241 HydrophobicContact CE1-CE1 3.64Å; Y141-L244 HydrophobicContact CD1-CD1 3.62Å; Y141-L244 HydrophobicContact CE1-CD1 3.81Å
142H97.6Very high96.5Very high20 Ų2046.9 Ų46.99%0.09321%0.212CC..Hα-helixtrans-54.7-52.1-180175.482.9000113.2L138 H139 M144 T145 V146 Y241L138-H142 WeakPolarHBondContact O-CB 3.42Å; L138-H142 PolarHBondContact O-N 3.47Å; H139-H142 PolarHBondContact O-N 2.87Å; H142-M144 VanDerWaalsContact C-N 3.29Å; H142-M144 PolarHBondContact O-N 3.36Å; H142-T145 PolarHBondContact O-N 3.35Å; H142-T145 PolarHBondContact O-OG1 3.19Å; H142-V146 WeakPolarHBondContact O-CB 3.27Å; H142-V146 VanDerWaalsContact O-CG1 3.25Å; H142-V146 WeakPolarHBondContact O-CG1 3.48Å; H142-V146 PolarHBondContact O-N 3.23Å; H142-Y241 HydrophobicContact CB-CE1 4.15Å; H142-Y241 AromaticContact CE1-CD2 3.99Å; H142-Y241 AromaticContact CE1-CE2 3.61Å; H142-Y241 AromaticContact ND1-CD2 3.53Å; H142-Y241 AromaticContact ND1-CE1 3.77Å; H142-Y241 AromaticContact ND1-CE2 3.17Å; H142-Y241 WeakPolarHBondContact ND1-CE2 3.47Å; H142-Y241 AromaticContact ND1-CG 3.96Å; H142-Y241 AromaticContact ND1-CZ 3.31Å; H142-Y241 VanDerWaalsContact ND1-CZ 3.31Å; H142-Y241 PolarHBondContact O-OH 3.49Å
143H97.7Very high96.5Very high10 Ų1042.7 Ų42.75%0.04620%0.196CC..Hα-helixtrans-61.4-37.4-178.2-84.1-74.5000112.7L122 D124 H139 Y141 L147L122-H143 HydrophobicContact CD2-CB 3.94Å; D124-H143 IonicContact OD2-CE1 3.72Å; D124-H143 IonicContact OD2-NE2 3.37Å; H139-H143 AromaticContact CD2-CD2 3.77Å; H139-H143 AromaticContact CE1-CD2 3.31Å; H139-H143 PolarHBondContact CE1-CD2 3.45Å; H139-H143 AromaticContact CE1-NE2 3.08Å; H139-H143 PolarHBondContact CE1-NE2 2.88Å; H139-H143 AromaticContact CG-CD2 3.89Å; H139-H143 AromaticContact ND1-CD2 3.6Å; H139-H143 AromaticContact ND1-NE2 3.53Å; H139-H143 AromaticContact NE2-CD2 3.46Å; H139-H143 PolarHBondContact NE2-CD2 3.38Å; H139-H143 AromaticContact NE2-NE2 3.66Å; H139-H143 PolarHBondContact O-CD2 2.94Å; H139-H143 PolarHBondContact O-N 3.34Å; Y141-H143 PolarHBondContact O-N 3.25Å; H143-L147 WeakPolarHBondContact O-CB 3.27Å; H143-L147 PolarHBondContact O-N 3.42Å
144M97.5Very high96.5Very high44 Ų4437.9 Ų37.922%0.21717%0.173CC..Hα-helixtrans-70-49.6177.3-171.517769.400111.3Y38 W140 Y141 H142 L147 L148Y38-M144 HydrophobicContact CD1-CB 4.3Å; Y38-M144 HydrophobicContact CE1-CB 4.18Å; W140-M144 HydrophobicContact CZ3-CE 3.96Å; W140-M144 WeakPolarHBondContact O-CB 3.48Å; W140-M144 PolarHBondContact O-N 3.16Å; Y141-M144 PolarHBondContact O-N 3.16Å; H142-M144 VanDerWaalsContact C-N 3.29Å; H142-M144 PolarHBondContact O-N 3.36Å; M144-L147 PolarHBondContact O-N 3.02Å; M144-L148 HydrophobicContact CG-CD1 4.45Å; M144-L148 WeakPolarHBondContact O-CG 3.42Å; M144-L148 PolarHBondContact O-N 3.13Å
145T97.7Very high96.4Very high27 Ų2730.9 Ų30.917%0.16614%0.143CC..Hα-helixtrans-72.8-34.3-175.244.60000113Y141 H142 L147 L148 Y149 Y241Y141-T145 HydrophobicContact CD2-CG2 4.14Å; Y141-T145 HydrophobicContact CE2-CG2 3.75Å; Y141-T145 PolarHBondContact O-N 2.97Å; Y141-T145 PolarHBondContact O-OG1 3.37Å; H142-T145 PolarHBondContact O-N 3.35Å; H142-T145 PolarHBondContact O-OG1 3.19Å; T145-L147 VanDerWaalsContact C-N 3.35Å; T145-L148 PolarHBondContact O-N 2.66Å; T145-Y149 VanDerWaalsContact O-CB 3.27Å; T145-Y149 WeakPolarHBondContact O-CB 3.45Å; T145-Y149 PolarHBondContact O-N 3.34Å; T145-Y241 WeakPolarHBondContact CB-OH 3.36Å; T145-Y241 WeakPolarHBondContact OG1-CE1 3.38Å; T145-Y241 PolarHBondContact OG1-OH 3.45Å
146V97.2Very high96.2Very high11 Ų1131.4 Ų31.47%0.06715%0.146CC..Hα-helixtrans-69.1-33.917678.40000111.9K118 H142 S150 Y241K118-V146 HydrophobicContact CD-CG1 4.3Å; H142-V146 WeakPolarHBondContact O-CB 3.27Å; H142-V146 VanDerWaalsContact O-CG1 3.25Å; H142-V146 WeakPolarHBondContact O-CG1 3.48Å; H142-V146 PolarHBondContact O-N 3.23Å; V146-S150 WeakPolarHBondContact O-CB 3.45Å; V146-S150 PolarHBondContact O-N 3.45Å; V146-S150 PolarHBondContact O-OG 2.91Å; V146-Y241 PolarHBondContact N-OH 3.14Å; V146-Y241 VanDerWaalsContact N-OH 3.16Å
147L97.7Very high96.1Very high0 Ų030.8 Ų30.80%014%0.142CC..Hα-helixtrans-63.2-51.8173.3173.262.4000110.9F34 K118 A119 L122 H143 M144 T145 Y149 S150 W151F34-L147 HydrophobicContact CB-CD2 3.84Å; K118-L147 HydrophobicContact CB-CB 4.23Å; K118-L147 HydrophobicContact CB-CD1 3.81Å; A119-L147 HydrophobicContact CB-CD1 4.15Å; L122-L147 HydrophobicContact CD1-CD2 3.8Å; L122-L147 HydrophobicContact CD2-CD2 4.36Å; L122-L147 HydrophobicContact CG-CD2 4.36Å; H143-L147 WeakPolarHBondContact O-CB 3.27Å; H143-L147 PolarHBondContact O-N 3.42Å; M144-L147 PolarHBondContact O-N 3.02Å; T145-L147 VanDerWaalsContact C-N 3.35Å; L147-Y149 PolarHBondContact O-N 2.84Å; L147-S150 PolarHBondContact O-OG 2.75Å; L147-W151 HydrophobicContact CD1-CG 4.41Å; L147-W151 PolarHBondContact O-N 2.98Å
148L97.7Very high95.9Very high39 Ų3926 Ų2620%0.20412%0.121CC..Hα-helixtrans-59.1-49.4178.3-68171.8000111.6F32 S35 M144 T145 Y152F32-L148 HydrophobicContact CD1-CD2 3.61Å; F32-L148 HydrophobicContact CE1-CD2 3.86Å; F32-L148 HydrophobicContact CG-CD2 4.04Å; F32-L148 HydrophobicContact CZ-CD2 4.5Å; S35-L148 WeakPolarHBondContact OG-CD2 3.29Å; S35-L148 WeakPolarHBondContact OG-CG 3.37Å; M144-L148 HydrophobicContact CG-CD1 4.45Å; M144-L148 WeakPolarHBondContact O-CG 3.42Å; M144-L148 PolarHBondContact O-N 3.13Å; T145-L148 PolarHBondContact O-N 2.66Å; L148-Y152 VanDerWaalsContact O-CB 3.31Å; L148-Y152 WeakPolarHBondContact O-CB 3.4Å; L148-Y152 PolarHBondContact O-N 3.4Å
149Y97.3Very high95.8Very high24 Ų2425.4 Ų25.49%0.09412%0.119CC..Hα-helixtrans-66.8-45.7-176.1176.7-103.7000112.4T145 L147 W151 Y152 S153 W233 S234 M237T145-Y149 VanDerWaalsContact O-CB 3.27Å; T145-Y149 WeakPolarHBondContact O-CB 3.45Å; T145-Y149 PolarHBondContact O-N 3.34Å; L147-Y149 PolarHBondContact O-N 2.84Å; Y149-W151 VanDerWaalsContact C-N 3.33Å; Y149-W151 PolarHBondContact O-N 3.41Å; Y149-Y152 PolarHBondContact O-N 2.62Å; Y149-S153 WeakPolarHBondContact O-CB 3.31Å; Y149-S153 PolarHBondContact O-N 3.37Å; Y149-S153 PolarHBondContact O-OG 2.95Å; Y149-W233 HydrophobicContact CD2-CB 4.38Å; Y149-W233 HydrophobicContact CE2-CB 4.48Å; Y149-S234 WeakPolarHBondContact OH-CB 3.44Å; Y149-S234 PolarHBondContact OH-OG 3.18Å; Y149-S234 VanDerWaalsContact OH-OG 3.12Å; Y149-M237 HydrophobicContact CD1-CE 3.38Å; Y149-M237 HydrophobicContact CD1-SD 3.76Å; Y149-M237 HydrophobicContact CE1-CE 3.77Å; Y149-M237 HydrophobicContact CG-CE 3.97Å; Y149-M237 HydrophobicContact CG-SD 3.81Å
150S96.8Very high95.6Very high6 Ų623.8 Ų23.84%0.04211%0.112CC..Hα-helixtrans-62.9-38.3-179.157.40000112.8K118 V146 L147 S153 Y154K118-S150 WeakPolarHBondContact CG-OG 3.13Å; V146-S150 WeakPolarHBondContact O-CB 3.45Å; V146-S150 PolarHBondContact O-N 3.45Å; V146-S150 PolarHBondContact O-OG 2.91Å; L147-S150 PolarHBondContact O-OG 2.75Å; S150-S153 PolarHBondContact O-OG 2.87Å; S150-Y154 VanDerWaalsContact O-CB 3.29Å; S150-Y154 WeakPolarHBondContact O-CB 3.47Å; S150-Y154 PolarHBondContact O-N 3.33Å; S150-Y154 VanDerWaalsContact O-N 3.12Å
151W96.9Very high95.5Very high5 Ų520.1 Ų20.12%0.01910%0.099CC..Hα-helixtrans-70.4-40.5176.8-76.947.1000111.5W23 M24 W28 K30 F34 V115 L116 L147 Y149W23-W151 AromaticContact CH2-CH2 3.71Å; W23-W151 HydrophobicContact CH2-CH2 3.71Å; W23-W151 AromaticContact CH2-CZ3 3.98Å; W23-W151 HydrophobicContact CH2-CZ3 3.98Å; W23-W151 AromaticContact CZ3-CH2 3.93Å; W23-W151 HydrophobicContact CZ3-CH2 3.93Å; W23-W151 HydrophobicContact CZ3-CZ3 4.02Å; M24-W151 HydrophobicContact CE-CB 4Å; M24-W151 HydrophobicContact CE-CD2 3.96Å; M24-W151 HydrophobicContact CE-CE3 4.2Å; M24-W151 HydrophobicContact CE-CG 3.92Å; W28-W151 HydrophobicContact CB-CB 4.35Å; W28-W151 WeakPolarHBondContact CB-O 3.31Å; K30-W151 HydrophobicContact CB-CZ3 3.97Å; F34-W151 HydrophobicContact CD2-CH2 4.34Å; F34-W151 HydrophobicContact CD2-CZ2 4.49Å; F34-W151 AromaticContact CE2-CH2 3.66Å; F34-W151 HydrophobicContact CE2-CH2 3.66Å; F34-W151 HydrophobicContact CE2-CZ2 4.08Å; F34-W151 HydrophobicContact CE2-CZ3 4.27Å; V115-W151 HydrophobicContact CG1-CB 4.44Å; V115-W151 HydrophobicContact CG1-CG 3.9Å; V115-W151 PolarHBondContact O-NE1 3.46Å; L116-W151 HydrophobicContact CD2-CH2 4.31Å; L116-W151 HydrophobicContact CD2-CZ2 3.91Å; L147-W151 HydrophobicContact CD1-CG 4.41Å; L147-W151 PolarHBondContact O-N 2.98Å; Y149-W151 VanDerWaalsContact C-N 3.33Å; Y149-W151 PolarHBondContact O-N 3.41Å
152Y95.9Very high95.4Very high40 Ų4017.7 Ų17.716%0.1579%0.092CC..Hα-helixtrans-66.3-41.3176.5172.8-110000112.7W28 L148 Y149 K155 N230W28-Y152 HydrophobicContact CE3-CD2 4.1Å; W28-Y152 HydrophobicContact CH2-CD2 4.08Å; W28-Y152 AromaticContact CZ3-CD2 3.79Å; W28-Y152 HydrophobicContact CZ3-CD2 3.79Å; L148-Y152 VanDerWaalsContact O-CB 3.31Å; L148-Y152 WeakPolarHBondContact O-CB 3.4Å; L148-Y152 PolarHBondContact O-N 3.4Å; Y149-Y152 PolarHBondContact O-N 2.62Å; Y152-K155 HydrophobicContact CD2-CD 4.42Å; Y152-K155 WeakPolarHBondContact O-CD 3.38Å; Y152-K155 VanDerWaalsContact O-CG 3.26Å; Y152-K155 WeakPolarHBondContact O-CG 3.49Å; Y152-N230 VanDerWaalsContact CD1-OD1 3.28Å; Y152-N230 WeakPolarHBondContact CD1-OD1 3.46Å; Y152-N230 HydrophobicContact CE1-CB 4.47Å; Y152-N230 VanDerWaalsContact CE1-CG 3.45Å; Y152-N230 WeakPolarHBondContact CE1-OD1 3.44Å
153S94.8Very high95.4Very high13 Ų1319.7 Ų19.79%0.09110%0.098CC..Hα-helixtrans-79.3-34.8-174.466.30000113.3Y149 S150 K155 D156 M157 V158Y149-S153 WeakPolarHBondContact O-CB 3.31Å; Y149-S153 PolarHBondContact O-N 3.37Å; Y149-S153 PolarHBondContact O-OG 2.95Å; S150-S153 PolarHBondContact O-OG 2.87Å; S153-K155 VanDerWaalsContact C-N 3.3Å; S153-K155 PolarHBondContact O-N 2.87Å; S153-D156 PolarHBondContact O-N 2.91Å; S153-M157 PolarHBondContact O-N 2.8Å; S153-V158 PolarHBondContact O-N 3.41Å
154Y94.4Very high95.3Very high1 Ų119.8 Ų19.80%0.00410%0.099CC..Hα-helixtrans-64.1-34.9178.7-174.1-81.4000112.6I21 M24 Y102 A111 Y112 V115 S150 D156 M157I21-Y154 HydrophobicContact CG1-CE1 4.28Å; M24-Y154 HydrophobicContact CB-CD1 3.67Å; M24-Y154 HydrophobicContact CB-CE1 4.04Å; M24-Y154 HydrophobicContact CE-CD1 4.44Å; M24-Y154 HydrophobicContact CG-CD1 3.46Å; M24-Y154 VanDerWaalsContact CG-CD1 3.46Å; M24-Y154 HydrophobicContact CG-CE1 3.61Å; M24-Y154 HydrophobicContact CG-CG 4.46Å; Y102-Y154 AromaticContact CD1-CD2 3.78Å; Y102-Y154 HydrophobicContact CD1-CD2 3.78Å; Y102-Y154 AromaticContact CD1-CE2 3.59Å; Y102-Y154 HydrophobicContact CD1-CE2 3.59Å; Y102-Y154 AromaticContact CE1-CD2 3.58Å; Y102-Y154 HydrophobicContact CE1-CD2 3.58Å; Y102-Y154 AromaticContact CE1-CE2 3.9Å; Y102-Y154 HydrophobicContact CE1-CE2 3.9Å; Y102-Y154 HydrophobicContact CE1-CG 4.29Å; A111-Y154 HydrophobicContact CB-CE2 3.88Å; A111-Y154 WeakPolarHBondContact O-CE2 3.41Å; Y112-Y154 HydrophobicContact CD2-CE1 4.25Å; V115-Y154 HydrophobicContact CB-CD2 4.39Å; V115-Y154 HydrophobicContact CG2-CD2 3.46Å; V115-Y154 VanDerWaalsContact CG2-CD2 3.46Å; V115-Y154 HydrophobicContact CG2-CE2 4.31Å; V115-Y154 HydrophobicContact CG2-CG 3.82Å; S150-Y154 VanDerWaalsContact O-CB 3.29Å; S150-Y154 WeakPolarHBondContact O-CB 3.47Å; S150-Y154 PolarHBondContact O-N 3.33Å; S150-Y154 VanDerWaalsContact O-N 3.12Å; Y154-D156 PolarHBondContact O-N 3.03Å; Y154-D156 VanDerWaalsContact O-N 3.12Å; Y154-M157 PolarHBondContact O-N 3.42Å
155K91Very high95.3Very high37 Ų3718.1 Ų18.116%0.1619%0.09CC..THydrogen-bonded Turntrans-56.6-31.3179.493.4-171.3169.161.60112.7Q25 W28 Y152 S153Q25-K155 HydrophobicContact CG-CB 4.13Å; Q25-K155 WeakPolarHBondContact CG-O 3.24Å; Q25-K155 PolarHBondContact NE2-O 2.83Å; W28-K155 HydrophobicContact CD2-CD 4.03Å; W28-K155 HydrophobicContact CG-CD 3.83Å; Y152-K155 HydrophobicContact CD2-CD 4.42Å; Y152-K155 WeakPolarHBondContact O-CD 3.38Å; Y152-K155 VanDerWaalsContact O-CG 3.26Å; Y152-K155 WeakPolarHBondContact O-CG 3.49Å; S153-K155 VanDerWaalsContact C-N 3.3Å; S153-K155 PolarHBondContact O-N 2.87Å
156D90.3Very high95.3Very high34 Ų3417.7 Ų17.718%0.1829%0.088CC..THydrogen-bonded Turntrans-100.40-177.6-66.3-26.1000111.9Q99 S153 Y154 V158 H227 N230Q99-D156 PolarHBondContact NE2-O 3.47Å; S153-D156 PolarHBondContact O-N 2.91Å; Y154-D156 PolarHBondContact O-N 3.03Å; Y154-D156 VanDerWaalsContact O-N 3.12Å; D156-V158 HydrophobicContact CB-CG1 3.78Å; D156-V158 PolarHBondContact O-N 3.03Å; D156-V158 VanDerWaalsContact O-N 3.17Å; D156-H227 IonicContact OD2-CD2 3.46Å; D156-N230 PolarHBondContact OD2-ND2 3.34Å; D156-N230 VanDerWaalsContact OD2-ND2 3.12Å
157M93Very high95.3Very high43 Ų4318.2 Ų18.221%0.2129%0.09CC..THydrogen-bonded Turntrans47.743.9-177.3-62.9-179.6-71.500112.4I21 Q99 Y102 S153 Y154I21-M157 HydrophobicContact CD1-SD 3.51Å; I21-M157 VanDerWaalsContact CD1-SD 3.51Å; I21-M157 HydrophobicContact CG1-SD 4.07Å; I21-M157 HydrophobicContact CG2-SD 4.42Å; Q99-M157 WeakPolarHBondContact CG-O 3.34Å; Q99-M157 PolarHBondContact NE2-O 3.17Å; Y102-M157 HydrophobicContact CD1-CB 4.4Å; Y102-M157 HydrophobicContact CD1-CG 4.16Å; Y102-M157 HydrophobicContact CD2-CB 3.64Å; Y102-M157 HydrophobicContact CD2-CG 4.11Å; Y102-M157 HydrophobicContact CE2-CB 3.86Å; Y102-M157 VanDerWaalsContact CE2-O 3.31Å; Y102-M157 WeakPolarHBondContact CE2-O 3.22Å; Y102-M157 HydrophobicContact CG-CB 3.92Å; Y102-M157 HydrophobicContact CG-CG 3.85Å; Y102-M157 HydrophobicContact CG-SD 4.42Å; S153-M157 PolarHBondContact O-N 2.8Å; Y154-M157 PolarHBondContact O-N 3.42Å
158V93.2Very high95.3Very high2 Ų218.5 Ų18.51%0.0129%0.091CC..  trans-59.3142.6-167.9-61.20000113Y102 S153 D156 G161 N230Y102-V158 PolarHBondContact OH-O 3.41Å; Y102-V158 VanDerWaalsContact OH-O 3.06Å; S153-V158 PolarHBondContact O-N 3.41Å; D156-V158 HydrophobicContact CB-CG1 3.78Å; D156-V158 PolarHBondContact O-N 3.03Å; D156-V158 VanDerWaalsContact O-N 3.17Å; V158-G161 PolarHBondContact O-N 3.24Å; V158-N230 HydrophobicContact CG1-CB 3.93Å
159A93.3Very high95.3Very high4 Ų416.8 Ų16.83%0.0338%0.082CC..THydrogen-bonded Turntrans-51.5146.6167.500000111.8G161 V214 P225A159-G161 PolarHBondContact O-N 3.02Å; A159-V214 HydrophobicContact CB-CG1 4.04Å; A159-V214 HydrophobicContact CB-CG2 4.14Å; A159-P225 WeakPolarHBondContact CB-O 3.49Å; A159-P225 PolarHBondContact N-O 2.83Å; A159-P225 VanDerWaalsContact N-O 3.08Å
160G93.8Very high95.4Very high2 Ų220.6 Ų20.62%0.02110%0.103CC..THydrogen-bonded Turntrans84.6-15-174.100000114.1V96 G162 W163 F164V96-G160 WeakPolarHBondContact O-CA 3.46Å; V96-G160 PolarHBondContact O-N 3.15Å; G160-G162 VanDerWaalsContact C-N 3.32Å; G160-G162 PolarHBondContact O-N 3.42Å; G160-W163 WeakPolarHBondContact O-CB 3.5Å; G160-W163 PolarHBondContact O-N 3.04Å; G160-W163 VanDerWaalsContact O-N 3.11Å; G160-F164 VanDerWaalsContact O-CD2 3.26Å; G160-F164 WeakPolarHBondContact O-CD2 3.38Å; G160-F164 WeakPolarHBondContact O-CG 3.38Å; G160-F164 PolarHBondContact O-N 3.3Å
161G94.5Very high95.5Very high4 Ų420.8 Ų20.84%0.04111%0.105CC..Hα-helixtrans-52-45.4-179.500000114.1Y102 V158 A159 W163 F164 M165Y102-G161 WeakPolarHBondContact OH-CA 3.46Å; V158-G161 PolarHBondContact O-N 3.24Å; A159-G161 PolarHBondContact O-N 3.02Å; G161-W163 VanDerWaalsContact C-N 3.32Å; G161-W163 PolarHBondContact O-N 2.91Å; G161-F164 PolarHBondContact O-N 3.01Å; G161-F164 VanDerWaalsContact O-N 3.14Å; G161-M165 WeakPolarHBondContact O-CB 3.44Å; G161-M165 VanDerWaalsContact O-CE 3.23Å; G161-M165 WeakPolarHBondContact O-CE 3.21Å; G161-M165 VanDerWaalsContact O-CG 3.31Å; G161-M165 WeakPolarHBondContact O-CG 3.29Å; G161-M165 PolarHBondContact O-N 3.39Å
162G95.4Very high95.5Very high6 Ų621 Ų216%0.06211%0.105CC..Hα-helixtrans-58.5-40.8179.300000113.6F101 G160 T166F101-G162 VanDerWaalsContact CD2-CA 3.5Å; F101-G162 VanDerWaalsContact CG-CA 3.45Å; G160-G162 VanDerWaalsContact C-N 3.32Å; G160-G162 PolarHBondContact O-N 3.42Å; G162-T166 WeakPolarHBondContact O-CB 3.34Å; G162-T166 PolarHBondContact O-N 3.36Å; G162-T166 PolarHBondContact O-OG1 2.92Å
163W96.7Very high95.6Very high62 Ų6219.4 Ų19.424%0.23510%0.101CC..Hα-helixtrans-66-48.6173-80.597.2000111.5M83 L87 L92 S95 G160 G161 M165 T166 M167 V210M83-W163 HydrophobicContact CE-CD2 3.91Å; M83-W163 HydrophobicContact CE-CG 3.73Å; M83-W163 HydrophobicContact CE-CZ2 4.47Å; L87-W163 HydrophobicContact CD1-CZ2 4.38Å; L87-W163 HydrophobicContact CD2-CH2 4.05Å; L87-W163 HydrophobicContact CD2-CZ2 4.13Å; L92-W163 HydrophobicContact CD1-CZ2 4.16Å; S95-W163 PolarHBondContact O-NE1 3.41Å; S95-W163 PolarHBondContact OG-NE1 3.34Å; S95-W163 VanDerWaalsContact OG-NE1 3.09Å; G160-W163 WeakPolarHBondContact O-CB 3.5Å; G160-W163 PolarHBondContact O-N 3.04Å; G160-W163 VanDerWaalsContact O-N 3.11Å; G161-W163 VanDerWaalsContact C-N 3.32Å; G161-W163 PolarHBondContact O-N 2.91Å; W163-M165 PolarHBondContact O-N 3.39Å; W163-T166 PolarHBondContact O-N 2.66Å; W163-M167 WeakPolarHBondContact O-CB 3.36Å; W163-M167 WeakPolarHBondContact O-CG 3.28Å; W163-M167 PolarHBondContact O-N 3.42Å; W163-V210 HydrophobicContact CB-CG1 4.37Å; W163-V210 HydrophobicContact CB-CG2 4.07Å; W163-V210 HydrophobicContact CG-CG2 4.23Å
164F96.6Very high95.8Very high12 Ų1220.8 Ų20.85%0.05311%0.109CC..Hα-helixtrans-59.3-45-178.6-61.5-39000113G160 G161 M167 N168 V210 N211 Y238G160-F164 VanDerWaalsContact O-CD2 3.26Å; G160-F164 WeakPolarHBondContact O-CD2 3.38Å; G160-F164 WeakPolarHBondContact O-CG 3.38Å; G160-F164 PolarHBondContact O-N 3.3Å; G161-F164 PolarHBondContact O-N 3.01Å; G161-F164 VanDerWaalsContact O-N 3.14Å; F164-M167 HydrophobicContact CB-CE 4.45Å; F164-M167 HydrophobicContact CD1-CE 3.62Å; F164-M167 HydrophobicContact CE1-CE 4.44Å; F164-M167 WeakPolarHBondContact O-CG 3.39Å; F164-N168 VanDerWaalsContact O-CB 3.31Å; F164-N168 WeakPolarHBondContact O-CB 3.42Å; F164-N168 PolarHBondContact O-N 3.14Å; F164-V210 HydrophobicContact CD1-CG1 4.46Å; F164-V210 HydrophobicContact CE1-CB 3.83Å; F164-V210 HydrophobicContact CE1-CG1 3.72Å; F164-V210 HydrophobicContact CE2-CG1 4.4Å; F164-V210 HydrophobicContact CZ-CB 4.15Å; F164-V210 HydrophobicContact CZ-CG1 3.66Å; F164-N211 WeakPolarHBondContact CZ-OD1 3.23Å; F164-Y238 AromaticContact CD1-CE2 3.67Å; F164-Y238 HydrophobicContact CD1-CE2 3.67Å; F164-Y238 AromaticContact CD1-CZ 3.62Å; F164-Y238 VanDerWaalsContact CD1-OH 3.26Å; F164-Y238 WeakPolarHBondContact CD1-OH 3.42Å; F164-Y238 HydrophobicContact CE1-CD2 4.36Å; F164-Y238 AromaticContact CE1-CE2 3.68Å; F164-Y238 HydrophobicContact CE1-CE2 3.68Å; F164-Y238 HydrophobicContact CG-CE2 4.18Å; F164-Y238 HydrophobicContact CZ-CE2 4.23Å
165M97.4Very high95.9Very high8 Ų821.5 Ų21.54%0.03911%0.112CC..Hα-helixtrans-69-47.4179.5-67.2-177.1-92.300111.1F101 Y102 A111 F114 G161 W163 M167 N168 Y169F101-M165 HydrophobicContact CD1-CE 3.44Å; F101-M165 VanDerWaalsContact CD1-CE 3.44Å; F101-M165 HydrophobicContact CD1-SD 4.49Å; F101-M165 HydrophobicContact CE1-CB 4.25Å; F101-M165 HydrophobicContact CE1-CE 3.32Å; F101-M165 HydrophobicContact CE1-SD 3.84Å; F101-M165 HydrophobicContact CZ-CB 4.36Å; F101-M165 HydrophobicContact CZ-CE 4.44Å; Y102-M165 HydrophobicContact CD1-CE 4.32Å; Y102-M165 HydrophobicContact CE1-CE 3.56Å; A111-M165 HydrophobicContact CB-CE 4.19Å; A111-M165 HydrophobicContact CB-SD 3.95Å; F114-M165 HydrophobicContact CB-CG 4.48Å; F114-M165 HydrophobicContact CB-SD 4.29Å; F114-M165 HydrophobicContact CD1-CB 4.28Å; F114-M165 HydrophobicContact CD1-CG 3.53Å; F114-M165 HydrophobicContact CD1-SD 3.98Å; F114-M165 HydrophobicContact CD2-CB 4.18Å; F114-M165 HydrophobicContact CD2-CG 4.31Å; F114-M165 HydrophobicContact CE1-CB 4.44Å; F114-M165 HydrophobicContact CE1-CG 3.72Å; F114-M165 HydrophobicContact CE2-CB 4.32Å; F114-M165 HydrophobicContact CE2-CG 4.46Å; F114-M165 HydrophobicContact CG-CB 4.14Å; F114-M165 HydrophobicContact CG-CG 3.84Å; F114-M165 HydrophobicContact CG-SD 4.24Å; F114-M165 HydrophobicContact CZ-CB 4.45Å; F114-M165 HydrophobicContact CZ-CG 4.18Å; G161-M165 WeakPolarHBondContact O-CB 3.44Å; G161-M165 VanDerWaalsContact O-CE 3.23Å; G161-M165 WeakPolarHBondContact O-CE 3.21Å; G161-M165 VanDerWaalsContact O-CG 3.31Å; G161-M165 WeakPolarHBondContact O-CG 3.29Å; G161-M165 PolarHBondContact O-N 3.39Å; W163-M165 PolarHBondContact O-N 3.39Å; M165-M167 PolarHBondContact O-N 3.19Å; M165-N168 PolarHBondContact O-N 2.88Å; M165-Y169 WeakPolarHBondContact O-CD2 3.31Å; M165-Y169 PolarHBondContact O-N 3.43Å
166T97.3Very high96.2Very high18 Ų1819.7 Ų19.711%0.1111%0.105CC..Hα-helixtrans-63.5-44.9-177.6-61.80000112.4T79 M83 G162 W163 Y169 L170T79-T166 VanDerWaalsContact CB-OG1 3.28Å; T79-T166 WeakPolarHBondContact CB-OG1 3.28Å; T79-T166 WeakPolarHBondContact OG1-CA 3.29Å; T79-T166 WeakPolarHBondContact OG1-CB 3.41Å; T79-T166 PolarHBondContact OG1-OG1 3.02Å; M83-T166 HydrophobicContact CG-CG2 4.25Å; M83-T166 WeakPolarHBondContact CG-OG1 3.28Å; G162-T166 WeakPolarHBondContact O-CB 3.34Å; G162-T166 PolarHBondContact O-N 3.36Å; G162-T166 PolarHBondContact O-OG1 2.92Å; W163-T166 PolarHBondContact O-N 2.66Å; T166-Y169 PolarHBondContact O-N 3.34Å; T166-L170 PolarHBondContact O-N 3.15Å
167M97.4Very high96.6Very high22 Ų2219.9 Ų19.911%0.10811%0.109CC..Hα-helixtrans-67.5-36.9178.270.7-171.4-166.700112W163 F164 M165 L170 V171 Q203 V206 Y238W163-M167 WeakPolarHBondContact O-CB 3.36Å; W163-M167 WeakPolarHBondContact O-CG 3.28Å; W163-M167 PolarHBondContact O-N 3.42Å; F164-M167 HydrophobicContact CB-CE 4.45Å; F164-M167 HydrophobicContact CD1-CE 3.62Å; F164-M167 HydrophobicContact CE1-CE 4.44Å; F164-M167 WeakPolarHBondContact O-CG 3.39Å; M165-M167 PolarHBondContact O-N 3.19Å; M167-L170 PolarHBondContact O-N 3.06Å; M167-V171 WeakPolarHBondContact O-CG2 3.17Å; M167-V171 PolarHBondContact O-N 3.26Å; M167-Q203 HydrophobicContact CB-CG 4.13Å; M167-Q203 HydrophobicContact CE-CG 3.79Å; M167-Q203 HydrophobicContact CG-CG 3.61Å; M167-Q203 HydrophobicContact SD-CG 3.82Å; M167-V206 HydrophobicContact SD-CG1 4.22Å; M167-Y238 HydrophobicContact CE-CE1 3.4Å; M167-Y238 VanDerWaalsContact CE-CE1 3.4Å; M167-Y238 VanDerWaalsContact CE-CZ 3.47Å; M167-Y238 WeakPolarHBondContact CE-OH 3.29Å
168N98.2Very high96.7Very high7 Ų719.6 Ų19.64%0.03711%0.105CC..Hα-helixtrans-65.9-44.6175.8-178.1-91.6000111F114 K118 F164 M165 L170 V171 H172F114-N168 HydrophobicContact CE2-CB 3.64Å; F114-N168 WeakPolarHBondContact CE2-OD1 3.49Å; F114-N168 HydrophobicContact CZ-CB 3.8Å; K118-N168 PolarHBondContact NZ-OD1 3.03Å; F164-N168 VanDerWaalsContact O-CB 3.31Å; F164-N168 WeakPolarHBondContact O-CB 3.42Å; F164-N168 PolarHBondContact O-N 3.14Å; M165-N168 PolarHBondContact O-N 2.88Å; N168-L170 VanDerWaalsContact C-N 3.31Å; N168-L170 PolarHBondContact O-N 3.45Å; N168-V171 PolarHBondContact O-N 3.25Å; N168-H172 PolarHBondContact ND2-CD2 3.2Å; N168-H172 PolarHBondContact ND2-NE2 3.05Å; N168-H172 VanDerWaalsContact ND2-NE2 3.1Å; N168-H172 WeakPolarHBondContact O-CB 3.47Å; N168-H172 PolarHBondContact O-CD2 3.03Å; N168-H172 PolarHBondContact O-N 3.44Å
169Y98.4Very high96.8Very high2 Ų224.2 Ų24.21%0.00812%0.123CC..Hα-helixtrans-55.2-46.6173.6-88.9-52000112.1F71 T79 W110 F114 M165 T166 H172 A173F71-Y169 HydrophobicContact CD1-CE1 4.12Å; F71-Y169 AromaticContact CE1-CE1 3.55Å; F71-Y169 HydrophobicContact CE1-CE1 3.55Å; F71-Y169 AromaticContact CZ-CE1 3.82Å; F71-Y169 HydrophobicContact CZ-CE1 3.82Å; F71-Y169 VanDerWaalsContact CZ-OH 3.25Å; F71-Y169 WeakPolarHBondContact CZ-OH 3.45Å; T79-Y169 HydrophobicContact CG2-CD2 4.21Å; T79-Y169 HydrophobicContact CG2-CE2 4.2Å; W110-Y169 HydrophobicContact CB-CE2 4.48Å; W110-Y169 PolarHBondContact O-OH 2.92Å; W110-Y169 VanDerWaalsContact O-OH 3.05Å; F114-Y169 VanDerWaalsContact CA-OH 3.31Å; F114-Y169 WeakPolarHBondContact CA-OH 3.35Å; F114-Y169 HydrophobicContact CB-CE2 3.78Å; F114-Y169 WeakPolarHBondContact CB-OH 3.48Å; F114-Y169 HydrophobicContact CD2-CD1 4.37Å; F114-Y169 AromaticContact CD2-CD2 3.91Å; F114-Y169 HydrophobicContact CD2-CD2 3.91Å; F114-Y169 HydrophobicContact CD2-CE1 4.14Å; F114-Y169 AromaticContact CD2-CE2 3.63Å; F114-Y169 HydrophobicContact CD2-CE2 3.63Å; F114-Y169 HydrophobicContact CD2-CG 4.28Å; F114-Y169 AromaticContact CD2-CZ 3.76Å; F114-Y169 HydrophobicContact CG-CE2 4.15Å; F114-Y169 PolarHBondContact N-OH 2.61Å; M165-Y169 WeakPolarHBondContact O-CD2 3.31Å; M165-Y169 PolarHBondContact O-N 3.43Å; T166-Y169 PolarHBondContact O-N 3.34Å; Y169-H172 PolarHBondContact O-N 3.48Å; Y169-A173 VanDerWaalsContact O-CB 3.28Å; Y169-A173 WeakPolarHBondContact O-CB 3.26Å; Y169-A173 PolarHBondContact O-N 2.92Å
170L98.2Very high97Very high104 Ų10424.6 Ų24.655%0.54513%0.126SC..Hα-helixtrans-61.3-48.3179179.762.7000111.9A76 T166 M167 N168 A173 V174A76-L170 HydrophobicContact CB-CB 4.37Å; T166-L170 PolarHBondContact O-N 3.15Å; M167-L170 PolarHBondContact O-N 3.06Å; N168-L170 VanDerWaalsContact C-N 3.31Å; N168-L170 PolarHBondContact O-N 3.45Å; L170-A173 WeakPolarHBondContact O-CB 3.38Å; L170-A173 PolarHBondContact O-N 3.06Å; L170-V174 PolarHBondContact O-N 3.48Å
171V98.1Very high97Very high11 Ų1128.2 Ų28.27%0.06715%0.145CC..Hα-helixtrans-67.7-39.6179.8171.30000111.5M167 N168 V174 M175 Q200 Q203M167-V171 WeakPolarHBondContact O-CG2 3.17Å; M167-V171 PolarHBondContact O-N 3.26Å; N168-V171 PolarHBondContact O-N 3.25Å; V171-V174 PolarHBondContact O-N 3.38Å; V171-M175 VanDerWaalsContact O-CB 3.3Å; V171-M175 WeakPolarHBondContact O-CB 3.32Å; V171-M175 PolarHBondContact O-N 2.93Å; V171-Q200 HydrophobicContact CG1-CB 4.49Å; V171-Q200 HydrophobicContact CG1-CG 3.45Å; V171-Q200 VanDerWaalsContact CG1-CG 3.45Å; V171-Q203 HydrophobicContact CG2-CB 4.15Å; V171-Q203 HydrophobicContact CG2-CG 4.39Å; V171-Q203 VanDerWaalsContact CG2-OE1 3.25Å
172H98Very high97Very high8 Ų833.7 Ų33.74%0.03716%0.164CC..Hα-helixtrans-66.6-36.8176.7-81.3-141.7000111.7E121 N168 Y169 V174 M175 Y176E121-H172 IonicContact OE1-ND1 2.8Å; E121-H172 IonicContact OE2-CE1 3.19Å; E121-H172 PolarHBondContact OE2-CE1 3.35Å; E121-H172 VanDerWaalsContact OE2-CE1 3.3Å; E121-H172 IonicContact OE2-ND1 4Å; N168-H172 PolarHBondContact ND2-CD2 3.2Å; N168-H172 PolarHBondContact ND2-NE2 3.05Å; N168-H172 VanDerWaalsContact ND2-NE2 3.1Å; N168-H172 WeakPolarHBondContact O-CB 3.47Å; N168-H172 PolarHBondContact O-CD2 3.03Å; N168-H172 PolarHBondContact O-N 3.44Å; Y169-H172 PolarHBondContact O-N 3.48Å; H172-V174 VanDerWaalsContact C-N 3.33Å; H172-V174 PolarHBondContact O-N 2.97Å; H172-M175 PolarHBondContact O-N 3.29Å; H172-Y176 HydrophobicContact CB-CD2 3.99Å; H172-Y176 HydrophobicContact CB-CE2 4.13Å; H172-Y176 AromaticContact ND1-CE2 3.55Å; H172-Y176 WeakPolarHBondContact O-CB 3.27Å; H172-Y176 WeakPolarHBondContact O-CD2 3.31Å; H172-Y176 PolarHBondContact O-N 2.93Å
173A98.2Very high96.8Very high8 Ų834 Ų347%0.06617%0.166CC..Hα-helixtrans-56.2-47.7173.400000111.3I73 Y169 L170 S177I73-A173 HydrophobicContact CB-CB 4.47Å; I73-A173 HydrophobicContact CG1-CB 3.7Å; Y169-A173 VanDerWaalsContact O-CB 3.28Å; Y169-A173 WeakPolarHBondContact O-CB 3.26Å; Y169-A173 PolarHBondContact O-N 2.92Å; L170-A173 WeakPolarHBondContact O-CB 3.38Å; L170-A173 PolarHBondContact O-N 3.06Å; A173-S177 VanDerWaalsContact O-CB 3.23Å; A173-S177 WeakPolarHBondContact O-CB 3.42Å; A173-S177 PolarHBondContact O-N 3.07Å; A173-S177 PolarHBondContact O-OG 2.82Å
174V97.6Very high96.7Very high42 Ų4235.5 Ų35.526%0.25518%0.182SC..Hα-helixtrans-70.2-45.6178.5-175.10000111.3L170 V171 H172 Y178 F192 I196L170-V174 PolarHBondContact O-N 3.48Å; V171-V174 PolarHBondContact O-N 3.38Å; H172-V174 VanDerWaalsContact C-N 3.33Å; H172-V174 PolarHBondContact O-N 2.97Å; V174-Y178 PolarHBondContact O-N 2.83Å; V174-F192 HydrophobicContact CG1-CZ 4.08Å; V174-I196 HydrophobicContact CG1-CD1 4.47Å; V174-I196 HydrophobicContact CG1-CG1 3.92Å
175M97.6Very high96.4Very high15 Ų1537.2 Ų37.27%0.07420%0.203CC..Hα-helixtrans-63.8-48-177.4-176.5-170.170.500112.4V171 H172 Y178 Y179 I196 Q200V171-M175 VanDerWaalsContact O-CB 3.3Å; V171-M175 WeakPolarHBondContact O-CB 3.32Å; V171-M175 PolarHBondContact O-N 2.93Å; H172-M175 PolarHBondContact O-N 3.29Å; M175-Y178 WeakPolarHBondContact O-CB 3.45Å; M175-Y178 PolarHBondContact O-N 3.42Å; M175-Y179 HydrophobicContact CE-CE2 3.98Å; M175-Y179 HydrophobicContact CG-CD2 4.14Å; M175-Y179 HydrophobicContact CG-CE1 4.43Å; M175-Y179 HydrophobicContact CG-CE2 3.56Å; M175-Y179 PolarHBondContact O-N 2.99Å; M175-Y179 HydrophobicContact SD-CE2 3.76Å; M175-I196 HydrophobicContact CB-CG2 4.14Å; M175-I196 HydrophobicContact CG-CG2 4.31Å; M175-Q200 PolarHBondContact SD-NE2 2.94Å
176Y98Very high96.1Very high0 Ų043.2 Ų43.20%023%0.229CC..Hα-helixtrans-71.8-33.5-179.8-77.7-61.9000112.4L68 D124 H172 Y178 Y179 A180L68-Y176 HydrophobicContact CB-CD1 3.9Å; L68-Y176 HydrophobicContact CB-CD2 3.71Å; L68-Y176 HydrophobicContact CB-CE1 4.11Å; L68-Y176 HydrophobicContact CB-CE2 3.92Å; L68-Y176 HydrophobicContact CB-CG 3.72Å; L68-Y176 HydrophobicContact CD1-CD1 4.06Å; L68-Y176 HydrophobicContact CD1-CE1 3.47Å; L68-Y176 VanDerWaalsContact CD1-CE1 3.47Å; L68-Y176 HydrophobicContact CD1-CE2 4.05Å; L68-Y176 VanDerWaalsContact CD1-CZ 3.48Å; L68-Y176 HydrophobicContact CG-CE1 4.45Å; D124-Y176 VanDerWaalsContact OD2-CE1 3.3Å; D124-Y176 WeakPolarHBondContact OD2-CE1 3.41Å; D124-Y176 PolarHBondContact OD2-OH 3.2Å; H172-Y176 HydrophobicContact CB-CD2 3.99Å; H172-Y176 HydrophobicContact CB-CE2 4.13Å; H172-Y176 AromaticContact ND1-CE2 3.55Å; H172-Y176 WeakPolarHBondContact O-CB 3.27Å; H172-Y176 WeakPolarHBondContact O-CD2 3.31Å; H172-Y176 PolarHBondContact O-N 2.93Å; Y176-Y178 VanDerWaalsContact C-N 3.27Å; Y176-Y178 PolarHBondContact O-N 3.46Å; Y176-Y179 HydrophobicContact CD1-CD2 4.04Å; Y176-Y179 HydrophobicContact CE1-CD2 4.32Å; Y176-Y179 PolarHBondContact O-N 3.37Å; Y176-Y179 VanDerWaalsContact O-N 3.15Å; Y176-A180 WeakPolarHBondContact O-CB 3.25Å; Y176-A180 PolarHBondContact O-N 3.41Å
177S97.2Very high95.7Very high38 Ų3851.9 Ų51.927%0.26627%0.265SS..Hα-helixtrans-58.5-43.7170.4-63.80000110.8A173 A180 L181A173-S177 VanDerWaalsContact O-CB 3.23Å; A173-S177 WeakPolarHBondContact O-CB 3.42Å; A173-S177 PolarHBondContact O-N 3.07Å; A173-S177 PolarHBondContact O-OG 2.82Å; S177-A180 PolarHBondContact O-N 3.25Å; S177-L181 VanDerWaalsContact O-CG 3.3Å; S177-L181 WeakPolarHBondContact O-CG 3.48Å; S177-L181 PolarHBondContact O-N 3.34Å
178Y96.6Very high95.3Very high36 Ų3652.5 Ų52.514%0.14127%0.27CS..Hα-helixtrans-60.9-44.8173.3170.7-100.8000112.7V174 M175 Y176 L181 R182 V188 F192 A193 I196V174-Y178 PolarHBondContact O-N 2.83Å; M175-Y178 WeakPolarHBondContact O-CB 3.45Å; M175-Y178 PolarHBondContact O-N 3.42Å; Y176-Y178 VanDerWaalsContact C-N 3.27Å; Y176-Y178 PolarHBondContact O-N 3.46Å; Y178-L181 PolarHBondContact O-N 3.37Å; Y178-R182 HydrophobicContact CD1-CG 4.35Å; Y178-R182 HydrophobicContact CD2-CG 4.17Å; Y178-R182 HydrophobicContact CE1-CG 3.95Å; Y178-R182 HydrophobicContact CE2-CG 3.8Å; Y178-R182 HydrophobicContact CG-CG 4.44Å; Y178-R182 WeakPolarHBondContact O-CB 3.46Å; Y178-R182 WeakPolarHBondContact O-CG 3.37Å; Y178-R182 PolarHBondContact O-N 2.88Å; Y178-V188 HydrophobicContact CD2-CB 4Å; Y178-V188 HydrophobicContact CD2-CG1 3.71Å; Y178-V188 HydrophobicContact CD2-CG2 4.22Å; Y178-V188 HydrophobicContact CE2-CB 3.66Å; Y178-V188 HydrophobicContact CE2-CG1 3.62Å; Y178-V188 HydrophobicContact CE2-CG2 4.26Å; Y178-F192 AromaticContact CD2-CD1 3.69Å; Y178-F192 HydrophobicContact CD2-CD1 3.69Å; Y178-F192 HydrophobicContact CD2-CE1 4.05Å; Y178-F192 HydrophobicContact CE2-CD1 4.33Å; Y178-F192 HydrophobicContact CG-CD1 4.47Å; Y178-F192 HydrophobicContact CG-CE1 4.49Å; Y178-A193 HydrophobicContact CE2-CB 4.29Å; Y178-I196 HydrophobicContact CD1-CD1 3.86Å; Y178-I196 HydrophobicContact CD2-CD1 3.83Å; Y178-I196 HydrophobicContact CG-CD1 3.42Å; Y178-I196 VanDerWaalsContact CG-CD1 3.42Å
179Y95Very high95Very high100 Ų10055.3 Ų55.339%0.39229%0.29SS..Hα-helixtrans-65.7-39.8178.4-67-22000112.9M175 Y176 R182 A183M175-Y179 HydrophobicContact CE-CE2 3.98Å; M175-Y179 HydrophobicContact CG-CD2 4.14Å; M175-Y179 HydrophobicContact CG-CE1 4.43Å; M175-Y179 HydrophobicContact CG-CE2 3.56Å; M175-Y179 PolarHBondContact O-N 2.99Å; M175-Y179 HydrophobicContact SD-CE2 3.76Å; Y176-Y179 HydrophobicContact CD1-CD2 4.04Å; Y176-Y179 HydrophobicContact CE1-CD2 4.32Å; Y176-Y179 PolarHBondContact O-N 3.37Å; Y176-Y179 VanDerWaalsContact O-N 3.15Å; Y179-R182 PolarHBondContact O-N 3.45Å; Y179-A183 VanDerWaalsContact O-CB 3.29Å; Y179-A183 WeakPolarHBondContact O-CB 3.35Å; Y179-A183 PolarHBondContact O-N 3Å
180A96Very high94.5Very high11 Ų1160.8 Ų60.89%0.09131%0.311CS..Hα-helixtrans-59.3-50.5174.500000110.8L66 Y176 S177 R182 A183 V184L66-A180 HydrophobicContact CB-CB 4.25Å; Y176-A180 WeakPolarHBondContact O-CB 3.25Å; Y176-A180 PolarHBondContact O-N 3.41Å; S177-A180 PolarHBondContact O-N 3.25Å; A180-R182 VanDerWaalsContact C-N 3.32Å; A180-R182 PolarHBondContact O-N 2.82Å; A180-A183 PolarHBondContact O-N 3.28Å; A180-A183 VanDerWaalsContact O-N 3.12Å; A180-V184 WeakPolarHBondContact O-CG2 3.47Å; A180-V184 PolarHBondContact O-N 3.22Å; A180-V184 VanDerWaalsContact O-N 3.08Å
181L95.5Very high94.2Very high78 Ų7864.3 Ų64.341%0.40832%0.322SS..Hα-helixtrans-59-41.5176.4-70.6173.6000112.3S177 Y178 A183 V184 G185 F186 V188S177-L181 VanDerWaalsContact O-CG 3.3Å; S177-L181 WeakPolarHBondContact O-CG 3.48Å; S177-L181 PolarHBondContact O-N 3.34Å; Y178-L181 PolarHBondContact O-N 3.37Å; L181-A183 VanDerWaalsContact C-N 3.35Å; L181-V184 WeakPolarHBondContact O-CG2 3.28Å; L181-G185 PolarHBondContact O-N 3Å; L181-F186 HydrophobicContact CB-CB 4.5Å; L181-F186 WeakPolarHBondContact O-CB 3.27Å; L181-F186 PolarHBondContact O-N 3.03Å; L181-V188 HydrophobicContact CB-CG2 4.06Å
182R93.5Very high94Very high120 Ų12067.4 Ų67.445%0.45333%0.334SS..Hα-helixtrans-67.7-35.4176.8-71.7-70.2-64.2168.1-5.1112.3Y178 Y179 A180 G185 V188Y178-R182 HydrophobicContact CD1-CG 4.35Å; Y178-R182 HydrophobicContact CD2-CG 4.17Å; Y178-R182 HydrophobicContact CE1-CG 3.95Å; Y178-R182 HydrophobicContact CE2-CG 3.8Å; Y178-R182 HydrophobicContact CG-CG 4.44Å; Y178-R182 WeakPolarHBondContact O-CB 3.46Å; Y178-R182 WeakPolarHBondContact O-CG 3.37Å; Y178-R182 PolarHBondContact O-N 2.88Å; Y179-R182 PolarHBondContact O-N 3.45Å; A180-R182 VanDerWaalsContact C-N 3.32Å; A180-R182 PolarHBondContact O-N 2.82Å; R182-G185 PolarHBondContact O-N 3.02Å; R182-V188 HydrophobicContact CG-CG2 4.29Å
183A92.5Very high93.7Very high12 Ų1267.6 Ų67.610%0.09934%0.337CS..Hα-helixtrans-71.4-35.6-17900000112.7L61 A62 Y179 A180 L181 G185L61-A183 HydrophobicContact CD2-CB 4.32Å; L61-A183 HydrophobicContact CG-CB 4.11Å; A62-A183 HydrophobicContact CB-CB 3.68Å; Y179-A183 VanDerWaalsContact O-CB 3.29Å; Y179-A183 WeakPolarHBondContact O-CB 3.35Å; Y179-A183 PolarHBondContact O-N 3Å; A180-A183 PolarHBondContact O-N 3.28Å; A180-A183 VanDerWaalsContact O-N 3.12Å; L181-A183 VanDerWaalsContact C-N 3.35Å; A183-G185 PolarHBondContact O-N 3.35Å
184V93.2Very high93.5Very high93 Ų9370.1 Ų70.156%0.56435%0.349SS*.THydrogen-bonded Turntrans-75.8-5172.7-63.40000113.6A62 A180 L181 F186A62-V184 HydrophobicContact CB-CG1 3.71Å; A180-V184 WeakPolarHBondContact O-CG2 3.47Å; A180-V184 PolarHBondContact O-N 3.22Å; A180-V184 VanDerWaalsContact O-N 3.08Å; L181-V184 WeakPolarHBondContact O-CG2 3.28Å; V184-F186 HydrophobicContact CG2-CD2 3.57Å; V184-F186 HydrophobicContact CG2-CE2 4.1Å
185G90.1Very high93.4Very high48 Ų4873.3 Ų73.350%0.49536%0.359SS..THydrogen-bonded Turntrans100.64.8172.500000115.4L181 R182 A183 K187L181-G185 PolarHBondContact O-N 3Å; R182-G185 PolarHBondContact O-N 3.02Å; A183-G185 PolarHBondContact O-N 3.35Å; G185-K187 PolarHBondContact O-N 3.4Å
186F91.5Very high93.4Very high135 Ų13572.9 Ų72.959%0.59236%0.357SS*.  trans-66.8133.2175.2-80.2-97000111.1L181 V184 V188L181-F186 HydrophobicContact CB-CB 4.5Å; L181-F186 WeakPolarHBondContact O-CB 3.27Å; L181-F186 PolarHBondContact O-N 3.03Å; V184-F186 HydrophobicContact CG2-CD2 3.57Å; V184-F186 HydrophobicContact CG2-CE2 4.1Å; F186-V188 PolarHBondContact O-N 3.25Å; F186-V188 VanDerWaalsContact O-N 3.1Å
187K88.8Confident93.3Very high199 Ų19973.1 Ų73.187%0.86536%0.359SS*.  trans-81.688.5175.1-67.7-176.5-176174.60109.5G185G185-K187 PolarHBondContact O-N 3.4Å
188V90.1Very high93.3Very high35 Ų3575 Ų7521%0.21237%0.365CS..  trans-78.3142.6173-171.10000110.8Y178 L181 R182 F186 F192Y178-V188 HydrophobicContact CD2-CB 4Å; Y178-V188 HydrophobicContact CD2-CG1 3.71Å; Y178-V188 HydrophobicContact CD2-CG2 4.22Å; Y178-V188 HydrophobicContact CE2-CB 3.66Å; Y178-V188 HydrophobicContact CE2-CG1 3.62Å; Y178-V188 HydrophobicContact CE2-CG2 4.26Å; L181-V188 HydrophobicContact CB-CG2 4.06Å; R182-V188 HydrophobicContact CG-CG2 4.29Å; F186-V188 PolarHBondContact O-N 3.25Å; F186-V188 VanDerWaalsContact O-N 3.1Å; V188-F192 HydrophobicContact CG1-CB 3.88Å; V188-F192 HydrophobicContact CG1-CD1 3.65Å; V188-F192 HydrophobicContact CG1-CG 4.05Å
189S90.3Very high93.3Very high66 Ų6674.9 Ų74.946%0.46237%0.368SS..  trans-66.6148.4-175.578.30000112.8K191 F192 A193S189-K191 PolarHBondContact O-N 2.97Å; S189-F192 PolarHBondContact O-N 2.91Å; S189-F192 VanDerWaalsContact O-N 3.15Å; S189-F192 PolarHBondContact OG-N 3.12Å; S189-A193 PolarHBondContact O-N 3.18Å
190R88.8Confident93.4Very high118 Ų11871 Ų7145%0.44535%0.354SS..Hα-helixtrans-60.4-32174-173.7179.9-176.5-152.9-0.9112.3F192 A193 M194 A252 Y253 T257R190-F192 VanDerWaalsContact C-N 3.3Å; R190-F192 PolarHBondContact O-N 3.48Å; R190-A193 PolarHBondContact O-N 3.02Å; R190-M194 PolarHBondContact O-N 3.12Å; R190-A252 PolarHBondContact NH2-O 3.02Å; R190-Y253 HydrophobicContact CG-CD1 4.46Å; R190-Y253 HydrophobicContact CG-CE1 4.33Å; R190-Y253 PolarHBondContact NH2-O 2.84Å; R190-T257 PolarHBondContact NH1-OG1 3.37Å; R190-T257 PolarHBondContact NH2-OG1 3.27Å; R190-T257 VanDerWaalsContact NH2-OG1 3.13Å
191K91Very high93.5Very high177 Ų17771.3 Ų71.377%0.7735%0.354SS*.Hα-helixtrans-62.3-39.3177-65.6-176.3179.2-178.60111.3S189 M194 F195S189-K191 PolarHBondContact O-N 2.97Å; K191-M194 WeakPolarHBondContact O-CB 3.29Å; K191-M194 PolarHBondContact O-N 3.05Å; K191-F195 PolarHBondContact O-N 3.41Å
192F93.7Very high93.6Very high76 Ų7671.4 Ų71.433%0.33336%0.358SS..Hα-helixtrans-69.1-40.8177.3-167-103.3000112V174 Y178 V188 S189 R190 M194 F195 I196V174-F192 HydrophobicContact CG1-CZ 4.08Å; Y178-F192 AromaticContact CD2-CD1 3.69Å; Y178-F192 HydrophobicContact CD2-CD1 3.69Å; Y178-F192 HydrophobicContact CD2-CE1 4.05Å; Y178-F192 HydrophobicContact CE2-CD1 4.33Å; Y178-F192 HydrophobicContact CG-CD1 4.47Å; Y178-F192 HydrophobicContact CG-CE1 4.49Å; V188-F192 HydrophobicContact CG1-CB 3.88Å; V188-F192 HydrophobicContact CG1-CD1 3.65Å; V188-F192 HydrophobicContact CG1-CG 4.05Å; S189-F192 PolarHBondContact O-N 2.91Å; S189-F192 VanDerWaalsContact O-N 3.15Å; S189-F192 PolarHBondContact OG-N 3.12Å; R190-F192 VanDerWaalsContact C-N 3.3Å; R190-F192 PolarHBondContact O-N 3.48Å; F192-M194 VanDerWaalsContact C-N 3.28Å; F192-M194 PolarHBondContact O-N 2.6Å; F192-F195 HydrophobicContact CE2-CD1 4.38Å; F192-F195 WeakPolarHBondContact O-CB 3.1Å; F192-F195 PolarHBondContact O-N 2.71Å; F192-I196 HydrophobicContact CD1-CD1 3.8Å; F192-I196 HydrophobicContact CD1-CG1 4.38Å; F192-I196 HydrophobicContact CE1-CD1 3.7Å; F192-I196 HydrophobicContact CE1-CG1 4.23Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 3.26Å
193A92.7Very high93.8Very high12 Ų1266.4 Ų66.410%0.09934%0.339CS..Hα-helixtrans-59.6-40.5172.800000112.2Y178 S189 R190 I196 T197 Y253Y178-A193 HydrophobicContact CE2-CB 4.29Å; S189-A193 PolarHBondContact O-N 3.18Å; R190-A193 PolarHBondContact O-N 3.02Å; A193-I196 PolarHBondContact O-N 2.85Å; A193-T197 PolarHBondContact O-N 3.02Å; A193-T197 VanDerWaalsContact O-N 3.11Å; A193-T197 PolarHBondContact O-OG1 3.42Å; A193-T197 VanDerWaalsContact O-OG1 3.12Å; A193-Y253 PolarHBondContact O-OH 3.34Å; A193-Y253 VanDerWaalsContact O-OH 3.04Å
194M94.2Very high94.1Very high62 Ų6266 Ų6631%0.30534%0.335SS..Hα-helixtrans-63.2-44.6174.6-176.5-170.4-77.300111.8R190 K191 F192 I196 T197 L198 F249 Y253R190-M194 PolarHBondContact O-N 3.12Å; K191-M194 WeakPolarHBondContact O-CB 3.29Å; K191-M194 PolarHBondContact O-N 3.05Å; F192-M194 VanDerWaalsContact C-N 3.28Å; F192-M194 PolarHBondContact O-N 2.6Å; M194-I196 VanDerWaalsContact C-N 3.33Å; M194-I196 PolarHBondContact O-N 3.36Å; M194-T197 PolarHBondContact O-N 2.66Å; M194-L198 HydrophobicContact CG-CD1 4.43Å; M194-L198 WeakPolarHBondContact O-CG 3.18Å; M194-L198 PolarHBondContact O-N 3.35Å; M194-F249 HydrophobicContact CG-CE2 3.49Å; M194-F249 VanDerWaalsContact CG-CE2 3.49Å; M194-F249 HydrophobicContact CG-CZ 3.76Å; M194-F249 HydrophobicContact SD-CZ 4.23Å; M194-Y253 HydrophobicContact CB-CD1 4.09Å; M194-Y253 HydrophobicContact CB-CE1 3.91Å; M194-Y253 HydrophobicContact CE-CD1 3.94Å; M194-Y253 HydrophobicContact CE-CG 4.04Å; M194-Y253 HydrophobicContact CG-CD1 4.37Å; M194-Y253 HydrophobicContact CG-CG 4.34Å; M194-Y253 PolarHBondContact N-OH 3.46Å
195F96.2Very high94.3Very high108 Ų10865.4 Ų65.447%0.47433%0.329SS..Hα-helixtrans-56.5-45.8174.9171.6-101.1000111.6K191 F192 T197 L198 T199K191-F195 PolarHBondContact O-N 3.41Å; F192-F195 HydrophobicContact CE2-CD1 4.38Å; F192-F195 WeakPolarHBondContact O-CB 3.1Å; F192-F195 PolarHBondContact O-N 2.71Å; F195-T197 VanDerWaalsContact C-N 3.35Å; F195-T197 PolarHBondContact O-N 3.18Å; F195-L198 WeakPolarHBondContact O-CB 3.5Å; F195-L198 PolarHBondContact O-N 3.44Å; F195-L198 VanDerWaalsContact O-N 3.15Å; F195-T199 HydrophobicContact CD1-CG2 4.35Å; F195-T199 HydrophobicContact CD2-CG2 4.43Å; F195-T199 HydrophobicContact CE1-CG2 3.9Å; F195-T199 HydrophobicContact CE2-CG2 3.99Å; F195-T199 HydrophobicContact CZ-CG2 3.7Å; F195-T199 WeakPolarHBondContact O-CG2 3.24Å; F195-T199 PolarHBondContact O-N 3.37Å
196I96.5Very high94.6Very high7 Ų765.7 Ų65.74%0.03632%0.321CS..Hα-helixtrans-58.1-48.3175.9-64.5166.6000110.7V174 M175 Y178 F192 A193 M194 L198 T199 Q200V174-I196 HydrophobicContact CG1-CD1 4.47Å; V174-I196 HydrophobicContact CG1-CG1 3.92Å; M175-I196 HydrophobicContact CB-CG2 4.14Å; M175-I196 HydrophobicContact CG-CG2 4.31Å; Y178-I196 HydrophobicContact CD1-CD1 3.86Å; Y178-I196 HydrophobicContact CD2-CD1 3.83Å; Y178-I196 HydrophobicContact CG-CD1 3.42Å; Y178-I196 VanDerWaalsContact CG-CD1 3.42Å; F192-I196 HydrophobicContact CD1-CD1 3.8Å; F192-I196 HydrophobicContact CD1-CG1 4.38Å; F192-I196 HydrophobicContact CE1-CD1 3.7Å; F192-I196 HydrophobicContact CE1-CG1 4.23Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 3.26Å; A193-I196 PolarHBondContact O-N 2.85Å; M194-I196 VanDerWaalsContact C-N 3.33Å; M194-I196 PolarHBondContact O-N 3.36Å; I196-L198 VanDerWaalsContact C-N 3.28Å; I196-L198 PolarHBondContact O-N 2.68Å; I196-T199 PolarHBondContact O-N 3.32Å; I196-T199 VanDerWaalsContact O-N 3.14Å; I196-T199 PolarHBondContact O-OG1 2.91Å; I196-Q200 PolarHBondContact O-N 2.99Å
197T95.9Very high94.9Very high5 Ų559.3 Ų59.33%0.03129%0.293CS..Hα-helixtrans-61.7-37178.6-49.70000112A193 M194 F195 Q200 I201 F245 F248 F249 Y253A193-T197 PolarHBondContact O-N 3.02Å; A193-T197 VanDerWaalsContact O-N 3.11Å; A193-T197 PolarHBondContact O-OG1 3.42Å; A193-T197 VanDerWaalsContact O-OG1 3.12Å; M194-T197 PolarHBondContact O-N 2.66Å; F195-T197 VanDerWaalsContact C-N 3.35Å; F195-T197 PolarHBondContact O-N 3.18Å; T197-Q200 WeakPolarHBondContact O-CB 3.16Å; T197-Q200 PolarHBondContact O-N 3.46Å; T197-I201 HydrophobicContact CG2-CD1 4.4Å; T197-I201 WeakPolarHBondContact O-CG1 3.34Å; T197-I201 PolarHBondContact O-N 3.19Å; T197-F245 HydrophobicContact CG2-CD1 4.41Å; T197-F248 HydrophobicContact CG2-CD1 3.77Å; T197-F248 HydrophobicContact CG2-CE1 3.95Å; T197-F249 HydrophobicContact CG2-CB 4.2Å; T197-F249 HydrophobicContact CG2-CD2 3.82Å; T197-Y253 HydrophobicContact CG2-CE2 4.15Å; T197-Y253 WeakPolarHBondContact OG1-CE2 3.46Å; T197-Y253 PolarHBondContact OG1-OH 3.03Å
198L96.8Very high95.3Very high77 Ų7751.7 Ų51.740%0.40326%0.264SS..Hα-helixtrans-64-43.5173.9-69.9172000111.8M194 F195 I196 Q200 I201 T202 F249M194-L198 HydrophobicContact CG-CD1 4.43Å; M194-L198 WeakPolarHBondContact O-CG 3.18Å; M194-L198 PolarHBondContact O-N 3.35Å; F195-L198 WeakPolarHBondContact O-CB 3.5Å; F195-L198 PolarHBondContact O-N 3.44Å; F195-L198 VanDerWaalsContact O-N 3.15Å; I196-L198 VanDerWaalsContact C-N 3.28Å; I196-L198 PolarHBondContact O-N 2.68Å; L198-Q200 VanDerWaalsContact C-N 3.27Å; L198-Q200 PolarHBondContact O-N 2.93Å; L198-I201 PolarHBondContact O-N 2.77Å; L198-I201 VanDerWaalsContact O-N 3.13Å; L198-T202 PolarHBondContact O-N 2.65Å; L198-T202 PolarHBondContact O-OG1 2.73Å; L198-T202 VanDerWaalsContact O-OG1 3.12Å; L198-F249 HydrophobicContact CD1-CE2 4.46Å; L198-F249 HydrophobicContact CD2-CD2 4.21Å; L198-F249 HydrophobicContact CD2-CE2 3.6Å; L198-F249 HydrophobicContact CD2-CZ 3.88Å; L198-F249 HydrophobicContact CG-CE2 3.76Å; L198-F249 HydrophobicContact CG-CZ 4.3Å
199T97.4Very high95.6Very high33 Ų3354 Ų5420%0.20228%0.278CS..Hα-helixtrans-60.8-37176.361.90000112.2F195 I196 T202 Q203F195-T199 HydrophobicContact CD1-CG2 4.35Å; F195-T199 HydrophobicContact CD2-CG2 4.43Å; F195-T199 HydrophobicContact CE1-CG2 3.9Å; F195-T199 HydrophobicContact CE2-CG2 3.99Å; F195-T199 HydrophobicContact CZ-CG2 3.7Å; F195-T199 WeakPolarHBondContact O-CG2 3.24Å; F195-T199 PolarHBondContact O-N 3.37Å; I196-T199 PolarHBondContact O-N 3.32Å; I196-T199 VanDerWaalsContact O-N 3.14Å; I196-T199 PolarHBondContact O-OG1 2.91Å; T199-T202 PolarHBondContact O-N 2.97Å; T199-Q203 WeakPolarHBondContact O-CB 3.38Å; T199-Q203 PolarHBondContact O-N 3.48Å
200Q97.7Very high96Very high18 Ų1851 Ų518%0.08426%0.257CS..Hα-helixtrans-64.5-42.4173.5-71.8170.9-30.500112.2V171 M175 I196 T197 L198 Q203 M204 F245V171-Q200 HydrophobicContact CG1-CB 4.49Å; V171-Q200 HydrophobicContact CG1-CG 3.45Å; V171-Q200 VanDerWaalsContact CG1-CG 3.45Å; M175-Q200 PolarHBondContact SD-NE2 2.94Å; I196-Q200 PolarHBondContact O-N 2.99Å; T197-Q200 WeakPolarHBondContact O-CB 3.16Å; T197-Q200 PolarHBondContact O-N 3.46Å; L198-Q200 VanDerWaalsContact C-N 3.27Å; L198-Q200 PolarHBondContact O-N 2.93Å; Q200-Q203 WeakPolarHBondContact O-CB 3.14Å; Q200-Q203 PolarHBondContact O-N 3.13Å; Q200-M204 WeakPolarHBondContact O-CG 3.41Å; Q200-M204 PolarHBondContact O-N 3.43Å; Q200-M204 VanDerWaalsContact O-N 3.15Å; Q200-F245 HydrophobicContact CB-CD1 4.08Å; Q200-F245 HydrophobicContact CB-CE1 3.95Å; Q200-F245 HydrophobicContact CB-CZ 4.26Å; Q200-F245 HydrophobicContact CG-CE1 4.27Å; Q200-F245 HydrophobicContact CG-CZ 4.48Å
201I97.8Very high96.3Very high19 Ų1945.6 Ų45.610%0.09724%0.237CC..Hα-helixtrans-63.5-46.7175.9-68.9166.7000110.6T197 L198 Q203 M204 L205 F242 F245 F249T197-I201 HydrophobicContact CG2-CD1 4.4Å; T197-I201 WeakPolarHBondContact O-CG1 3.34Å; T197-I201 PolarHBondContact O-N 3.19Å; L198-I201 PolarHBondContact O-N 2.77Å; L198-I201 VanDerWaalsContact O-N 3.13Å; I201-Q203 VanDerWaalsContact C-N 3.28Å; I201-Q203 PolarHBondContact O-N 3.35Å; I201-M204 PolarHBondContact O-N 2.94Å; I201-M204 VanDerWaalsContact O-N 3.08Å; I201-L205 PolarHBondContact O-N 3.12Å; I201-L205 VanDerWaalsContact O-N 3.1Å; I201-F242 HydrophobicContact CG2-CD2 3.99Å; I201-F242 HydrophobicContact CG2-CE2 3.65Å; I201-F245 HydrophobicContact CG1-CB 3.71Å; I201-F249 HydrophobicContact CD1-CB 3.91Å; I201-F249 HydrophobicContact CD1-CD2 4.2Å; I201-F249 HydrophobicContact CD1-CG 4.18Å
202T97.6Very high96.6Very high80 Ų8044.3 Ų44.349%0.49123%0.229SC..Hα-helixtrans-59.2-41.4176.5-590000111.2L198 T199 M204 L205 V206L198-T202 PolarHBondContact O-N 2.65Å; L198-T202 PolarHBondContact O-OG1 2.73Å; L198-T202 VanDerWaalsContact O-OG1 3.12Å; T199-T202 PolarHBondContact O-N 2.97Å; T202-M204 VanDerWaalsContact C-N 3.28Å; T202-M204 PolarHBondContact O-N 2.9Å; T202-L205 PolarHBondContact O-N 2.88Å; T202-V206 HydrophobicContact CG2-CG2 4.29Å; T202-V206 WeakPolarHBondContact O-CG2 3.23Å; T202-V206 PolarHBondContact O-N 3.4Å
203Q97.9Very high96.7Very high14 Ų1442.4 Ų42.47%0.06522%0.221CC..Hα-helixtrans-56.9-42174.6-174.4-161.6-44.400111.7M167 V171 T199 Q200 I201 G207M167-Q203 HydrophobicContact CB-CG 4.13Å; M167-Q203 HydrophobicContact CE-CG 3.79Å; M167-Q203 HydrophobicContact CG-CG 3.61Å; M167-Q203 HydrophobicContact SD-CG 3.82Å; V171-Q203 HydrophobicContact CG2-CB 4.15Å; V171-Q203 HydrophobicContact CG2-CG 4.39Å; V171-Q203 VanDerWaalsContact CG2-OE1 3.25Å; T199-Q203 WeakPolarHBondContact O-CB 3.38Å; T199-Q203 PolarHBondContact O-N 3.48Å; Q200-Q203 WeakPolarHBondContact O-CB 3.14Å; Q200-Q203 PolarHBondContact O-N 3.13Å; I201-Q203 VanDerWaalsContact C-N 3.28Å; I201-Q203 PolarHBondContact O-N 3.35Å; Q203-G207 PolarHBondContact O-N 3.25Å
204M97.6Very high96.8Very high3 Ų341.9 Ų41.92%0.01522%0.217CC..Hα-helixtrans-67.2-40.7179-59.2-54.511100112.4Q200 I201 T202 G207 C208 Y238 Y241 F242 F245Q200-M204 WeakPolarHBondContact O-CG 3.41Å; Q200-M204 PolarHBondContact O-N 3.43Å; Q200-M204 VanDerWaalsContact O-N 3.15Å; I201-M204 PolarHBondContact O-N 2.94Å; I201-M204 VanDerWaalsContact O-N 3.08Å; T202-M204 VanDerWaalsContact C-N 3.28Å; T202-M204 PolarHBondContact O-N 2.9Å; M204-G207 PolarHBondContact O-N 3.14Å; M204-C208 PolarHBondContact O-N 3.15Å; M204-C208 PolarHBondContact O-SG 3.08Å; M204-C208 VanDerWaalsContact O-SG 3.41Å; M204-Y238 HydrophobicContact CE-CD1 4.36Å; M204-Y238 HydrophobicContact CE-CE1 4.13Å; M204-Y238 HydrophobicContact SD-CD1 3.61Å; M204-Y238 HydrophobicContact SD-CE1 3.97Å; M204-Y241 WeakPolarHBondContact SD-CB 3.4Å; M204-Y241 HydrophobicContact SD-CD2 3.6Å; M204-Y241 HydrophobicContact SD-CG 4Å; M204-F242 HydrophobicContact CB-CB 3.76Å; M204-F242 HydrophobicContact CB-CD2 4.28Å; M204-F242 HydrophobicContact CG-CB 4.48Å; M204-F245 HydrophobicContact CG-CD2 4.41Å
205L97.1Very high96.8Very high81 Ų8143.9 Ų43.942%0.42422%0.222SC..Hα-helixtrans-61.8-48.7175.6-73.5174.2000112I201 T202 G207 C208 V209 F242I201-L205 PolarHBondContact O-N 3.12Å; I201-L205 VanDerWaalsContact O-N 3.1Å; T202-L205 PolarHBondContact O-N 2.88Å; L205-G207 PolarHBondContact O-N 3.04Å; L205-C208 WeakPolarHBondContact O-CB 3.38Å; L205-C208 PolarHBondContact O-N 3.35Å; L205-V209 WeakPolarHBondContact O-CG2 3.15Å; L205-V209 PolarHBondContact O-N 3.26Å; L205-F242 HydrophobicContact CD1-CE2 3.79Å; L205-F242 HydrophobicContact CD1-CZ 4.49Å; L205-F242 HydrophobicContact CD2-CD2 3.67Å; L205-F242 HydrophobicContact CD2-CE1 4.29Å; L205-F242 HydrophobicContact CD2-CE2 3.29Å; L205-F242 HydrophobicContact CD2-CG 4.32Å; L205-F242 HydrophobicContact CD2-CZ 3.64Å; L205-F242 HydrophobicContact CG-CD2 3.69Å; L205-F242 HydrophobicContact CG-CE2 3.39Å; L205-F242 HydrophobicContact CG-CZ 4.21Å
206V97.4Very high96.8Very high55 Ų5539.9 Ų39.933%0.33321%0.208SC..Hα-helixtrans-60.2-39.3176.1174.20000110.2M167 T202 C208 V209 V210M167-V206 HydrophobicContact SD-CG1 4.22Å; T202-V206 HydrophobicContact CG2-CG2 4.29Å; T202-V206 WeakPolarHBondContact O-CG2 3.23Å; T202-V206 PolarHBondContact O-N 3.4Å; V206-C208 PolarHBondContact O-N 3.06Å; V206-V209 PolarHBondContact O-N 3.42Å; V206-V210 HydrophobicContact CG1-CG2 4.36Å; V206-V210 WeakPolarHBondContact O-CG2 3.46Å; V206-V210 PolarHBondContact O-N 2.87Å
207G97Very high96.7Very high0 Ų041.3 Ų41.30%021%0.212CC..Hα-helixtrans-59.2-43.8174.500000113.6Q203 M204 L205 V210 N211Q203-G207 PolarHBondContact O-N 3.25Å; M204-G207 PolarHBondContact O-N 3.14Å; L205-G207 PolarHBondContact O-N 3.04Å; G207-V210 PolarHBondContact O-N 3.35Å; G207-N211 PolarHBondContact O-N 3.39Å; G207-N211 PolarHBondContact O-ND2 3.11Å
208C97.4Very high96.5Very high39 Ų3943.2 Ų43.226%0.26422%0.222SC..Hα-helixtrans-61.9-41.4173.3-67.80000112.2M204 L205 V206 N211 Y212M204-C208 PolarHBondContact O-N 3.15Å; M204-C208 PolarHBondContact O-SG 3.08Å; M204-C208 VanDerWaalsContact O-SG 3.41Å; L205-C208 WeakPolarHBondContact O-CB 3.38Å; L205-C208 PolarHBondContact O-N 3.35Å; V206-C208 PolarHBondContact O-N 3.06Å; C208-N211 PolarHBondContact O-N 3.1Å; C208-Y212 PolarHBondContact O-N 3.17Å
209V97.4Very high96.1Very high83 Ų8345.1 Ų45.150%0.50323%0.228SC..Hα-helixtrans-63.3-45.4176.6173.60000111.1L205 V206 N211 Y212 L213L205-V209 WeakPolarHBondContact O-CG2 3.15Å; L205-V209 PolarHBondContact O-N 3.26Å; V206-V209 PolarHBondContact O-N 3.42Å; V209-N211 VanDerWaalsContact C-N 3.35Å; V209-N211 PolarHBondContact O-N 3.49Å; V209-Y212 WeakPolarHBondContact O-CB 3.08Å; V209-Y212 PolarHBondContact O-N 3.06Å; V209-L213 HydrophobicContact CG1-CD1 4.06Å; V209-L213 HydrophobicContact CG1-CG 4.31Å; V209-L213 WeakPolarHBondContact O-CG 3.39Å; V209-L213 PolarHBondContact O-N 3.47Å
210V96.9Very high95.8Very high5 Ų548.6 Ų48.63%0.0324%0.242CC..Hα-helixtrans-60.2-44.7177.1171.60000110.9V96 W163 F164 V206 G207 Y212 L213 V214V96-V210 HydrophobicContact CG1-CG1 4.16Å; W163-V210 HydrophobicContact CB-CG1 4.37Å; W163-V210 HydrophobicContact CB-CG2 4.07Å; W163-V210 HydrophobicContact CG-CG2 4.23Å; F164-V210 HydrophobicContact CD1-CG1 4.46Å; F164-V210 HydrophobicContact CE1-CB 3.83Å; F164-V210 HydrophobicContact CE1-CG1 3.72Å; F164-V210 HydrophobicContact CE2-CG1 4.4Å; F164-V210 HydrophobicContact CZ-CB 4.15Å; F164-V210 HydrophobicContact CZ-CG1 3.66Å; V206-V210 HydrophobicContact CG1-CG2 4.36Å; V206-V210 WeakPolarHBondContact O-CG2 3.46Å; V206-V210 PolarHBondContact O-N 2.87Å; G207-V210 PolarHBondContact O-N 3.35Å; V210-Y212 VanDerWaalsContact C-N 3.34Å; V210-Y212 PolarHBondContact O-N 2.92Å; V210-L213 PolarHBondContact O-N 3.35Å; V210-V214 HydrophobicContact CG1-CG2 4.43Å; V210-V214 WeakPolarHBondContact O-CG2 3.31Å; V210-V214 PolarHBondContact O-N 2.91Å
211N96.4Very high94.9Very high4 Ų451.1 Ų51.12%0.02127%0.274CS..Hα-helixtrans-59.3-43.9175.2-81.1-42.1000112.4F164 G207 C208 V209 V214 Y215 S234F164-N211 WeakPolarHBondContact CZ-OD1 3.23Å; G207-N211 PolarHBondContact O-N 3.39Å; G207-N211 PolarHBondContact O-ND2 3.11Å; C208-N211 PolarHBondContact O-N 3.1Å; V209-N211 VanDerWaalsContact C-N 3.35Å; V209-N211 PolarHBondContact O-N 3.49Å; N211-V214 PolarHBondContact O-N 2.9Å; N211-Y215 WeakPolarHBondContact O-CB 3.46Å; N211-Y215 PolarHBondContact O-N 3.29Å; N211-S234 VanDerWaalsContact CG-OG 3.31Å; N211-S234 PolarHBondContact ND2-OG 2.99Å; N211-S234 VanDerWaalsContact OD1-CB 3.24Å; N211-S234 WeakPolarHBondContact OD1-CB 3.41Å; N211-S234 PolarHBondContact OD1-OG 2.85Å
212Y96.1Very high94Very high150 Ų15053.2 Ų53.259%0.58828%0.283SS*.Hα-helixtrans-61.5-43.6176.1169.8-98.9000111.9C208 V209 V210 Y215 S216C208-Y212 PolarHBondContact O-N 3.17Å; V209-Y212 WeakPolarHBondContact O-CB 3.08Å; V209-Y212 PolarHBondContact O-N 3.06Å; V210-Y212 VanDerWaalsContact C-N 3.34Å; V210-Y212 PolarHBondContact O-N 2.92Å; Y212-Y215 PolarHBondContact O-N 3.48Å; Y212-S216 VanDerWaalsContact O-CB 3.29Å; Y212-S216 WeakPolarHBondContact O-CB 3.32Å; Y212-S216 PolarHBondContact O-N 2.86Å
213L96.1Very high93.3Very high35 Ų3558 Ų5818%0.18330%0.3CS..Hα-helixtrans-63.9-46.6178.8-71.6175.7000111.9L92 V209 V210 Y215 S216 W217L92-L213 HydrophobicContact CD2-CD1 4.42Å; V209-L213 HydrophobicContact CG1-CD1 4.06Å; V209-L213 HydrophobicContact CG1-CG 4.31Å; V209-L213 WeakPolarHBondContact O-CG 3.39Å; V209-L213 PolarHBondContact O-N 3.47Å; V210-L213 PolarHBondContact O-N 3.35Å; L213-Y215 VanDerWaalsContact C-N 3.33Å; L213-Y215 PolarHBondContact O-N 3.29Å; L213-S216 PolarHBondContact O-N 2.96Å; L213-W217 HydrophobicContact CB-CE3 4Å; L213-W217 HydrophobicContact CB-CH2 3.95Å; L213-W217 HydrophobicContact CB-CZ3 3.62Å; L213-W217 HydrophobicContact CD1-CH2 4.01Å; L213-W217 HydrophobicContact CD1-CZ3 4.35Å; L213-W217 HydrophobicContact CD2-CH2 4.05Å; L213-W217 HydrophobicContact CD2-CZ2 4.07Å; L213-W217 HydrophobicContact CG-CH2 4.23Å; L213-W217 HydrophobicContact CG-CZ3 4.39Å; L213-W217 VanDerWaalsContact O-CE3 3.3Å; L213-W217 PolarHBondContact O-N 3.28Å
214V95.3Very high92.8Very high1 Ų157.8 Ų57.81%0.00630%0.299CS..Hα-helixtrans-56.5-49.4174.9173.40000109.9V96 A159 V210 N211 S216 M218 I231V96-V214 HydrophobicContact CG1-CG2 3.47Å; V96-V214 VanDerWaalsContact CG1-CG2 3.47Å; A159-V214 HydrophobicContact CB-CG1 4.04Å; A159-V214 HydrophobicContact CB-CG2 4.14Å; V210-V214 HydrophobicContact CG1-CG2 4.43Å; V210-V214 WeakPolarHBondContact O-CG2 3.31Å; V210-V214 PolarHBondContact O-N 2.91Å; N211-V214 PolarHBondContact O-N 2.9Å; V214-S216 PolarHBondContact O-N 3.32Å; V214-M218 HydrophobicContact CG1-SD 4.05Å; V214-M218 WeakPolarHBondContact O-CB 3.42Å; V214-M218 VanDerWaalsContact O-CG 3.24Å; V214-M218 WeakPolarHBondContact O-CG 3.47Å; V214-M218 PolarHBondContact O-N 3.31Å; V214-I231 HydrophobicContact CG1-CD1 3.8Å; V214-I231 HydrophobicContact CG1-CG1 4.22Å
215Y94.9Very high92.3Very high104 Ų10460.1 Ų60.141%0.40832%0.315SS..Hα-helixtrans-60-47.4177.9-179.1-103.3000112.4N211 Y212 L213 W217 M218 Q219 I231N211-Y215 WeakPolarHBondContact O-CB 3.46Å; N211-Y215 PolarHBondContact O-N 3.29Å; Y212-Y215 PolarHBondContact O-N 3.48Å; L213-Y215 VanDerWaalsContact C-N 3.33Å; L213-Y215 PolarHBondContact O-N 3.29Å; Y215-W217 PolarHBondContact O-N 2.9Å; Y215-M218 PolarHBondContact O-N 3.26Å; Y215-Q219 HydrophobicContact CD1-CG 4.34Å; Y215-Q219 HydrophobicContact CD2-CG 4.49Å; Y215-Q219 HydrophobicContact CE1-CG 3.92Å; Y215-Q219 HydrophobicContact CE2-CG 4.09Å; Y215-Q219 WeakPolarHBondContact O-CG 3.26Å; Y215-Q219 PolarHBondContact O-N 3.43Å; Y215-I231 HydrophobicContact CD2-CD1 4.47Å
216S94.7Very high91.9Very high25 Ų2557 Ų5718%0.17530%0.3CS..Hα-helixtrans-60.8-46.4-178.2-170.70000111.8Y212 L213 V214 Q219 Q220Y212-S216 VanDerWaalsContact O-CB 3.29Å; Y212-S216 WeakPolarHBondContact O-CB 3.32Å; Y212-S216 PolarHBondContact O-N 2.86Å; L213-S216 PolarHBondContact O-N 2.96Å; V214-S216 PolarHBondContact O-N 3.32Å; S216-Q219 PolarHBondContact O-N 2.99Å; S216-Q220 VanDerWaalsContact O-CG 3.29Å; S216-Q220 WeakPolarHBondContact O-CG 3.37Å; S216-Q220 PolarHBondContact O-N 3.12Å; S216-Q220 VanDerWaalsContact O-N 3.13Å; S216-Q220 PolarHBondContact O-NE2 3.27Å; S216-Q220 PolarHBondContact OG-NE2 2.94Å
217W94.4Very high91.6Very high36 Ų3659.1 Ų59.114%0.13631%0.306CS..Hα-helixtrans-69.6-34.9179.1-68.4-40.1000112.9L92 K93 V96 C97 L213 Y215 Q219 Q220 Q222 C224L92-W217 HydrophobicContact CG-CH2 4.33Å; K93-W217 VanDerWaalsContact CA-CH2 3.48Å; K93-W217 HydrophobicContact CB-CH2 3.94Å; K93-W217 HydrophobicContact CB-CZ2 3.82Å; K93-W217 HydrophobicContact CB-CZ3 4.32Å; K93-W217 HydrophobicContact CG-CD2 3.94Å; K93-W217 HydrophobicContact CG-CE3 4.12Å; K93-W217 HydrophobicContact CG-CG 4.45Å; K93-W217 HydrophobicContact CG-CH2 4.35Å; K93-W217 HydrophobicContact CG-CZ2 4.17Å; K93-W217 HydrophobicContact CG-CZ3 4.32Å; V96-W217 HydrophobicContact CB-CH2 4.49Å; V96-W217 HydrophobicContact CB-CZ3 3.67Å; V96-W217 HydrophobicContact CG1-CE3 4.31Å; V96-W217 HydrophobicContact CG1-CZ3 3.75Å; V96-W217 HydrophobicContact CG2-CH2 4.48Å; V96-W217 HydrophobicContact CG2-CZ3 4.06Å; C97-W217 VanDerWaalsContact SG-CE3 3.54Å; L213-W217 HydrophobicContact CB-CE3 4Å; L213-W217 HydrophobicContact CB-CH2 3.95Å; L213-W217 HydrophobicContact CB-CZ3 3.62Å; L213-W217 HydrophobicContact CD1-CH2 4.01Å; L213-W217 HydrophobicContact CD1-CZ3 4.35Å; L213-W217 HydrophobicContact CD2-CH2 4.05Å; L213-W217 HydrophobicContact CD2-CZ2 4.07Å; L213-W217 HydrophobicContact CG-CH2 4.23Å; L213-W217 HydrophobicContact CG-CZ3 4.39Å; L213-W217 VanDerWaalsContact O-CE3 3.3Å; L213-W217 PolarHBondContact O-N 3.28Å; Y215-W217 PolarHBondContact O-N 2.9Å; W217-Q219 PolarHBondContact O-N 3.44Å; W217-Q220 PolarHBondContact O-N 2.89Å; W217-Q222 HydrophobicContact CB-CB 4.42Å; W217-Q222 WeakPolarHBondContact O-CB 3.07Å; W217-Q222 PolarHBondContact O-N 2.86Å; W217-Q222 VanDerWaalsContact O-N 3.14Å; W217-C224 HydrophobicContact CB-CB 4.34Å
218M92.3Very high91.3Very high46 Ų4662.9 Ų62.923%0.22733%0.329CS..Hα-helixtrans-59.8-44.1170.9-75.3178.772.500112.3V214 Y215 Q220 G221 C224 S226 I231V214-M218 HydrophobicContact CG1-SD 4.05Å; V214-M218 WeakPolarHBondContact O-CB 3.42Å; V214-M218 VanDerWaalsContact O-CG 3.24Å; V214-M218 WeakPolarHBondContact O-CG 3.47Å; V214-M218 PolarHBondContact O-N 3.31Å; Y215-M218 PolarHBondContact O-N 3.26Å; M218-Q220 VanDerWaalsContact C-N 3.29Å; M218-Q220 PolarHBondContact O-N 3.46Å; M218-G221 PolarHBondContact O-N 3.43Å; M218-C224 HydrophobicContact CG-CB 3.96Å; M218-C224 VanDerWaalsContact CG-O 3.27Å; M218-C224 WeakPolarHBondContact CG-O 3.18Å; M218-S226 WeakPolarHBondContact CE-O 3.32Å; M218-I231 HydrophobicContact CE-CD1 4.49Å; M218-I231 HydrophobicContact SD-CD1 3.42Å; M218-I231 WeakPolarHBondContact SD-CD1 3.43Å
219Q89.6Confident91.1Very high116 Ų11667.3 Ų67.354%0.54235%0.346SS..Hα-helixtrans-69-27.5180-66.4-58.5-38.700113Y215 S216 W217 G221Y215-Q219 HydrophobicContact CD1-CG 4.34Å; Y215-Q219 HydrophobicContact CD2-CG 4.49Å; Y215-Q219 HydrophobicContact CE1-CG 3.92Å; Y215-Q219 HydrophobicContact CE2-CG 4.09Å; Y215-Q219 WeakPolarHBondContact O-CG 3.26Å; Y215-Q219 PolarHBondContact O-N 3.43Å; S216-Q219 PolarHBondContact O-N 2.99Å; W217-Q219 PolarHBondContact O-N 3.44Å; Q219-G221 PolarHBondContact O-N 3.44Å
220Q89.8Confident90.9Very high106 Ų10663.4 Ų63.450%0.49532%0.322SS..THydrogen-bonded Turntrans-76.66.8175.7-69168.932.800113.2S216 W217 M218 Q222S216-Q220 VanDerWaalsContact O-CG 3.29Å; S216-Q220 WeakPolarHBondContact O-CG 3.37Å; S216-Q220 PolarHBondContact O-N 3.12Å; S216-Q220 VanDerWaalsContact O-N 3.13Å; S216-Q220 PolarHBondContact O-NE2 3.27Å; S216-Q220 PolarHBondContact OG-NE2 2.94Å; W217-Q220 PolarHBondContact O-N 2.89Å; M218-Q220 VanDerWaalsContact C-N 3.29Å; M218-Q220 PolarHBondContact O-N 3.46Å; Q220-Q222 HydrophobicContact CB-CG 3.99Å; Q220-Q222 PolarHBondContact O-N 2.92Å
221G79.1Confident90.8Very high72 Ų7263.7 Ų63.774%0.74232%0.323SS*.THydrogen-bonded Turntrans68.418.7-177.300000113.4M218 Q219M218-G221 PolarHBondContact O-N 3.43Å; Q219-G221 PolarHBondContact O-N 3.44Å
222Q78.3Confident90.8Very high63 Ų6366.9 Ų66.929%0.29434%0.342SS..  trans-87.4148.2178.7-57.6-176.7-0.400110.3W217 Q220 C224W217-Q222 HydrophobicContact CB-CB 4.42Å; W217-Q222 WeakPolarHBondContact O-CB 3.07Å; W217-Q222 PolarHBondContact O-N 2.86Å; W217-Q222 VanDerWaalsContact O-N 3.14Å; Q220-Q222 HydrophobicContact CB-CG 3.99Å; Q220-Q222 PolarHBondContact O-N 2.92Å; Q222-C224 PolarHBondContact O-N 2.97Å
223E83.3Confident90.7Very high181 Ų18166.8 Ų66.885%0.84634%0.341SS*.  trans-63.799.6176.2-66.1-174.6170.400110.9
224C87.7Confident90.8Very high8 Ų865.1 Ų65.15%0.05433%0.333CS..  trans-141.583.6173.2-156.10000108.3C97 W217 M218 Q222 S226C97-C224 VanDerWaalsContact CA-SG 3.57Å; C97-C224 HydrophobicContact CB-CB 3.79Å; C97-C224 WeakPolarHBondContact CB-SG 3.17Å; C97-C224 WeakPolarHBondContact SG-CB 3.28Å; C97-C224 CovalentContact SG-SG 2.05Å; C97-C224 PolarHBondContact SG-SG 3.42Å; W217-C224 HydrophobicContact CB-CB 4.34Å; M218-C224 HydrophobicContact CG-CB 3.96Å; M218-C224 VanDerWaalsContact CG-O 3.27Å; M218-C224 WeakPolarHBondContact CG-O 3.18Å; Q222-C224 PolarHBondContact O-N 2.97Å; C224-S226 PolarHBondContact O-N 3.09Å
225P86.8Confident90.8Very high52 Ų5267 Ų6734%0.33835%0.346SS..  trans-65.6103.3-171.327.1-37.1000111.3C97 Q99 A159C97-P225 WeakPolarHBondContact O-CD 3.24Å; Q99-P225 HydrophobicContact CG-CB 4.28Å; Q99-P225 HydrophobicContact CG-CG 3.43Å; Q99-P225 VanDerWaalsContact CG-CG 3.43Å; Q99-P225 VanDerWaalsContact OE1-CG 3.3Å; A159-P225 WeakPolarHBondContact CB-O 3.49Å; A159-P225 PolarHBondContact N-O 2.83Å; A159-P225 VanDerWaalsContact N-O 3.08Å
226S89.4Confident90.9Very high17 Ų1766.6 Ų66.612%0.11935%0.35CS..  trans-157.2175.3175.3-167.90000110.1M218 C224M218-S226 WeakPolarHBondContact CE-O 3.32Å; C224-S226 PolarHBondContact O-N 3.09Å
227H91.1Very high91Very high99 Ų9966 Ų6646%0.45834%0.344SS..  trans-120.4138.1179.2-58.4-68.4000110.4D156 Q229 N230 I231D156-H227 IonicContact OD2-CD2 3.46Å; H227-Q229 PolarHBondContact O-N 3.12Å; H227-N230 HydrophobicContact CB-CB 4.33Å; H227-N230 WeakPolarHBondContact O-CA 3.25Å; H227-N230 WeakPolarHBondContact O-CB 3.3Å; H227-N230 PolarHBondContact O-N 2.99Å; H227-I231 PolarHBondContact O-N 3.42Å
228V91.1Very high91.2Very high78 Ų7864.9 Ų64.947%0.47334%0.341SS..Hα-helixtrans-55-39.9178.7178.80000111.4N230 I231 V232V228-N230 PolarHBondContact O-N 3.02Å; V228-I231 PolarHBondContact O-N 2.93Å; V228-V232 HydrophobicContact CG1-CG2 4.34Å; V228-V232 WeakPolarHBondContact O-CG2 3.46Å; V228-V232 PolarHBondContact O-N 3.43Å
229Q92.6Very high91.4Very high133 Ų13367.3 Ų67.362%0.62135%0.354SS*.Hα-helixtrans-60.1-43.5176-66.6-179.2-10.300112.4H227 I231 V232 W233H227-Q229 PolarHBondContact O-N 3.12Å; Q229-I231 VanDerWaalsContact C-N 3.35Å; Q229-I231 PolarHBondContact O-N 3.36Å; Q229-V232 PolarHBondContact O-N 3.46Å; Q229-W233 PolarHBondContact O-N 2.9Å
230N93.8Very high91.8Very high1 Ų163.1 Ų63.11%0.00534%0.337CS..Hα-helixtrans-62.8-42176.5-97.1-69.4000111.6Y152 D156 V158 H227 V228 W233 S234Y152-N230 VanDerWaalsContact CD1-OD1 3.28Å; Y152-N230 WeakPolarHBondContact CD1-OD1 3.46Å; Y152-N230 HydrophobicContact CE1-CB 4.47Å; Y152-N230 VanDerWaalsContact CE1-CG 3.45Å; Y152-N230 WeakPolarHBondContact CE1-OD1 3.44Å; D156-N230 PolarHBondContact OD2-ND2 3.34Å; D156-N230 VanDerWaalsContact OD2-ND2 3.12Å; V158-N230 HydrophobicContact CG1-CB 3.93Å; H227-N230 HydrophobicContact CB-CB 4.33Å; H227-N230 WeakPolarHBondContact O-CA 3.25Å; H227-N230 WeakPolarHBondContact O-CB 3.3Å; H227-N230 PolarHBondContact O-N 2.99Å; V228-N230 PolarHBondContact O-N 3.02Å; N230-W233 PolarHBondContact O-N 3.23Å; N230-S234 WeakPolarHBondContact O-CB 3.25Å; N230-S234 PolarHBondContact O-N 2.98Å
231I94.4Very high92.2Very high11 Ų1158.2 Ų58.26%0.05631%0.314CS..Hα-helixtrans-64.6-42.6177.6-64.3169.6000110.9V214 Y215 M218 H227 V228 Q229 S234 S235V214-I231 HydrophobicContact CG1-CD1 3.8Å; V214-I231 HydrophobicContact CG1-CG1 4.22Å; Y215-I231 HydrophobicContact CD2-CD1 4.47Å; M218-I231 HydrophobicContact CE-CD1 4.49Å; M218-I231 HydrophobicContact SD-CD1 3.42Å; M218-I231 WeakPolarHBondContact SD-CD1 3.43Å; H227-I231 PolarHBondContact O-N 3.42Å; V228-I231 PolarHBondContact O-N 2.93Å; Q229-I231 VanDerWaalsContact C-N 3.35Å; Q229-I231 PolarHBondContact O-N 3.36Å; I231-S234 PolarHBondContact O-N 2.85Å; I231-S235 VanDerWaalsContact O-CB 3.22Å; I231-S235 WeakPolarHBondContact O-CB 3.42Å; I231-S235 PolarHBondContact O-N 3.39Å; I231-S235 PolarHBondContact O-OG 2.74Å
232V95.5Very high93.1Very high70 Ų7057.4 Ų57.442%0.42429%0.291SS..Hα-helixtrans-61.2-51.7177169.80000110.2V228 Q229 S234 S235 L236V228-V232 HydrophobicContact CG1-CG2 4.34Å; V228-V232 WeakPolarHBondContact O-CG2 3.46Å; V228-V232 PolarHBondContact O-N 3.43Å; Q229-V232 PolarHBondContact O-N 3.46Å; V232-S234 VanDerWaalsContact C-N 3.35Å; V232-S234 PolarHBondContact O-N 3.16Å; V232-S235 PolarHBondContact O-N 3.41Å; V232-L236 HydrophobicContact CG1-CD1 3.95Å; V232-L236 HydrophobicContact CG1-CG 4.46Å; V232-L236 WeakPolarHBondContact O-CB 3.11Å; V232-L236 VanDerWaalsContact O-CG 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.42Å; V232-L236 PolarHBondContact O-N 3.41Å
233W95.8Very high94Very high149 Ų14958.2 Ų58.256%0.56430%0.3SS*.Hα-helixtrans-62.3-41.4179-69.2126.8000112.6Y149 Q229 N230 L236 M237Y149-W233 HydrophobicContact CD2-CB 4.38Å; Y149-W233 HydrophobicContact CE2-CB 4.48Å; Q229-W233 PolarHBondContact O-N 2.9Å; N230-W233 PolarHBondContact O-N 3.23Å; W233-L236 HydrophobicContact CE3-CD1 3.99Å; W233-L236 HydrophobicContact CZ3-CD1 4.06Å; W233-M237 VanDerWaalsContact O-CB 3.32Å; W233-M237 WeakPolarHBondContact O-CB 3.46Å; W233-M237 PolarHBondContact O-N 3.37Å
234S96.3Very high94.7Very high0 Ų051 Ų510%027%0.266CS..Hα-helixtrans-61.1-47.9174.9-168.80000111.8Y149 N211 N230 I231 V232 M237 Y238Y149-S234 WeakPolarHBondContact OH-CB 3.44Å; Y149-S234 PolarHBondContact OH-OG 3.18Å; Y149-S234 VanDerWaalsContact OH-OG 3.12Å; N211-S234 VanDerWaalsContact CG-OG 3.31Å; N211-S234 PolarHBondContact ND2-OG 2.99Å; N211-S234 VanDerWaalsContact OD1-CB 3.24Å; N211-S234 WeakPolarHBondContact OD1-CB 3.41Å; N211-S234 PolarHBondContact OD1-OG 2.85Å; N230-S234 WeakPolarHBondContact O-CB 3.25Å; N230-S234 PolarHBondContact O-N 2.98Å; I231-S234 PolarHBondContact O-N 2.85Å; V232-S234 VanDerWaalsContact C-N 3.35Å; V232-S234 PolarHBondContact O-N 3.16Å; S234-M237 PolarHBondContact O-N 2.7Å; S234-Y238 WeakPolarHBondContact O-CD2 3.49Å; S234-Y238 PolarHBondContact O-N 3.14Å
235S96.1Very high95.1Very high40 Ų4051.5 Ų51.528%0.2827%0.268SS..Hα-helixtrans-64.6-43.7-177.9-59.90000111.2I231 V232 L239I231-S235 VanDerWaalsContact O-CB 3.22Å; I231-S235 WeakPolarHBondContact O-CB 3.42Å; I231-S235 PolarHBondContact O-N 3.39Å; I231-S235 PolarHBondContact O-OG 2.74Å; V232-S235 PolarHBondContact O-N 3.41Å; S235-L239 WeakPolarHBondContact O-CB 3.49Å; S235-L239 PolarHBondContact O-N 3.27Å
236L96.9Very high95.6Very high95 Ų9551.2 Ų51.250%0.49727%0.266SS..Hα-helixtrans-60.2-46174.2-71.1173.5000111.4V232 W233 S240V232-L236 HydrophobicContact CG1-CD1 3.95Å; V232-L236 HydrophobicContact CG1-CG 4.46Å; V232-L236 WeakPolarHBondContact O-CB 3.11Å; V232-L236 VanDerWaalsContact O-CG 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.42Å; V232-L236 PolarHBondContact O-N 3.41Å; W233-L236 HydrophobicContact CE3-CD1 3.99Å; W233-L236 HydrophobicContact CZ3-CD1 4.06Å; L236-S240 VanDerWaalsContact O-CB 3.25Å; L236-S240 WeakPolarHBondContact O-CB 3.26Å; L236-S240 PolarHBondContact O-N 3.17Å; L236-S240 PolarHBondContact O-OG 3.23Å
237M97.3Very high95.9Very high12 Ų1255.2 Ų55.26%0.05928%0.283CS..Hα-helixtrans-60.9-55.1178.1-176.9-170.367.700111.3Y149 W233 S234 L239 S240 Y241Y149-M237 HydrophobicContact CD1-CE 3.38Å; Y149-M237 HydrophobicContact CD1-SD 3.76Å; Y149-M237 HydrophobicContact CE1-CE 3.77Å; Y149-M237 HydrophobicContact CG-CE 3.97Å; Y149-M237 HydrophobicContact CG-SD 3.81Å; W233-M237 VanDerWaalsContact O-CB 3.32Å; W233-M237 WeakPolarHBondContact O-CB 3.46Å; W233-M237 PolarHBondContact O-N 3.37Å; S234-M237 PolarHBondContact O-N 2.7Å; M237-L239 PolarHBondContact O-N 2.88Å; M237-S240 PolarHBondContact O-N 3.46Å; M237-S240 PolarHBondContact O-OG 2.8Å; M237-Y241 HydrophobicContact CE-CE2 4.27Å; M237-Y241 HydrophobicContact CG-CD2 4.06Å; M237-Y241 HydrophobicContact CG-CE1 3.98Å; M237-Y241 HydrophobicContact CG-CE2 3.4Å; M237-Y241 WeakPolarHBondContact CG-OH 3.38Å; M237-Y241 VanDerWaalsContact O-CG 3.3Å; M237-Y241 PolarHBondContact O-N 3.46Å; M237-Y241 HydrophobicContact SD-CE2 3.74Å; M237-Y241 PolarHBondContact SD-OH 3.4Å
238Y97.3Very high96.1Very high14 Ų1453.6 Ų53.66%0.05528%0.275CS..Hα-helixtrans-63-40.5-178.1-86.5-74.1000112.8F164 M167 M204 S234 Y241 F242F164-Y238 AromaticContact CD1-CE2 3.67Å; F164-Y238 HydrophobicContact CD1-CE2 3.67Å; F164-Y238 AromaticContact CD1-CZ 3.62Å; F164-Y238 VanDerWaalsContact CD1-OH 3.26Å; F164-Y238 WeakPolarHBondContact CD1-OH 3.42Å; F164-Y238 HydrophobicContact CE1-CD2 4.36Å; F164-Y238 AromaticContact CE1-CE2 3.68Å; F164-Y238 HydrophobicContact CE1-CE2 3.68Å; F164-Y238 HydrophobicContact CG-CE2 4.18Å; F164-Y238 HydrophobicContact CZ-CE2 4.23Å; M167-Y238 HydrophobicContact CE-CE1 3.4Å; M167-Y238 VanDerWaalsContact CE-CE1 3.4Å; M167-Y238 VanDerWaalsContact CE-CZ 3.47Å; M167-Y238 WeakPolarHBondContact CE-OH 3.29Å; M204-Y238 HydrophobicContact CE-CD1 4.36Å; M204-Y238 HydrophobicContact CE-CE1 4.13Å; M204-Y238 HydrophobicContact SD-CD1 3.61Å; M204-Y238 HydrophobicContact SD-CE1 3.97Å; S234-Y238 WeakPolarHBondContact O-CD2 3.49Å; S234-Y238 PolarHBondContact O-N 3.14Å; Y238-Y241 PolarHBondContact O-N 3.42Å; Y238-F242 WeakPolarHBondContact O-CB 3.45Å; Y238-F242 PolarHBondContact O-N 3.39Å
239L97.3Very high96.3Very high96 Ų9651.5 Ų51.550%0.50326%0.26SS..Hα-helixtrans-64.7-44.3175.9-178.861.2000111.5S235 M237 Y241 F242 V243S235-L239 WeakPolarHBondContact O-CB 3.49Å; S235-L239 PolarHBondContact O-N 3.27Å; M237-L239 PolarHBondContact O-N 2.88Å; L239-Y241 VanDerWaalsContact C-N 3.33Å; L239-Y241 PolarHBondContact O-N 3.22Å; L239-F242 WeakPolarHBondContact O-CB 3.36Å; L239-F242 PolarHBondContact O-N 3.27Å; L239-V243 WeakPolarHBondContact O-CG2 3.22Å; L239-V243 PolarHBondContact O-N 3.02Å; L239-V243 VanDerWaalsContact O-N 3.09Å
240S97.9Very high96.4Very high28 Ų2848.9 Ų48.920%0.19625%0.247CC..Hα-helixtrans-61-43.1177.574.70000111.6Y141 L236 M237 V243 L244Y141-S240 PolarHBondContact OH-OG 2.92Å; L236-S240 VanDerWaalsContact O-CB 3.25Å; L236-S240 WeakPolarHBondContact O-CB 3.26Å; L236-S240 PolarHBondContact O-N 3.17Å; L236-S240 PolarHBondContact O-OG 3.23Å; M237-S240 PolarHBondContact O-N 3.46Å; M237-S240 PolarHBondContact O-OG 2.8Å; S240-V243 PolarHBondContact O-N 2.71Å; S240-L244 WeakPolarHBondContact O-CB 3.14Å; S240-L244 VanDerWaalsContact O-CG 3.25Å; S240-L244 WeakPolarHBondContact O-CG 3.38Å; S240-L244 PolarHBondContact O-N 2.82Å
241Y97.8Very high96.4Very high3 Ų353.6 Ų53.61%0.01227%0.269CS..Hα-helixtrans-65.7-42.5177.2-66.4-9000111.4Y141 H142 T145 V146 M204 M237 Y238 L239 V243 L244 F245Y141-Y241 HydrophobicContact CD1-CD1 4.26Å; Y141-Y241 AromaticContact CD1-CE1 3.94Å; Y141-Y241 HydrophobicContact CD1-CE1 3.94Å; Y141-Y241 AromaticContact CE1-CD1 3.89Å; Y141-Y241 HydrophobicContact CE1-CD1 3.89Å; Y141-Y241 AromaticContact CE1-CE1 3.64Å; Y141-Y241 HydrophobicContact CE1-CE1 3.64Å; H142-Y241 HydrophobicContact CB-CE1 4.15Å; H142-Y241 AromaticContact CE1-CD2 3.99Å; H142-Y241 AromaticContact CE1-CE2 3.61Å; H142-Y241 AromaticContact ND1-CD2 3.53Å; H142-Y241 AromaticContact ND1-CE1 3.77Å; H142-Y241 AromaticContact ND1-CE2 3.17Å; H142-Y241 WeakPolarHBondContact ND1-CE2 3.47Å; H142-Y241 AromaticContact ND1-CG 3.96Å; H142-Y241 AromaticContact ND1-CZ 3.31Å; H142-Y241 VanDerWaalsContact ND1-CZ 3.31Å; H142-Y241 PolarHBondContact O-OH 3.49Å; T145-Y241 WeakPolarHBondContact CB-OH 3.36Å; T145-Y241 WeakPolarHBondContact OG1-CE1 3.38Å; T145-Y241 PolarHBondContact OG1-OH 3.45Å; V146-Y241 PolarHBondContact N-OH 3.14Å; V146-Y241 VanDerWaalsContact N-OH 3.16Å; M204-Y241 WeakPolarHBondContact SD-CB 3.4Å; M204-Y241 HydrophobicContact SD-CD2 3.6Å; M204-Y241 HydrophobicContact SD-CG 4Å; M237-Y241 HydrophobicContact CE-CE2 4.27Å; M237-Y241 HydrophobicContact CG-CD2 4.06Å; M237-Y241 HydrophobicContact CG-CE1 3.98Å; M237-Y241 HydrophobicContact CG-CE2 3.4Å; M237-Y241 WeakPolarHBondContact CG-OH 3.38Å; M237-Y241 VanDerWaalsContact O-CG 3.3Å; M237-Y241 PolarHBondContact O-N 3.46Å; M237-Y241 HydrophobicContact SD-CE2 3.74Å; M237-Y241 PolarHBondContact SD-OH 3.4Å; Y238-Y241 PolarHBondContact O-N 3.42Å; L239-Y241 VanDerWaalsContact C-N 3.33Å; L239-Y241 PolarHBondContact O-N 3.22Å; Y241-V243 VanDerWaalsContact C-N 3.33Å; Y241-V243 PolarHBondContact O-N 3.08Å; Y241-L244 PolarHBondContact O-N 3.03Å; Y241-F245 WeakPolarHBondContact O-CB 3.5Å; Y241-F245 VanDerWaalsContact O-CD2 3.29Å; Y241-F245 WeakPolarHBondContact O-CD2 3.32Å; Y241-F245 PolarHBondContact O-N 3.28Å
242F97.9Very high96.2Very high56 Ų5653.9 Ų53.925%0.24627%0.273CS..Hα-helixtrans-54.2-50.9176.1175.2-106.4000111.3I201 M204 L205 Y238 L239 L244 F245 C246I201-F242 HydrophobicContact CG2-CD2 3.99Å; I201-F242 HydrophobicContact CG2-CE2 3.65Å; M204-F242 HydrophobicContact CB-CB 3.76Å; M204-F242 HydrophobicContact CB-CD2 4.28Å; M204-F242 HydrophobicContact CG-CB 4.48Å; L205-F242 HydrophobicContact CD1-CE2 3.79Å; L205-F242 HydrophobicContact CD1-CZ 4.49Å; L205-F242 HydrophobicContact CD2-CD2 3.67Å; L205-F242 HydrophobicContact CD2-CE1 4.29Å; L205-F242 HydrophobicContact CD2-CE2 3.29Å; L205-F242 HydrophobicContact CD2-CG 4.32Å; L205-F242 HydrophobicContact CD2-CZ 3.64Å; L205-F242 HydrophobicContact CG-CD2 3.69Å; L205-F242 HydrophobicContact CG-CE2 3.39Å; L205-F242 HydrophobicContact CG-CZ 4.21Å; Y238-F242 WeakPolarHBondContact O-CB 3.45Å; Y238-F242 PolarHBondContact O-N 3.39Å; L239-F242 WeakPolarHBondContact O-CB 3.36Å; L239-F242 PolarHBondContact O-N 3.27Å; F242-L244 PolarHBondContact O-N 3.41Å; F242-F245 PolarHBondContact O-N 3.06Å; F242-C246 VanDerWaalsContact CE2-SG 3.58Å; F242-C246 WeakPolarHBondContact O-CB 3.46Å; F242-C246 PolarHBondContact O-N 3.17Å; F242-C246 PolarHBondContact O-SG 3Å
243V97.9Very high96Very high80 Ų8051.6 Ų51.649%0.48526%0.257SS..Hα-helixtrans-60.1-48.1178.4173.90000111L239 S240 Y241 F245 C246 Q247L239-V243 WeakPolarHBondContact O-CG2 3.22Å; L239-V243 PolarHBondContact O-N 3.02Å; L239-V243 VanDerWaalsContact O-N 3.09Å; S240-V243 PolarHBondContact O-N 2.71Å; Y241-V243 VanDerWaalsContact C-N 3.33Å; Y241-V243 PolarHBondContact O-N 3.08Å; V243-F245 PolarHBondContact O-N 2.96Å; V243-C246 PolarHBondContact O-N 3.19Å; V243-Q247 WeakPolarHBondContact O-CB 3.33Å; V243-Q247 PolarHBondContact O-N 3.36Å
244L97.3Very high95.8Very high28 Ų2847.4 Ų47.415%0.14725%0.245CC..Hα-helixtrans-65.8-37.7-177.9-69.4169.6000113F137 L138 Y141 S240 Y241 F242 F248F137-L244 HydrophobicContact CD1-CD1 4.35Å; F137-L244 HydrophobicContact CD1-CD2 3.94Å; F137-L244 HydrophobicContact CE1-CD1 3.98Å; F137-L244 HydrophobicContact CE1-CD2 4Å; L138-L244 HydrophobicContact CD1-CB 3.46Å; L138-L244 VanDerWaalsContact CD1-CB 3.46Å; L138-L244 HydrophobicContact CD1-CD1 4.01Å; L138-L244 HydrophobicContact CD1-CG 4.36Å; L138-L244 HydrophobicContact CG-CB 4.35Å; Y141-L244 HydrophobicContact CD1-CD1 3.62Å; Y141-L244 HydrophobicContact CE1-CD1 3.81Å; S240-L244 WeakPolarHBondContact O-CB 3.14Å; S240-L244 VanDerWaalsContact O-CG 3.25Å; S240-L244 WeakPolarHBondContact O-CG 3.38Å; S240-L244 PolarHBondContact O-N 2.82Å; Y241-L244 PolarHBondContact O-N 3.03Å; F242-L244 PolarHBondContact O-N 3.41Å; L244-F248 VanDerWaalsContact O-CB 3.31Å; L244-F248 WeakPolarHBondContact O-CB 3.22Å; L244-F248 PolarHBondContact O-N 2.91Å
245F96.4Very high95.5Very high19 Ų1949.9 Ų49.98%0.08326%0.258CS..Hα-helixtrans-71.1-38175.7-87.9-74.6000112.1L138 T197 Q200 I201 M204 Y241 F242 V243 F248 F249L138-F245 HydrophobicContact CD1-CD2 4.08Å; L138-F245 HydrophobicContact CD1-CE2 3.97Å; L138-F245 HydrophobicContact CD1-CZ 4.39Å; L138-F245 HydrophobicContact CD2-CD1 3.96Å; L138-F245 HydrophobicContact CD2-CD2 4.44Å; L138-F245 HydrophobicContact CD2-CE1 3.97Å; L138-F245 HydrophobicContact CD2-CE2 4.46Å; L138-F245 HydrophobicContact CD2-CG 4.19Å; L138-F245 HydrophobicContact CD2-CZ 4.24Å; T197-F245 HydrophobicContact CG2-CD1 4.41Å; Q200-F245 HydrophobicContact CB-CD1 4.08Å; Q200-F245 HydrophobicContact CB-CE1 3.95Å; Q200-F245 HydrophobicContact CB-CZ 4.26Å; Q200-F245 HydrophobicContact CG-CE1 4.27Å; Q200-F245 HydrophobicContact CG-CZ 4.48Å; I201-F245 HydrophobicContact CG1-CB 3.71Å; M204-F245 HydrophobicContact CG-CD2 4.41Å; Y241-F245 WeakPolarHBondContact O-CB 3.5Å; Y241-F245 VanDerWaalsContact O-CD2 3.29Å; Y241-F245 WeakPolarHBondContact O-CD2 3.32Å; Y241-F245 PolarHBondContact O-N 3.28Å; F242-F245 PolarHBondContact O-N 3.06Å; V243-F245 PolarHBondContact O-N 2.96Å; F245-F248 PolarHBondContact O-N 3.49Å; F245-F249 WeakPolarHBondContact O-CB 3.38Å; F245-F249 PolarHBondContact O-N 3.24Å
246C97Very high95Very high46 Ų4654.2 Ų54.231%0.31127%0.272SS..Hα-helixtrans-61.8-45.5172.5-75.80000111.4F242 V243 F249 H250F242-C246 VanDerWaalsContact CE2-SG 3.58Å; F242-C246 WeakPolarHBondContact O-CB 3.46Å; F242-C246 PolarHBondContact O-N 3.17Å; F242-C246 PolarHBondContact O-SG 3Å; V243-C246 PolarHBondContact O-N 3.19Å; C246-F249 PolarHBondContact O-N 3.44Å; C246-H250 PolarHBondContact O-N 2.81Å
247Q96.6Very high94.4Very high102 Ų10252.4 Ų52.448%0.47727%0.265SS..Hα-helixtrans-60.3-48.6174.1-178.4-178.8-12.100111.2V243 F249 H250 E251V243-Q247 WeakPolarHBondContact O-CB 3.33Å; V243-Q247 PolarHBondContact O-N 3.36Å; Q247-F249 VanDerWaalsContact C-N 3.28Å; Q247-F249 PolarHBondContact O-N 2.94Å; Q247-H250 PolarHBondContact O-N 2.66Å; Q247-E251 WeakPolarHBondContact CG-OE1 3.22Å; Q247-E251 PolarHBondContact NE2-OE1 3.4Å; Q247-E251 WeakPolarHBondContact O-CG 3.39Å; Q247-E251 PolarHBondContact O-N 3.39Å
248F95.6Very high93.8Very high65 Ų6557.8 Ų57.829%0.28529%0.288SS..Hα-helixtrans-57.6-42.2176.5171.8-98.5000111.9I136 L138 T197 L244 F245 E251 A252 Y253I136-F248 HydrophobicContact CD1-CD2 4.14Å; I136-F248 HydrophobicContact CD1-CE2 4.17Å; L138-F248 HydrophobicContact CD2-CB 3.88Å; L138-F248 HydrophobicContact CD2-CG 4.19Å; T197-F248 HydrophobicContact CG2-CD1 3.77Å; T197-F248 HydrophobicContact CG2-CE1 3.95Å; L244-F248 VanDerWaalsContact O-CB 3.31Å; L244-F248 WeakPolarHBondContact O-CB 3.22Å; L244-F248 PolarHBondContact O-N 2.91Å; F245-F248 PolarHBondContact O-N 3.49Å; F248-E251 PolarHBondContact O-N 2.98Å; F248-A252 HydrophobicContact CE1-CB 4.28Å; F248-A252 HydrophobicContact CE2-CB 4.2Å; F248-A252 HydrophobicContact CZ-CB 4.06Å; F248-A252 WeakPolarHBondContact O-CB 3.45Å; F248-A252 PolarHBondContact O-N 3.36Å; F248-Y253 HydrophobicContact CE1-CE2 4.4Å
249F95.3Very high93.3Very high34 Ų3464.7 Ų64.715%0.14932%0.319CS..Hα-helixtrans-62.5-45.1178.5-174.8-86000111.6M194 T197 L198 I201 F245 C246 Q247 Y253 I254M194-F249 HydrophobicContact CG-CE2 3.49Å; M194-F249 VanDerWaalsContact CG-CE2 3.49Å; M194-F249 HydrophobicContact CG-CZ 3.76Å; M194-F249 HydrophobicContact SD-CZ 4.23Å; T197-F249 HydrophobicContact CG2-CB 4.2Å; T197-F249 HydrophobicContact CG2-CD2 3.82Å; L198-F249 HydrophobicContact CD1-CE2 4.46Å; L198-F249 HydrophobicContact CD2-CD2 4.21Å; L198-F249 HydrophobicContact CD2-CE2 3.6Å; L198-F249 HydrophobicContact CD2-CZ 3.88Å; L198-F249 HydrophobicContact CG-CE2 3.76Å; L198-F249 HydrophobicContact CG-CZ 4.3Å; I201-F249 HydrophobicContact CD1-CB 3.91Å; I201-F249 HydrophobicContact CD1-CD2 4.2Å; I201-F249 HydrophobicContact CD1-CG 4.18Å; F245-F249 WeakPolarHBondContact O-CB 3.38Å; F245-F249 PolarHBondContact O-N 3.24Å; C246-F249 PolarHBondContact O-N 3.44Å; Q247-F249 VanDerWaalsContact C-N 3.28Å; Q247-F249 PolarHBondContact O-N 2.94Å; F249-Y253 HydrophobicContact CB-CD2 4.45Å; F249-Y253 AromaticContact CD2-CD2 3.51Å; F249-Y253 HydrophobicContact CD2-CD2 3.51Å; F249-Y253 AromaticContact CD2-CE2 3.94Å; F249-Y253 HydrophobicContact CD2-CE2 3.94Å; F249-Y253 HydrophobicContact CD2-CG 4.48Å; F249-Y253 AromaticContact CE2-CD2 3.77Å; F249-Y253 HydrophobicContact CE2-CD2 3.77Å; F249-Y253 HydrophobicContact CE2-CE2 4.29Å; F249-Y253 HydrophobicContact CE2-CG 4.39Å; F249-Y253 AromaticContact CG-CD2 3.94Å; F249-Y253 HydrophobicContact CG-CD2 3.94Å; F249-Y253 HydrophobicContact CZ-CD2 4.39Å; F249-Y253 WeakPolarHBondContact O-CB 3.43Å; F249-Y253 WeakPolarHBondContact O-CD2 3.45Å; F249-Y253 PolarHBondContact O-N 3.47Å; F249-I254 HydrophobicContact CD1-CD1 4.28Å; F249-I254 HydrophobicContact CD1-CG1 4.41Å; F249-I254 HydrophobicContact CE1-CD1 4.24Å; F249-I254 HydrophobicContact CE1-CG1 4.25Å
250H94.4Very high92.7Very high78 Ų7862.6 Ų62.636%0.36132%0.315SS..Iπ-helixtrans-58.8-52.2176.8-171.6-83.6000111.3C246 Q247 A252 I254 D255C246-H250 PolarHBondContact O-N 2.81Å; Q247-H250 PolarHBondContact O-N 2.66Å; H250-A252 PolarHBondContact O-N 3.17Å; H250-I254 WeakPolarHBondContact O-CA 3.45Å; H250-I254 WeakPolarHBondContact O-CB 3.07Å; H250-I254 PolarHBondContact O-N 3.47Å; H250-D255 VanDerWaalsContact CE1-CG 3.47Å; H250-D255 IonicContact CE1-OD1 3.7Å; H250-D255 PolarHBondContact CE1-OD1 2.68Å; H250-D255 IonicContact CE1-OD2 3.51Å; H250-D255 PolarHBondContact CE1-OD2 2.88Å; H250-D255 IonicContact ND1-OD1 3.94Å; H250-D255 IonicContact ND1-OD2 3.35Å; H250-D255 PolarHBondContact ND1-OD2 3.31Å; H250-D255 IonicContact NE2-OD1 3.03Å; H250-D255 PolarHBondContact O-N 3.09Å
251E92.4Very high92.2Very high99 Ų9965.5 Ų65.546%0.46333%0.332SS..Iπ-helixtrans-65-42.1-178.7-68.6178-164.500112.7Q247 F248Q247-E251 WeakPolarHBondContact CG-OE1 3.22Å; Q247-E251 PolarHBondContact NE2-OE1 3.4Å; Q247-E251 WeakPolarHBondContact O-CG 3.39Å; Q247-E251 PolarHBondContact O-N 3.39Å; F248-E251 PolarHBondContact O-N 2.98Å
252A90.9Very high91.7Very high17 Ų1767.5 Ų67.514%0.1435%0.349CS..Iπ-helixtrans-80.4-32.9-173.800000113.2R190 F248 H250 K256R190-A252 PolarHBondContact NH2-O 3.02Å; F248-A252 HydrophobicContact CE1-CB 4.28Å; F248-A252 HydrophobicContact CE2-CB 4.2Å; F248-A252 HydrophobicContact CZ-CB 4.06Å; F248-A252 WeakPolarHBondContact O-CB 3.45Å; F248-A252 PolarHBondContact O-N 3.36Å; H250-A252 PolarHBondContact O-N 3.17Å; A252-K256 WeakPolarHBondContact O-CD 2.96Å
253Y92.2Very high91.3Very high22 Ų2267.3 Ų67.39%0.08636%0.358CS..Iπ-helixtrans-115.5-42.6-171.2-59.1-70.1000114.1R190 A193 M194 T197 F248 F249 T257R190-Y253 HydrophobicContact CG-CD1 4.46Å; R190-Y253 HydrophobicContact CG-CE1 4.33Å; R190-Y253 PolarHBondContact NH2-O 2.84Å; A193-Y253 PolarHBondContact O-OH 3.34Å; A193-Y253 VanDerWaalsContact O-OH 3.04Å; M194-Y253 HydrophobicContact CB-CD1 4.09Å; M194-Y253 HydrophobicContact CB-CE1 3.91Å; M194-Y253 HydrophobicContact CE-CD1 3.94Å; M194-Y253 HydrophobicContact CE-CG 4.04Å; M194-Y253 HydrophobicContact CG-CD1 4.37Å; M194-Y253 HydrophobicContact CG-CG 4.34Å; M194-Y253 PolarHBondContact N-OH 3.46Å; T197-Y253 HydrophobicContact CG2-CE2 4.15Å; T197-Y253 WeakPolarHBondContact OG1-CE2 3.46Å; T197-Y253 PolarHBondContact OG1-OH 3.03Å; F248-Y253 HydrophobicContact CE1-CE2 4.4Å; F249-Y253 HydrophobicContact CB-CD2 4.45Å; F249-Y253 AromaticContact CD2-CD2 3.51Å; F249-Y253 HydrophobicContact CD2-CD2 3.51Å; F249-Y253 AromaticContact CD2-CE2 3.94Å; F249-Y253 HydrophobicContact CD2-CE2 3.94Å; F249-Y253 HydrophobicContact CD2-CG 4.48Å; F249-Y253 AromaticContact CE2-CD2 3.77Å; F249-Y253 HydrophobicContact CE2-CD2 3.77Å; F249-Y253 HydrophobicContact CE2-CE2 4.29Å; F249-Y253 HydrophobicContact CE2-CG 4.39Å; F249-Y253 AromaticContact CG-CD2 3.94Å; F249-Y253 HydrophobicContact CG-CD2 3.94Å; F249-Y253 HydrophobicContact CZ-CD2 4.39Å; F249-Y253 WeakPolarHBondContact O-CB 3.43Å; F249-Y253 WeakPolarHBondContact O-CD2 3.45Å; F249-Y253 PolarHBondContact O-N 3.47Å; Y253-T257 VanDerWaalsContact O-CB 3.27Å; Y253-T257 WeakPolarHBondContact O-CB 3.34Å; Y253-T257 PolarHBondContact O-N 2.9Å; Y253-T257 PolarHBondContact O-OG1 2.89Å
254I91.5Very high90.9Very high62 Ų6271.3 Ų71.332%0.31837%0.369SS..Iπ-helixtrans-80.7-57.7-175.5-58.5-178.4000109.8F249 H250 K256 T257 K258F249-I254 HydrophobicContact CD1-CD1 4.28Å; F249-I254 HydrophobicContact CD1-CG1 4.41Å; F249-I254 HydrophobicContact CE1-CD1 4.24Å; F249-I254 HydrophobicContact CE1-CG1 4.25Å; H250-I254 WeakPolarHBondContact O-CA 3.45Å; H250-I254 WeakPolarHBondContact O-CB 3.07Å; H250-I254 PolarHBondContact O-N 3.47Å; I254-K256 PolarHBondContact O-N 3.31Å; I254-T257 PolarHBondContact O-N 3.07Å; I254-K258 HydrophobicContact CG2-CD 4.15Å; I254-K258 PolarHBondContact O-N 3.14Å
255D90.3Very high90.5Very high51 Ų5172.9 Ų72.927%0.27339%0.386SS..Iπ-helixtrans-63.4-41.6-174.9-70.1-28.5000112.6H250 T257 K258 K259H250-D255 VanDerWaalsContact CE1-CG 3.47Å; H250-D255 IonicContact CE1-OD1 3.7Å; H250-D255 PolarHBondContact CE1-OD1 2.68Å; H250-D255 IonicContact CE1-OD2 3.51Å; H250-D255 PolarHBondContact CE1-OD2 2.88Å; H250-D255 IonicContact ND1-OD1 3.94Å; H250-D255 IonicContact ND1-OD2 3.35Å; H250-D255 PolarHBondContact ND1-OD2 3.31Å; H250-D255 IonicContact NE2-OD1 3.03Å; H250-D255 PolarHBondContact O-N 3.09Å; D255-T257 VanDerWaalsContact C-N 3.28Å; D255-T257 PolarHBondContact O-N 3.19Å; D255-K258 PolarHBondContact O-N 2.05Å; D255-K259 WeakPolarHBondContact O-CB 3.48Å; D255-K259 WeakPolarHBondContact O-CG 3.02Å; D255-K259 PolarHBondContact O-N 3.49Å
256K84.1Confident90.3Very high131 Ų13178.4 Ų78.457%0.5741%0.412SS*.Hα-helixtrans-62.1-36.5175.3-73.8-169.4-173.5174.20112.6A252 I254 A260A252-K256 WeakPolarHBondContact O-CD 2.96Å; I254-K256 PolarHBondContact O-N 3.31Å; K256-A260 VanDerWaalsContact O-CB 3.32Å; K256-A260 WeakPolarHBondContact O-CB 3.27Å; K256-A260 PolarHBondContact O-N 3.44Å
257T85.1Confident90Very high58 Ų5879.2 Ų79.236%0.35642%0.421SS..Hα-helixtrans-72.6-43.8179-57.60000110.4R190 Y253 I254 D255 K259 A260 T261R190-T257 PolarHBondContact NH1-OG1 3.37Å; R190-T257 PolarHBondContact NH2-OG1 3.27Å; R190-T257 VanDerWaalsContact NH2-OG1 3.13Å; Y253-T257 VanDerWaalsContact O-CB 3.27Å; Y253-T257 WeakPolarHBondContact O-CB 3.34Å; Y253-T257 PolarHBondContact O-N 2.9Å; Y253-T257 PolarHBondContact O-OG1 2.89Å; I254-T257 PolarHBondContact O-N 3.07Å; D255-T257 VanDerWaalsContact C-N 3.28Å; D255-T257 PolarHBondContact O-N 3.19Å; T257-K259 PolarHBondContact O-N 3.08Å; T257-A260 PolarHBondContact O-N 3.4Å; T257-T261 PolarHBondContact O-N 3.21Å; T257-T261 PolarHBondContact O-OG1 2.97Å; T257-T261 VanDerWaalsContact O-OG1 3.06Å
258K84.3Confident89.7Confident125 Ų12576.9 Ų76.954%0.54342%0.42SS..Hα-helixtrans-56-49.4173.8-71.7178.2177.5174.40111.8I254 D255 A260 T261 A262I254-K258 HydrophobicContact CG2-CD 4.15Å; I254-K258 PolarHBondContact O-N 3.14Å; D255-K258 PolarHBondContact O-N 2.05Å; K258-A260 PolarHBondContact O-N 2.9Å; K258-T261 PolarHBondContact O-N 2.99Å; K258-A262 WeakPolarHBondContact O-CB 3.32Å; K258-A262 PolarHBondContact O-N 2.94Å
259K86.3Confident89.4Confident159 Ų15976.2 Ų76.269%0.69143%0.426SS*.Hα-helixtrans-61.3-42.2177.7-72179.9-179.3-175.80112.7D255 T257 A262 A263D255-K259 WeakPolarHBondContact O-CB 3.48Å; D255-K259 WeakPolarHBondContact O-CG 3.02Å; D255-K259 PolarHBondContact O-N 3.49Å; T257-K259 PolarHBondContact O-N 3.08Å; K259-A262 PolarHBondContact O-N 3.24Å; K259-A263 WeakPolarHBondContact O-CB 3.42Å; K259-A263 PolarHBondContact O-N 3Å
260A85Confident89.1Confident51 Ų5177.2 Ų77.242%0.42144%0.441SS..Hα-helixtrans-65.6-38.1177.600000112.5K256 T257 K258 K264K256-A260 VanDerWaalsContact O-CB 3.32Å; K256-A260 WeakPolarHBondContact O-CB 3.27Å; K256-A260 PolarHBondContact O-N 3.44Å; T257-A260 PolarHBondContact O-N 3.4Å; K258-A260 PolarHBondContact O-N 2.9Å; A260-K264 WeakPolarHBondContact O-CG 3.24Å; A260-K264 PolarHBondContact O-N 3.37Å; A260-K264 VanDerWaalsContact O-N 3.17Å
261T87.5Confident88.7Confident89 Ų8976.4 Ų76.455%0.54645%0.448SS..Hα-helixtrans-67.7-44.5175.7-58.50000111.5T257 K258 K264 A265T257-T261 PolarHBondContact O-N 3.21Å; T257-T261 PolarHBondContact O-OG1 2.97Å; T257-T261 VanDerWaalsContact O-OG1 3.06Å; K258-T261 PolarHBondContact O-N 2.99Å; T261-K264 PolarHBondContact O-N 3.48Å; T261-A265 PolarHBondContact O-N 2.96Å
262A88.5Confident88.4Confident46 Ų4681.3 Ų81.338%0.3846%0.462SS..Hα-helixtrans-59.7-48.7176.700000111.7K258 K259 K264 A265 E266K258-A262 WeakPolarHBondContact O-CB 3.32Å; K258-A262 PolarHBondContact O-N 2.94Å; K259-A262 PolarHBondContact O-N 3.24Å; A262-K264 VanDerWaalsContact C-N 3.28Å; A262-K264 PolarHBondContact O-N 3.02Å; A262-A265 WeakPolarHBondContact O-CB 3.42Å; A262-A265 PolarHBondContact O-N 3.28Å; A262-E266 WeakPolarHBondContact O-CG 3.13Å; A262-E266 PolarHBondContact O-N 3.49Å
263A89.1Confident87.8Confident52 Ų5289.2 Ų89.243%0.4349%0.493SS..Hα-helixtrans-59.9-36.6177.800000112.9K259 A267K259-A263 WeakPolarHBondContact O-CB 3.42Å; K259-A263 PolarHBondContact O-N 3Å; A263-A267 WeakPolarHBondContact O-CB 3.36Å; A263-A267 PolarHBondContact O-N 3.3Å
264K89.3Confident86.8Confident163 Ų16394.2 Ų94.271%0.70953%0.526SS*.Hα-helixtrans-67.9-40.2174.3-77.6-177.5177.2-169.80112.4A260 T261 A262 A268A260-K264 WeakPolarHBondContact O-CG 3.24Å; A260-K264 PolarHBondContact O-N 3.37Å; A260-K264 VanDerWaalsContact O-N 3.17Å; T261-K264 PolarHBondContact O-N 3.48Å; A262-K264 VanDerWaalsContact C-N 3.28Å; A262-K264 PolarHBondContact O-N 3.02Å; K264-A268 WeakPolarHBondContact O-CB 3.29Å; K264-A268 PolarHBondContact O-N 3.22Å
265A89.6Confident84.9Confident61 Ų61102.1 Ų102.150%0.50456%0.562SS.*Hα-helixtrans-65.5-43.1177.300000111.3T261 A262 A268 A269T261-A265 PolarHBondContact O-N 2.96Å; A262-A265 WeakPolarHBondContact O-CB 3.42Å; A262-A265 PolarHBondContact O-N 3.28Å; A265-A268 PolarHBondContact O-N 3.42Å; A265-A269 WeakPolarHBondContact O-CB 3.46Å; A265-A269 PolarHBondContact O-N 3.44Å
266E91.4Very high84.7Confident136 Ų136104.7 Ų104.764%0.63658%0.576SS**Hα-helixtrans-61.5-46.1174.7-72.4170.7-171.800111.8A262 A268 A269 A270A262-E266 WeakPolarHBondContact O-CG 3.13Å; A262-E266 PolarHBondContact O-N 3.49Å; E266-A268 PolarHBondContact O-N 3.34Å; E266-A269 PolarHBondContact O-N 3.32Å; E266-A270 WeakPolarHBondContact O-CB 3.35Å; E266-A270 PolarHBondContact O-N 3.48Å
267A90.1Very high84.7Confident62 Ų62103.3 Ų103.351%0.51258%0.577SS.*Hα-helixtrans-62.2-41.3176.800000112.4A263 A270 A271A263-A267 WeakPolarHBondContact O-CB 3.36Å; A263-A267 PolarHBondContact O-N 3.3Å; A267-A270 PolarHBondContact O-N 3.04Å; A267-A271 PolarHBondContact O-N 2.82Å
268A90.4Very high84.7Confident53 Ų53105.8 Ų105.844%0.43859%0.589SS.*Hα-helixtrans-66.4-37.5176.200000112.3K264 A265 E266 R272K264-A268 WeakPolarHBondContact O-CB 3.29Å; K264-A268 PolarHBondContact O-N 3.22Å; A265-A268 PolarHBondContact O-N 3.42Å; E266-A268 PolarHBondContact O-N 3.34Å; A268-R272 WeakPolarHBondContact O-CG 3.29Å; A268-R272 PolarHBondContact O-N 3.14Å
269A89.7Confident84.7Confident52 Ų52104.7 Ų104.743%0.4359%0.592SS.*Hα-helixtrans-68.7-38.2175.600000112.2A265 E266 R272A265-A269 WeakPolarHBondContact O-CB 3.46Å; A265-A269 PolarHBondContact O-N 3.44Å; E266-A269 PolarHBondContact O-N 3.32Å; A269-R272 PolarHBondContact O-N 3.46Å
270A88.3Confident84.6Confident55 Ų55101.3 Ų101.346%0.45559%0.585SS.*Hα-helixtrans-64.8-45.5175.500000111.8E266 A267 R272 K273 T274E266-A270 WeakPolarHBondContact O-CB 3.35Å; E266-A270 PolarHBondContact O-N 3.48Å; A267-A270 PolarHBondContact O-N 3.04Å; A270-R272 VanDerWaalsContact C-N 3.25Å; A270-R272 PolarHBondContact O-N 3.31Å; A270-K273 PolarHBondContact O-N 3.13Å; A270-T274 PolarHBondContact O-OG1 3.22Å; A270-T274 VanDerWaalsContact O-OG1 3.1Å
271A86.6Confident84.6Confident61 Ų61104.7 Ų104.750%0.50460%0.596SS.*Hα-helixtrans-60.8-32.2178.500000113.3A267 K273A267-A271 PolarHBondContact O-N 2.82Å; A271-K273 VanDerWaalsContact C-N 3.32Å; A271-K273 PolarHBondContact O-N 3.04Å
272R85.6Confident84.3Confident202 Ų202105.8 Ų105.876%0.76260%0.6SS**Hα-helixtrans-72.7-19.1176-74.5178.1179.6-174.5-0.7114.4A268 A269 A270A268-R272 WeakPolarHBondContact O-CG 3.29Å; A268-R272 PolarHBondContact O-N 3.14Å; A269-R272 PolarHBondContact O-N 3.46Å; A270-R272 VanDerWaalsContact C-N 3.25Å; A270-R272 PolarHBondContact O-N 3.31Å
273K79.2Confident84Confident182 Ų182110.4 Ų110.479%0.79162%0.617SS**THydrogen-bonded Turntrans-89.5-7.5178.4-70.6-178.5177.6-175.90113.1A270 A271A270-K273 PolarHBondContact O-N 3.13Å; A271-K273 VanDerWaalsContact C-N 3.32Å; A271-K273 PolarHBondContact O-N 3.04Å
274T70.8Confident83.6Confident127 Ų127115.3 Ų115.378%0.77963%0.632SS**  trans-102.7-2.5-178.4-27.80000112.7A270A270-T274 PolarHBondContact O-OG1 3.22Å; A270-T274 VanDerWaalsContact O-OG1 3.1Å
275Q52.3Low83.1Confident229 Ų229110.9 Ų110.9100%1.0763%0.626SS**  trans-98.80165.7-81.6-177.1-3300109.5

Retrieved 275 of 275 residues in 199.6 ms (Link to these results)