A0A087X8W9_POEFO Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A087X8W9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 270 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.9Very low44.7Very low246 Ų246162.9 Ų162.9100%1.21279%0.79SS**  096.20-151.1173.6-170.900107.6R3M1-R3 PolarHBondContact O-N 2.99Å
2S38.6Very low46.9Very low130 Ų130162.8 Ų162.891%0.90979%0.787SS**  trans-75.3115.4-167.6-176.20000111.1
3R42.9Very low49Very low241 Ų241152.8 Ų152.891%0.90974%0.742SS**  trans-97.5100.6-174.7-144.4175.6-173.1178.50.9108.7M1M1-R3 PolarHBondContact O-N 2.99Å
4K44.9Very low51.2Low172 Ų172145.3 Ų145.375%0.74871%0.713SS**  trans52.770.6148.6-100.7178.7176.6179.80117R6K4-R6 PolarHBondContact O-N 3.39Å
5H39.8Very low53.3Low190 Ų190140.7 Ų140.788%0.8870%0.7SS**  trans-84.372.6142.6-91.3-51.3000108.9H7H5-H7 PolarHBondContact O-N 3.44Å
6R42.8Very low55.2Low205 Ų205138.3 Ų138.377%0.77470%0.699SS**  trans-81.5105.3154.3-94.2-174.8180176.5-0.6105K4 L8K4-R6 PolarHBondContact O-N 3.39Å; R6-L8 VanDerWaalsContact C-N 3.26Å; R6-L8 PolarHBondContact O-N 3.19Å
7H41Very low56.9Low174 Ų174132 Ų13281%0.80667%0.669SS**  trans-47.297.6156.3-93.9-90.4000107.8H5 K9H5-H7 PolarHBondContact O-N 3.44Å; H7-K9 PolarHBondContact O-N 2.92Å
8L47.9Very low58.4Low159 Ų159126.5 Ų126.583%0.83264%0.64SS**  trans-65.693.1150.2-89.384.3000103.8R6 G10R6-L8 VanDerWaalsContact C-N 3.26Å; R6-L8 PolarHBondContact O-N 3.19Å; L8-G10 PolarHBondContact O-N 3.44Å
9K45.7Very low60Low191 Ų191127.2 Ų127.283%0.8364%0.635SS**  trans-54.5115.3152.4-85.5-176.3172.8-175.80104.2H7 A11H7-K9 PolarHBondContact O-N 2.92Å; K9-A11 PolarHBondContact O-N 3.31Å
10G51.8Low61.5Low46 Ų46126.4 Ų126.447%0.47463%0.628SS.*  trans-50.1144172.200000108.3L8 E12L8-G10 PolarHBondContact O-N 3.44Å; G10-E12 PolarHBondContact O-N 3.17Å
11A58.8Low62.8Low38 Ų38120.4 Ų120.431%0.31460%0.598SS.*  trans-58.3115.7169.200000106.9K9 A265 V266 N269K9-A11 PolarHBondContact O-N 3.31Å; A11-A265 HydrophobicContact CB-CB 3.61Å; A11-V266 HydrophobicContact CB-CG2 4.37Å; A11-V266 WeakPolarHBondContact O-CG2 3.34Å; A11-N269 WeakPolarHBondContact CB-ND2 3.41Å
12E70.4Confident65.4Low161 Ų161111.4 Ų111.475%0.75255%0.552SS**  trans-121.7139.7178.1-74.4178.9-178.100107.5G10 S14G10-E12 PolarHBondContact O-N 3.17Å; E12-S14 PolarHBondContact O-N 3.14Å
13V74.4Confident67.8Low33 Ų33106.6 Ų106.620%0.252%0.523CS..  trans-67.3124.9175.9179.50000109.1C15 L259 D262 V263 V266V13-C15 PolarHBondContact O-N 2.88Å; V13-L259 HydrophobicContact CG1-CD1 3.36Å; V13-D262 HydrophobicContact CG2-CB 4.38Å; V13-V263 HydrophobicContact CG2-CG2 4.14Å; V13-V266 HydrophobicContact CG2-CG2 4Å
14S80.3Confident70.1Confident48 Ų4897.2 Ų97.234%0.33649%0.489SS..  trans-64.7107178-177.50000111.2E12 C16 V17 K18 D262E12-S14 PolarHBondContact O-N 3.14Å; S14-C16 VanDerWaalsContact C-N 3.27Å; S14-C16 PolarHBondContact O-N 3.29Å; S14-V17 PolarHBondContact O-N 3.35Å; S14-V17 VanDerWaalsContact O-N 3.12Å; S14-K18 PolarHBondContact O-N 2.9Å; S14-K18 VanDerWaalsContact O-N 3.08Å; S14-D262 PolarHBondContact N-OD2 3.22Å
15C82.1Confident72.4Confident77 Ų7789.2 Ų89.252%0.5245%0.454SS..Hα-helixtrans-53.7-44179.7-176.40000111.8V13 V17 K18 Y19V13-C15 PolarHBondContact O-N 2.88Å; C15-V17 PolarHBondContact O-N 3.05Å; C15-K18 PolarHBondContact O-N 2.99Å; C15-Y19 VanDerWaalsContact O-CD2 3.25Å; C15-Y19 WeakPolarHBondContact O-CD2 3.41Å; C15-Y19 PolarHBondContact O-N 3.13Å; C15-Y19 WeakPolarHBondContact SG-CD2 3.42Å; C15-Y19 WeakPolarHBondContact SG-CE2 3.41Å
16C84.3Confident75.1Confident102 Ų10282.4 Ų82.469%0.68942%0.424SS*.Hα-helixtrans-60.3-44.2178.5-610000112.1S14 F20S14-C16 VanDerWaalsContact C-N 3.27Å; S14-C16 PolarHBondContact O-N 3.29Å; C16-F20 WeakPolarHBondContact O-CB 3.49Å; C16-F20 PolarHBondContact O-N 3.1Å
17V82.8Confident77.5Confident31 Ų3177.1 Ų77.119%0.18841%0.41CS..Hα-helixtrans-64.7-42.6179.2171.90000110.8S14 C15 L21 L255S14-V17 PolarHBondContact O-N 3.35Å; S14-V17 VanDerWaalsContact O-N 3.12Å; C15-V17 PolarHBondContact O-N 3.05Å; V17-L21 WeakPolarHBondContact O-CB 3.19Å; V17-L21 PolarHBondContact O-N 2.99Å; V17-L255 HydrophobicContact CG1-CD2 4.09Å
18K84.9Confident80.1Confident33 Ų3371.8 Ų71.814%0.14339%0.385CS..Hα-helixtrans-60.2-53.9178.8-179.6177.6179.8170.10112.1S14 C15 F22 A85 L86 E88S14-K18 PolarHBondContact O-N 2.9Å; S14-K18 VanDerWaalsContact O-N 3.08Å; C15-K18 PolarHBondContact O-N 2.99Å; K18-F22 WeakPolarHBondContact O-CB 3.36Å; K18-F22 PolarHBondContact O-N 2.83Å; K18-A85 VanDerWaalsContact CE-O 3.25Å; K18-A85 WeakPolarHBondContact CE-O 3.49Å; K18-L86 PolarHBondContact NZ-O 3.45Å; K18-E88 IonicContact NZ-OE1 3.21Å; K18-E88 PolarHBondContact NZ-OE1 3.42Å
19Y88.9Confident82.4Confident140 Ų14067.8 Ų67.855%0.54936%0.358SS..Hα-helixtrans-71.3-33.7-177.5-75.2-72.1000112.7C15 G23C15-Y19 VanDerWaalsContact O-CD2 3.25Å; C15-Y19 WeakPolarHBondContact O-CD2 3.41Å; C15-Y19 PolarHBondContact O-N 3.13Å; C15-Y19 WeakPolarHBondContact SG-CD2 3.42Å; C15-Y19 WeakPolarHBondContact SG-CE2 3.41Å; Y19-G23 PolarHBondContact O-N 3.28Å
20F89.4Confident84.9Confident111 Ų11163.5 Ų63.549%0.48734%0.344SS..Hα-helixtrans-66.2-47174.5-174.9-83.9000111.6C16 F22 G23 F24 F251 L255C16-F20 WeakPolarHBondContact O-CB 3.49Å; C16-F20 PolarHBondContact O-N 3.1Å; F20-F22 VanDerWaalsContact C-N 3.31Å; F20-F22 PolarHBondContact O-N 3.48Å; F20-G23 PolarHBondContact O-N 2.89Å; F20-F24 PolarHBondContact O-N 2.98Å; F20-F251 HydrophobicContact CD1-CE1 4.45Å; F20-F251 AromaticContact CE1-CE1 3.44Å; F20-F251 HydrophobicContact CE1-CE1 3.44Å; F20-F251 VanDerWaalsContact CE1-CE1 3.44Å; F20-F251 AromaticContact CE1-CZ 3.79Å; F20-F251 HydrophobicContact CE1-CZ 3.79Å; F20-F251 AromaticContact CZ-CE1 3.92Å; F20-F251 HydrophobicContact CZ-CE1 3.92Å; F20-F251 HydrophobicContact CZ-CZ 4.25Å; F20-L255 HydrophobicContact CD1-CD1 3.74Å; F20-L255 HydrophobicContact CE1-CD1 3.91Å
21L89.4Confident87Confident0 Ų065.2 Ų65.20%034%0.342CS..Hα-helixtrans-61.2-41.2176.6-177.165000111.4V17 N25 A85 L93 F96 L255 A256 L259V17-L21 WeakPolarHBondContact O-CB 3.19Å; V17-L21 PolarHBondContact O-N 2.99Å; L21-N25 VanDerWaalsContact CD1-ND2 3.3Å; L21-N25 WeakPolarHBondContact CD1-ND2 3.32Å; L21-N25 WeakPolarHBondContact O-CB 3.29Å; L21-N25 PolarHBondContact O-N 3.44Å; L21-N25 PolarHBondContact O-ND2 2.9Å; L21-A85 HydrophobicContact CD2-CB 4.11Å; L21-A85 HydrophobicContact CG-CB 4.38Å; L21-L93 HydrophobicContact CD2-CD2 3.99Å; L21-F96 HydrophobicContact CD1-CE1 4.4Å; L21-L255 HydrophobicContact CD1-CB 4.01Å; L21-L255 HydrophobicContact CD1-CD1 4.37Å; L21-A256 HydrophobicContact CD2-CB 4.42Å; L21-L259 HydrophobicContact CD2-CD2 3.92Å
22F91.3Very high88.8Confident57 Ų5763.4 Ų63.425%0.2533%0.327CS..Hα-helixtrans-61.9-49.4173.8171.9-103.3000112.1K18 F20 F24 N25 I26 C82 L86K18-F22 WeakPolarHBondContact O-CB 3.36Å; K18-F22 PolarHBondContact O-N 2.83Å; F20-F22 VanDerWaalsContact C-N 3.31Å; F20-F22 PolarHBondContact O-N 3.48Å; F22-F24 VanDerWaalsContact C-N 3.3Å; F22-F24 PolarHBondContact O-N 3.27Å; F22-N25 PolarHBondContact O-N 2.88Å; F22-I26 HydrophobicContact CE2-CD1 4.38Å; F22-I26 HydrophobicContact CZ-CD1 4.34Å; F22-I26 PolarHBondContact O-N 3.45Å; F22-C82 HydrophobicContact CD2-CB 4.01Å; F22-C82 HydrophobicContact CE2-CB 4.09Å; F22-L86 HydrophobicContact CD2-CD1 3.78Å; F22-L86 HydrophobicContact CD2-CD2 4.09Å; F22-L86 HydrophobicContact CD2-CG 3.69Å; F22-L86 HydrophobicContact CE2-CD1 3.48Å; F22-L86 VanDerWaalsContact CE2-CD1 3.48Å; F22-L86 HydrophobicContact CE2-CD2 4.39Å; F22-L86 HydrophobicContact CE2-CG 3.96Å; F22-L86 HydrophobicContact CG-CD2 4.25Å; F22-L86 HydrophobicContact CG-CG 4.32Å; F22-L86 HydrophobicContact CZ-CD1 4.18Å
23G90.9Very high90.1Very high29 Ų2957.6 Ų57.630%0.29931%0.306SS..Hα-helixtrans-63.1-33.9-179.300000113.4Y19 F20 I26 I27Y19-G23 PolarHBondContact O-N 3.28Å; F20-G23 PolarHBondContact O-N 2.89Å; G23-I26 VanDerWaalsContact O-CG2 3.32Å; G23-I26 WeakPolarHBondContact O-CG2 3.5Å; G23-I27 WeakPolarHBondContact O-CG1 3.38Å
24F90.4Very high91.2Very high45 Ų4558.3 Ų58.320%0.19732%0.316CS..Hα-helixtrans-69.4-51.1171.8178.7-97.6000111.3F20 F22 I26 I27 F28 L248F20-F24 PolarHBondContact O-N 2.98Å; F22-F24 VanDerWaalsContact C-N 3.3Å; F22-F24 PolarHBondContact O-N 3.27Å; F24-I26 VanDerWaalsContact C-N 3.32Å; F24-I26 PolarHBondContact O-N 3.49Å; F24-I27 WeakPolarHBondContact O-CB 3.41Å; F24-I27 PolarHBondContact O-N 3.11Å; F24-F28 HydrophobicContact CD1-CD2 4.02Å; F24-F28 HydrophobicContact CD1-CE2 4.15Å; F24-F28 HydrophobicContact CD2-CD2 4.37Å; F24-F28 AromaticContact CD2-CE2 3.88Å; F24-F28 HydrophobicContact CD2-CE2 3.88Å; F24-F28 AromaticContact CE1-CD2 3.61Å; F24-F28 HydrophobicContact CE1-CD2 3.61Å; F24-F28 AromaticContact CE1-CE2 3.5Å; F24-F28 HydrophobicContact CE1-CE2 3.5Å; F24-F28 VanDerWaalsContact CE1-CE2 3.5Å; F24-F28 HydrophobicContact CE1-CZ 4.25Å; F24-F28 AromaticContact CE2-CD2 4Å; F24-F28 HydrophobicContact CE2-CD2 4Å; F24-F28 AromaticContact CE2-CE2 3.18Å; F24-F28 HydrophobicContact CE2-CE2 3.18Å; F24-F28 AromaticContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CG-CD2 4.38Å; F24-F28 HydrophobicContact CG-CE2 4.32Å; F24-F28 AromaticContact CZ-CD2 3.6Å; F24-F28 HydrophobicContact CZ-CD2 3.6Å; F24-F28 AromaticContact CZ-CE2 2.95Å; F24-F28 HydrophobicContact CZ-CE2 2.95Å; F24-F28 AromaticContact CZ-CZ 3.5Å; F24-F28 HydrophobicContact CZ-CZ 3.5Å; F24-F28 WeakPolarHBondContact O-CD2 3.49Å; F24-F28 PolarHBondContact O-N 2.9Å; F24-L248 HydrophobicContact CE2-CD1 3.5Å; F24-L248 HydrophobicContact CE2-CD2 3.9Å; F24-L248 HydrophobicContact CE2-CG 3.84Å; F24-L248 HydrophobicContact CZ-CD1 3.65Å; F24-L248 HydrophobicContact CZ-CD2 3.57Å; F24-L248 HydrophobicContact CZ-CG 3.45Å; F24-L248 VanDerWaalsContact CZ-CG 3.45Å
25N93.9Very high91.9Very high3 Ų359.5 Ų59.52%0.01632%0.315CS..Hα-helixtrans-65.1-30.6-176.8-80.6-73.8000113.8L21 F22 I27 F28 W29 C82 F96L21-N25 VanDerWaalsContact CD1-ND2 3.3Å; L21-N25 WeakPolarHBondContact CD1-ND2 3.32Å; L21-N25 WeakPolarHBondContact O-CB 3.29Å; L21-N25 PolarHBondContact O-N 3.44Å; L21-N25 PolarHBondContact O-ND2 2.9Å; F22-N25 PolarHBondContact O-N 2.88Å; N25-I27 VanDerWaalsContact C-N 3.27Å; N25-I27 PolarHBondContact O-N 3.49Å; N25-F28 PolarHBondContact O-N 3.47Å; N25-W29 WeakPolarHBondContact O-CB 3.49Å; N25-W29 PolarHBondContact O-N 3.34Å; N25-C82 WeakPolarHBondContact CB-SG 3.47Å; N25-F96 WeakPolarHBondContact OD1-CE2 3.38Å; N25-F96 VanDerWaalsContact OD1-CZ 3.28Å; N25-F96 WeakPolarHBondContact OD1-CZ 3.32Å
26I95.3Very high92.5Very high48 Ų4857.8 Ų57.825%0.24630%0.301CS..Hα-helixtrans-65.7-34.4178-161.974.7000111.2F22 G23 F24 W29 L30 C82F22-I26 HydrophobicContact CE2-CD1 4.38Å; F22-I26 HydrophobicContact CZ-CD1 4.34Å; F22-I26 PolarHBondContact O-N 3.45Å; G23-I26 VanDerWaalsContact O-CG2 3.32Å; G23-I26 WeakPolarHBondContact O-CG2 3.5Å; F24-I26 VanDerWaalsContact C-N 3.32Å; F24-I26 PolarHBondContact O-N 3.49Å; I26-W29 HydrophobicContact CD1-CD2 4.42Å; I26-W29 HydrophobicContact CD1-CE3 3.45Å; I26-W29 VanDerWaalsContact CD1-CE3 3.45Å; I26-W29 HydrophobicContact CD1-CZ3 3.88Å; I26-W29 HydrophobicContact CG1-CE3 4.32Å; I26-W29 PolarHBondContact O-N 2.91Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.46Å; I26-L30 PolarHBondContact O-N 3.36Å; I26-C82 PolarHBondContact N-SG 3.27Å
27I94.7Very high93Very high94 Ų9454.8 Ų54.848%0.48229%0.287SS..Hα-helixtrans-64.6-48.9175.3-62.6168.6000109.6G23 F24 N25 W29 L30 L31G23-I27 WeakPolarHBondContact O-CG1 3.38Å; F24-I27 WeakPolarHBondContact O-CB 3.41Å; F24-I27 PolarHBondContact O-N 3.11Å; N25-I27 VanDerWaalsContact C-N 3.27Å; N25-I27 PolarHBondContact O-N 3.49Å; I27-W29 VanDerWaalsContact C-N 3.28Å; I27-W29 PolarHBondContact O-N 3.3Å; I27-L30 PolarHBondContact O-N 3.07Å; I27-L31 HydrophobicContact CG2-CD1 3.96Å; I27-L31 HydrophobicContact CG2-CG 4.4Å; I27-L31 WeakPolarHBondContact O-CB 3.4Å; I27-L31 WeakPolarHBondContact O-CG 3.34Å; I27-L31 PolarHBondContact O-N 3.49Å
28F93.9Very high93.4Very high62 Ų6257.4 Ų57.427%0.27230%0.299SS..Hα-helixtrans-62.1-36.8177.2-79.2-89.6000112.8F24 N25 G32 M74 L248F24-F28 HydrophobicContact CD1-CD2 4.02Å; F24-F28 HydrophobicContact CD1-CE2 4.15Å; F24-F28 HydrophobicContact CD2-CD2 4.37Å; F24-F28 AromaticContact CD2-CE2 3.88Å; F24-F28 HydrophobicContact CD2-CE2 3.88Å; F24-F28 AromaticContact CE1-CD2 3.61Å; F24-F28 HydrophobicContact CE1-CD2 3.61Å; F24-F28 AromaticContact CE1-CE2 3.5Å; F24-F28 HydrophobicContact CE1-CE2 3.5Å; F24-F28 VanDerWaalsContact CE1-CE2 3.5Å; F24-F28 HydrophobicContact CE1-CZ 4.25Å; F24-F28 AromaticContact CE2-CD2 4Å; F24-F28 HydrophobicContact CE2-CD2 4Å; F24-F28 AromaticContact CE2-CE2 3.18Å; F24-F28 HydrophobicContact CE2-CE2 3.18Å; F24-F28 AromaticContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CG-CD2 4.38Å; F24-F28 HydrophobicContact CG-CE2 4.32Å; F24-F28 AromaticContact CZ-CD2 3.6Å; F24-F28 HydrophobicContact CZ-CD2 3.6Å; F24-F28 AromaticContact CZ-CE2 2.95Å; F24-F28 HydrophobicContact CZ-CE2 2.95Å; F24-F28 AromaticContact CZ-CZ 3.5Å; F24-F28 HydrophobicContact CZ-CZ 3.5Å; F24-F28 WeakPolarHBondContact O-CD2 3.49Å; F24-F28 PolarHBondContact O-N 2.9Å; N25-F28 PolarHBondContact O-N 3.47Å; F28-G32 PolarHBondContact O-N 3.39Å; F28-M74 HydrophobicContact CD1-CE 4.08Å; F28-L248 HydrophobicContact CE2-CD2 4.37Å; F28-L248 HydrophobicContact CZ-CD2 3.68Å
29W96.9Very high93.6Very high74 Ų7455.9 Ų55.928%0.2829%0.293SS..Hα-helixtrans-64-46.3176.6-17959000112N25 I26 I27 G32 A33 F75N25-W29 WeakPolarHBondContact O-CB 3.49Å; N25-W29 PolarHBondContact O-N 3.34Å; I26-W29 HydrophobicContact CD1-CD2 4.42Å; I26-W29 HydrophobicContact CD1-CE3 3.45Å; I26-W29 VanDerWaalsContact CD1-CE3 3.45Å; I26-W29 HydrophobicContact CD1-CZ3 3.88Å; I26-W29 HydrophobicContact CG1-CE3 4.32Å; I26-W29 PolarHBondContact O-N 2.91Å; I27-W29 VanDerWaalsContact C-N 3.28Å; I27-W29 PolarHBondContact O-N 3.3Å; W29-G32 PolarHBondContact O-N 3.05Å; W29-A33 PolarHBondContact O-N 2.95Å; W29-F75 AromaticContact CD1-CD2 3.56Å; W29-F75 AromaticContact CD1-CE2 3.74Å; W29-F75 VanDerWaalsContact CD1-O 3.31Å; W29-F75 AromaticContact CE2-CE2 3.65Å; W29-F75 HydrophobicContact CZ2-CE2 4.04Å; W29-F75 HydrophobicContact CZ2-CZ 4.25Å; W29-F75 AromaticContact NE1-CD2 3.34Å; W29-F75 VanDerWaalsContact NE1-CD2 3.34Å; W29-F75 AromaticContact NE1-CE1 3.94Å; W29-F75 AromaticContact NE1-CE2 3Å; W29-F75 AromaticContact NE1-CG 3.97Å; W29-F75 AromaticContact NE1-CZ 3.34Å; W29-F75 VanDerWaalsContact NE1-CZ 3.34Å
30L97.3Very high93.7Very high102 Ų10253.7 Ų53.753%0.53429%0.29SS..Hα-helixtrans-66.3-41.5177-68.4175.3000112I26 I27 G32 A33 A34I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.46Å; I26-L30 PolarHBondContact O-N 3.36Å; I27-L30 PolarHBondContact O-N 3.07Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-A33 PolarHBondContact O-N 2.92Å; L30-A34 PolarHBondContact O-N 3.02Å
31L96.3Very high93.6Very high81 Ų8156.4 Ų56.442%0.42430%0.297SS..Hα-helixtrans-62.7-41.3173.9-70.6174.6000111.6I27 A34 F35 M74I27-L31 HydrophobicContact CG2-CD1 3.96Å; I27-L31 HydrophobicContact CG2-CG 4.4Å; I27-L31 WeakPolarHBondContact O-CB 3.4Å; I27-L31 WeakPolarHBondContact O-CG 3.34Å; I27-L31 PolarHBondContact O-N 3.49Å; L31-A34 PolarHBondContact O-N 2.99Å; L31-F35 PolarHBondContact O-N 3.04Å; L31-M74 HydrophobicContact CB-CE 3.64Å
32G97Very high93.3Very high0 Ų057.6 Ų57.60%031%0.307CS..Hα-helixtrans-62.3-42.1175.200000112.2F28 W29 L30 A34 F35 L36F28-G32 PolarHBondContact O-N 3.39Å; W29-G32 PolarHBondContact O-N 3.05Å; L30-G32 VanDerWaalsContact C-N 3.34Å; G32-A34 VanDerWaalsContact C-N 3.34Å; G32-A34 PolarHBondContact O-N 3.06Å; G32-F35 PolarHBondContact O-N 3.08Å; G32-L36 WeakPolarHBondContact O-CB 3.33Å; G32-L36 WeakPolarHBondContact O-CG 3.26Å; G32-L36 PolarHBondContact O-N 3.46Å
33A97.4Very high92.9Very high39 Ų3961.4 Ų61.432%0.32232%0.32SS..Hα-helixtrans-62.3-40.817400000112.1W29 L30 G37 F75W29-A33 PolarHBondContact O-N 2.95Å; L30-A33 PolarHBondContact O-N 2.92Å; A33-G37 PolarHBondContact O-N 2.72Å; A33-F75 HydrophobicContact CB-CD2 3.9Å; A33-F75 HydrophobicContact CB-CE2 4.07Å
34A97.1Very high92.6Very high49 Ų4962.4 Ų62.441%0.40533%0.325SS..Hα-helixtrans-63.7-46.817600000111.8L30 L31 G32 L36 G37 I38L30-A34 PolarHBondContact O-N 3.02Å; L31-A34 PolarHBondContact O-N 2.99Å; G32-A34 VanDerWaalsContact C-N 3.34Å; G32-A34 PolarHBondContact O-N 3.06Å; A34-L36 PolarHBondContact O-N 2.73Å; A34-G37 PolarHBondContact O-N 3.15Å; A34-I38 WeakPolarHBondContact O-CG1 3.25Å; A34-I38 PolarHBondContact O-N 3.18Å
35F95Very high92Very high73 Ų7365.7 Ų65.732%0.3234%0.341SS..Hα-helixtrans-63.6-41.4178-81.517.2000112.3L31 G32 I38 G39 F67 V70 M74L31-F35 PolarHBondContact O-N 3.04Å; G32-F35 PolarHBondContact O-N 3.08Å; F35-I38 PolarHBondContact O-N 3.13Å; F35-G39 PolarHBondContact O-N 3.11Å; F35-F67 HydrophobicContact CG-CD1 4.43Å; F35-V70 HydrophobicContact CD2-CG1 4.21Å; F35-V70 HydrophobicContact CE2-CG1 4.49Å; F35-M74 HydrophobicContact CD2-SD 4.37Å
36L94.9Very high90.7Very high40 Ų4068 Ų6821%0.20935%0.351CS..Hα-helixtrans-61-45171.7-80.2174.3000112.1G32 A34 G39 L40 M68 G71 F75G32-L36 WeakPolarHBondContact O-CB 3.33Å; G32-L36 WeakPolarHBondContact O-CG 3.26Å; G32-L36 PolarHBondContact O-N 3.46Å; A34-L36 PolarHBondContact O-N 2.73Å; L36-G39 PolarHBondContact O-N 3.36Å; L36-L40 WeakPolarHBondContact O-CB 3.17Å; L36-L40 VanDerWaalsContact O-CG 3.27Å; L36-L40 WeakPolarHBondContact O-CG 3.25Å; L36-L40 PolarHBondContact O-N 3.36Å; L36-M68 VanDerWaalsContact CD2-O 3.27Å; L36-M68 WeakPolarHBondContact CD2-O 3.49Å; L36-G71 VanDerWaalsContact CG-C 3.46Å; L36-F75 HydrophobicContact CD1-CB 3.72Å; L36-F75 HydrophobicContact CD1-CD1 4.5Å; L36-F75 HydrophobicContact CD1-CD2 4.39Å; L36-F75 HydrophobicContact CD1-CG 3.98Å
37G94.6Very high88.9Confident39 Ų3967.9 Ų67.940%0.40236%0.361SS..Hα-helixtrans-60.2-46.5178.800000112.1A33 A34 W41A33-G37 PolarHBondContact O-N 2.72Å; A34-G37 PolarHBondContact O-N 3.15Å; G37-W41 VanDerWaalsContact O-CB 3.28Å; G37-W41 WeakPolarHBondContact O-CB 3.24Å; G37-W41 PolarHBondContact O-N 2.93Å
38I91.6Very high86.9Confident86 Ų8669.4 Ų69.444%0.44138%0.375SS..Hα-helixtrans-62.8-46.6176-65.7165.3000110.6A34 F35 W41 A42A34-I38 WeakPolarHBondContact O-CG1 3.25Å; A34-I38 PolarHBondContact O-N 3.18Å; F35-I38 PolarHBondContact O-N 3.13Å; I38-W41 PolarHBondContact O-N 3.48Å; I38-A42 WeakPolarHBondContact O-CB 3.08Å; I38-A42 PolarHBondContact O-N 2.91Å
39G89.3Confident84.8Confident1 Ų173.5 Ų73.51%0.0140%0.399CS..Hα-helixtrans-62.3-43.9179.500000112.9F35 L36 W43 V64F35-G39 PolarHBondContact O-N 3.11Å; L36-G39 PolarHBondContact O-N 3.36Å; G39-W43 VanDerWaalsContact O-CB 3.26Å; G39-W43 WeakPolarHBondContact O-CB 3.47Å; G39-W43 PolarHBondContact O-N 2.92Å; G39-V64 VanDerWaalsContact O-CG1 3.3Å; G39-V64 WeakPolarHBondContact O-CG1 3.3Å
40L90.2Very high82.6Confident94 Ų9472.9 Ų72.949%0.49241%0.405SS..Hα-helixtrans-68.4-38.8177.2-72.1172000112.4L36 W43 A44 M68L36-L40 WeakPolarHBondContact O-CB 3.17Å; L36-L40 VanDerWaalsContact O-CG 3.27Å; L36-L40 WeakPolarHBondContact O-CG 3.25Å; L36-L40 PolarHBondContact O-N 3.36Å; L40-W43 PolarHBondContact O-N 3.45Å; L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 2.99Å; L40-M68 HydrophobicContact CD2-SD 4.18Å
41W89.3Confident79.9Confident169 Ų16975.4 Ų75.464%0.6442%0.419SS*.Hα-helixtrans-63.6-49.4175.1174.663.2000111.1G37 I38 W43 A44 E45G37-W41 VanDerWaalsContact O-CB 3.28Å; G37-W41 WeakPolarHBondContact O-CB 3.24Å; G37-W41 PolarHBondContact O-N 2.93Å; I38-W41 PolarHBondContact O-N 3.48Å; W41-W43 VanDerWaalsContact C-N 3.31Å; W41-W43 PolarHBondContact O-N 3.18Å; W41-A44 PolarHBondContact O-N 3.04Å; W41-A44 VanDerWaalsContact O-N 3.17Å; W41-E45 HydrophobicContact CZ2-CG 4.35Å; W41-E45 PolarHBondContact NE1-OE1 3.42Å; W41-E45 PolarHBondContact O-N 3.25Å
42A82.8Confident77.6Confident25 Ų2579.6 Ų79.621%0.20744%0.442CS..Hα-helixtrans-61.2-39.6176.300000112.1I38 K46 V64I38-A42 WeakPolarHBondContact O-CB 3.08Å; I38-A42 PolarHBondContact O-N 2.91Å; A42-K46 WeakPolarHBondContact O-CG 3.33Å; A42-K46 PolarHBondContact O-N 2.87Å; A42-K46 VanDerWaalsContact O-N 3.1Å; A42-V64 HydrophobicContact CB-CG1 4.1Å; A42-V64 HydrophobicContact CB-CG2 3.8Å
43W82.9Confident74.8Confident137 Ų13784.5 Ų84.552%0.51948%0.476SS..Hα-helixtrans-65.8-38.8175.6-177.770.5000112.5G39 L40 W41 K46 G47 V64 M68G39-W43 VanDerWaalsContact O-CB 3.26Å; G39-W43 WeakPolarHBondContact O-CB 3.47Å; G39-W43 PolarHBondContact O-N 2.92Å; L40-W43 PolarHBondContact O-N 3.45Å; W41-W43 VanDerWaalsContact C-N 3.31Å; W41-W43 PolarHBondContact O-N 3.18Å; W43-K46 PolarHBondContact O-N 2.97Å; W43-G47 PolarHBondContact O-N 3.48Å; W43-V64 HydrophobicContact CB-CG1 3.82Å; W43-M68 HydrophobicContact CB-CE 4.46Å; W43-M68 HydrophobicContact CB-SD 4.15Å; W43-M68 HydrophobicContact CG-CE 4.4Å; W43-M68 HydrophobicContact CG-SD 4.39Å
44A83.2Confident72.3Confident49 Ų4989.2 Ų89.241%0.40550%0.495SS..Hα-helixtrans-65.9-43.9177.900000111.9L40 W41 K46 G47 V48L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 2.99Å; W41-A44 PolarHBondContact O-N 3.04Å; W41-A44 VanDerWaalsContact O-N 3.17Å; A44-K46 VanDerWaalsContact C-N 3.34Å; A44-K46 PolarHBondContact O-N 3.25Å; A44-G47 PolarHBondContact O-N 2.91Å; A44-V48 WeakPolarHBondContact O-CG2 3.31Å; A44-V48 PolarHBondContact O-N 3.5Å
45E77.6Confident69.9Low114 Ų11493.5 Ų93.553%0.53351%0.509SS..Hα-helixtrans-59.5-44.4174.5-68.8-69172.500111.1W41 G47W41-E45 HydrophobicContact CZ2-CG 4.35Å; W41-E45 PolarHBondContact NE1-OE1 3.42Å; W41-E45 PolarHBondContact O-N 3.25Å; E45-G47 PolarHBondContact O-N 3.41Å
46K67.1Low67.3Low53 Ų5396.5 Ų96.523%0.2353%0.534CS..Hα-helixtrans-63.9-39174.3-72.2-174.6178.7-161.30113.4A42 W43 A44 L49 S50 D62 V64A42-K46 WeakPolarHBondContact O-CG 3.33Å; A42-K46 PolarHBondContact O-N 2.87Å; A42-K46 VanDerWaalsContact O-N 3.1Å; W43-K46 PolarHBondContact O-N 2.97Å; A44-K46 VanDerWaalsContact C-N 3.34Å; A44-K46 PolarHBondContact O-N 3.25Å; K46-L49 PolarHBondContact O-N 3.12Å; K46-S50 PolarHBondContact O-N 2.98Å; K46-S50 PolarHBondContact O-OG 3.3Å; K46-D62 IonicContact NZ-OD1 2.64Å; K46-D62 PolarHBondContact NZ-OD1 2.94Å; K46-D62 IonicContact NZ-OD2 3.62Å; K46-D62 PolarHBondContact NZ-OD2 3.49Å; K46-V64 HydrophobicContact CD-CG2 4.06Å
47G56.9Low64.7Low44 Ų44101.6 Ų101.645%0.45456%0.562SS.*Hα-helixtrans-71.9-25.4-177.300000114.1W43 A44 E45 L49W43-G47 PolarHBondContact O-N 3.48Å; A44-G47 PolarHBondContact O-N 2.91Å; E45-G47 PolarHBondContact O-N 3.41Å; G47-L49 VanDerWaalsContact C-N 3.25Å; G47-L49 PolarHBondContact O-N 3.02Å
48V52.7Low62.1Low127 Ų127103.8 Ų103.877%0.7756%0.563SS**Hα-helixtrans-70.6-24.6171.9172.40000111.4A44A44-V48 WeakPolarHBondContact O-CG2 3.31Å; A44-V48 PolarHBondContact O-N 3.5Å
49L50.9Low59.7Low148 Ų148103.8 Ų103.878%0.77559%0.585SS**Hα-helixtrans-98.7-16.2-173.2-143.873000114.8K46 G47K46-L49 PolarHBondContact O-N 3.12Å; G47-L49 VanDerWaalsContact C-N 3.25Å; G47-L49 PolarHBondContact O-N 3.02Å
50S51.3Low57.7Low60 Ų60105.8 Ų105.842%0.4261%0.606SS.*  trans-123.295.6-168.652.70000114.3K46 L52K46-S50 PolarHBondContact O-N 2.98Å; K46-S50 PolarHBondContact O-OG 3.3Å; S50-L52 VanDerWaalsContact C-N 3.35Å; S50-L52 PolarHBondContact O-N 3.4Å
51N40.5Very low56Low155 Ų155108.1 Ų108.183%0.82961%0.612SS**  trans-6593.3160.1-87.3-71.6000110.3S53N51-S53 PolarHBondContact O-N 3.39Å; N51-S53 PolarHBondContact O-OG 3.46Å
52L46.7Very low54.9Low170 Ų170102.4 Ų102.489%0.8959%0.594SS**SBendtrans53.516.3134-139.586000121.5S50S50-L52 VanDerWaalsContact C-N 3.35Å; S50-L52 PolarHBondContact O-N 3.4Å
53S39.3Very low54.4Low103 Ų103104.1 Ų104.172%0.7260%0.603SS**SBendtrans-143.46-174.254.10000119.6N51N51-S53 PolarHBondContact O-N 3.39Å; N51-S53 PolarHBondContact O-OG 3.46Å
54L44.8Very low54.3Low138 Ų13898.2 Ų98.272%0.72358%0.582SS**SBendtrans-129.20.5-176.5-130.9151.9000115.3T56L54-T56 VanDerWaalsContact C-N 3.31Å; L54-T56 PolarHBondContact O-N 3.33Å
55I46.4Very low54.2Low138 Ų138102.7 Ų102.771%0.70859%0.589SS**THydrogen-bonded Turntrans-81.5-12.7-176.1-57177.5000111.9
56T40.7Very low54.6Low136 Ų136101.2 Ų101.283%0.83458%0.584SS**THydrogen-bonded Turntrans-99.6-5.3-172.119.20000116.3L54L54-T56 VanDerWaalsContact C-N 3.31Å; L54-T56 PolarHBondContact O-N 3.33Å
57D39.8Very low55.5Low148 Ų148102.6 Ų102.679%0.79159%0.59SS**SBendtrans-109.6-6.2-170.9-135.523000115.2
58L39.3Very low57.1Low84 Ų84101.8 Ų101.844%0.4458%0.575SS.*SBendtrans-132.9102.4173.8-71.4166000107.5G60 N131L58-G60 PolarHBondContact O-N 2.97Å; L58-N131 WeakPolarHBondContact CD1-ND2 3.34Å; L58-N131 WeakPolarHBondContact CD2-ND2 3.29Å; L58-N131 WeakPolarHBondContact CD2-OD1 3.48Å
59G41.3Very low59Low86 Ų86100 Ų10089%0.88756%0.564SS**  trans-6352.6179.700000114.8
60G47.2Very low61Low44 Ų4495.7 Ų95.745%0.45454%0.543SS..  trans-85.2124.3171.200000109.7L58 D62L58-G60 PolarHBondContact O-N 2.97Å; G60-D62 PolarHBondContact O-N 3.35Å
61F54.3Low63.2Low143 Ų14392.8 Ų92.863%0.62752%0.523SS*.  trans-69.299.7171.1-162.6-97.4000108.2P63 L66F61-P63 WeakPolarHBondContact O-CD 3.33Å; F61-L66 HydrophobicContact CE1-CB 3.74Å; F61-L66 HydrophobicContact CE1-CD1 3.88Å; F61-L66 HydrophobicContact CE1-CG 4.04Å
62D67.7Low65.9Low48 Ų4886.1 Ų86.126%0.25749%0.491SS..  trans-62.8122.6176.4179.9-16.3000109K46 G60 V64 W65K46-D62 IonicContact NZ-OD1 2.64Å; K46-D62 PolarHBondContact NZ-OD1 2.94Å; K46-D62 IonicContact NZ-OD2 3.62Å; K46-D62 PolarHBondContact NZ-OD2 3.49Å; G60-D62 PolarHBondContact O-N 3.35Å; D62-V64 PolarHBondContact O-N 3.49Å; D62-V64 WeakPolarHBondContact OD1-CB 3.49Å; D62-V64 VanDerWaalsContact OD1-CG2 3.3Å; D62-V64 WeakPolarHBondContact OD1-CG2 3.21Å; D62-V64 PolarHBondContact OD1-N 2.81Å; D62-W65 PolarHBondContact O-N 2.94Å
63P71Confident68.2Low62 Ų6281.1 Ų81.140%0.40347%0.467SS..Hα-helixtrans-50.3-30.4178.8-2834.9000113.6F61 W65 L66 F67F61-P63 WeakPolarHBondContact O-CD 3.33Å; P63-W65 VanDerWaalsContact C-N 3.3Å; P63-W65 PolarHBondContact O-N 3.35Å; P63-L66 WeakPolarHBondContact O-CB 3.41Å; P63-L66 PolarHBondContact O-N 2.83Å; P63-F67 VanDerWaalsContact O-CD2 3.28Å; P63-F67 WeakPolarHBondContact O-CD2 3.34Å; P63-F67 PolarHBondContact O-N 2.97Å
64V81.1Confident70.9Confident12 Ų1278.1 Ų78.17%0.07344%0.443CS..Hα-helixtrans-59.2-39178.6178.30000112G39 A42 W43 K46 D62 L66 F67 M68G39-V64 VanDerWaalsContact O-CG1 3.3Å; G39-V64 WeakPolarHBondContact O-CG1 3.3Å; A42-V64 HydrophobicContact CB-CG1 4.1Å; A42-V64 HydrophobicContact CB-CG2 3.8Å; W43-V64 HydrophobicContact CB-CG1 3.82Å; K46-V64 HydrophobicContact CD-CG2 4.06Å; D62-V64 PolarHBondContact O-N 3.49Å; D62-V64 WeakPolarHBondContact OD1-CB 3.49Å; D62-V64 VanDerWaalsContact OD1-CG2 3.3Å; D62-V64 WeakPolarHBondContact OD1-CG2 3.21Å; D62-V64 PolarHBondContact OD1-N 2.81Å; V64-L66 VanDerWaalsContact C-N 3.31Å; V64-L66 PolarHBondContact O-N 3.43Å; V64-F67 PolarHBondContact O-N 3.45Å; V64-M68 HydrophobicContact CG1-CE 4.17Å; V64-M68 WeakPolarHBondContact O-CG 3.39Å; V64-M68 PolarHBondContact O-N 3.36Å; V64-M68 VanDerWaalsContact O-N 3.11Å
65W82.2Confident73.4Confident144 Ų14475 Ų7555%0.54542%0.423SS..Hα-helixtrans-65.1-35.3175.5-81.790.5000112.2D62 P63 M68 V69D62-W65 PolarHBondContact O-N 2.94Å; P63-W65 VanDerWaalsContact C-N 3.3Å; P63-W65 PolarHBondContact O-N 3.35Å; W65-M68 HydrophobicContact CD2-CE 3.85Å; W65-M68 HydrophobicContact CE3-CE 4.05Å; W65-M68 HydrophobicContact CG-CE 4.07Å; W65-M68 PolarHBondContact O-N 2.94Å; W65-V69 WeakPolarHBondContact O-CB 3.33Å; W65-V69 WeakPolarHBondContact O-CG2 3.33Å; W65-V69 PolarHBondContact O-N 2.95Å
66L84.4Confident75.8Confident83 Ų8373 Ų7344%0.43541%0.413SS..Hα-helixtrans-58.8-51.7174.9-161.3153.3000110.4F61 P63 V64 M68 V69 V70F61-L66 HydrophobicContact CE1-CB 3.74Å; F61-L66 HydrophobicContact CE1-CD1 3.88Å; F61-L66 HydrophobicContact CE1-CG 4.04Å; P63-L66 WeakPolarHBondContact O-CB 3.41Å; P63-L66 PolarHBondContact O-N 2.83Å; V64-L66 VanDerWaalsContact C-N 3.31Å; V64-L66 PolarHBondContact O-N 3.43Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3.46Å; L66-V69 PolarHBondContact O-N 2.91Å; L66-V70 HydrophobicContact CD2-CG2 3.79Å; L66-V70 HydrophobicContact CG-CG2 4.39Å; L66-V70 WeakPolarHBondContact O-CB 3.36Å; L66-V70 VanDerWaalsContact O-CG2 3.32Å; L66-V70 WeakPolarHBondContact O-CG2 3.24Å; L66-V70 PolarHBondContact O-N 3.47Å
67F87.4Confident78.5Confident81 Ų8167.1 Ų67.136%0.35538%0.376SS..Hα-helixtrans-59.2-42.8179.6-79.4-84.7000112F35 P63 V64 G71F35-F67 HydrophobicContact CG-CD1 4.43Å; P63-F67 VanDerWaalsContact O-CD2 3.28Å; P63-F67 WeakPolarHBondContact O-CD2 3.34Å; P63-F67 PolarHBondContact O-N 2.97Å; V64-F67 PolarHBondContact O-N 3.45Å; F67-G71 WeakPolarHBondContact O-CA 3.4Å; F67-G71 PolarHBondContact O-N 3.35Å
68M90.9Very high81.2Confident28 Ų2860.1 Ų60.114%0.13834%0.34CS..Hα-helixtrans-65.5-46.8178.2-69.5-170.2-64.500112.6L36 L40 W43 V64 W65 L66 G72L36-M68 VanDerWaalsContact CD2-O 3.27Å; L36-M68 WeakPolarHBondContact CD2-O 3.49Å; L40-M68 HydrophobicContact CD2-SD 4.18Å; W43-M68 HydrophobicContact CB-CE 4.46Å; W43-M68 HydrophobicContact CB-SD 4.15Å; W43-M68 HydrophobicContact CG-CE 4.4Å; W43-M68 HydrophobicContact CG-SD 4.39Å; V64-M68 HydrophobicContact CG1-CE 4.17Å; V64-M68 WeakPolarHBondContact O-CG 3.39Å; V64-M68 PolarHBondContact O-N 3.36Å; V64-M68 VanDerWaalsContact O-N 3.11Å; W65-M68 HydrophobicContact CD2-CE 3.85Å; W65-M68 HydrophobicContact CE3-CE 4.05Å; W65-M68 HydrophobicContact CG-CE 4.07Å; W65-M68 PolarHBondContact O-N 2.94Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3.46Å; M68-G72 PolarHBondContact O-N 2.88Å
69V91.9Very high83.9Confident88 Ų8861.1 Ų61.153%0.53334%0.34SS..Hα-helixtrans-67.5-48.9-178.91720000111W65 L66 G72 V73W65-V69 WeakPolarHBondContact O-CB 3.33Å; W65-V69 WeakPolarHBondContact O-CG2 3.33Å; W65-V69 PolarHBondContact O-N 2.95Å; L66-V69 PolarHBondContact O-N 2.91Å; V69-G72 PolarHBondContact O-N 3.32Å; V69-V73 WeakPolarHBondContact O-CG2 3.26Å; V69-V73 PolarHBondContact O-N 3.35Å
70V93.6Very high86.5Confident58 Ų5857.2 Ų57.235%0.35230%0.3SS..Hα-helixtrans-63.3-47.6179.7173.50000110.5F35 L66 G72 V73 M74F35-V70 HydrophobicContact CD2-CG1 4.21Å; F35-V70 HydrophobicContact CE2-CG1 4.49Å; L66-V70 HydrophobicContact CD2-CG2 3.79Å; L66-V70 HydrophobicContact CG-CG2 4.39Å; L66-V70 WeakPolarHBondContact O-CB 3.36Å; L66-V70 VanDerWaalsContact O-CG2 3.32Å; L66-V70 WeakPolarHBondContact O-CG2 3.24Å; L66-V70 PolarHBondContact O-N 3.47Å; V70-G72 VanDerWaalsContact C-N 3.31Å; V70-G72 PolarHBondContact O-N 3.47Å; V70-V73 PolarHBondContact O-N 2.94Å; V70-M74 HydrophobicContact CG1-CG 4.47Å; V70-M74 HydrophobicContact CG1-SD 3.91Å; V70-M74 WeakPolarHBondContact O-CB 3.29Å; V70-M74 WeakPolarHBondContact O-CG 3.25Å; V70-M74 PolarHBondContact O-N 2.98Å
71G96.1Very high88.7Confident0 Ų055.1 Ų55.10%028%0.279CS..Hα-helixtrans-59.5-42.1176.300000112.3L36 F67 M74 F75L36-G71 VanDerWaalsContact CG-C 3.46Å; F67-G71 WeakPolarHBondContact O-CA 3.4Å; F67-G71 PolarHBondContact O-N 3.35Å; G71-M74 PolarHBondContact O-N 3.4Å; G71-F75 VanDerWaalsContact O-CB 3.27Å; G71-F75 WeakPolarHBondContact O-CB 3.42Å; G71-F75 PolarHBondContact O-N 2.8Å
72G96.6Very high90.7Very high15 Ų1548.6 Ų48.616%0.15525%0.251CS..Hα-helixtrans-60-50.8177.700000112.9M68 V69 V70 F75 I76M68-G72 PolarHBondContact O-N 2.88Å; V69-G72 PolarHBondContact O-N 3.32Å; V70-G72 VanDerWaalsContact C-N 3.31Å; V70-G72 PolarHBondContact O-N 3.47Å; G72-F75 PolarHBondContact O-N 2.96Å; G72-I76 VanDerWaalsContact O-CG1 3.32Å; G72-I76 WeakPolarHBondContact O-CG1 3.47Å; G72-I76 PolarHBondContact O-N 3.47Å
73V96.1Very high91.9Very high64 Ų6448.9 Ų48.939%0.38825%0.252SS..Hα-helixtrans-61.6-46.9177.3172.20000110.6V69 V70 F75 I76 L77 I103V69-V73 WeakPolarHBondContact O-CG2 3.26Å; V69-V73 PolarHBondContact O-N 3.35Å; V70-V73 PolarHBondContact O-N 2.94Å; V73-F75 VanDerWaalsContact C-N 3.35Å; V73-F75 PolarHBondContact O-N 2.81Å; V73-I76 PolarHBondContact O-N 3.01Å; V73-L77 HydrophobicContact CG1-CD1 3.78Å; V73-L77 HydrophobicContact CG1-CG 4.3Å; V73-L77 WeakPolarHBondContact O-CB 3.48Å; V73-L77 VanDerWaalsContact O-CG 3.3Å; V73-L77 WeakPolarHBondContact O-CG 3.28Å; V73-L77 PolarHBondContact O-N 3.17Å; V73-I103 HydrophobicContact CG1-CD1 3.76Å
74M96.6Very high93Very high41 Ų4146 Ų4620%0.20223%0.233CC..Hα-helixtrans-59.9-43.2177.3-75.5178.755.300112.5F28 L31 F35 V70 G71 G78F28-M74 HydrophobicContact CD1-CE 4.08Å; L31-M74 HydrophobicContact CB-CE 3.64Å; F35-M74 HydrophobicContact CD2-SD 4.37Å; V70-M74 HydrophobicContact CG1-CG 4.47Å; V70-M74 HydrophobicContact CG1-SD 3.91Å; V70-M74 WeakPolarHBondContact O-CB 3.29Å; V70-M74 WeakPolarHBondContact O-CG 3.25Å; V70-M74 PolarHBondContact O-N 2.98Å; G71-M74 PolarHBondContact O-N 3.4Å; M74-G78 PolarHBondContact O-N 3.38Å
75F97.4Very high93.5Very high71 Ų7145.4 Ų45.431%0.31123%0.229SC..Hα-helixtrans-63.7-48.4178.9-177.5-91.6000111.6W29 A33 L36 G71 G72 V73 F79W29-F75 AromaticContact CD1-CD2 3.56Å; W29-F75 AromaticContact CD1-CE2 3.74Å; W29-F75 VanDerWaalsContact CD1-O 3.31Å; W29-F75 AromaticContact CE2-CE2 3.65Å; W29-F75 HydrophobicContact CZ2-CE2 4.04Å; W29-F75 HydrophobicContact CZ2-CZ 4.25Å; W29-F75 AromaticContact NE1-CD2 3.34Å; W29-F75 VanDerWaalsContact NE1-CD2 3.34Å; W29-F75 AromaticContact NE1-CE1 3.94Å; W29-F75 AromaticContact NE1-CE2 3Å; W29-F75 AromaticContact NE1-CG 3.97Å; W29-F75 AromaticContact NE1-CZ 3.34Å; W29-F75 VanDerWaalsContact NE1-CZ 3.34Å; A33-F75 HydrophobicContact CB-CD2 3.9Å; A33-F75 HydrophobicContact CB-CE2 4.07Å; L36-F75 HydrophobicContact CD1-CB 3.72Å; L36-F75 HydrophobicContact CD1-CD1 4.5Å; L36-F75 HydrophobicContact CD1-CD2 4.39Å; L36-F75 HydrophobicContact CD1-CG 3.98Å; G71-F75 VanDerWaalsContact O-CB 3.27Å; G71-F75 WeakPolarHBondContact O-CB 3.42Å; G71-F75 PolarHBondContact O-N 2.8Å; G72-F75 PolarHBondContact O-N 2.96Å; V73-F75 VanDerWaalsContact C-N 3.35Å; V73-F75 PolarHBondContact O-N 2.81Å; F75-F79 VanDerWaalsContact O-CB 3.24Å; F75-F79 WeakPolarHBondContact O-CB 3.24Å; F75-F79 PolarHBondContact O-N 3.03Å
76I97.1Very high93.9Very high96 Ų9641.9 Ų41.949%0.49222%0.221SC..Hα-helixtrans-63.4-46.7-179.6-67.4166.9000110.8G72 V73 F79 A80 F95G72-I76 VanDerWaalsContact O-CG1 3.32Å; G72-I76 WeakPolarHBondContact O-CG1 3.47Å; G72-I76 PolarHBondContact O-N 3.47Å; V73-I76 PolarHBondContact O-N 3.01Å; I76-F79 PolarHBondContact O-N 3.37Å; I76-A80 WeakPolarHBondContact O-CB 3.31Å; I76-A80 PolarHBondContact O-N 3.41Å; I76-F95 HydrophobicContact CG2-CE1 4.12Å; I76-F95 HydrophobicContact CG2-CZ 4.25Å
77L96.8Very high94.2Very high13 Ų1347.5 Ų47.57%0.06824%0.236CC..Hα-helixtrans-69.2-42.4-179.2-65.2-177.6000112.1V73 F79 A80 G81 F95 F96 F99 L100 I103V73-L77 HydrophobicContact CG1-CD1 3.78Å; V73-L77 HydrophobicContact CG1-CG 4.3Å; V73-L77 WeakPolarHBondContact O-CB 3.48Å; V73-L77 VanDerWaalsContact O-CG 3.3Å; V73-L77 WeakPolarHBondContact O-CG 3.28Å; V73-L77 PolarHBondContact O-N 3.17Å; L77-F79 PolarHBondContact O-N 2.97Å; L77-A80 PolarHBondContact O-N 2.91Å; L77-G81 PolarHBondContact O-N 3.4Å; L77-F95 HydrophobicContact CD2-CE1 3.94Å; L77-F96 HydrophobicContact CB-CD2 4.28Å; L77-F96 WeakPolarHBondContact O-CD2 3.49Å; L77-F99 HydrophobicContact CD1-CB 4.33Å; L77-F99 HydrophobicContact CD2-CB 3.54Å; L77-F99 HydrophobicContact CD2-CG 4.19Å; L77-L100 HydrophobicContact CD1-CD2 4.28Å; L77-I103 HydrophobicContact CD1-CD1 3.49Å; L77-I103 VanDerWaalsContact CD1-CD1 3.49Å
78G96.1Very high94.4Very high2 Ų246.9 Ų46.92%0.02123%0.234CC..Hα-helixtrans-60.9-43.9175.100000111.9M74 G81 C82M74-G78 PolarHBondContact O-N 3.38Å; G78-G81 PolarHBondContact O-N 3.28Å; G78-C82 WeakPolarHBondContact O-CB 3.46Å; G78-C82 PolarHBondContact O-N 2.79Å; G78-C82 PolarHBondContact O-SG 3.31Å
79F95.1Very high94.5Very high104 Ų10448.5 Ų48.546%0.45624%0.244SC..Hα-helixtrans-62.3-48175.2-179.3-102.2000112F75 I76 L77 G81 C82 I83F75-F79 VanDerWaalsContact O-CB 3.24Å; F75-F79 WeakPolarHBondContact O-CB 3.24Å; F75-F79 PolarHBondContact O-N 3.03Å; I76-F79 PolarHBondContact O-N 3.37Å; L77-F79 PolarHBondContact O-N 2.97Å; F79-G81 PolarHBondContact O-N 3.28Å; F79-C82 PolarHBondContact O-N 3.29Å; F79-I83 HydrophobicContact CD1-CG1 4.42Å; F79-I83 HydrophobicContact CD2-CG1 4.12Å; F79-I83 HydrophobicContact CE1-CG1 4.07Å; F79-I83 HydrophobicContact CE2-CD1 4.16Å; F79-I83 HydrophobicContact CE2-CG1 3.74Å; F79-I83 HydrophobicContact CG-CG1 4.45Å; F79-I83 HydrophobicContact CZ-CD1 4.37Å; F79-I83 HydrophobicContact CZ-CG1 3.71Å; F79-I83 WeakPolarHBondContact O-CG1 3.44Å; F79-I83 PolarHBondContact O-N 3.43Å
80A96.1Very high94.5Very high5 Ų545.8 Ų45.84%0.04123%0.227CC..Hα-helixtrans-62.1-41178.200000112.2I76 L77 G84 L92 F95I76-A80 WeakPolarHBondContact O-CB 3.31Å; I76-A80 PolarHBondContact O-N 3.41Å; L77-A80 PolarHBondContact O-N 2.91Å; A80-G84 WeakPolarHBondContact O-CA 3.33Å; A80-G84 PolarHBondContact O-N 2.91Å; A80-L92 HydrophobicContact CB-CD2 4.43Å; A80-F95 HydrophobicContact CB-CD1 3.92Å; A80-F95 HydrophobicContact CB-CE1 4.19Å
81G95.1Very high94.6Very high0 Ų049.1 Ų49.10%024%0.242CC..Hα-helixtrans-63.2-46.7175.500000112.3L77 G78 F79 A85L77-G81 PolarHBondContact O-N 3.4Å; G78-G81 PolarHBondContact O-N 3.28Å; F79-G81 PolarHBondContact O-N 3.28Å; G81-A85 VanDerWaalsContact O-CB 3.29Å; G81-A85 WeakPolarHBondContact O-CB 3.4Å; G81-A85 PolarHBondContact O-N 3.47Å
82C94.5Very high94.5Very high6 Ų651.3 Ų51.34%0.04125%0.254CS..Hα-helixtrans-61.2-54.7177.1-77.20000112.7F22 N25 I26 G78 F79 A85 L86F22-C82 HydrophobicContact CD2-CB 4.01Å; F22-C82 HydrophobicContact CE2-CB 4.09Å; N25-C82 WeakPolarHBondContact CB-SG 3.47Å; I26-C82 PolarHBondContact N-SG 3.27Å; G78-C82 WeakPolarHBondContact O-CB 3.46Å; G78-C82 PolarHBondContact O-N 2.79Å; G78-C82 PolarHBondContact O-SG 3.31Å; F79-C82 PolarHBondContact O-N 3.29Å; C82-A85 PolarHBondContact O-N 3.19Å; C82-L86 WeakPolarHBondContact O-CG 3.5Å; C82-L86 PolarHBondContact O-N 2.98Å
83I94.7Very high94.4Very high54 Ų5450.6 Ų50.628%0.27725%0.247SC..Hα-helixtrans-68.4-38.5-178.5-60-58.6000110.7F79 A85 L86 R87 L92F79-I83 HydrophobicContact CD1-CG1 4.42Å; F79-I83 HydrophobicContact CD2-CG1 4.12Å; F79-I83 HydrophobicContact CE1-CG1 4.07Å; F79-I83 HydrophobicContact CE2-CD1 4.16Å; F79-I83 HydrophobicContact CE2-CG1 3.74Å; F79-I83 HydrophobicContact CG-CG1 4.45Å; F79-I83 HydrophobicContact CZ-CD1 4.37Å; F79-I83 HydrophobicContact CZ-CG1 3.71Å; F79-I83 WeakPolarHBondContact O-CG1 3.44Å; F79-I83 PolarHBondContact O-N 3.43Å; I83-A85 VanDerWaalsContact C-N 3.33Å; I83-A85 PolarHBondContact O-N 2.93Å; I83-L86 PolarHBondContact O-N 3.36Å; I83-R87 HydrophobicContact CG2-CG 3.94Å; I83-R87 VanDerWaalsContact O-CB 3.25Å; I83-R87 WeakPolarHBondContact O-CB 3.37Å; I83-R87 PolarHBondContact O-N 2.92Å; I83-L92 HydrophobicContact CB-CD1 4.12Å; I83-L92 HydrophobicContact CG2-CD1 3.64Å
84G93Very high94.3Very high0 Ų051.9 Ų51.90%025%0.247CC..Hα-helixtrans-57.5-45174.400000112.1A80 E88 N89A80-G84 WeakPolarHBondContact O-CA 3.33Å; A80-G84 PolarHBondContact O-N 2.91Å; G84-E88 CarbonylContact O-C 3.24Å; G84-E88 WeakPolarHBondContact O-CA 3.36Å; G84-E88 PolarHBondContact O-N 3.28Å; G84-E88 VanDerWaalsContact O-N 3.13Å; G84-N89 PolarHBondContact O-N 3.12Å
85A92Very high94.3Very high0 Ų053.6 Ų53.60%025%0.253CS..Hα-helixtrans-68.8-49.1177.800000112.5K18 L21 G81 C82 I83 E88 L259K18-A85 VanDerWaalsContact CE-O 3.25Å; K18-A85 WeakPolarHBondContact CE-O 3.49Å; L21-A85 HydrophobicContact CD2-CB 4.11Å; L21-A85 HydrophobicContact CG-CB 4.38Å; G81-A85 VanDerWaalsContact O-CB 3.29Å; G81-A85 WeakPolarHBondContact O-CB 3.4Å; G81-A85 PolarHBondContact O-N 3.47Å; C82-A85 PolarHBondContact O-N 3.19Å; I83-A85 VanDerWaalsContact C-N 3.33Å; I83-A85 PolarHBondContact O-N 2.93Å; A85-E88 PolarHBondContact O-N 3.08Å; A85-L259 HydrophobicContact CB-CD2 4.05Å
86L90.6Very high94.2Very high71 Ų7150.4 Ų50.437%0.37224%0.239SC..Hα-helixtrans-67.1-44.6-176.5-74.4178.1000113.1K18 F22 C82 I83 E88K18-L86 PolarHBondContact NZ-O 3.45Å; F22-L86 HydrophobicContact CD2-CD1 3.78Å; F22-L86 HydrophobicContact CD2-CD2 4.09Å; F22-L86 HydrophobicContact CD2-CG 3.69Å; F22-L86 HydrophobicContact CE2-CD1 3.48Å; F22-L86 VanDerWaalsContact CE2-CD1 3.48Å; F22-L86 HydrophobicContact CE2-CD2 4.39Å; F22-L86 HydrophobicContact CE2-CG 3.96Å; F22-L86 HydrophobicContact CG-CD2 4.25Å; F22-L86 HydrophobicContact CG-CG 4.32Å; F22-L86 HydrophobicContact CZ-CD1 4.18Å; C82-L86 WeakPolarHBondContact O-CG 3.5Å; C82-L86 PolarHBondContact O-N 2.98Å; I83-L86 PolarHBondContact O-N 3.36Å; L86-E88 VanDerWaalsContact C-N 3.3Å
87R90.9Very high94.2Very high200 Ų20046.1 Ų46.176%0.75522%0.218SC*.THydrogen-bonded Turntrans-870.6-178.4-62.2-66.2-170.41730.4113.1I83 N89I83-R87 HydrophobicContact CG2-CG 3.94Å; I83-R87 VanDerWaalsContact O-CB 3.25Å; I83-R87 WeakPolarHBondContact O-CB 3.37Å; I83-R87 PolarHBondContact O-N 2.92Å; R87-N89 HydrophobicContact CB-CB 4.35Å; R87-N89 PolarHBondContact O-N 2.97Å; R87-N89 VanDerWaalsContact O-N 3.08Å
88E91Very high94.2Very high68 Ų6849.6 Ų49.632%0.31824%0.24SC..THydrogen-bonded Turntrans52.134.1-176.3-68.3165.7-156.100111.6K18 G84 A85 L86 T90 V263K18-E88 IonicContact NZ-OE1 3.21Å; K18-E88 PolarHBondContact NZ-OE1 3.42Å; G84-E88 CarbonylContact O-C 3.24Å; G84-E88 WeakPolarHBondContact O-CA 3.36Å; G84-E88 PolarHBondContact O-N 3.28Å; G84-E88 VanDerWaalsContact O-N 3.13Å; A85-E88 PolarHBondContact O-N 3.08Å; L86-E88 VanDerWaalsContact C-N 3.3Å; E88-T90 PolarHBondContact O-N 3.3Å; E88-V263 HydrophobicContact CB-CG1 4.44Å; E88-V263 HydrophobicContact CB-CG2 3.76Å; E88-V263 HydrophobicContact CG-CG2 4.01Å
89N92.8Very high94.3Very high63 Ų6353.6 Ų53.634%0.33726%0.257SS..  trans-84.998.7-175.9-174.1-17.6000109.7G84 R87 L91 L92 L93G84-N89 PolarHBondContact O-N 3.12Å; R87-N89 HydrophobicContact CB-CB 4.35Å; R87-N89 PolarHBondContact O-N 2.97Å; R87-N89 VanDerWaalsContact O-N 3.08Å; N89-L91 PolarHBondContact O-N 3.46Å; N89-L91 VanDerWaalsContact O-N 3.13Å; N89-L91 WeakPolarHBondContact OD1-CB 3.37Å; N89-L91 PolarHBondContact OD1-N 2.94Å; N89-L92 HydrophobicContact CB-CB 4.32Å; N89-L92 HydrophobicContact CB-CD1 4.1Å; N89-L92 HydrophobicContact CB-CG 4.39Å; N89-L92 PolarHBondContact O-N 3.36Å; N89-L92 VanDerWaalsContact O-N 3.15Å; N89-L93 PolarHBondContact O-N 3.39Å
90T92.3Very high94.3Very high30 Ų3049.8 Ų49.818%0.18424%0.241CC..Hα-helixtrans-57.9-25.6-179.959.40000114.5E88 K94 V260 V263E88-T90 PolarHBondContact O-N 3.3Å; T90-K94 WeakPolarHBondContact O-CB 3.11Å; T90-K94 WeakPolarHBondContact O-CG 3.28Å; T90-K94 PolarHBondContact O-N 2.98Å; T90-V260 HydrophobicContact CG2-CG1 4.32Å; T90-V263 HydrophobicContact CG2-CB 4Å; T90-V263 HydrophobicContact CG2-CG1 3.63Å
91L95.1Very high94.4Very high128 Ų12850.2 Ų50.267%0.6725%0.246SC*.Hα-helixtrans-70.9-46.9177.1-176.468.1000110.7N89 K94 F95N89-L91 PolarHBondContact O-N 3.46Å; N89-L91 VanDerWaalsContact O-N 3.13Å; N89-L91 WeakPolarHBondContact OD1-CB 3.37Å; N89-L91 PolarHBondContact OD1-N 2.94Å; L91-K94 PolarHBondContact O-N 3.41Å; L91-F95 WeakPolarHBondContact O-CB 3.3Å; L91-F95 PolarHBondContact O-N 2.87Å
92L94.9Very high94.5Very high47 Ų4754.6 Ų54.625%0.24627%0.269CS..Hα-helixtrans-65.6-40.9177.7-72.5173.3000111.9A80 I83 N89 F95 F96A80-L92 HydrophobicContact CB-CD2 4.43Å; I83-L92 HydrophobicContact CB-CD1 4.12Å; I83-L92 HydrophobicContact CG2-CD1 3.64Å; N89-L92 HydrophobicContact CB-CB 4.32Å; N89-L92 HydrophobicContact CB-CD1 4.1Å; N89-L92 HydrophobicContact CB-CG 4.39Å; N89-L92 PolarHBondContact O-N 3.36Å; N89-L92 VanDerWaalsContact O-N 3.15Å; L92-F95 WeakPolarHBondContact O-CB 3.22Å; L92-F95 PolarHBondContact O-N 2.96Å; L92-F96 WeakPolarHBondContact O-CB 3.07Å; L92-F96 PolarHBondContact O-N 3.43Å
93L94.1Very high94.6Very high0 Ų056.6 Ų56.60%028%0.279CS..Hα-helixtrans-64.2-40.1175.6-71.7170.6000112.2L21 N89 F96 S97 A256 L259 V260L21-L93 HydrophobicContact CD2-CD2 3.99Å; N89-L93 PolarHBondContact O-N 3.39Å; L93-F96 PolarHBondContact O-N 3.35Å; L93-S97 PolarHBondContact O-N 3.4Å; L93-S97 PolarHBondContact O-OG 2.84Å; L93-S97 VanDerWaalsContact O-OG 3.12Å; L93-A256 HydrophobicContact CD2-CB 4.42Å; L93-L259 HydrophobicContact CD1-CB 4.26Å; L93-L259 HydrophobicContact CD1-CD2 3.74Å; L93-L259 HydrophobicContact CD1-CG 3.81Å; L93-L259 HydrophobicContact CD2-CD2 4.15Å; L93-V260 HydrophobicContact CB-CG2 3.44Å; L93-V260 VanDerWaalsContact CB-CG2 3.44Å; L93-V260 HydrophobicContact CD1-CG2 3.89Å; L93-V260 HydrophobicContact CG-CG2 4.32Å
94K94.8Very high94.7Very high90 Ų9056.3 Ų56.339%0.39128%0.275SS..Hα-helixtrans-65.1-44.7173.8-78.7176.5179-174.90111.9T90 L91 F96 S97 V98T90-K94 WeakPolarHBondContact O-CB 3.11Å; T90-K94 WeakPolarHBondContact O-CG 3.28Å; T90-K94 PolarHBondContact O-N 2.98Å; L91-K94 PolarHBondContact O-N 3.41Å; K94-F96 VanDerWaalsContact C-N 3.33Å; K94-F96 PolarHBondContact O-N 2.84Å; K94-S97 PolarHBondContact O-N 3.31Å; K94-V98 WeakPolarHBondContact O-CB 3.41Å; K94-V98 VanDerWaalsContact O-CG2 3.29Å; K94-V98 WeakPolarHBondContact O-CG2 3.32Å; K94-V98 PolarHBondContact O-N 3.41Å
95F96.5Very high94.9Very high77 Ų7762.3 Ų62.334%0.33830%0.302SS..Hα-helixtrans-54.5-52.4174.4172.3-90000110.2I76 L77 A80 L91 L92 S97 V98 F99I76-F95 HydrophobicContact CG2-CE1 4.12Å; I76-F95 HydrophobicContact CG2-CZ 4.25Å; L77-F95 HydrophobicContact CD2-CE1 3.94Å; A80-F95 HydrophobicContact CB-CD1 3.92Å; A80-F95 HydrophobicContact CB-CE1 4.19Å; L91-F95 WeakPolarHBondContact O-CB 3.3Å; L91-F95 PolarHBondContact O-N 2.87Å; L92-F95 WeakPolarHBondContact O-CB 3.22Å; L92-F95 PolarHBondContact O-N 2.96Å; F95-S97 PolarHBondContact O-N 2.92Å; F95-V98 PolarHBondContact O-N 3.4Å; F95-F99 HydrophobicContact CD1-CD2 4.33Å; F95-F99 AromaticContact CD2-CD2 3.68Å; F95-F99 HydrophobicContact CD2-CD2 3.68Å; F95-F99 AromaticContact CD2-CE2 3.43Å; F95-F99 HydrophobicContact CD2-CE2 3.43Å; F95-F99 VanDerWaalsContact CD2-CE2 3.43Å; F95-F99 HydrophobicContact CD2-CZ 4.48Å; F95-F99 HydrophobicContact CE1-CD2 4.18Å; F95-F99 HydrophobicContact CE1-CE2 4.49Å; F95-F99 AromaticContact CE2-CD2 3.52Å; F95-F99 HydrophobicContact CE2-CD2 3.52Å; F95-F99 AromaticContact CE2-CE2 3.05Å; F95-F99 HydrophobicContact CE2-CE2 3.05Å; F95-F99 AromaticContact CE2-CZ 3.74Å; F95-F99 HydrophobicContact CE2-CZ 3.74Å; F95-F99 HydrophobicContact CG-CD2 4.1Å; F95-F99 HydrophobicContact CG-CE2 4.29Å; F95-F99 AromaticContact CZ-CD2 3.76Å; F95-F99 HydrophobicContact CZ-CD2 3.76Å; F95-F99 AromaticContact CZ-CE2 3.66Å; F95-F99 HydrophobicContact CZ-CE2 3.66Å; F95-F99 HydrophobicContact CZ-CG 4.39Å; F95-F99 HydrophobicContact CZ-CZ 4.17Å; F95-F99 WeakPolarHBondContact O-CD2 3.5Å; F95-F99 PolarHBondContact O-N 2.79Å
96F95.9Very high95.1Very high5 Ų568 Ų682%0.02233%0.332CS..Hα-helixtrans-54.1-50.5176.1171.3-102.2000112.6L21 N25 L77 L92 L93 K94 V98 L100 A256L21-F96 HydrophobicContact CD1-CE1 4.4Å; N25-F96 WeakPolarHBondContact OD1-CE2 3.38Å; N25-F96 VanDerWaalsContact OD1-CZ 3.28Å; N25-F96 WeakPolarHBondContact OD1-CZ 3.32Å; L77-F96 HydrophobicContact CB-CD2 4.28Å; L77-F96 WeakPolarHBondContact O-CD2 3.49Å; L92-F96 WeakPolarHBondContact O-CB 3.07Å; L92-F96 PolarHBondContact O-N 3.43Å; L93-F96 PolarHBondContact O-N 3.35Å; K94-F96 VanDerWaalsContact C-N 3.33Å; K94-F96 PolarHBondContact O-N 2.84Å; F96-V98 PolarHBondContact O-N 3Å; F96-L100 HydrophobicContact CD1-CD1 4.21Å; F96-L100 HydrophobicContact CD2-CD1 4.37Å; F96-L100 HydrophobicContact CD2-CG 4.42Å; F96-L100 HydrophobicContact CE1-CD1 3.53Å; F96-L100 HydrophobicContact CE1-CG 4.48Å; F96-L100 HydrophobicContact CE2-CD1 3.71Å; F96-L100 HydrophobicContact CE2-CG 4.07Å; F96-L100 HydrophobicContact CZ-CD1 3.26Å; F96-L100 HydrophobicContact CZ-CG 4.12Å; F96-L100 WeakPolarHBondContact O-CB 3.41Å; F96-L100 WeakPolarHBondContact O-CG 3.35Å; F96-L100 PolarHBondContact O-N 3.01Å; F96-A256 HydrophobicContact CD1-CB 3.82Å; F96-A256 HydrophobicContact CE1-CB 4.04Å
97S96.1Very high95.2Very high6 Ų666.3 Ų66.34%0.04232%0.322CS..Hα-helixtrans-63.3-41.5179.1-61.30000113.8L93 K94 F95 G101 A256 Q257L93-S97 PolarHBondContact O-N 3.4Å; L93-S97 PolarHBondContact O-OG 2.84Å; L93-S97 VanDerWaalsContact O-OG 3.12Å; K94-S97 PolarHBondContact O-N 3.31Å; F95-S97 PolarHBondContact O-N 2.92Å; S97-G101 PolarHBondContact O-N 3.05Å; S97-A256 WeakPolarHBondContact OG-CB 3.42Å; S97-Q257 PolarHBondContact OG-NE2 2.79Å
98V97.2Very high95.4Very high86 Ų8661.1 Ų61.152%0.52131%0.309SS..Hα-helixtrans-64.9-47.3-179.1168.50000110.1K94 F95 F96 G101 L102K94-V98 WeakPolarHBondContact O-CB 3.41Å; K94-V98 VanDerWaalsContact O-CG2 3.29Å; K94-V98 WeakPolarHBondContact O-CG2 3.32Å; K94-V98 PolarHBondContact O-N 3.41Å; F95-V98 PolarHBondContact O-N 3.4Å; F96-V98 PolarHBondContact O-N 3Å; V98-G101 PolarHBondContact O-N 3.3Å; V98-L102 HydrophobicContact CG1-CD1 4.33Å; V98-L102 WeakPolarHBondContact O-CG 3.49Å; V98-L102 PolarHBondContact O-N 2.89Å
99F97Very high95.7Very high86 Ų8661.4 Ų61.438%0.37732%0.315SS..Hα-helixtrans-68-37.7179.6-83.7-91.8000112.8L77 F95 G101 L102 I103L77-F99 HydrophobicContact CD1-CB 4.33Å; L77-F99 HydrophobicContact CD2-CB 3.54Å; L77-F99 HydrophobicContact CD2-CG 4.19Å; F95-F99 HydrophobicContact CD1-CD2 4.33Å; F95-F99 AromaticContact CD2-CD2 3.68Å; F95-F99 HydrophobicContact CD2-CD2 3.68Å; F95-F99 AromaticContact CD2-CE2 3.43Å; F95-F99 HydrophobicContact CD2-CE2 3.43Å; F95-F99 VanDerWaalsContact CD2-CE2 3.43Å; F95-F99 HydrophobicContact CD2-CZ 4.48Å; F95-F99 HydrophobicContact CE1-CD2 4.18Å; F95-F99 HydrophobicContact CE1-CE2 4.49Å; F95-F99 AromaticContact CE2-CD2 3.52Å; F95-F99 HydrophobicContact CE2-CD2 3.52Å; F95-F99 AromaticContact CE2-CE2 3.05Å; F95-F99 HydrophobicContact CE2-CE2 3.05Å; F95-F99 AromaticContact CE2-CZ 3.74Å; F95-F99 HydrophobicContact CE2-CZ 3.74Å; F95-F99 HydrophobicContact CG-CD2 4.1Å; F95-F99 HydrophobicContact CG-CE2 4.29Å; F95-F99 AromaticContact CZ-CD2 3.76Å; F95-F99 HydrophobicContact CZ-CD2 3.76Å; F95-F99 AromaticContact CZ-CE2 3.66Å; F95-F99 HydrophobicContact CZ-CE2 3.66Å; F95-F99 HydrophobicContact CZ-CG 4.39Å; F95-F99 HydrophobicContact CZ-CZ 4.17Å; F95-F99 WeakPolarHBondContact O-CD2 3.5Å; F95-F99 PolarHBondContact O-N 2.79Å; F99-G101 VanDerWaalsContact C-N 3.29Å; F99-G101 PolarHBondContact O-N 3.41Å; F99-L102 HydrophobicContact CD1-CD1 4.48Å; F99-L102 PolarHBondContact O-N 2.93Å; F99-I103 VanDerWaalsContact O-CG1 3.31Å; F99-I103 WeakPolarHBondContact O-CG1 3.37Å; F99-I103 PolarHBondContact O-N 3.34Å
100L96Very high95.6Very high23 Ų2361 Ų6112%0.1232%0.32CS..Hα-helixtrans-60.1-41170-79.2-171.9000112L77 F96 I103 F104 I253L77-L100 HydrophobicContact CD1-CD2 4.28Å; F96-L100 HydrophobicContact CD1-CD1 4.21Å; F96-L100 HydrophobicContact CD2-CD1 4.37Å; F96-L100 HydrophobicContact CD2-CG 4.42Å; F96-L100 HydrophobicContact CE1-CD1 3.53Å; F96-L100 HydrophobicContact CE1-CG 4.48Å; F96-L100 HydrophobicContact CE2-CD1 3.71Å; F96-L100 HydrophobicContact CE2-CG 4.07Å; F96-L100 HydrophobicContact CZ-CD1 3.26Å; F96-L100 HydrophobicContact CZ-CG 4.12Å; F96-L100 WeakPolarHBondContact O-CB 3.41Å; F96-L100 WeakPolarHBondContact O-CG 3.35Å; F96-L100 PolarHBondContact O-N 3.01Å; L100-I103 PolarHBondContact O-N 3.17Å; L100-F104 WeakPolarHBondContact O-CB 3.25Å; L100-F104 PolarHBondContact O-N 3.03Å; L100-I253 HydrophobicContact CB-CD1 4.04Å; L100-I253 HydrophobicContact CB-CG1 3.79Å; L100-I253 HydrophobicContact CD1-CG1 4.26Å
101G97.2Very high95.6Very high15 Ų1560.9 Ų60.916%0.15533%0.325CS..Hα-helixtrans-62.4-42174.900000112.6S97 V98 F99 F104 F105S97-G101 PolarHBondContact O-N 3.05Å; V98-G101 PolarHBondContact O-N 3.3Å; F99-G101 VanDerWaalsContact C-N 3.29Å; F99-G101 PolarHBondContact O-N 3.41Å; G101-F104 WeakPolarHBondContact O-CB 3.4Å; G101-F104 PolarHBondContact O-N 2.92Å; G101-F105 WeakPolarHBondContact O-CD2 3.39Å; G101-F105 PolarHBondContact O-N 3.2Å; G101-F105 VanDerWaalsContact O-N 3.11Å
102L97.3Very high95.6Very high92 Ų9259.3 Ų59.348%0.48232%0.316SS..Hα-helixtrans-62.2-44.8175-69174.6000111.7V98 F99 F104 F105 L106V98-L102 HydrophobicContact CG1-CD1 4.33Å; V98-L102 WeakPolarHBondContact O-CG 3.49Å; V98-L102 PolarHBondContact O-N 2.89Å; F99-L102 HydrophobicContact CD1-CD1 4.48Å; F99-L102 PolarHBondContact O-N 2.93Å; L102-F104 VanDerWaalsContact C-N 3.33Å; L102-F104 PolarHBondContact O-N 2.94Å; L102-F105 PolarHBondContact O-N 3.21Å; L102-L106 WeakPolarHBondContact O-CG 3.42Å; L102-L106 PolarHBondContact O-N 2.84Å
103I96.6Very high95.5Very high48 Ų4861.1 Ų61.125%0.24633%0.326CS..Hα-helixtrans-61.8-43.2177.1-67.5166.9000110.6V73 L77 F99 L100 F105 L106 E107V73-I103 HydrophobicContact CG1-CD1 3.76Å; L77-I103 HydrophobicContact CD1-CD1 3.49Å; L77-I103 VanDerWaalsContact CD1-CD1 3.49Å; F99-I103 VanDerWaalsContact O-CG1 3.31Å; F99-I103 WeakPolarHBondContact O-CG1 3.37Å; F99-I103 PolarHBondContact O-N 3.34Å; L100-I103 PolarHBondContact O-N 3.17Å; I103-F105 PolarHBondContact O-N 2.94Å; I103-L106 WeakPolarHBondContact O-CB 3.27Å; I103-L106 PolarHBondContact O-N 3.39Å; I103-E107 WeakPolarHBondContact O-CB 3.27Å; I103-E107 PolarHBondContact O-N 3.21Å
104F97.1Very high95.3Very high47 Ų4763.3 Ų63.321%0.20634%0.344CS..Hα-helixtrans-56.5-46.7176.1172.5-96.1000112.5L100 G101 L102 E107 L108 A246 Q249 I250L100-F104 WeakPolarHBondContact O-CB 3.25Å; L100-F104 PolarHBondContact O-N 3.03Å; G101-F104 WeakPolarHBondContact O-CB 3.4Å; G101-F104 PolarHBondContact O-N 2.92Å; L102-F104 VanDerWaalsContact C-N 3.33Å; L102-F104 PolarHBondContact O-N 2.94Å; F104-E107 PolarHBondContact O-N 3.17Å; F104-L108 WeakPolarHBondContact O-CB 3.32Å; F104-L108 PolarHBondContact O-N 3.41Å; F104-A246 HydrophobicContact CD2-CB 4.23Å; F104-A246 HydrophobicContact CE2-CB 3.88Å; F104-Q249 VanDerWaalsContact CB-OE1 3.24Å; F104-I250 HydrophobicContact CD2-CG1 4.39Å; F104-I250 HydrophobicContact CE2-CD1 3.88Å; F104-I250 HydrophobicContact CE2-CG1 4.08Å; F104-I250 HydrophobicContact CZ-CD1 4.22Å
105F97Very high95Very high126 Ų12667 Ų6755%0.55336%0.36SS*.Hα-helixtrans-68.4-35.5177.5-73.4-64.4000112.7G101 L102 I103 T109G101-F105 WeakPolarHBondContact O-CD2 3.39Å; G101-F105 PolarHBondContact O-N 3.2Å; G101-F105 VanDerWaalsContact O-N 3.11Å; L102-F105 PolarHBondContact O-N 3.21Å; I103-F105 PolarHBondContact O-N 2.94Å; F105-T109 VanDerWaalsContact O-CB 3.31Å; F105-T109 WeakPolarHBondContact O-CB 3.47Å; F105-T109 PolarHBondContact O-N 3.39Å; F105-T109 PolarHBondContact O-OG1 3.4Å
106L95.9Very high94.9Very high120 Ų12067.5 Ų67.563%0.62837%0.369SS*.Hα-helixtrans-64.3-42.8173.5-72.7172.4000111.4L102 I103 T109 A110L102-L106 WeakPolarHBondContact O-CG 3.42Å; L102-L106 PolarHBondContact O-N 2.84Å; I103-L106 WeakPolarHBondContact O-CB 3.27Å; I103-L106 PolarHBondContact O-N 3.39Å; L106-T109 PolarHBondContact O-N 2.89Å; L106-A110 VanDerWaalsContact O-CB 3.24Å; L106-A110 WeakPolarHBondContact O-CB 3.37Å; L106-A110 PolarHBondContact O-N 3.47Å
107E94.2Very high94.8Very high35 Ų3572.3 Ų72.316%0.16439%0.39CS..Hα-helixtrans-64.2-45.2177.7-173.6176.3168.300111.4I103 F104 T109 A110 G111 F242 T245 Q249I103-E107 WeakPolarHBondContact O-CB 3.27Å; I103-E107 PolarHBondContact O-N 3.21Å; F104-E107 PolarHBondContact O-N 3.17Å; E107-T109 PolarHBondContact O-N 3.28Å; E107-A110 PolarHBondContact O-N 3.35Å; E107-G111 PolarHBondContact O-N 3.44Å; E107-F242 HydrophobicContact CG-CD1 3.94Å; E107-F242 HydrophobicContact CG-CE1 4.02Å; E107-T245 WeakPolarHBondContact OE1-CB 3.27Å; E107-T245 WeakPolarHBondContact OE2-CG2 3.06Å; E107-Q249 PolarHBondContact OE2-NE2 3.41Å; E107-Q249 PolarHBondContact OE2-OE1 3.31Å
108L95Very high94.5Very high92 Ų9278.1 Ų78.148%0.48242%0.415SS..Hα-helixtrans-60.2-46.1174.6-176.967.9000111.4F104 G111 I112F104-L108 WeakPolarHBondContact O-CB 3.32Å; F104-L108 PolarHBondContact O-N 3.41Å; L108-G111 PolarHBondContact O-N 3.44Å; L108-I112 HydrophobicContact CD1-CD1 4.36Å; L108-I112 HydrophobicContact CG-CD1 4.06Å; L108-I112 VanDerWaalsContact O-CG1 3.28Å; L108-I112 WeakPolarHBondContact O-CG1 3.48Å; L108-I112 PolarHBondContact O-N 2.82Å
109T95.9Very high94.3Very high73 Ų7379 Ų7945%0.44842%0.417SS..Hα-helixtrans-63.9-45.9179-56.80000110.8F105 L106 E107 G111 I112 L113F105-T109 VanDerWaalsContact O-CB 3.31Å; F105-T109 WeakPolarHBondContact O-CB 3.47Å; F105-T109 PolarHBondContact O-N 3.39Å; F105-T109 PolarHBondContact O-OG1 3.4Å; L106-T109 PolarHBondContact O-N 2.89Å; E107-T109 PolarHBondContact O-N 3.28Å; T109-G111 PolarHBondContact O-N 3.47Å; T109-I112 PolarHBondContact O-N 2.86Å; T109-L113 HydrophobicContact CG2-CD1 3.91Å; T109-L113 HydrophobicContact CG2-CG 4.29Å; T109-L113 WeakPolarHBondContact O-CB 3.25Å; T109-L113 VanDerWaalsContact O-CG 3.26Å; T109-L113 WeakPolarHBondContact O-CG 3.47Å; T109-L113 PolarHBondContact O-N 2.92Å
110A92.3Very high94Very high54 Ų5482.4 Ų82.445%0.44643%0.427SS..Hα-helixtrans-61.2-42.7177.400000111.7L106 E107 L113 A114L106-A110 VanDerWaalsContact O-CB 3.24Å; L106-A110 WeakPolarHBondContact O-CB 3.37Å; L106-A110 PolarHBondContact O-N 3.47Å; E107-A110 PolarHBondContact O-N 3.35Å; A110-L113 PolarHBondContact O-N 3.4Å; A110-A114 VanDerWaalsContact O-CB 3.25Å; A110-A114 WeakPolarHBondContact O-CB 3.36Å; A110-A114 PolarHBondContact O-N 2.89Å
111G92.4Very high93.6Very high28 Ų2884.6 Ų84.629%0.28944%0.438SS..Hα-helixtrans-62-43.8175.800000112.9E107 L108 T109 A114 F115E107-G111 PolarHBondContact O-N 3.44Å; L108-G111 PolarHBondContact O-N 3.44Å; T109-G111 PolarHBondContact O-N 3.47Å; G111-A114 PolarHBondContact O-N 2.98Å; G111-F115 PolarHBondContact O-N 2.96Å; G111-F115 VanDerWaalsContact O-N 3.17Å
112I93.7Very high93.2Very high95 Ų9587.4 Ų87.449%0.48745%0.446SS..Hα-helixtrans-63.6-48.5175.6-66.8165000110.4L108 T109 A114 F115 V116L108-I112 HydrophobicContact CD1-CD1 4.36Å; L108-I112 HydrophobicContact CG-CD1 4.06Å; L108-I112 VanDerWaalsContact O-CG1 3.28Å; L108-I112 WeakPolarHBondContact O-CG1 3.48Å; L108-I112 PolarHBondContact O-N 2.82Å; T109-I112 PolarHBondContact O-N 2.86Å; I112-A114 VanDerWaalsContact C-N 3.3Å; I112-A114 PolarHBondContact O-N 3.21Å; I112-F115 PolarHBondContact O-N 2.67Å; I112-V116 HydrophobicContact CG2-CG2 4.21Å; I112-V116 WeakPolarHBondContact O-CG2 3.3Å; I112-V116 PolarHBondContact O-N 3.06Å
113L93.3Very high92.9Very high85 Ų8587.9 Ų87.945%0.44545%0.449SS..Hα-helixtrans-61.9-39.4179.2-70.6175.7000111.6T109 A110 F115 V116 F117T109-L113 HydrophobicContact CG2-CD1 3.91Å; T109-L113 HydrophobicContact CG2-CG 4.29Å; T109-L113 WeakPolarHBondContact O-CB 3.25Å; T109-L113 VanDerWaalsContact O-CG 3.26Å; T109-L113 WeakPolarHBondContact O-CG 3.47Å; T109-L113 PolarHBondContact O-N 2.92Å; A110-L113 PolarHBondContact O-N 3.4Å; L113-F115 VanDerWaalsContact C-N 3.28Å; L113-F115 PolarHBondContact O-N 2.94Å; L113-V116 PolarHBondContact O-N 3.34Å; L113-F117 HydrophobicContact CB-CD2 4.36Å; L113-F117 HydrophobicContact CD2-CD2 3.81Å; L113-F117 HydrophobicContact CD2-CE2 3.54Å; L113-F117 WeakPolarHBondContact O-CB 3.26Å; L113-F117 WeakPolarHBondContact O-CD2 3.48Å; L113-F117 PolarHBondContact O-N 2.99Å
114A90.1Very high92.4Very high46 Ų4689.7 Ų89.738%0.3846%0.457SS..Hα-helixtrans-62.4-37.4177.600000112.4A110 G111 I112 K118 I121A110-A114 VanDerWaalsContact O-CB 3.25Å; A110-A114 WeakPolarHBondContact O-CB 3.36Å; A110-A114 PolarHBondContact O-N 2.89Å; G111-A114 PolarHBondContact O-N 2.98Å; I112-A114 VanDerWaalsContact C-N 3.3Å; I112-A114 PolarHBondContact O-N 3.21Å; A114-K118 PolarHBondContact O-N 3.04Å; A114-I121 HydrophobicContact CB-CD1 3.97Å
115F89.1Confident91.9Very high168 Ų16889.3 Ų89.374%0.73746%0.457SS*.Hα-helixtrans-72.8-44.3175.7-175.6-98.9000112.5G111 I112 L113G111-F115 PolarHBondContact O-N 2.96Å; G111-F115 VanDerWaalsContact O-N 3.17Å; I112-F115 PolarHBondContact O-N 2.67Å; L113-F115 VanDerWaalsContact C-N 3.28Å; L113-F115 PolarHBondContact O-N 2.94Å
116V94.4Very high91.6Very high87 Ų8784 Ų8453%0.52743%0.434SS..Hα-helixtrans-68.6-41.7-1781720000111.7I112 L113I112-V116 HydrophobicContact CG2-CG2 4.21Å; I112-V116 WeakPolarHBondContact O-CG2 3.3Å; I112-V116 PolarHBondContact O-N 3.06Å; L113-V116 PolarHBondContact O-N 3.34Å
117F93.4Very high91.2Very high106 Ų10684 Ų8447%0.46543%0.429SS..THydrogen-bonded Turntrans-10431.4-175.2-64.2-75000112.8L113 D119 W120 I121L113-F117 HydrophobicContact CB-CD2 4.36Å; L113-F117 HydrophobicContact CD2-CD2 3.81Å; L113-F117 HydrophobicContact CD2-CE2 3.54Å; L113-F117 WeakPolarHBondContact O-CB 3.26Å; L113-F117 WeakPolarHBondContact O-CD2 3.48Å; L113-F117 PolarHBondContact O-N 2.99Å; F117-D119 VanDerWaalsContact C-N 3.25Å; F117-D119 PolarHBondContact O-N 2.91Å; F117-W120 HydrophobicContact CB-CB 4.3Å; F117-W120 PolarHBondContact O-N 3Å; F117-W120 VanDerWaalsContact O-N 3.17Å; F117-I121 WeakPolarHBondContact O-CG1 3.47Å; F117-I121 PolarHBondContact O-N 3.22Å
118K89.8Confident90.7Very high128 Ų12885.7 Ų85.756%0.55744%0.436SS*.Hα-helixtrans-54.2-39.5-178.269.2180-174171.10113.4A114 I121 K122A114-K118 PolarHBondContact O-N 3.04Å; K118-I121 PolarHBondContact O-N 2.82Å; K118-K122 PolarHBondContact O-N 3.34Å
119D91.9Very high90.3Very high104 Ų10481.9 Ų81.956%0.55642%0.416SS*.Hα-helixtrans-71.8-40.3-177-59.6-45.2000110.2F117 I121 K122 D123F117-D119 VanDerWaalsContact C-N 3.25Å; F117-D119 PolarHBondContact O-N 2.91Å; D119-I121 PolarHBondContact O-N 3.4Å; D119-K122 WeakPolarHBondContact O-CB 3.37Å; D119-K122 PolarHBondContact O-N 3.44Å; D119-D123 PolarHBondContact O-N 2.9Å
120W91Very high89.9Confident159 Ų15979.6 Ų79.660%0.60240%0.401SS*.Hα-helixtrans-63.8-39.2172.9178.682.4000112.2F117 K122 D123 Q124F117-W120 HydrophobicContact CB-CB 4.3Å; F117-W120 PolarHBondContact O-N 3Å; F117-W120 VanDerWaalsContact O-N 3.17Å; W120-K122 VanDerWaalsContact C-N 3.31Å; W120-K122 PolarHBondContact O-N 3.37Å; W120-D123 PolarHBondContact O-N 3.4Å; W120-Q124 WeakPolarHBondContact O-CB 3.38Å; W120-Q124 PolarHBondContact O-N 2.87Å
121I87.8Confident89.6Confident68 Ų6878.5 Ų78.535%0.34939%0.388SS..Hα-helixtrans-62.5-41.2174.2-70.6174.9000110.8A114 F117 K118 D119 D123 Q124 L125A114-I121 HydrophobicContact CB-CD1 3.97Å; F117-I121 WeakPolarHBondContact O-CG1 3.47Å; F117-I121 PolarHBondContact O-N 3.22Å; K118-I121 PolarHBondContact O-N 2.82Å; D119-I121 PolarHBondContact O-N 3.4Å; I121-D123 VanDerWaalsContact C-N 3.34Å; I121-Q124 PolarHBondContact O-N 2.92Å; I121-L125 WeakPolarHBondContact O-CB 3.37Å; I121-L125 PolarHBondContact O-N 3.42Å
122K89.6Confident89.2Confident75 Ų7578.3 Ų78.333%0.32638%0.38SS..Hα-helixtrans-61.3-44175.5-178.1176177.5165.70111.3K118 D119 W120 Q124 L125 N126 V224 E228K118-K122 PolarHBondContact O-N 3.34Å; D119-K122 WeakPolarHBondContact O-CB 3.37Å; D119-K122 PolarHBondContact O-N 3.44Å; W120-K122 VanDerWaalsContact C-N 3.31Å; W120-K122 PolarHBondContact O-N 3.37Å; K122-Q124 VanDerWaalsContact C-N 3.34Å; K122-Q124 PolarHBondContact O-N 3.29Å; K122-L125 PolarHBondContact O-N 3.19Å; K122-N126 WeakPolarHBondContact O-CB 3.32Å; K122-N126 PolarHBondContact O-N 3.31Å; K122-N126 PolarHBondContact O-ND2 2.84Å; K122-V224 HydrophobicContact CD-CG1 4.47Å; K122-V224 HydrophobicContact CG-CG1 3.7Å; K122-E228 IonicContact NZ-OE2 2.73Å; K122-E228 PolarHBondContact NZ-OE2 3.31Å
123D90.1Very high88.9Confident102 Ų10273.8 Ų73.855%0.54536%0.357SS..Hα-helixtrans-63.4-40.4175.8-69.6-23.1000112D119 W120 I121 N126 F127D119-D123 PolarHBondContact O-N 2.9Å; W120-D123 PolarHBondContact O-N 3.4Å; I121-D123 VanDerWaalsContact C-N 3.34Å; D123-N126 WeakPolarHBondContact O-CB 3.32Å; D123-N126 PolarHBondContact O-N 3.33Å; D123-F127 WeakPolarHBondContact O-CB 3.42Å; D123-F127 PolarHBondContact O-N 3.42Å
124Q87.4Confident88.8Confident85 Ų8574.7 Ų74.740%0.39736%0.357SS..Hα-helixtrans-66.1-39175.9-169.864.76.700111.9W120 I121 K122 F127 F128W120-Q124 WeakPolarHBondContact O-CB 3.38Å; W120-Q124 PolarHBondContact O-N 2.87Å; I121-Q124 PolarHBondContact O-N 2.92Å; K122-Q124 VanDerWaalsContact C-N 3.34Å; K122-Q124 PolarHBondContact O-N 3.29Å; Q124-F127 PolarHBondContact O-N 2.91Å; Q124-F128 VanDerWaalsContact O-CB 3.32Å; Q124-F128 WeakPolarHBondContact O-CB 3.32Å; Q124-F128 PolarHBondContact O-N 2.93Å
125L86.6Confident88.6Confident40 Ų4073.5 Ų73.521%0.20935%0.348CS..Hα-helixtrans-65.4-42.4174.6-177.761.6000111.2I121 K122 F128 I129 V224 F227I121-L125 WeakPolarHBondContact O-CB 3.37Å; I121-L125 PolarHBondContact O-N 3.42Å; K122-L125 PolarHBondContact O-N 3.19Å; L125-F128 PolarHBondContact O-N 3.25Å; L125-I129 HydrophobicContact CD1-CD1 4.24Å; L125-I129 HydrophobicContact CD1-CG1 4.29Å; L125-I129 HydrophobicContact CG-CD1 4.26Å; L125-I129 WeakPolarHBondContact O-CG1 3.28Å; L125-I129 PolarHBondContact O-N 2.75Å; L125-V224 HydrophobicContact CD2-CG1 4.23Å; L125-V224 HydrophobicContact CD2-CG2 4.11Å; L125-V224 HydrophobicContact CG-CG2 3.93Å; L125-F227 HydrophobicContact CD2-CB 4.39Å; L125-F227 HydrophobicContact CD2-CD1 3.46Å; L125-F227 VanDerWaalsContact CD2-CD1 3.46Å; L125-F227 HydrophobicContact CD2-CE1 4.03Å; L125-F227 HydrophobicContact CD2-CG 4.15Å
126N89.4Confident88.5Confident13 Ų1365.5 Ų65.57%0.0731%0.313CS..Hα-helixtrans-58.3-48.2173.1-82.5-37.3000111.7K122 D123 F128 I129 N130 H159 V224K122-N126 WeakPolarHBondContact O-CB 3.32Å; K122-N126 PolarHBondContact O-N 3.31Å; K122-N126 PolarHBondContact O-ND2 2.84Å; D123-N126 WeakPolarHBondContact O-CB 3.32Å; D123-N126 PolarHBondContact O-N 3.33Å; N126-F128 VanDerWaalsContact C-N 3.34Å; N126-F128 PolarHBondContact O-N 2.86Å; N126-I129 PolarHBondContact O-N 3.11Å; N126-N130 VanDerWaalsContact O-CB 3.31Å; N126-N130 WeakPolarHBondContact O-CB 3.32Å; N126-N130 PolarHBondContact O-N 3.33Å; N126-N130 PolarHBondContact O-ND2 2.92Å; N126-N130 VanDerWaalsContact O-ND2 3.12Å; N126-H159 PolarHBondContact ND2-NE2 3.29Å; N126-H159 VanDerWaalsContact ND2-NE2 3.17Å; N126-H159 PolarHBondContact OD1-CE1 3.31Å; N126-H159 PolarHBondContact OD1-NE2 3.42Å; N126-H159 VanDerWaalsContact OD1-NE2 3.13Å; N126-V224 WeakPolarHBondContact OD1-CB 3.19Å; N126-V224 WeakPolarHBondContact OD1-CG1 3.3Å; N126-V224 WeakPolarHBondContact OD1-CG2 3.35Å
127F87Confident88.1Confident120 Ų12065.2 Ų65.253%0.52630%0.302SS..Hα-helixtrans-59.9-45.8176.8179.4-96.7000111.3D123 Q124 N130 N131D123-F127 WeakPolarHBondContact O-CB 3.42Å; D123-F127 PolarHBondContact O-N 3.42Å; Q124-F127 PolarHBondContact O-N 2.91Å; F127-N130 PolarHBondContact O-N 3.23Å; F127-N131 VanDerWaalsContact O-CB 3.28Å; F127-N131 WeakPolarHBondContact O-CB 3.34Å; F127-N131 PolarHBondContact O-N 3.37Å
128F84.1Confident87.7Confident71 Ų7165.7 Ų65.731%0.31131%0.309SS..Hα-helixtrans-58.5-53.8177.5178.7-97.4000111.6Q124 L125 N126 N130 N131 N132Q124-F128 VanDerWaalsContact O-CB 3.32Å; Q124-F128 WeakPolarHBondContact O-CB 3.32Å; Q124-F128 PolarHBondContact O-N 2.93Å; L125-F128 PolarHBondContact O-N 3.25Å; N126-F128 VanDerWaalsContact C-N 3.34Å; N126-F128 PolarHBondContact O-N 2.86Å; F128-N130 PolarHBondContact O-N 2.91Å; F128-N131 PolarHBondContact O-N 3.5Å; F128-N132 WeakPolarHBondContact CD1-ND2 3.49Å; F128-N132 WeakPolarHBondContact CD2-ND2 3.46Å; F128-N132 WeakPolarHBondContact CE1-ND2 3.32Å; F128-N132 VanDerWaalsContact CE2-ND2 3.31Å; F128-N132 WeakPolarHBondContact CE2-ND2 3.3Å; F128-N132 WeakPolarHBondContact CZ-ND2 3.45Å; F128-N132 WeakPolarHBondContact O-CB 3.46Å; F128-N132 PolarHBondContact O-N 3.24Å; F128-N132 PolarHBondContact O-ND2 2.93Å
129I86.3Confident86.9Confident13 Ų1362.8 Ų62.87%0.06730%0.3CS..Hα-helixtrans-62.5-44.8-178.9-65.1-179.2000110.9L125 N126 N131 N132 I133 A158 C223 V224L125-I129 HydrophobicContact CD1-CD1 4.24Å; L125-I129 HydrophobicContact CD1-CG1 4.29Å; L125-I129 HydrophobicContact CG-CD1 4.26Å; L125-I129 WeakPolarHBondContact O-CG1 3.28Å; L125-I129 PolarHBondContact O-N 2.75Å; N126-I129 PolarHBondContact O-N 3.11Å; I129-N131 VanDerWaalsContact C-N 3.34Å; I129-N131 PolarHBondContact O-N 3.39Å; I129-N132 PolarHBondContact O-N 2.95Å; I129-I133 HydrophobicContact CG2-CD1 3.8Å; I129-I133 HydrophobicContact CG2-CG1 4.28Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å; I129-I133 PolarHBondContact O-N 3.34Å; I129-A158 HydrophobicContact CB-CB 4.07Å; I129-A158 HydrophobicContact CG2-CB 3.79Å; I129-C223 HydrophobicContact CD1-CB 4.14Å; I129-V224 HydrophobicContact CD1-CG2 3.61Å
130N88.5Confident86.4Confident24 Ų2463 Ų6313%0.12830%0.3CS..Hα-helixtrans-62.9-40.5179.6-77.9-36.2000112.6N126 F127 F128 N132 I133 K134 Q166N126-N130 VanDerWaalsContact O-CB 3.31Å; N126-N130 WeakPolarHBondContact O-CB 3.32Å; N126-N130 PolarHBondContact O-N 3.33Å; N126-N130 PolarHBondContact O-ND2 2.92Å; N126-N130 VanDerWaalsContact O-ND2 3.12Å; F127-N130 PolarHBondContact O-N 3.23Å; F128-N130 PolarHBondContact O-N 2.91Å; N130-N132 VanDerWaalsContact C-N 3.3Å; N130-N132 PolarHBondContact O-N 3.31Å; N130-I133 PolarHBondContact O-N 3.49Å; N130-K134 WeakPolarHBondContact O-CG 3.33Å; N130-K134 PolarHBondContact O-N 3Å; N130-K134 VanDerWaalsContact O-N 3.11Å; N130-Q166 PolarHBondContact OD1-NE2 3.45Å
131N85Confident85.6Confident32 Ų3259.1 Ų59.117%0.17129%0.291CS..Hα-helixtrans-64.9-39.1177-164.962.6000111.7L58 F127 F128 I129 K134 A135L58-N131 WeakPolarHBondContact CD1-ND2 3.34Å; L58-N131 WeakPolarHBondContact CD2-ND2 3.29Å; L58-N131 WeakPolarHBondContact CD2-OD1 3.48Å; F127-N131 VanDerWaalsContact O-CB 3.28Å; F127-N131 WeakPolarHBondContact O-CB 3.34Å; F127-N131 PolarHBondContact O-N 3.37Å; F128-N131 PolarHBondContact O-N 3.5Å; I129-N131 VanDerWaalsContact C-N 3.34Å; I129-N131 PolarHBondContact O-N 3.39Å; N131-K134 WeakPolarHBondContact O-CB 3.48Å; N131-K134 PolarHBondContact O-N 2.93Å; N131-A135 PolarHBondContact O-N 3.49Å
132N83.6Confident85.1Confident23 Ų2356.9 Ų56.912%0.12328%0.28CS..Hα-helixtrans-69.5-34.5175.5-77.9-52.1000113.1F128 I129 N130 K134 A135 Y136 L142 I146F128-N132 WeakPolarHBondContact CD1-ND2 3.49Å; F128-N132 WeakPolarHBondContact CD2-ND2 3.46Å; F128-N132 WeakPolarHBondContact CE1-ND2 3.32Å; F128-N132 VanDerWaalsContact CE2-ND2 3.31Å; F128-N132 WeakPolarHBondContact CE2-ND2 3.3Å; F128-N132 WeakPolarHBondContact CZ-ND2 3.45Å; F128-N132 WeakPolarHBondContact O-CB 3.46Å; F128-N132 PolarHBondContact O-N 3.24Å; F128-N132 PolarHBondContact O-ND2 2.93Å; I129-N132 PolarHBondContact O-N 2.95Å; N130-N132 VanDerWaalsContact C-N 3.3Å; N130-N132 PolarHBondContact O-N 3.31Å; N132-K134 VanDerWaalsContact C-N 3.32Å; N132-K134 PolarHBondContact O-N 2.81Å; N132-A135 CarbonylContact O-C 2.99Å; N132-A135 PolarHBondContact O-N 3.33Å; N132-Y136 WeakPolarHBondContact O-CA 3.38Å; N132-Y136 PolarHBondContact O-N 3.22Å; N132-L142 HydrophobicContact CB-CD1 3.74Å; N132-L142 HydrophobicContact CB-CD2 4.25Å; N132-L142 HydrophobicContact CB-CG 4.43Å; N132-L142 WeakPolarHBondContact OD1-CD1 3.42Å; N132-I146 HydrophobicContact CB-CD1 3.93Å; N132-I146 HydrophobicContact CB-CG1 4.44Å
133I89.4Confident84.9Confident0 Ų055.1 Ų55.10%027%0.272CS..Hα-helixtrans-61.5-40.8171.3-74.4168.4000110.7I129 N130 A135 Y136 I146 D163 W164 N167I129-I133 HydrophobicContact CG2-CD1 3.8Å; I129-I133 HydrophobicContact CG2-CG1 4.28Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å; I129-I133 PolarHBondContact O-N 3.34Å; N130-I133 PolarHBondContact O-N 3.49Å; I133-A135 VanDerWaalsContact C-N 3.3Å; I133-A135 PolarHBondContact O-N 3.48Å; I133-Y136 VanDerWaalsContact O-CB 3.26Å; I133-Y136 WeakPolarHBondContact O-CB 3.31Å; I133-Y136 PolarHBondContact O-N 3.17Å; I133-I146 HydrophobicContact CG1-CD1 4.48Å; I133-D163 HydrophobicContact CD1-CB 4.17Å; I133-W164 HydrophobicContact CG1-CH2 4.35Å; I133-W164 HydrophobicContact CG1-CZ2 4.48Å; I133-W164 HydrophobicContact CG2-CD2 4.17Å; I133-W164 HydrophobicContact CG2-CE3 3.72Å; I133-W164 HydrophobicContact CG2-CH2 4.49Å; I133-W164 HydrophobicContact CG2-CZ3 3.9Å; I133-N167 HydrophobicContact CG2-CB 4.2Å; I133-N167 WeakPolarHBondContact O-CB 3.26Å; I133-N167 PolarHBondContact O-ND2 3.04Å
134K89.6Confident84.7Confident104 Ų10454.5 Ų54.545%0.45227%0.269SS..Hα-helixtrans-60-42.2176.6-68.8172.6-175.7174.60111.8N130 N131 N132 Q166 N167N130-K134 WeakPolarHBondContact O-CG 3.33Å; N130-K134 PolarHBondContact O-N 3Å; N130-K134 VanDerWaalsContact O-N 3.11Å; N131-K134 WeakPolarHBondContact O-CB 3.48Å; N131-K134 PolarHBondContact O-N 2.93Å; N132-K134 VanDerWaalsContact C-N 3.32Å; N132-K134 PolarHBondContact O-N 2.81Å; K134-Q166 HydrophobicContact CG-CB 4.01Å; K134-N167 PolarHBondContact O-ND2 3.16Å
135A85.6Confident84.6Confident22 Ų2254 Ų5418%0.18227%0.269CS..THydrogen-bonded Turntrans-89.79.9-17900000114.3N131 N132 I133 R137 D138 L142N131-A135 PolarHBondContact O-N 3.49Å; N132-A135 CarbonylContact O-C 2.99Å; N132-A135 PolarHBondContact O-N 3.33Å; I133-A135 VanDerWaalsContact C-N 3.3Å; I133-A135 PolarHBondContact O-N 3.48Å; A135-R137 PolarHBondContact O-N 3.21Å; A135-D138 WeakPolarHBondContact CA-OD2 3.33Å; A135-D138 HydrophobicContact CB-CB 4.46Å; A135-D138 WeakPolarHBondContact O-CB 3.28Å; A135-D138 PolarHBondContact O-N 2.82Å; A135-L142 HydrophobicContact CB-CD2 3.69Å
136Y86.9Confident84.7Confident0 Ų052.6 Ų52.60%026%0.262CS..THydrogen-bonded Turntrans-54.6-32.9-169.3173.5-101.9000115.1N132 I133 Q143 I146 D147 W164 F170 P185N132-Y136 WeakPolarHBondContact O-CA 3.38Å; N132-Y136 PolarHBondContact O-N 3.22Å; I133-Y136 VanDerWaalsContact O-CB 3.26Å; I133-Y136 WeakPolarHBondContact O-CB 3.31Å; I133-Y136 PolarHBondContact O-N 3.17Å; Y136-Q143 HydrophobicContact CD1-CG 4.22Å; Y136-Q143 HydrophobicContact CD2-CB 4.43Å; Y136-Q143 HydrophobicContact CD2-CG 3.85Å; Y136-Q143 HydrophobicContact CE1-CG 3.71Å; Y136-Q143 HydrophobicContact CE2-CB 4.19Å; Y136-Q143 HydrophobicContact CE2-CG 3.3Å; Y136-Q143 HydrophobicContact CG-CG 4.28Å; Y136-Q143 WeakPolarHBondContact O-CB 3.37Å; Y136-Q143 WeakPolarHBondContact O-CG 3.35Å; Y136-Q143 WeakPolarHBondContact OH-CG 3.45Å; Y136-I146 HydrophobicContact CD2-CB 3.85Å; Y136-I146 HydrophobicContact CD2-CG1 4.23Å; Y136-I146 HydrophobicContact CD2-CG2 3.75Å; Y136-I146 HydrophobicContact CE2-CB 3.94Å; Y136-I146 HydrophobicContact CE2-CG2 3.74Å; Y136-D147 WeakPolarHBondContact CE2-OD1 3.4Å; Y136-D147 PolarHBondContact OH-OD1 2.89Å; Y136-D147 PolarHBondContact OH-OD2 3.41Å; Y136-W164 HydrophobicContact CD1-CH2 4.07Å; Y136-W164 AromaticContact CD1-CZ3 3.88Å; Y136-W164 HydrophobicContact CD1-CZ3 3.88Å; Y136-W164 AromaticContact CD2-CH2 3.73Å; Y136-W164 HydrophobicContact CD2-CH2 3.73Å; Y136-W164 HydrophobicContact CD2-CZ3 4.23Å; Y136-W164 HydrophobicContact CE1-CH2 4.34Å; Y136-W164 HydrophobicContact CE1-CZ3 4.43Å; Y136-W164 AromaticContact CE2-CH2 3.99Å; Y136-W164 HydrophobicContact CE2-CH2 3.99Å; Y136-W164 AromaticContact CG-CH2 3.76Å; Y136-W164 HydrophobicContact CG-CH2 3.76Å; Y136-W164 AromaticContact CG-CZ3 3.77Å; Y136-W164 HydrophobicContact CG-CZ3 3.77Å; Y136-F170 AromaticContact CD1-CE2 3.89Å; Y136-F170 HydrophobicContact CD1-CE2 3.89Å; Y136-F170 HydrophobicContact CE1-CE2 4.04Å; Y136-F170 HydrophobicContact CE1-CZ 4.23Å; Y136-P185 HydrophobicContact CD1-CG 4.47Å; Y136-P185 HydrophobicContact CE1-CB 4.13Å; Y136-P185 HydrophobicContact CE1-CG 3.79Å; Y136-P185 HydrophobicContact CE2-CG 4.29Å; Y136-P185 VanDerWaalsContact OH-CB 3.3Å; Y136-P185 WeakPolarHBondContact OH-CB 3.44Å
137R87.3Confident84.8Confident81 Ų8152.4 Ų52.431%0.30626%0.26SS..THydrogen-bonded Turntrans-97-2.8179-70.5-60.8-166.9-167.5-0.5113.8A135 Q143 Y169 E180A135-R137 PolarHBondContact O-N 3.21Å; R137-Q143 VanDerWaalsContact NH1-CD 3.35Å; R137-Y169 HydrophobicContact CB-CD2 3.73Å; R137-Y169 HydrophobicContact CB-CE2 3.41Å; R137-Y169 VanDerWaalsContact CB-CE2 3.41Å; R137-Y169 HydrophobicContact CG-CD2 3.46Å; R137-Y169 VanDerWaalsContact CG-CD2 3.46Å; R137-Y169 HydrophobicContact CG-CE2 3.69Å; R137-Y169 HydrophobicContact CG-CG 4.16Å; R137-E180 IonicContact CZ-OE1 2.82Å; R137-E180 IonicContact CZ-OE2 2.75Å; R137-E180 IonicContact NE-OE2 2.72Å; R137-E180 PolarHBondContact NE-OE2 3.39Å; R137-E180 IonicContact NH2-OE1 2.89Å; R137-E180 PolarHBondContact NH2-OE1 3.42Å; R137-E180 IonicContact NH2-OE2 3.97Å; R137-E180 PolarHBondContact NH2-OE2 3.28Å
138D83.9Confident85Confident115 Ų11552.8 Ų52.862%0.61526%0.262SS*.THydrogen-bonded Turntrans-86.8-25.5-174.6-59.1-20000111.5A135A135-D138 WeakPolarHBondContact CA-OD2 3.33Å; A135-D138 HydrophobicContact CB-CB 4.46Å; A135-D138 WeakPolarHBondContact O-CB 3.28Å; A135-D138 PolarHBondContact O-N 2.82Å
139D74.6Confident85.4Confident68 Ų6851 Ų5136%0.36426%0.257SS..  trans-138.8125.8-179.3-175-19.9000110.5D141 L142 Q143D139-D141 VanDerWaalsContact C-N 3.33Å; D139-D141 PolarHBondContact O-N 3.46Å; D139-D141 WeakPolarHBondContact OD1-CB 3.41Å; D139-D141 PolarHBondContact OD1-N 3.38Å; D139-L142 HydrophobicContact CB-CB 3.85Å; D139-L142 WeakPolarHBondContact O-CB 3.32Å; D139-L142 PolarHBondContact O-N 2.88Å; D139-Q143 PolarHBondContact O-N 3.2Å
140I80.2Confident85.8Confident108 Ų10850.4 Ų50.455%0.55425%0.254SS*.Hα-helixtrans-67.2-33-179.6-164.5164.6000112.5L142 Q143 N144I140-L142 VanDerWaalsContact C-N 3.32Å; I140-Q143 WeakPolarHBondContact O-CB 3.43Å; I140-Q143 PolarHBondContact O-N 3.47Å; I140-N144 WeakPolarHBondContact O-CB 3.28Å; I140-N144 PolarHBondContact O-N 2.93Å; I140-N144 PolarHBondContact O-ND2 2.84Å
141D74.1Confident86Confident78 Ų7852 Ų5242%0.41726%0.26SS..Hα-helixtrans-68.2-40.5177-70.4-24.5000109.9D139 N144 L145D139-D141 VanDerWaalsContact C-N 3.33Å; D139-D141 PolarHBondContact O-N 3.46Å; D139-D141 WeakPolarHBondContact OD1-CB 3.41Å; D139-D141 PolarHBondContact OD1-N 3.38Å; D141-N144 PolarHBondContact O-N 2.88Å; D141-L145 WeakPolarHBondContact O-CB 3.18Å; D141-L145 PolarHBondContact O-N 3.35Å
142L76.9Confident86.4Confident21 Ų2157.4 Ų57.411%0.1128%0.28CS..Hα-helixtrans-65.4-42.8175.1-179.156.2000111.7N132 A135 D139 I140 N144 L145 I146N132-L142 HydrophobicContact CB-CD1 3.74Å; N132-L142 HydrophobicContact CB-CD2 4.25Å; N132-L142 HydrophobicContact CB-CG 4.43Å; N132-L142 WeakPolarHBondContact OD1-CD1 3.42Å; A135-L142 HydrophobicContact CB-CD2 3.69Å; D139-L142 HydrophobicContact CB-CB 3.85Å; D139-L142 WeakPolarHBondContact O-CB 3.32Å; D139-L142 PolarHBondContact O-N 2.88Å; I140-L142 VanDerWaalsContact C-N 3.32Å; L142-N144 VanDerWaalsContact C-N 3.35Å; L142-N144 PolarHBondContact O-N 3.49Å; L142-L145 PolarHBondContact O-N 3.05Å; L142-I146 HydrophobicContact CD1-CG1 4.26Å; L142-I146 WeakPolarHBondContact O-CG1 3.31Å; L142-I146 PolarHBondContact O-N 2.96Å
143Q85.9Confident86.8Confident37 Ų3759.2 Ų59.217%0.17329%0.285CS..Hα-helixtrans-56.4-51.2175.5-157.1-166.9-61.700110.6Y136 R137 D139 I140 L145 I146 D147Y136-Q143 HydrophobicContact CD1-CG 4.22Å; Y136-Q143 HydrophobicContact CD2-CB 4.43Å; Y136-Q143 HydrophobicContact CD2-CG 3.85Å; Y136-Q143 HydrophobicContact CE1-CG 3.71Å; Y136-Q143 HydrophobicContact CE2-CB 4.19Å; Y136-Q143 HydrophobicContact CE2-CG 3.3Å; Y136-Q143 HydrophobicContact CG-CG 4.28Å; Y136-Q143 WeakPolarHBondContact O-CB 3.37Å; Y136-Q143 WeakPolarHBondContact O-CG 3.35Å; Y136-Q143 WeakPolarHBondContact OH-CG 3.45Å; R137-Q143 VanDerWaalsContact NH1-CD 3.35Å; D139-Q143 PolarHBondContact O-N 3.2Å; I140-Q143 WeakPolarHBondContact O-CB 3.43Å; I140-Q143 PolarHBondContact O-N 3.47Å; Q143-L145 VanDerWaalsContact C-N 3.32Å; Q143-L145 PolarHBondContact O-N 3.39Å; Q143-I146 PolarHBondContact O-N 3.33Å; Q143-D147 PolarHBondContact NE2-OD2 2.97Å; Q143-D147 WeakPolarHBondContact O-CB 3.48Å; Q143-D147 PolarHBondContact O-N 2.87Å
144N85.8Confident87.1Confident90 Ų9064.5 Ų64.548%0.48131%0.311SS..Hα-helixtrans-61.1-38.2178.7-72.5-35.6000112.5I140 D141 L142 F148I140-N144 WeakPolarHBondContact O-CB 3.28Å; I140-N144 PolarHBondContact O-N 2.93Å; I140-N144 PolarHBondContact O-ND2 2.84Å; D141-N144 PolarHBondContact O-N 2.88Å; L142-N144 VanDerWaalsContact C-N 3.35Å; L142-N144 PolarHBondContact O-N 3.49Å; N144-F148 VanDerWaalsContact O-CB 3.23Å; N144-F148 WeakPolarHBondContact O-CB 3.44Å; N144-F148 PolarHBondContact O-N 2.87Å
145L84.7Confident87.4Confident73 Ų7359.6 Ų59.638%0.38229%0.289SS..Hα-helixtrans-65.9-45.7177.1177.663.6000111.9D141 L142 Q143 T149D141-L145 WeakPolarHBondContact O-CB 3.18Å; D141-L145 PolarHBondContact O-N 3.35Å; L142-L145 PolarHBondContact O-N 3.05Å; Q143-L145 VanDerWaalsContact C-N 3.32Å; Q143-L145 PolarHBondContact O-N 3.39Å; L145-T149 WeakPolarHBondContact O-CB 3.47Å; L145-T149 PolarHBondContact O-N 3.29Å; L145-T149 PolarHBondContact O-OG1 3.29Å
146I89.6Confident87.9Confident12 Ų1258.5 Ų58.56%0.06228%0.281CS..Hα-helixtrans-63.7-45.2176.8-69.7-78.4000109.8N132 I133 Y136 L142 Q143 T149 Q150 W164N132-I146 HydrophobicContact CB-CD1 3.93Å; N132-I146 HydrophobicContact CB-CG1 4.44Å; I133-I146 HydrophobicContact CG1-CD1 4.48Å; Y136-I146 HydrophobicContact CD2-CB 3.85Å; Y136-I146 HydrophobicContact CD2-CG1 4.23Å; Y136-I146 HydrophobicContact CD2-CG2 3.75Å; Y136-I146 HydrophobicContact CE2-CB 3.94Å; Y136-I146 HydrophobicContact CE2-CG2 3.74Å; L142-I146 HydrophobicContact CD1-CG1 4.26Å; L142-I146 WeakPolarHBondContact O-CG1 3.31Å; L142-I146 PolarHBondContact O-N 2.96Å; Q143-I146 PolarHBondContact O-N 3.33Å; I146-T149 PolarHBondContact O-N 2.85Å; I146-Q150 HydrophobicContact CG2-CG 4.46Å; I146-Q150 WeakPolarHBondContact O-CB 3.39Å; I146-Q150 WeakPolarHBondContact O-CG 3.39Å; I146-Q150 PolarHBondContact O-N 2.9Å; I146-W164 HydrophobicContact CG2-CH2 4.05Å; I146-W164 HydrophobicContact CG2-CZ2 4.18Å
147D92.4Very high88.3Confident8 Ų858.5 Ų58.54%0.04328%0.281CS..Hα-helixtrans-62-47.5-180-71.6-19.9000111.5Y136 Q143 T149 Q150 E151 F186 S187Y136-D147 WeakPolarHBondContact CE2-OD1 3.4Å; Y136-D147 PolarHBondContact OH-OD1 2.89Å; Y136-D147 PolarHBondContact OH-OD2 3.41Å; Q143-D147 PolarHBondContact NE2-OD2 2.97Å; Q143-D147 WeakPolarHBondContact O-CB 3.48Å; Q143-D147 PolarHBondContact O-N 2.87Å; D147-T149 VanDerWaalsContact C-N 3.33Å; D147-T149 PolarHBondContact O-N 3.49Å; D147-Q150 PolarHBondContact O-N 3.33Å; D147-E151 WeakPolarHBondContact O-CG 3.05Å; D147-E151 PolarHBondContact O-N 3.1Å; D147-F186 HydrophobicContact CB-CZ 4.48Å; D147-S187 VanDerWaalsContact CA-CB 3.41Å; D147-S187 WeakPolarHBondContact O-CB 3.44Å; D147-S187 VanDerWaalsContact OD1-CB 3.3Å; D147-S187 WeakPolarHBondContact OD1-CB 3.22Å; D147-S187 PolarHBondContact OD1-OG 3.32Å
148F90.9Very high88.6Confident128 Ų12854.7 Ų54.756%0.56127%0.266SS*.Hα-helixtrans-58.4-44.8174.1175.5-96.6000111.9N144 Q150 E151 Y152N144-F148 VanDerWaalsContact O-CB 3.23Å; N144-F148 WeakPolarHBondContact O-CB 3.44Å; N144-F148 PolarHBondContact O-N 2.87Å; F148-Q150 PolarHBondContact O-N 3.45Å; F148-E151 PolarHBondContact O-N 3.47Å; F148-Y152 HydrophobicContact CE1-CG 4.36Å; F148-Y152 HydrophobicContact CZ-CD2 4.21Å; F148-Y152 HydrophobicContact CZ-CG 4.14Å; F148-Y152 WeakPolarHBondContact O-CB 3.33Å; F148-Y152 PolarHBondContact O-N 2.83Å
149T91.5Very high89.1Confident33 Ų3354.5 Ų54.520%0.20226%0.262CS..Hα-helixtrans-62.6-44.7-179.2-58.80000111.3L145 I146 D147 W153L145-T149 WeakPolarHBondContact O-CB 3.47Å; L145-T149 PolarHBondContact O-N 3.29Å; L145-T149 PolarHBondContact O-OG1 3.29Å; I146-T149 PolarHBondContact O-N 2.85Å; D147-T149 VanDerWaalsContact C-N 3.33Å; D147-T149 PolarHBondContact O-N 3.49Å; T149-W153 HydrophobicContact CG2-CE3 4.02Å; T149-W153 HydrophobicContact CG2-CZ3 4.19Å; T149-W153 PolarHBondContact O-N 3.29Å
150Q95.1Very high90.1Very high2 Ų251.8 Ų51.81%0.00925%0.249CC..Hα-helixtrans-66.8-42.8-179.2-75179.2-5.300112.2I146 D147 F148 M154 C155 W164 S187 C188I146-Q150 HydrophobicContact CG2-CG 4.46Å; I146-Q150 WeakPolarHBondContact O-CB 3.39Å; I146-Q150 WeakPolarHBondContact O-CG 3.39Å; I146-Q150 PolarHBondContact O-N 2.9Å; D147-Q150 PolarHBondContact O-N 3.33Å; F148-Q150 PolarHBondContact O-N 3.45Å; Q150-M154 VanDerWaalsContact O-CA 3.32Å; Q150-M154 WeakPolarHBondContact O-CA 3.34Å; Q150-M154 PolarHBondContact O-N 3.42Å; Q150-C155 WeakPolarHBondContact CA-O 3.36Å; Q150-C155 VanDerWaalsContact CB-O 3.31Å; Q150-C155 WeakPolarHBondContact CB-O 3.22Å; Q150-C155 WeakPolarHBondContact CG-O 3.47Å; Q150-C155 PolarHBondContact O-N 3.49Å; Q150-W164 VanDerWaalsContact NE2-CZ2 3.31Å; Q150-S187 PolarHBondContact OE1-OG 3.33Å; Q150-C188 PolarHBondContact OE1-SG 3.05Å
151E93.1Very high90.8Very high56 Ų5647 Ų4726%0.26223%0.226SC..Hα-helixtrans-67.4-45.5175.4-73-164.6-166.100112.5D147 F148 M154 K191D147-E151 WeakPolarHBondContact O-CG 3.05Å; D147-E151 PolarHBondContact O-N 3.1Å; F148-E151 PolarHBondContact O-N 3.47Å; E151-M154 PolarHBondContact O-N 2.87Å; E151-K191 IonicContact OE2-NZ 2.7Å; E151-K191 PolarHBondContact OE2-NZ 3.19Å
152Y92.8Very high91.8Very high147 Ų14747.3 Ų47.358%0.57623%0.227SC*.Hα-helixtrans-68.4-39.2-174.1-174.9-107.3000112.1F148F148-Y152 HydrophobicContact CE1-CG 4.36Å; F148-Y152 HydrophobicContact CZ-CD2 4.21Å; F148-Y152 HydrophobicContact CZ-CG 4.14Å; F148-Y152 WeakPolarHBondContact O-CB 3.33Å; F148-Y152 PolarHBondContact O-N 2.83Å
153W93.3Very high92.7Very high60 Ų6047.4 Ų47.423%0.22723%0.228CC..Hα-helixtrans-97.95.1178.8-70.7-9.1000114.4T149 C155 C223 Q226 F227T149-W153 HydrophobicContact CG2-CE3 4.02Å; T149-W153 HydrophobicContact CG2-CZ3 4.19Å; T149-W153 PolarHBondContact O-N 3.29Å; W153-C155 VanDerWaalsContact C-N 3.29Å; W153-C155 HydrophobicContact CB-CB 4.43Å; W153-C155 PolarHBondContact O-N 3.31Å; W153-C223 HydrophobicContact CE3-CB 4.45Å; W153-Q226 HydrophobicContact CB-CB 4.4Å; W153-Q226 PolarHBondContact O-NE2 2.96Å; W153-F227 HydrophobicContact CE3-CB 4.02Å; W153-F227 HydrophobicContact CH2-CB 3.73Å; W153-F227 AromaticContact CH2-CD2 3.06Å; W153-F227 HydrophobicContact CH2-CD2 3.06Å; W153-F227 AromaticContact CH2-CE2 3.83Å; W153-F227 HydrophobicContact CH2-CE2 3.83Å; W153-F227 AromaticContact CH2-CG 3.62Å; W153-F227 HydrophobicContact CH2-CG 3.62Å; W153-F227 AromaticContact CZ2-CD2 3.46Å; W153-F227 HydrophobicContact CZ2-CD2 3.46Å; W153-F227 VanDerWaalsContact CZ2-CD2 3.46Å; W153-F227 HydrophobicContact CZ2-CE2 4.1Å; W153-F227 HydrophobicContact CZ2-CG 4.37Å; W153-F227 HydrophobicContact CZ3-CB 3.43Å; W153-F227 VanDerWaalsContact CZ3-CB 3.43Å; W153-F227 AromaticContact CZ3-CD2 3.77Å; W153-F227 HydrophobicContact CZ3-CD2 3.77Å; W153-F227 AromaticContact CZ3-CG 3.86Å; W153-F227 HydrophobicContact CZ3-CG 3.86Å
154M94.4Very high93.2Very high112 Ų11245.7 Ų45.755%0.55222%0.22SC*.THydrogen-bonded Turntrans49.354.8179-59.7176-176.300110.6Q150 E151 Y219 Q226Q150-M154 VanDerWaalsContact O-CA 3.32Å; Q150-M154 WeakPolarHBondContact O-CA 3.34Å; Q150-M154 PolarHBondContact O-N 3.42Å; E151-M154 PolarHBondContact O-N 2.87Å; M154-Y219 HydrophobicContact CB-CD1 3.8Å; M154-Y219 HydrophobicContact CB-CD2 4.47Å; M154-Y219 HydrophobicContact CB-CE1 3.57Å; M154-Y219 HydrophobicContact CB-CE2 4.29Å; M154-Y219 HydrophobicContact CB-CG 4.26Å; M154-Y219 HydrophobicContact CG-CE1 3.95Å; M154-Q226 PolarHBondContact O-NE2 3.01Å
155C96.1Very high93.6Very high0 Ų044.1 Ų44.10%021%0.211CC..  trans-136.9163.5-171.964.80000110.7Q150 W153 K221 C223 Q226Q150-C155 WeakPolarHBondContact CA-O 3.36Å; Q150-C155 VanDerWaalsContact CB-O 3.31Å; Q150-C155 WeakPolarHBondContact CB-O 3.22Å; Q150-C155 WeakPolarHBondContact CG-O 3.47Å; Q150-C155 PolarHBondContact O-N 3.49Å; W153-C155 VanDerWaalsContact C-N 3.29Å; W153-C155 HydrophobicContact CB-CB 4.43Å; W153-C155 PolarHBondContact O-N 3.31Å; C155-K221 CarbonylContact C-O 3.54Å; C155-K221 WeakPolarHBondContact CA-O 3.32Å; C155-K221 WeakPolarHBondContact CB-O 3.2Å; C155-C223 HydrophobicContact CB-CB 3.89Å; C155-C223 WeakPolarHBondContact CB-SG 3.24Å; C155-C223 WeakPolarHBondContact SG-CA 3Å; C155-C223 WeakPolarHBondContact SG-CB 3.5Å; C155-C223 CovalentContact SG-SG 2.03Å; C155-C223 PolarHBondContact SG-SG 2.79Å; C155-Q226 HydrophobicContact CB-CB 4.31Å; C155-Q226 HydrophobicContact CB-CG 3.95Å
156C96.3Very high94Very high0 Ų044 Ų440%021%0.209CC..  trans-142.6127.5176-167.20000110.2G160 P161 W164 C188 Y219 K221C156-G160 CarbonylContact O-C 3.49Å; C156-G160 WeakPolarHBondContact O-CA 3.42Å; C156-P161 HydrophobicContact CB-CG 4.19Å; C156-W164 PolarHBondContact SG-NE1 2.91Å; C156-W164 VanDerWaalsContact SG-NE1 3.37Å; C156-C188 WeakPolarHBondContact CA-SG 3.31Å; C156-C188 HydrophobicContact CB-CB 3.68Å; C156-C188 WeakPolarHBondContact CB-SG 3.04Å; C156-C188 WeakPolarHBondContact SG-CB 3.33Å; C156-C188 CovalentContact SG-SG 2.04Å; C156-C188 PolarHBondContact SG-SG 2.93Å; C156-Y219 WeakPolarHBondContact CB-O 3.47Å; C156-K221 PolarHBondContact N-O 2.62Å
157G95.3Very high94.2Very high0 Ų043.5 Ų43.50%021%0.206CC..SBendtrans67.9-174.4-174.300000113.9G160 C223G157-G160 WeakPolarHBondContact CA-O 3.36Å; G157-C223 WeakPolarHBondContact O-CB 3.49Å; G157-C223 PolarHBondContact O-N 3.47Å; G157-C223 PolarHBondContact O-SG 2.93Å
158A93.8Very high94.3Very high0 Ų048.4 Ų48.40%023%0.231CC..SBendtrans-76.5-52.6178.800000111.2I129 D163 G222 C223 V224I129-A158 HydrophobicContact CB-CB 4.07Å; I129-A158 HydrophobicContact CG2-CB 3.79Å; A158-D163 WeakPolarHBondContact CA-OD2 3.41Å; A158-D163 PolarHBondContact N-OD2 3.1Å; A158-G222 CarbonylContact O-C 3.47Å; A158-G222 VanDerWaalsContact O-C 3.24Å; A158-G222 WeakPolarHBondContact O-CA 3.41Å; A158-C223 PolarHBondContact O-N 3.4Å; A158-C223 VanDerWaalsContact O-N 3.08Å; A158-V224 HydrophobicContact CB-CG2 4.3Å; A158-V224 WeakPolarHBondContact O-CB 2.94Å; A158-V224 PolarHBondContact O-N 2.77Å
159H95.1Very high94.4Very high112 Ų11246.7 Ų46.752%0.51922%0.222SC..SBendtrans-105.8-28.4176.1-58.895.2000112.1N126 D163 G222N126-H159 PolarHBondContact ND2-NE2 3.29Å; N126-H159 VanDerWaalsContact ND2-NE2 3.17Å; N126-H159 PolarHBondContact OD1-CE1 3.31Å; N126-H159 PolarHBondContact OD1-NE2 3.42Å; N126-H159 VanDerWaalsContact OD1-NE2 3.13Å; H159-D163 PolarHBondContact N-OD2 2.9Å; H159-G222 WeakPolarHBondContact O-CA 3.13Å; H159-G222 PolarHBondContact O-N 2.88Å
160G95.3Very high94.6Very high10 Ų1045.1 Ų45.110%0.10321%0.212CC..SBendtrans177.1-176.4175.700000113.5C156 G157 D162 D163C156-G160 CarbonylContact O-C 3.49Å; C156-G160 WeakPolarHBondContact O-CA 3.42Å; G157-G160 WeakPolarHBondContact CA-O 3.36Å; G160-D162 PolarHBondContact O-N 2.77Å; G160-D163 PolarHBondContact N-OD2 3.35Å; G160-D163 VanDerWaalsContact N-OD2 3.09Å; G160-D163 PolarHBondContact O-N 3.48Å; G160-D163 VanDerWaalsContact O-N 3.15Å
161P95.1Very high94.6Very high9 Ų947.3 Ų47.36%0.05822%0.224CC..G310 helixtrans-56-25.6-178.2-27.835.3000114.5C156 D163 W164 V184 R207 I218 T220C156-P161 HydrophobicContact CB-CG 4.19Å; P161-D163 VanDerWaalsContact C-N 3.26Å; P161-D163 PolarHBondContact O-N 2.92Å; P161-W164 WeakPolarHBondContact O-CB 3.36Å; P161-W164 VanDerWaalsContact O-CD1 3.29Å; P161-W164 PolarHBondContact O-N 3.03Å; P161-V184 HydrophobicContact CB-CG1 4.04Å; P161-R207 PolarHBondContact O-NE 3.43Å; P161-I218 HydrophobicContact CB-CD1 4Å; P161-I218 HydrophobicContact CG-CD1 3.85Å; P161-T220 WeakPolarHBondContact CD-O 3.42Å
162D95.1Very high94.6Very high83 Ų8346.3 Ų46.344%0.44422%0.223SC..G310 helixtrans-73.9-15.7-176.9-67.1-41.9000114.4G160 W164 N165 R207G160-D162 PolarHBondContact O-N 2.77Å; D162-W164 PolarHBondContact O-N 3.04Å; D162-W164 VanDerWaalsContact O-N 3.16Å; D162-N165 VanDerWaalsContact O-CB 3.3Å; D162-N165 WeakPolarHBondContact O-CB 3.34Å; D162-N165 PolarHBondContact O-N 3.22Å; D162-R207 IonicContact OD1-CZ 3.92Å; D162-R207 IonicContact OD1-NE 3.42Å; D162-R207 PolarHBondContact OD1-NE 3.24Å; D162-R207 IonicContact OD1-NH2 3.6Å; D162-R207 PolarHBondContact OD1-NH2 2.86Å
163D95.4Very high94.7Very high24 Ų2443 Ų4313%0.12822%0.218CC..G310 helixtrans-61.4-23.1173.7-65.7-42.5000112.2I133 A158 H159 G160 P161 N165 Q166I133-D163 HydrophobicContact CD1-CB 4.17Å; A158-D163 WeakPolarHBondContact CA-OD2 3.41Å; A158-D163 PolarHBondContact N-OD2 3.1Å; H159-D163 PolarHBondContact N-OD2 2.9Å; G160-D163 PolarHBondContact N-OD2 3.35Å; G160-D163 VanDerWaalsContact N-OD2 3.09Å; G160-D163 PolarHBondContact O-N 3.48Å; G160-D163 VanDerWaalsContact O-N 3.15Å; P161-D163 VanDerWaalsContact C-N 3.26Å; P161-D163 PolarHBondContact O-N 2.92Å; D163-N165 PolarHBondContact O-N 3.21Å; D163-N165 VanDerWaalsContact O-N 3.09Å; D163-Q166 WeakPolarHBondContact O-CB 3.31Å; D163-Q166 WeakPolarHBondContact O-CG 3.41Å; D163-Q166 PolarHBondContact O-N 3.47Å
164W95.7Very high94.5Very high0 Ų046.9 Ų46.90%024%0.243CC..G310 helixtrans-62.9-12.3173.4-72107.2000113.8I133 Y136 I146 Q150 C156 P161 D162 Q166 N167 F170 V184 P185I133-W164 HydrophobicContact CG1-CH2 4.35Å; I133-W164 HydrophobicContact CG1-CZ2 4.48Å; I133-W164 HydrophobicContact CG2-CD2 4.17Å; I133-W164 HydrophobicContact CG2-CE3 3.72Å; I133-W164 HydrophobicContact CG2-CH2 4.49Å; I133-W164 HydrophobicContact CG2-CZ3 3.9Å; Y136-W164 HydrophobicContact CD1-CH2 4.07Å; Y136-W164 AromaticContact CD1-CZ3 3.88Å; Y136-W164 HydrophobicContact CD1-CZ3 3.88Å; Y136-W164 AromaticContact CD2-CH2 3.73Å; Y136-W164 HydrophobicContact CD2-CH2 3.73Å; Y136-W164 HydrophobicContact CD2-CZ3 4.23Å; Y136-W164 HydrophobicContact CE1-CH2 4.34Å; Y136-W164 HydrophobicContact CE1-CZ3 4.43Å; Y136-W164 AromaticContact CE2-CH2 3.99Å; Y136-W164 HydrophobicContact CE2-CH2 3.99Å; Y136-W164 AromaticContact CG-CH2 3.76Å; Y136-W164 HydrophobicContact CG-CH2 3.76Å; Y136-W164 AromaticContact CG-CZ3 3.77Å; Y136-W164 HydrophobicContact CG-CZ3 3.77Å; I146-W164 HydrophobicContact CG2-CH2 4.05Å; I146-W164 HydrophobicContact CG2-CZ2 4.18Å; Q150-W164 VanDerWaalsContact NE2-CZ2 3.31Å; C156-W164 PolarHBondContact SG-NE1 2.91Å; C156-W164 VanDerWaalsContact SG-NE1 3.37Å; P161-W164 WeakPolarHBondContact O-CB 3.36Å; P161-W164 VanDerWaalsContact O-CD1 3.29Å; P161-W164 PolarHBondContact O-N 3.03Å; D162-W164 PolarHBondContact O-N 3.04Å; D162-W164 VanDerWaalsContact O-N 3.16Å; W164-Q166 PolarHBondContact O-N 2.86Å; W164-N167 HydrophobicContact CE3-CB 4.19Å; W164-N167 PolarHBondContact O-N 3.13Å; W164-F170 HydrophobicContact CB-CB 4Å; W164-F170 HydrophobicContact CE3-CB 4.38Å; W164-F170 AromaticContact CE3-CD2 3.61Å; W164-F170 HydrophobicContact CE3-CD2 3.61Å; W164-F170 HydrophobicContact CE3-CE2 4.05Å; W164-F170 HydrophobicContact CE3-CG 4.01Å; W164-F170 AromaticContact CZ3-CD2 3.92Å; W164-F170 HydrophobicContact CZ3-CD2 3.92Å; W164-F170 AromaticContact CZ3-CE2 3.94Å; W164-F170 HydrophobicContact CZ3-CE2 3.94Å; W164-F170 WeakPolarHBondContact O-CB 3.45Å; W164-V184 HydrophobicContact CB-CG1 4.48Å; W164-V184 VanDerWaalsContact CD1-CG1 3.49Å; W164-V184 HydrophobicContact CG-CB 4.5Å; W164-V184 HydrophobicContact CG-CG1 4.1Å; W164-P185 HydrophobicContact CD2-CG 4.22Å; W164-P185 HydrophobicContact CE3-CG 4.14Å; W164-P185 HydrophobicContact CH2-CG 3.15Å; W164-P185 HydrophobicContact CZ2-CB 4.49Å; W164-P185 HydrophobicContact CZ2-CG 3.18Å; W164-P185 HydrophobicContact CZ3-CG 3.65Å
165N95.1Very high94.4Very high57 Ų5752.6 Ų52.631%0.30526%0.259SS..G310 helixtrans-60.7-21.9166.5-82.7-22.9000113.8D162 D163 N167 N171 C172 R207D162-N165 VanDerWaalsContact O-CB 3.3Å; D162-N165 WeakPolarHBondContact O-CB 3.34Å; D162-N165 PolarHBondContact O-N 3.22Å; D163-N165 PolarHBondContact O-N 3.21Å; D163-N165 VanDerWaalsContact O-N 3.09Å; N165-N167 VanDerWaalsContact C-N 3.28Å; N165-N171 PolarHBondContact O-ND2 3.21Å; N165-C172 WeakPolarHBondContact OD1-CB 3.49Å; N165-C172 PolarHBondContact OD1-N 2.72Å; N165-R207 PolarHBondContact ND2-NH2 3.42Å; N165-R207 PolarHBondContact OD1-NH1 3.44Å; N165-R207 PolarHBondContact OD1-NH2 3.42Å; N165-R207 VanDerWaalsContact OD1-NH2 3.13Å
166Q92.8Very high94.2Very high71 Ų7153.9 Ų53.933%0.33227%0.265SS..G310 helixtrans-75.8-19.1179.1-60.3-177.346.200112.5N130 K134 D163 W164N130-Q166 PolarHBondContact OD1-NE2 3.45Å; K134-Q166 HydrophobicContact CG-CB 4.01Å; D163-Q166 WeakPolarHBondContact O-CB 3.31Å; D163-Q166 WeakPolarHBondContact O-CG 3.41Å; D163-Q166 PolarHBondContact O-N 3.47Å; W164-Q166 PolarHBondContact O-N 2.86Å
167N94.1Very high94Very high1 Ų160.1 Ų60.11%0.00531%0.306CS..SBendtrans-88137178.1-176.3-77000111.3I133 K134 W164 N165 Y169 F170 N171I133-N167 HydrophobicContact CG2-CB 4.2Å; I133-N167 WeakPolarHBondContact O-CB 3.26Å; I133-N167 PolarHBondContact O-ND2 3.04Å; K134-N167 PolarHBondContact O-ND2 3.16Å; W164-N167 HydrophobicContact CE3-CB 4.19Å; W164-N167 PolarHBondContact O-N 3.13Å; N165-N167 VanDerWaalsContact C-N 3.28Å; N167-Y169 VanDerWaalsContact C-N 3.27Å; N167-Y169 PolarHBondContact O-N 3.17Å; N167-Y169 WeakPolarHBondContact OD1-CB 3.49Å; N167-Y169 WeakPolarHBondContact OD1-CD2 3.47Å; N167-Y169 PolarHBondContact OD1-N 2.95Å; N167-F170 HydrophobicContact CB-CB 4.46Å; N167-F170 HydrophobicContact CB-CD2 4.04Å; N167-F170 PolarHBondContact O-N 3.09Å; N167-F170 WeakPolarHBondContact OD1-CD2 3.26Å; N167-N171 VanDerWaalsContact O-CB 3.3Å; N167-N171 WeakPolarHBondContact O-CB 3.49Å; N167-N171 PolarHBondContact O-N 3.17Å
168I93.3Very high94Very high112 Ų11261.1 Ų61.157%0.57431%0.313SS*.THydrogen-bonded Turntrans-61-30.7-176.864.6177.4000113.8N176I168-N176 PolarHBondContact O-ND2 3.2Å
169Y93.6Very high93.9Very high91 Ų9169 Ų6936%0.35734%0.342SS..THydrogen-bonded Turntrans-84.6-31.9-178.3-59.9-81.3000112.8R137 N167 S178 E180 R181R137-Y169 HydrophobicContact CB-CD2 3.73Å; R137-Y169 HydrophobicContact CB-CE2 3.41Å; R137-Y169 VanDerWaalsContact CB-CE2 3.41Å; R137-Y169 HydrophobicContact CG-CD2 3.46Å; R137-Y169 VanDerWaalsContact CG-CD2 3.46Å; R137-Y169 HydrophobicContact CG-CE2 3.69Å; R137-Y169 HydrophobicContact CG-CG 4.16Å; N167-Y169 VanDerWaalsContact C-N 3.27Å; N167-Y169 PolarHBondContact O-N 3.17Å; N167-Y169 WeakPolarHBondContact OD1-CB 3.49Å; N167-Y169 WeakPolarHBondContact OD1-CD2 3.47Å; N167-Y169 PolarHBondContact OD1-N 2.95Å; Y169-S178 WeakPolarHBondContact O-CB 3.43Å; Y169-S178 PolarHBondContact O-OG 3.37Å; Y169-E180 CarbonylContact O-C 3.4Å; Y169-R181 PolarHBondContact O-N 2.97Å
170F95.6Very high93.8Very high1 Ų165.3 Ų65.30%0.00433%0.326CS..THydrogen-bonded Turntrans-98.5-10-176.1-63-83.7000113.9Y136 W164 N167 C172 E180 C182 P185Y136-F170 AromaticContact CD1-CE2 3.89Å; Y136-F170 HydrophobicContact CD1-CE2 3.89Å; Y136-F170 HydrophobicContact CE1-CE2 4.04Å; Y136-F170 HydrophobicContact CE1-CZ 4.23Å; W164-F170 HydrophobicContact CB-CB 4Å; W164-F170 HydrophobicContact CE3-CB 4.38Å; W164-F170 AromaticContact CE3-CD2 3.61Å; W164-F170 HydrophobicContact CE3-CD2 3.61Å; W164-F170 HydrophobicContact CE3-CE2 4.05Å; W164-F170 HydrophobicContact CE3-CG 4.01Å; W164-F170 AromaticContact CZ3-CD2 3.92Å; W164-F170 HydrophobicContact CZ3-CD2 3.92Å; W164-F170 AromaticContact CZ3-CE2 3.94Å; W164-F170 HydrophobicContact CZ3-CE2 3.94Å; W164-F170 WeakPolarHBondContact O-CB 3.45Å; N167-F170 HydrophobicContact CB-CB 4.46Å; N167-F170 HydrophobicContact CB-CD2 4.04Å; N167-F170 PolarHBondContact O-N 3.09Å; N167-F170 WeakPolarHBondContact OD1-CD2 3.26Å; F170-C172 PolarHBondContact O-N 2.98Å; F170-E180 HydrophobicContact CD1-CB 3.87Å; F170-E180 WeakPolarHBondContact CD1-O 3.4Å; F170-E180 HydrophobicContact CE1-CB 3.71Å; F170-E180 HydrophobicContact CE1-CG 4.38Å; F170-E180 HydrophobicContact CZ-CB 4.31Å; F170-C182 PolarHBondContact O-N 3.27Å; F170-P185 HydrophobicContact CE1-CG 4.24Å; F170-P185 HydrophobicContact CE2-CG 4.22Å; F170-P185 HydrophobicContact CZ-CB 4.34Å; F170-P185 HydrophobicContact CZ-CG 3.8Å
171N95.2Very high93.8Very high47 Ų4768.6 Ų68.625%0.25134%0.335SS..  trans-54.2128.5-179.2-176-62000112.7N165 N167 T173 N176N165-N171 PolarHBondContact O-ND2 3.21Å; N167-N171 VanDerWaalsContact O-CB 3.3Å; N167-N171 WeakPolarHBondContact O-CB 3.49Å; N167-N171 PolarHBondContact O-N 3.17Å; N171-T173 PolarHBondContact O-N 3.48Å; N171-T173 VanDerWaalsContact OD1-CB 3.23Å; N171-T173 WeakPolarHBondContact OD1-CB 3.43Å; N171-T173 PolarHBondContact OD1-N 3.12Å; N171-T173 PolarHBondContact OD1-OG1 3.11Å; N171-N176 PolarHBondContact O-ND2 2.88Å
172C93.9Very high93.8Very high35 Ų3568.3 Ų68.324%0.23633%0.333CS..  trans-75.66.4-175.1-107.10000116.4N165 F170 D174 C182N165-C172 WeakPolarHBondContact OD1-CB 3.49Å; N165-C172 PolarHBondContact OD1-N 2.72Å; F170-C172 PolarHBondContact O-N 2.98Å; C172-D174 PolarHBondContact O-N 3.47Å; C172-C182 WeakPolarHBondContact CA-SG 3.42Å; C172-C182 HydrophobicContact CB-CB 4.31Å; C172-C182 WeakPolarHBondContact CB-SG 3.39Å; C172-C182 WeakPolarHBondContact SG-CA 3.44Å; C172-C182 WeakPolarHBondContact SG-CB 3.37Å; C172-C182 CovalentContact SG-SG 2.04Å; C172-C182 PolarHBondContact SG-SG 3.45Å
173T93.5Very high93.8Very high77 Ų7764.4 Ų64.447%0.47231%0.313SS..  trans-66.2136.9-178.4-56.80000110.6N171 R175 N176N171-T173 PolarHBondContact O-N 3.48Å; N171-T173 VanDerWaalsContact OD1-CB 3.23Å; N171-T173 WeakPolarHBondContact OD1-CB 3.43Å; N171-T173 PolarHBondContact OD1-N 3.12Å; N171-T173 PolarHBondContact OD1-OG1 3.11Å; T173-R175 HydrophobicContact CG2-CB 4.25Å; T173-R175 PolarHBondContact O-N 3.33Å; T173-N176 VanDerWaalsContact O-CB 3.24Å; T173-N176 WeakPolarHBondContact O-CB 3.47Å; T173-N176 PolarHBondContact O-N 2.9Å
174D89.4Confident93.8Very high143 Ų14363.5 Ų63.577%0.76531%0.308SS*.THydrogen-bonded Turntrans-55.6-25.9-179.3-67.9-42.3000114.3C172 N176C172-D174 PolarHBondContact O-N 3.47Å; D174-N176 VanDerWaalsContact C-N 3.32Å
175R91.8Very high93.8Very high232 Ų23263.7 Ų63.788%0.87531%0.309SS*.THydrogen-bonded Turntrans-80.6-9.5178.5-61.2-177.5-178.8177.60.7113.8T173 P177T173-R175 HydrophobicContact CG2-CB 4.25Å; T173-R175 PolarHBondContact O-N 3.33Å; R175-P177 VanDerWaalsContact O-CD 3.27Å; R175-P177 WeakPolarHBondContact O-CD 3.34Å
176N92.4Very high93.6Very high26 Ų2664.5 Ų64.514%0.13931%0.31CS..  trans-72.1115.4-179.2-168.8-13.7000109.7I168 N171 T173 D174 S178 R181I168-N176 PolarHBondContact O-ND2 3.2Å; N171-N176 PolarHBondContact O-ND2 2.88Å; T173-N176 VanDerWaalsContact O-CB 3.24Å; T173-N176 WeakPolarHBondContact O-CB 3.47Å; T173-N176 PolarHBondContact O-N 2.9Å; D174-N176 VanDerWaalsContact C-N 3.32Å; N176-S178 PolarHBondContact O-N 2.83Å; N176-S178 WeakPolarHBondContact OD1-CB 3.21Å; N176-S178 PolarHBondContact OD1-N 2.78Å; N176-R181 HydrophobicContact CB-CB 4.29Å; N176-R181 WeakPolarHBondContact O-CD 3.44Å
177P93.6Very high93.7Very high132 Ų13261.1 Ų61.186%0.85729%0.294SS*.  trans-77.5-7.1-179.634-36.6000113.1R175R175-P177 VanDerWaalsContact O-CD 3.27Å; R175-P177 WeakPolarHBondContact O-CD 3.34Å
178S93.6Very high93.7Very high21 Ų2161 Ų6115%0.14729%0.294CS..  trans-60.7137.6-178.3179.20000111.9Y169 N176 E180 R181Y169-S178 WeakPolarHBondContact O-CB 3.43Å; Y169-S178 PolarHBondContact O-OG 3.37Å; N176-S178 PolarHBondContact O-N 2.83Å; N176-S178 WeakPolarHBondContact OD1-CB 3.21Å; N176-S178 PolarHBondContact OD1-N 2.78Å; S178-E180 PolarHBondContact O-N 3.28Å; S178-E180 PolarHBondContact OG-N 2.91Å; S178-R181 WeakPolarHBondContact O-CB 3.41Å; S178-R181 VanDerWaalsContact O-CG 3.31Å; S178-R181 WeakPolarHBondContact O-CG 3.33Å; S178-R181 PolarHBondContact O-N 3.01Å
179R92.3Very high93.8Very high164 Ų16455.9 Ų55.962%0.61927%0.268SS*.THydrogen-bonded Turntrans-68.5-24.5172.8-176.856.1-175.9127.3-2.4112.2R181 Y204 D205R179-R181 VanDerWaalsContact C-N 3.29Å; R179-Y204 HydrophobicContact CG-CD1 4.27Å; R179-Y204 HydrophobicContact CG-CE1 3.85Å; R179-Y204 WeakPolarHBondContact O-CD1 3.33Å; R179-D205 IonicContact CZ-OD2 3.88Å; R179-D205 IonicContact NH1-OD2 2.94Å; R179-D205 PolarHBondContact NH1-OD2 3.05Å; R179-D205 IonicContact NH2-OD2 4Å
180E93.2Very high93.6Very high35 Ų3554.3 Ų54.316%0.16427%0.267CS..THydrogen-bonded Turntrans-87.54.2179.2-53.3-170.5118.800112.8R137 Y169 F170 S178 G183 Y204R137-E180 IonicContact CZ-OE1 2.82Å; R137-E180 IonicContact CZ-OE2 2.75Å; R137-E180 IonicContact NE-OE2 2.72Å; R137-E180 PolarHBondContact NE-OE2 3.39Å; R137-E180 IonicContact NH2-OE1 2.89Å; R137-E180 PolarHBondContact NH2-OE1 3.42Å; R137-E180 IonicContact NH2-OE2 3.97Å; R137-E180 PolarHBondContact NH2-OE2 3.28Å; Y169-E180 CarbonylContact O-C 3.4Å; F170-E180 HydrophobicContact CD1-CB 3.87Å; F170-E180 WeakPolarHBondContact CD1-O 3.4Å; F170-E180 HydrophobicContact CE1-CB 3.71Å; F170-E180 HydrophobicContact CE1-CG 4.38Å; F170-E180 HydrophobicContact CZ-CB 4.31Å; S178-E180 PolarHBondContact O-N 3.28Å; S178-E180 PolarHBondContact OG-N 2.91Å; E180-G183 WeakPolarHBondContact O-CA 3.49Å; E180-G183 PolarHBondContact O-N 3.49Å; E180-Y204 HydrophobicContact CG-CE1 3.93Å
181R94.9Very high93.1Very high79 Ų7958.8 Ų58.830%0.29829%0.287SS..THydrogen-bonded Turntrans-55.1144.1177.574.9-177.4-165.8130.57.6110.5Y169 N176 S178 R179 G183Y169-R181 PolarHBondContact O-N 2.97Å; N176-R181 HydrophobicContact CB-CB 4.29Å; N176-R181 WeakPolarHBondContact O-CD 3.44Å; S178-R181 WeakPolarHBondContact O-CB 3.41Å; S178-R181 VanDerWaalsContact O-CG 3.31Å; S178-R181 WeakPolarHBondContact O-CG 3.33Å; S178-R181 PolarHBondContact O-N 3.01Å; R179-R181 VanDerWaalsContact C-N 3.29Å; R181-G183 PolarHBondContact O-N 2.91Å
182C94.8Very high92.2Very high4 Ų460.3 Ų60.33%0.02730%0.295CS..THydrogen-bonded Turntrans54.919.2-175.4-68.80000115.1F170 C172 D205 R207 L208F170-C182 PolarHBondContact O-N 3.27Å; C172-C182 WeakPolarHBondContact CA-SG 3.42Å; C172-C182 HydrophobicContact CB-CB 4.31Å; C172-C182 WeakPolarHBondContact CB-SG 3.39Å; C172-C182 WeakPolarHBondContact SG-CA 3.44Å; C172-C182 WeakPolarHBondContact SG-CB 3.37Å; C172-C182 CovalentContact SG-SG 2.04Å; C172-C182 PolarHBondContact SG-SG 3.45Å; C182-D205 CarbonylContact O-C 3.58Å; C182-R207 WeakPolarHBondContact O-CB 3.42Å; C182-R207 WeakPolarHBondContact O-CG 3.3Å; C182-R207 PolarHBondContact O-N 3.02Å; C182-L208 HydrophobicContact CB-CD1 4.24Å; C182-L208 HydrophobicContact CB-CD2 4.06Å; C182-L208 HydrophobicContact CB-CG 3.81Å; C182-L208 VanDerWaalsContact SG-CD2 3.59Å
183G95Very high91Very high1 Ų165 Ų651%0.0133%0.325CS..  trans-105.5-173.3174.200000113.3E180 R181 G203 R207E180-G183 WeakPolarHBondContact O-CA 3.49Å; E180-G183 PolarHBondContact O-N 3.49Å; R181-G183 PolarHBondContact O-N 2.91Å; G183-G203 CarbonylContact C-O 3.46Å; G183-G203 WeakPolarHBondContact CA-O 3.3Å; G183-R207 WeakPolarHBondContact O-CD 3.43Å
184V95.9Very high89.8Confident5 Ų565.5 Ų65.53%0.0334%0.337CS..  trans-136.2159.5166.5-61.20000108P161 W164 C188 G203 I206 R207 I218P161-V184 HydrophobicContact CB-CG1 4.04Å; W164-V184 HydrophobicContact CB-CG1 4.48Å; W164-V184 VanDerWaalsContact CD1-CG1 3.49Å; W164-V184 HydrophobicContact CG-CB 4.5Å; W164-V184 HydrophobicContact CG-CG1 4.1Å; V184-C188 HydrophobicContact CB-CB 4.03Å; V184-C188 HydrophobicContact CG2-CB 3.59Å; V184-G203 PolarHBondContact N-O 3.37Å; V184-G203 WeakPolarHBondContact O-CA 3.17Å; V184-I206 HydrophobicContact CG2-CG2 4.09Å; V184-R207 HydrophobicContact CG1-CG 4.31Å; V184-I218 HydrophobicContact CG2-CD1 4.29Å; V184-I218 HydrophobicContact CG2-CG2 3.88Å
185P95.1Very high88.7Confident3 Ų364.4 Ų64.42%0.01933%0.327CS..  trans-64.9161.6175.2-15.727.3000112.4Y136 W164 F170 S187 C188Y136-P185 HydrophobicContact CD1-CG 4.47Å; Y136-P185 HydrophobicContact CE1-CB 4.13Å; Y136-P185 HydrophobicContact CE1-CG 3.79Å; Y136-P185 HydrophobicContact CE2-CG 4.29Å; Y136-P185 VanDerWaalsContact OH-CB 3.3Å; Y136-P185 WeakPolarHBondContact OH-CB 3.44Å; W164-P185 HydrophobicContact CD2-CG 4.22Å; W164-P185 HydrophobicContact CE3-CG 4.14Å; W164-P185 HydrophobicContact CH2-CG 3.15Å; W164-P185 HydrophobicContact CZ2-CB 4.49Å; W164-P185 HydrophobicContact CZ2-CG 3.18Å; W164-P185 HydrophobicContact CZ3-CG 3.65Å; F170-P185 HydrophobicContact CE1-CG 4.24Å; F170-P185 HydrophobicContact CE2-CG 4.22Å; F170-P185 HydrophobicContact CZ-CB 4.34Å; F170-P185 HydrophobicContact CZ-CG 3.8Å; P185-S187 PolarHBondContact O-N 2.83Å; P185-S187 VanDerWaalsContact O-N 3.15Å; P185-C188 WeakPolarHBondContact O-CB 3.32Å; P185-C188 PolarHBondContact O-N 3.49Å
186F92.4Very high87.6Confident74 Ų7461.6 Ų61.633%0.32533%0.329SS..G310 helixtrans-61.2-24.9-178.676.1-86.5000113.1D147 C188 C189D147-F186 HydrophobicContact CB-CZ 4.48Å; F186-C188 PolarHBondContact O-N 3.44Å; F186-C189 WeakPolarHBondContact O-CB 3.03Å; F186-C189 PolarHBondContact O-N 3.3Å; F186-C189 PolarHBondContact O-SG 2.88Å
187S93.9Very high86.7Confident0 Ų067.1 Ų67.10%036%0.357CS..G310 helixtrans-64.7-20.6176.751.20000113.4D147 Q150 P185 C189D147-S187 VanDerWaalsContact CA-CB 3.41Å; D147-S187 WeakPolarHBondContact O-CB 3.44Å; D147-S187 VanDerWaalsContact OD1-CB 3.3Å; D147-S187 WeakPolarHBondContact OD1-CB 3.22Å; D147-S187 PolarHBondContact OD1-OG 3.32Å; Q150-S187 PolarHBondContact OE1-OG 3.33Å; P185-S187 PolarHBondContact O-N 2.83Å; P185-S187 VanDerWaalsContact O-N 3.15Å; S187-C189 VanDerWaalsContact C-N 3.3Å
188C95.3Very high85.7Confident0 Ų063.2 Ų63.20%033%0.329CS..G310 helixtrans-78.5-7.8170.3-68.80000113.9Q150 C156 V184 P185 F186 I218 Y219Q150-C188 PolarHBondContact OE1-SG 3.05Å; C156-C188 WeakPolarHBondContact CA-SG 3.31Å; C156-C188 HydrophobicContact CB-CB 3.68Å; C156-C188 WeakPolarHBondContact CB-SG 3.04Å; C156-C188 WeakPolarHBondContact SG-CB 3.33Å; C156-C188 CovalentContact SG-SG 2.04Å; C156-C188 PolarHBondContact SG-SG 2.93Å; V184-C188 HydrophobicContact CB-CB 4.03Å; V184-C188 HydrophobicContact CG2-CB 3.59Å; P185-C188 WeakPolarHBondContact O-CB 3.32Å; P185-C188 PolarHBondContact O-N 3.49Å; F186-C188 PolarHBondContact O-N 3.44Å; C188-I218 CarbonylContact O-C 3.54Å; C188-I218 VanDerWaalsContact O-CA 3.29Å; C188-I218 WeakPolarHBondContact O-CA 3.21Å; C188-Y219 VanDerWaalsContact O-CD2 3.28Å; C188-Y219 WeakPolarHBondContact O-CD2 3.49Å; C188-Y219 PolarHBondContact O-N 2.9Å
189C93.6Very high85.1Confident4 Ų466.5 Ų66.53%0.02735%0.345CS..BIsolated β-bridgetrans-70.8137.4-177.2-66.60000112.4F186 S187 K191 I198 N199 C202 Y219F186-C189 WeakPolarHBondContact O-CB 3.03Å; F186-C189 PolarHBondContact O-N 3.3Å; F186-C189 PolarHBondContact O-SG 2.88Å; S187-C189 VanDerWaalsContact C-N 3.3Å; C189-K191 PolarHBondContact O-N 2.96Å; C189-I198 HydrophobicContact CB-CG2 4.14Å; C189-N199 PolarHBondContact SG-O 3.39Å; C189-C202 WeakPolarHBondContact CA-SG 3.09Å; C189-C202 HydrophobicContact CB-CB 4.02Å; C189-C202 WeakPolarHBondContact CB-SG 3.37Å; C189-C202 WeakPolarHBondContact SG-CB 3.23Å; C189-C202 CovalentContact SG-SG 2Å; C189-C202 PolarHBondContact SG-SG 3.38Å; C189-Y219 VanDerWaalsContact O-CE2 3.22Å; C189-Y219 WeakPolarHBondContact O-CE2 3.42Å
190V91.2Very high84.6Confident57 Ų5763.1 Ų63.135%0.34534%0.342SS..PPolyproline II helixtrans-72.1129171.7-1800000109.1N192 S217 Y219V190-N192 PolarHBondContact O-N 3.48Å; V190-S217 PolarHBondContact N-O 3.15Å; V190-Y219 HydrophobicContact CB-CE1 4.36Å; V190-Y219 HydrophobicContact CG1-CE1 4.47Å; V190-Y219 HydrophobicContact CG2-CD1 3.88Å; V190-Y219 HydrophobicContact CG2-CE1 3.86Å; V190-Y219 HydrophobicContact CG2-CG 4.5Å
191K83.7Confident84.3Confident95 Ų9568.1 Ų68.141%0.41337%0.366SS..PPolyproline II helixtrans-78.4118.6174.3-53.3-167.9-173.8-170.40108.7E151 C189 P193 I198E151-K191 IonicContact OE2-NZ 2.7Å; E151-K191 PolarHBondContact OE2-NZ 3.19Å; C189-K191 PolarHBondContact O-N 2.96Å; K191-P193 WeakPolarHBondContact O-CD 3.3Å; K191-I198 HydrophobicContact CD-CD1 3.67Å; K191-I198 HydrophobicContact CD-CG1 4.06Å; K191-I198 HydrophobicContact CG-CD1 4.02Å; K191-I198 HydrophobicContact CG-CG1 4Å
192N75.8Confident84.1Confident80 Ų8065.2 Ų65.243%0.42836%0.357SS..PPolyproline II helixtrans-78.8119.8176.8-174.6-7.9000109.4V190 A194 E195V190-N192 PolarHBondContact O-N 3.48Å; N192-A194 PolarHBondContact O-N 2.94Å; N192-A194 VanDerWaalsContact O-N 3.08Å; N192-A194 PolarHBondContact OD1-N 3.47Å; N192-A194 VanDerWaalsContact OD1-N 3.17Å; N192-E195 HydrophobicContact CB-CB 4.39Å; N192-E195 PolarHBondContact O-N 3.36Å
193P69.2Low83.9Confident132 Ų13265.1 Ų65.186%0.85736%0.357SS*.THydrogen-bonded Turntrans-62.8-18.3-178.4-19.630.8000114.3K191K191-P193 WeakPolarHBondContact O-CD 3.3Å
194A68.3Low83.8Confident88 Ų8869.1 Ų69.173%0.72737%0.372SS*.THydrogen-bonded Turntrans-85.2-12.1178.500000113.4N192N192-A194 PolarHBondContact O-N 2.94Å; N192-A194 VanDerWaalsContact O-N 3.08Å; N192-A194 PolarHBondContact OD1-N 3.47Å; N192-A194 VanDerWaalsContact OD1-N 3.17Å
195E67.3Low83.6Confident121 Ų12171 Ų7157%0.56538%0.382SS*.  trans-127.3116.7-177.3-67.4177.8171.400109.4N192 I197N192-E195 HydrophobicContact CB-CB 4.39Å; N192-E195 PolarHBondContact O-N 3.36Å; E195-I197 PolarHBondContact O-N 3.13Å; E195-I197 VanDerWaalsContact O-N 3.09Å
196D67.8Low83.5Confident172 Ų17271.4 Ų71.492%0.9238%0.384SS*.SBendtrans-67.8-7.6179.7-77.2-30.2000113.5
197I73.7Confident83.5Confident142 Ų14269 Ų6973%0.72837%0.373SS*.SBendtrans-113121.6-175.6-53.9173.5000109.2E195 N199E195-I197 PolarHBondContact O-N 3.13Å; E195-I197 VanDerWaalsContact O-N 3.09Å; I197-N199 PolarHBondContact O-N 3.09Å
198I72.5Confident83.5Confident50 Ų5074.2 Ų74.226%0.25640%0.4SS..  trans-69.4126.9173.5-56.9169.4000108.4C189 K191 T200C189-I198 HydrophobicContact CB-CG2 4.14Å; K191-I198 HydrophobicContact CD-CD1 3.67Å; K191-I198 HydrophobicContact CD-CG1 4.06Å; K191-I198 HydrophobicContact CG-CD1 4.02Å; K191-I198 HydrophobicContact CG-CG1 4Å; I198-T200 PolarHBondContact O-N 3.08Å
199N81.2Confident83.3Confident91 Ų9179 Ų7949%0.48742%0.423SS..  trans-69.395.8170.6-178.51.8000109.7C189 I197 Q201 C202C189-N199 PolarHBondContact SG-O 3.39Å; I197-N199 PolarHBondContact O-N 3.09Å; N199-Q201 PolarHBondContact O-N 2.69Å; N199-Q201 VanDerWaalsContact O-N 3.1Å; N199-Q201 WeakPolarHBondContact OD1-CA 3.42Å; N199-Q201 WeakPolarHBondContact OD1-CB 3.36Å; N199-Q201 PolarHBondContact OD1-N 2.95Å; N199-C202 HydrophobicContact CB-CB 4.35Å; N199-C202 WeakPolarHBondContact O-CB 3.27Å; N199-C202 PolarHBondContact O-N 3.1Å; N199-C202 PolarHBondContact OD1-N 3.41Å
200T82.8Confident83.1Confident92 Ų9280.7 Ų80.756%0.56444%0.441SS*.THydrogen-bonded Turntrans-65.1-12.4178550000113.4I198I198-T200 PolarHBondContact O-N 3.08Å
201Q86.1Confident83Confident141 Ų14182.8 Ų82.866%0.65945%0.45SS*.THydrogen-bonded Turntrans-93-0.6175.1-58.7-175.2-41.100113.4N199 G203 Y204N199-Q201 PolarHBondContact O-N 2.69Å; N199-Q201 VanDerWaalsContact O-N 3.1Å; N199-Q201 WeakPolarHBondContact OD1-CA 3.42Å; N199-Q201 WeakPolarHBondContact OD1-CB 3.36Å; N199-Q201 PolarHBondContact OD1-N 2.95Å; Q201-G203 PolarHBondContact O-N 2.99Å; Q201-G203 VanDerWaalsContact O-N 3.09Å; Q201-Y204 HydrophobicContact CB-CD2 4.19Å; Q201-Y204 PolarHBondContact O-N 3.45Å
202C90.6Very high83.2Confident17 Ų1784.4 Ų84.412%0.11546%0.462CS..THydrogen-bonded Turntrans-59.6-27.9-175.9101.20000113.2C189 N199 S217C189-C202 WeakPolarHBondContact CA-SG 3.09Å; C189-C202 HydrophobicContact CB-CB 4.02Å; C189-C202 WeakPolarHBondContact CB-SG 3.37Å; C189-C202 WeakPolarHBondContact SG-CB 3.23Å; C189-C202 CovalentContact SG-SG 2Å; C189-C202 PolarHBondContact SG-SG 3.38Å; N199-C202 HydrophobicContact CB-CB 4.35Å; N199-C202 WeakPolarHBondContact O-CB 3.27Å; N199-C202 PolarHBondContact O-N 3.1Å; N199-C202 PolarHBondContact OD1-N 3.41Å; C202-S217 PolarHBondContact SG-O 3.23Å; C202-S217 VanDerWaalsContact SG-O 3.39Å
203G91.2Very high83.7Confident2 Ų284 Ų842%0.02146%0.46CS..THydrogen-bonded Turntrans-81-10.3-174.700000114.2G183 V184 Q201 I206G183-G203 CarbonylContact C-O 3.46Å; G183-G203 WeakPolarHBondContact CA-O 3.3Å; V184-G203 PolarHBondContact N-O 3.37Å; V184-G203 WeakPolarHBondContact O-CA 3.17Å; Q201-G203 PolarHBondContact O-N 2.99Å; Q201-G203 VanDerWaalsContact O-N 3.09Å; G203-I206 WeakPolarHBondContact O-CG2 3.43Å
204Y92.9Very high84.7Confident85 Ų8580.1 Ų80.133%0.33343%0.429SS..SBendtrans-76.1133.2-177.4-76.5-92.1000111.8R179 E180 Q201 I206R179-Y204 HydrophobicContact CG-CD1 4.27Å; R179-Y204 HydrophobicContact CG-CE1 3.85Å; R179-Y204 WeakPolarHBondContact O-CD1 3.33Å; E180-Y204 HydrophobicContact CG-CE1 3.93Å; Q201-Y204 HydrophobicContact CB-CD2 4.19Å; Q201-Y204 PolarHBondContact O-N 3.45Å; Y204-I206 PolarHBondContact O-N 3.4Å
205D92.2Very high85.7Confident45 Ų4581.8 Ų81.824%0.24142%0.421CS..SBendtrans55.64.8177.1-60.5-52.7000114.3R179 C182 R207 L208R179-D205 IonicContact CZ-OD2 3.88Å; R179-D205 IonicContact NH1-OD2 2.94Å; R179-D205 PolarHBondContact NH1-OD2 3.05Å; R179-D205 IonicContact NH2-OD2 4Å; C182-D205 CarbonylContact O-C 3.58Å; D205-R207 PolarHBondContact O-N 3.41Å; D205-R207 VanDerWaalsContact O-N 3.1Å; D205-L208 HydrophobicContact CB-CD1 4.25Å; D205-L208 VanDerWaalsContact O-CB 3.28Å; D205-L208 WeakPolarHBondContact O-CB 3.36Å; D205-L208 PolarHBondContact O-N 3.38Å
206I92.5Very high86.7Confident11 Ų1183.2 Ų83.26%0.05643%0.426CS..THydrogen-bonded Turntrans-65.1-23-170.4-164.753.9000112.9V184 G203 Y204 L208 E209 R214 I218V184-I206 HydrophobicContact CG2-CG2 4.09Å; G203-I206 WeakPolarHBondContact O-CG2 3.43Å; Y204-I206 PolarHBondContact O-N 3.4Å; I206-L208 VanDerWaalsContact C-N 3.27Å; I206-E209 HydrophobicContact CD1-CB 4.36Å; I206-E209 HydrophobicContact CD1-CG 4.21Å; I206-E209 WeakPolarHBondContact O-CB 3.23Å; I206-E209 PolarHBondContact O-N 2.86Å; I206-R214 HydrophobicContact CG1-CG 4.18Å; I206-R214 WeakPolarHBondContact O-CD 3.46Å; I206-R214 WeakPolarHBondContact O-CG 3.39Å; I206-I218 HydrophobicContact CG1-CD1 4.29Å; I206-I218 HydrophobicContact CG1-CG1 4.26Å; I206-I218 HydrophobicContact CG1-CG2 4.08Å; I206-I218 HydrophobicContact CG2-CD1 4.03Å; I206-I218 HydrophobicContact CG2-CG2 4.27Å
207R92.9Very high87.8Confident23 Ų2377.2 Ų77.29%0.08740%0.397CS..THydrogen-bonded Turntrans-81.9-6.7176.9-56.6174.853.6-135.5-8.7113.1P161 D162 N165 C182 G183 V184 D205P161-R207 PolarHBondContact O-NE 3.43Å; D162-R207 IonicContact OD1-CZ 3.92Å; D162-R207 IonicContact OD1-NE 3.42Å; D162-R207 PolarHBondContact OD1-NE 3.24Å; D162-R207 IonicContact OD1-NH2 3.6Å; D162-R207 PolarHBondContact OD1-NH2 2.86Å; N165-R207 PolarHBondContact ND2-NH2 3.42Å; N165-R207 PolarHBondContact OD1-NH1 3.44Å; N165-R207 PolarHBondContact OD1-NH2 3.42Å; N165-R207 VanDerWaalsContact OD1-NH2 3.13Å; C182-R207 WeakPolarHBondContact O-CB 3.42Å; C182-R207 WeakPolarHBondContact O-CG 3.3Å; C182-R207 PolarHBondContact O-N 3.02Å; G183-R207 WeakPolarHBondContact O-CD 3.43Å; V184-R207 HydrophobicContact CG1-CG 4.31Å; D205-R207 PolarHBondContact O-N 3.41Å; D205-R207 VanDerWaalsContact O-N 3.1Å
208L92.3Very high88.8Confident110 Ų11070.5 Ų70.558%0.57636%0.363SS*.THydrogen-bonded Turntrans-85.2-19.6167.7-58.9174.7000112C182 D205 I206C182-L208 HydrophobicContact CB-CD1 4.24Å; C182-L208 HydrophobicContact CB-CD2 4.06Å; C182-L208 HydrophobicContact CB-CG 3.81Å; C182-L208 VanDerWaalsContact SG-CD2 3.59Å; D205-L208 HydrophobicContact CB-CD1 4.25Å; D205-L208 VanDerWaalsContact O-CB 3.28Å; D205-L208 WeakPolarHBondContact O-CB 3.36Å; D205-L208 PolarHBondContact O-N 3.38Å; I206-L208 VanDerWaalsContact C-N 3.27Å
209E91.2Very high89.8Confident101 Ų10169.5 Ų69.547%0.47236%0.356SS..SBendtrans-76.9159.7-179.6-63.3-69.9176.300112.5I206 D213 R214I206-E209 HydrophobicContact CD1-CB 4.36Å; I206-E209 HydrophobicContact CD1-CG 4.21Å; I206-E209 WeakPolarHBondContact O-CB 3.23Å; I206-E209 PolarHBondContact O-N 2.86Å; E209-D213 HydrophobicContact CB-CB 4.3Å; E209-R214 PolarHBondContact O-NE 3.35Å; E209-R214 VanDerWaalsContact O-NE 3.08Å
210G90.8Very high90.5Very high39 Ų3968 Ų6840%0.40235%0.35SS..  trans-61.5156.7176.200000113.1L212 D213 R214G210-L212 PolarHBondContact O-N 3.32Å; G210-L212 VanDerWaalsContact O-N 3.16Å; G210-D213 PolarHBondContact O-N 2.87Å; G210-D213 VanDerWaalsContact O-N 3.08Å; G210-R214 PolarHBondContact O-N 2.85Å
211D88.2Confident91.1Very high102 Ų10269.2 Ų69.255%0.54535%0.348SS..Hα-helixtrans-56.3-35.7-177.4-68.8-28.8000113.1D213 R214 Q215D211-D213 VanDerWaalsContact C-N 3.35Å; D211-R214 IonicContact OD1-CZ 3.32Å; D211-R214 IonicContact OD1-NE 2.79Å; D211-R214 IonicContact OD1-NH1 3.03Å; D211-R214 IonicContact OD1-NH2 2.74Å; D211-R214 PolarHBondContact OD1-NH2 2.86Å; D211-Q215 WeakPolarHBondContact O-CG 3.36Å; D211-Q215 PolarHBondContact O-N 2.93Å
212L88Confident91.6Very high128 Ų12862.8 Ų62.867%0.6732%0.319SS*.Hα-helixtrans-66.6-35.5180-68.5174.4000112.7G210 K216G210-L212 PolarHBondContact O-N 3.32Å; G210-L212 VanDerWaalsContact O-N 3.16Å; L212-K216 WeakPolarHBondContact O-CG 3.45Å
213D86.9Confident91.8Very high72 Ų7262 Ų6239%0.38531%0.314SS..Hα-helixtrans-82-35.5-179.6-61.6-45.3000110.6E209 G210 D211 Q215 K216 S217E209-D213 HydrophobicContact CB-CB 4.3Å; G210-D213 PolarHBondContact O-N 2.87Å; G210-D213 VanDerWaalsContact O-N 3.08Å; D211-D213 VanDerWaalsContact C-N 3.35Å; D213-Q215 PolarHBondContact O-N 2.95Å; D213-K216 PolarHBondContact O-N 2.97Å; D213-K216 IonicContact OD1-NZ 3.8Å; D213-S217 PolarHBondContact O-N 2.92Å; D213-S217 PolarHBondContact O-OG 2.99Å
214R89.5Confident91.9Very high50 Ų5062.1 Ų62.119%0.18931%0.314CS..Hα-helixtrans-55.6-49168.6-83.5-170.1-93.4151.95.7112.4I206 E209 G210 D211 K216 S217 I218I206-R214 HydrophobicContact CG1-CG 4.18Å; I206-R214 WeakPolarHBondContact O-CD 3.46Å; I206-R214 WeakPolarHBondContact O-CG 3.39Å; E209-R214 PolarHBondContact O-NE 3.35Å; E209-R214 VanDerWaalsContact O-NE 3.08Å; G210-R214 PolarHBondContact O-N 2.85Å; D211-R214 IonicContact OD1-CZ 3.32Å; D211-R214 IonicContact OD1-NE 2.79Å; D211-R214 IonicContact OD1-NH1 3.03Å; D211-R214 IonicContact OD1-NH2 2.74Å; D211-R214 PolarHBondContact OD1-NH2 2.86Å; R214-K216 PolarHBondContact O-N 3.09Å; R214-S217 PolarHBondContact O-N 3.36Å; R214-I218 HydrophobicContact CB-CG1 4.39Å; R214-I218 HydrophobicContact CG-CD1 4.43Å; R214-I218 WeakPolarHBondContact O-CG1 3.41Å; R214-I218 PolarHBondContact O-N 3.16Å
215Q88.6Confident92Very high124 Ų12460 Ų6058%0.57932%0.318SS*.Hα-helixtrans-63.9-23.9-178.1-76179.213.400114.1D211 D213 T220D211-Q215 WeakPolarHBondContact O-CG 3.36Å; D211-Q215 PolarHBondContact O-N 2.93Å; D213-Q215 PolarHBondContact O-N 2.95Å; Q215-T220 HydrophobicContact CG-CG2 3.95Å
216K88.6Confident92.1Very high151 Ų15159.4 Ų59.466%0.65731%0.314SS*.Hα-helixtrans-82.8-35.1177.5-69171-170.4163.80112.5L212 D213 R214L212-K216 WeakPolarHBondContact O-CG 3.45Å; D213-K216 PolarHBondContact O-N 2.97Å; D213-K216 IonicContact OD1-NZ 3.8Å; R214-K216 PolarHBondContact O-N 3.09Å
217S90.4Very high92.1Very high46 Ų4661.8 Ų61.832%0.32232%0.324SS..Hα-helixtrans-97.2-31.3-171.4-60.90000114V190 C202 D213 R214V190-S217 PolarHBondContact N-O 3.15Å; C202-S217 PolarHBondContact SG-O 3.23Å; C202-S217 VanDerWaalsContact SG-O 3.39Å; D213-S217 PolarHBondContact O-N 2.92Å; D213-S217 PolarHBondContact O-OG 2.99Å; R214-S217 PolarHBondContact O-N 3.36Å
218I94.7Very high92Very high1 Ų164.1 Ų64.11%0.00534%0.336CS..BIsolated β-bridgetrans-131.5154.9-175.761.1163.6000113.1P161 V184 C188 I206 R214 T220P161-I218 HydrophobicContact CB-CD1 4Å; P161-I218 HydrophobicContact CG-CD1 3.85Å; V184-I218 HydrophobicContact CG2-CD1 4.29Å; V184-I218 HydrophobicContact CG2-CG2 3.88Å; C188-I218 CarbonylContact O-C 3.54Å; C188-I218 VanDerWaalsContact O-CA 3.29Å; C188-I218 WeakPolarHBondContact O-CA 3.21Å; I206-I218 HydrophobicContact CG1-CD1 4.29Å; I206-I218 HydrophobicContact CG1-CG1 4.26Å; I206-I218 HydrophobicContact CG1-CG2 4.08Å; I206-I218 HydrophobicContact CG2-CD1 4.03Å; I206-I218 HydrophobicContact CG2-CG2 4.27Å; R214-I218 HydrophobicContact CB-CG1 4.39Å; R214-I218 HydrophobicContact CG-CD1 4.43Å; R214-I218 WeakPolarHBondContact O-CG1 3.41Å; R214-I218 PolarHBondContact O-N 3.16Å; I218-T220 HydrophobicContact CG1-CG2 4.5Å; I218-T220 PolarHBondContact O-N 2.03Å
219Y95.3Very high92.1Very high29 Ų2963.8 Ų63.811%0.11433%0.33CS..  trans-67.3124.7167.1-56.7-56.4000109.8M154 C156 C188 C189 V190M154-Y219 HydrophobicContact CB-CD1 3.8Å; M154-Y219 HydrophobicContact CB-CD2 4.47Å; M154-Y219 HydrophobicContact CB-CE1 3.57Å; M154-Y219 HydrophobicContact CB-CE2 4.29Å; M154-Y219 HydrophobicContact CB-CG 4.26Å; M154-Y219 HydrophobicContact CG-CE1 3.95Å; C156-Y219 WeakPolarHBondContact CB-O 3.47Å; C188-Y219 VanDerWaalsContact O-CD2 3.28Å; C188-Y219 WeakPolarHBondContact O-CD2 3.49Å; C188-Y219 PolarHBondContact O-N 2.9Å; C189-Y219 VanDerWaalsContact O-CE2 3.22Å; C189-Y219 WeakPolarHBondContact O-CE2 3.42Å; V190-Y219 HydrophobicContact CB-CE1 4.36Å; V190-Y219 HydrophobicContact CG1-CE1 4.47Å; V190-Y219 HydrophobicContact CG2-CD1 3.88Å; V190-Y219 HydrophobicContact CG2-CE1 3.86Å; V190-Y219 HydrophobicContact CG2-CG 4.5Å
220T94.6Very high92.2Very high59 Ų5963.8 Ų63.836%0.36233%0.325SS..  trans-100.7-9-177.953.40000113.7P161 Q215 I218P161-T220 WeakPolarHBondContact CD-O 3.42Å; Q215-T220 HydrophobicContact CG-CG2 3.95Å; I218-T220 HydrophobicContact CG1-CG2 4.5Å; I218-T220 PolarHBondContact O-N 2.03Å
221K95.8Very high92.3Very high117 Ų11764.9 Ų64.951%0.50932%0.322SS..SBendtrans-85137.4179-66.1176.6177.2175.20110.5C155 C156 Q226C155-K221 CarbonylContact C-O 3.54Å; C155-K221 WeakPolarHBondContact CA-O 3.32Å; C155-K221 WeakPolarHBondContact CB-O 3.2Å; C156-K221 PolarHBondContact N-O 2.62Å; K221-Q226 HydrophobicContact CB-CG 3.95Å; K221-Q226 HydrophobicContact CD-CG 4.48Å; K221-Q226 VanDerWaalsContact CD-NE2 3.26Å
222G95.7Very high92.4Very high6 Ų666 Ų666%0.06232%0.324CS..  trans-68.9146.5171.700000113.8A158 H159 V224 G225 Q226A158-G222 CarbonylContact O-C 3.47Å; A158-G222 VanDerWaalsContact O-C 3.24Å; A158-G222 WeakPolarHBondContact O-CA 3.41Å; H159-G222 WeakPolarHBondContact O-CA 3.13Å; H159-G222 PolarHBondContact O-N 2.88Å; G222-V224 VanDerWaalsContact C-N 3.32Å; G222-V224 PolarHBondContact O-N 2.99Å; G222-G225 PolarHBondContact O-N 3.18Å; G222-Q226 WeakPolarHBondContact O-CG 3.01Å; G222-Q226 PolarHBondContact O-N 3.41Å; G222-Q226 VanDerWaalsContact O-N 3.1Å
223C95.4Very high92.8Very high2 Ų265.2 Ų65.21%0.01432%0.32CS..Hα-helixtrans-66.8-30.2-179.3-62.40000113.3I129 W153 C155 G157 A158 Q226 F227I129-C223 HydrophobicContact CD1-CB 4.14Å; W153-C223 HydrophobicContact CE3-CB 4.45Å; C155-C223 HydrophobicContact CB-CB 3.89Å; C155-C223 WeakPolarHBondContact CB-SG 3.24Å; C155-C223 WeakPolarHBondContact SG-CA 3Å; C155-C223 WeakPolarHBondContact SG-CB 3.5Å; C155-C223 CovalentContact SG-SG 2.03Å; C155-C223 PolarHBondContact SG-SG 2.79Å; G157-C223 WeakPolarHBondContact O-CB 3.49Å; G157-C223 PolarHBondContact O-N 3.47Å; G157-C223 PolarHBondContact O-SG 2.93Å; A158-C223 PolarHBondContact O-N 3.4Å; A158-C223 VanDerWaalsContact O-N 3.08Å; C223-Q226 PolarHBondContact O-N 3.22Å; C223-F227 WeakPolarHBondContact O-CB 3.02Å; C223-F227 PolarHBondContact O-N 2.88Å
224V93.8Very high93.1Very high3 Ų364.3 Ų64.32%0.01832%0.316CS..Hα-helixtrans-68.8-42.5177.2175.70000111.4K122 L125 N126 I129 A158 G222 Q226 F227 E228K122-V224 HydrophobicContact CD-CG1 4.47Å; K122-V224 HydrophobicContact CG-CG1 3.7Å; L125-V224 HydrophobicContact CD2-CG1 4.23Å; L125-V224 HydrophobicContact CD2-CG2 4.11Å; L125-V224 HydrophobicContact CG-CG2 3.93Å; N126-V224 WeakPolarHBondContact OD1-CB 3.19Å; N126-V224 WeakPolarHBondContact OD1-CG1 3.3Å; N126-V224 WeakPolarHBondContact OD1-CG2 3.35Å; I129-V224 HydrophobicContact CD1-CG2 3.61Å; A158-V224 HydrophobicContact CB-CG2 4.3Å; A158-V224 WeakPolarHBondContact O-CB 2.94Å; A158-V224 PolarHBondContact O-N 2.77Å; G222-V224 VanDerWaalsContact C-N 3.32Å; G222-V224 PolarHBondContact O-N 2.99Å; V224-Q226 VanDerWaalsContact C-N 3.34Å; V224-F227 PolarHBondContact O-N 3.33Å; V224-E228 PolarHBondContact O-N 3.24Å
225G94.4Very high93.3Very high40 Ų4067 Ų6741%0.41233%0.333SS..Hα-helixtrans-65.9-37.617500000112.4G222 E228 K229G222-G225 PolarHBondContact O-N 3.18Å; G225-E228 PolarHBondContact O-N 3.21Å; G225-K229 WeakPolarHBondContact O-CB 3.4Å; G225-K229 PolarHBondContact O-N 2.73Å
226Q94.9Very high93.6Very high34 Ų3468.3 Ų68.316%0.15934%0.342CS..Hα-helixtrans-68.3-38.8176.3-70.5-82.947.400112.2W153 M154 C155 K221 G222 C223 V224 K229 W230W153-Q226 HydrophobicContact CB-CB 4.4Å; W153-Q226 PolarHBondContact O-NE2 2.96Å; M154-Q226 PolarHBondContact O-NE2 3.01Å; C155-Q226 HydrophobicContact CB-CB 4.31Å; C155-Q226 HydrophobicContact CB-CG 3.95Å; K221-Q226 HydrophobicContact CB-CG 3.95Å; K221-Q226 HydrophobicContact CD-CG 4.48Å; K221-Q226 VanDerWaalsContact CD-NE2 3.26Å; G222-Q226 WeakPolarHBondContact O-CG 3.01Å; G222-Q226 PolarHBondContact O-N 3.41Å; G222-Q226 VanDerWaalsContact O-N 3.1Å; C223-Q226 PolarHBondContact O-N 3.22Å; V224-Q226 VanDerWaalsContact C-N 3.34Å; Q226-K229 PolarHBondContact O-N 2.87Å; Q226-W230 WeakPolarHBondContact O-CB 3.19Å; Q226-W230 PolarHBondContact O-N 2.96Å
227F91.9Very high93.9Very high61 Ų6165.3 Ų65.327%0.26834%0.336SS..Hα-helixtrans-60.4-47.7172.2-179.9-120.2000112.1L125 W153 C223 V224 K229 W230 L231L125-F227 HydrophobicContact CD2-CB 4.39Å; L125-F227 HydrophobicContact CD2-CD1 3.46Å; L125-F227 VanDerWaalsContact CD2-CD1 3.46Å; L125-F227 HydrophobicContact CD2-CE1 4.03Å; L125-F227 HydrophobicContact CD2-CG 4.15Å; W153-F227 HydrophobicContact CE3-CB 4.02Å; W153-F227 HydrophobicContact CH2-CB 3.73Å; W153-F227 AromaticContact CH2-CD2 3.06Å; W153-F227 HydrophobicContact CH2-CD2 3.06Å; W153-F227 AromaticContact CH2-CE2 3.83Å; W153-F227 HydrophobicContact CH2-CE2 3.83Å; W153-F227 AromaticContact CH2-CG 3.62Å; W153-F227 HydrophobicContact CH2-CG 3.62Å; W153-F227 AromaticContact CZ2-CD2 3.46Å; W153-F227 HydrophobicContact CZ2-CD2 3.46Å; W153-F227 VanDerWaalsContact CZ2-CD2 3.46Å; W153-F227 HydrophobicContact CZ2-CE2 4.1Å; W153-F227 HydrophobicContact CZ2-CG 4.37Å; W153-F227 HydrophobicContact CZ3-CB 3.43Å; W153-F227 VanDerWaalsContact CZ3-CB 3.43Å; W153-F227 AromaticContact CZ3-CD2 3.77Å; W153-F227 HydrophobicContact CZ3-CD2 3.77Å; W153-F227 AromaticContact CZ3-CG 3.86Å; W153-F227 HydrophobicContact CZ3-CG 3.86Å; C223-F227 WeakPolarHBondContact O-CB 3.02Å; C223-F227 PolarHBondContact O-N 2.88Å; V224-F227 PolarHBondContact O-N 3.33Å; F227-K229 VanDerWaalsContact C-N 3.3Å; F227-K229 PolarHBondContact O-N 3.28Å; F227-W230 HydrophobicContact CD2-CE3 4.41Å; F227-W230 HydrophobicContact CE2-CE3 4.27Å; F227-W230 HydrophobicContact CE2-CZ3 4.43Å; F227-W230 PolarHBondContact O-N 3.42Å; F227-L231 WeakPolarHBondContact O-CB 3.31Å; F227-L231 PolarHBondContact O-N 2.81Å
228E92.1Very high94.1Very high72 Ų7264.7 Ų64.734%0.33633%0.331SS..Hα-helixtrans-59.1-45.2178.3-177.1179.3175.700110.8K122 V224 G225 L231 Q232K122-E228 IonicContact NZ-OE2 2.73Å; K122-E228 PolarHBondContact NZ-OE2 3.31Å; V224-E228 PolarHBondContact O-N 3.24Å; G225-E228 PolarHBondContact O-N 3.21Å; E228-L231 PolarHBondContact O-N 2.64Å; E228-Q232 WeakPolarHBondContact O-CG 3.26Å; E228-Q232 PolarHBondContact O-N 3.03Å; E228-Q232 PolarHBondContact OE1-NE2 2.87Å
229K93.9Very high94Very high102 Ų10267 Ų6744%0.44335%0.35SS..Hα-helixtrans-61.4-47.7175.9-175.1-179.4176.9-174.50111.7G225 Q226 F227 L231 Q232 D233G225-K229 WeakPolarHBondContact O-CB 3.4Å; G225-K229 PolarHBondContact O-N 2.73Å; Q226-K229 PolarHBondContact O-N 2.87Å; F227-K229 VanDerWaalsContact C-N 3.3Å; F227-K229 PolarHBondContact O-N 3.28Å; K229-L231 VanDerWaalsContact C-N 3.27Å; K229-L231 PolarHBondContact O-N 3.38Å; K229-Q232 PolarHBondContact O-N 3.13Å; K229-D233 WeakPolarHBondContact CE-OD2 3.39Å; K229-D233 WeakPolarHBondContact O-CB 3.01Å; K229-D233 VanDerWaalsContact O-CG 3.29Å; K229-D233 PolarHBondContact O-N 3.46Å
230W93.1Very high94Very high101 Ų10167.7 Ų67.738%0.38337%0.366SS..Hα-helixtrans-57.9-42.5177.2176.389.8000111.5Q226 F227 D233 N234 V238Q226-W230 WeakPolarHBondContact O-CB 3.19Å; Q226-W230 PolarHBondContact O-N 2.96Å; F227-W230 HydrophobicContact CD2-CE3 4.41Å; F227-W230 HydrophobicContact CE2-CE3 4.27Å; F227-W230 HydrophobicContact CE2-CZ3 4.43Å; F227-W230 PolarHBondContact O-N 3.42Å; W230-D233 PolarHBondContact O-N 2.82Å; W230-N234 HydrophobicContact CZ2-CB 4.37Å; W230-N234 PolarHBondContact NE1-ND2 3.04Å; W230-N234 WeakPolarHBondContact O-CB 3.46Å; W230-N234 PolarHBondContact O-N 3.5Å; W230-N234 PolarHBondContact O-ND2 3.05Å; W230-V238 HydrophobicContact CH2-CG2 4.3Å; W230-V238 HydrophobicContact CZ3-CG2 4.4Å
231L91.6Very high94Very high63 Ų6369.9 Ų69.933%0.3337%0.374SS..Hα-helixtrans-64.5-41.3178.3-177.364.2000111.6F227 E228 K229 N234 L235 V238F227-L231 WeakPolarHBondContact O-CB 3.31Å; F227-L231 PolarHBondContact O-N 2.81Å; E228-L231 PolarHBondContact O-N 2.64Å; K229-L231 VanDerWaalsContact C-N 3.27Å; K229-L231 PolarHBondContact O-N 3.38Å; L231-N234 CarbonylContact O-C 3.59Å; L231-N234 PolarHBondContact O-N 3.35Å; L231-L235 VanDerWaalsContact O-CA 3.31Å; L231-L235 WeakPolarHBondContact O-CA 3.38Å; L231-L235 WeakPolarHBondContact O-CB 3.46Å; L231-L235 PolarHBondContact O-N 3.48Å; L231-V238 HydrophobicContact CD1-CG1 4.35Å; L231-V238 HydrophobicContact CD1-CG2 4.07Å
232Q92.1Very high93.9Very high124 Ų12469 Ų6958%0.57937%0.371SS*.Hα-helixtrans-64.7-45.3175.6-72.1175.54.900111.6E228 K229 N234 L235E228-Q232 WeakPolarHBondContact O-CG 3.26Å; E228-Q232 PolarHBondContact O-N 3.03Å; E228-Q232 PolarHBondContact OE1-NE2 2.87Å; K229-Q232 PolarHBondContact O-N 3.13Å; Q232-N234 VanDerWaalsContact C-N 3.27Å; Q232-N234 PolarHBondContact O-N 2.74Å; Q232-L235 PolarHBondContact O-N 3.03Å
233D95Very high93.9Very high113 Ų11372.8 Ų72.860%0.60439%0.393SS*.Hα-helixtrans-66.3-30.5179.9-69.9-18.5000111.9K229 W230K229-D233 WeakPolarHBondContact CE-OD2 3.39Å; K229-D233 WeakPolarHBondContact O-CB 3.01Å; K229-D233 VanDerWaalsContact O-CG 3.29Å; K229-D233 PolarHBondContact O-N 3.46Å; W230-D233 PolarHBondContact O-N 2.82Å
234N94.8Very high94Very high53 Ų5374.5 Ų74.528%0.28341%0.411SS..THydrogen-bonded Turntrans-10915.5-177-64.7-84.4000113.8W230 L231 Q232 I236 V237 V238W230-N234 HydrophobicContact CZ2-CB 4.37Å; W230-N234 PolarHBondContact NE1-ND2 3.04Å; W230-N234 WeakPolarHBondContact O-CB 3.46Å; W230-N234 PolarHBondContact O-N 3.5Å; W230-N234 PolarHBondContact O-ND2 3.05Å; L231-N234 CarbonylContact O-C 3.59Å; L231-N234 PolarHBondContact O-N 3.35Å; Q232-N234 VanDerWaalsContact C-N 3.27Å; Q232-N234 PolarHBondContact O-N 2.74Å; N234-I236 PolarHBondContact O-N 3.34Å; N234-I236 VanDerWaalsContact O-N 3.13Å; N234-V237 WeakPolarHBondContact O-CB 3.48Å; N234-V237 PolarHBondContact O-N 3.18Å; N234-V238 PolarHBondContact O-N 3.45Å
235L92.8Very high94Very high105 Ų10576.9 Ų76.955%0.5543%0.425SS..Hα-helixtrans-56.5-37.2-173.3-174.366.4000112.6L231 Q232 V238 A239L231-L235 VanDerWaalsContact O-CA 3.31Å; L231-L235 WeakPolarHBondContact O-CA 3.38Å; L231-L235 WeakPolarHBondContact O-CB 3.46Å; L231-L235 PolarHBondContact O-N 3.48Å; Q232-L235 PolarHBondContact O-N 3.03Å; L235-V238 PolarHBondContact O-N 2.85Å; L235-A239 VanDerWaalsContact O-CB 3.22Å; L235-A239 WeakPolarHBondContact O-CB 3.09Å; L235-A239 PolarHBondContact O-N 3.05Å
236I95.1Very high94.1Very high152 Ų15276 Ų7678%0.77941%0.414SS*.Hα-helixtrans-63.4-42.9178.2-61173.2000110.9N234 G240N234-I236 PolarHBondContact O-N 3.34Å; N234-I236 VanDerWaalsContact O-N 3.13Å; I236-G240 PolarHBondContact O-N 3Å
237V95.5Very high94.1Very high88 Ų8879.5 Ų79.553%0.53343%0.433SS..Hα-helixtrans-66.6-47.1179.3177.80000109.9N234 G240 I241N234-V237 WeakPolarHBondContact O-CB 3.48Å; N234-V237 PolarHBondContact O-N 3.18Å; V237-G240 PolarHBondContact O-N 3.49Å; V237-G240 VanDerWaalsContact O-N 3.17Å; V237-I241 HydrophobicContact CG1-CD1 4.24Å; V237-I241 WeakPolarHBondContact O-CG1 3.37Å; V237-I241 PolarHBondContact O-N 3.04Å
238V93.3Very high94.3Very high33 Ų3379.6 Ų79.620%0.244%0.436CS..Hα-helixtrans-60.8-48.5178.6175.80000110.8W230 L231 N234 L235 G240 I241 F242W230-V238 HydrophobicContact CH2-CG2 4.3Å; W230-V238 HydrophobicContact CZ3-CG2 4.4Å; L231-V238 HydrophobicContact CD1-CG1 4.35Å; L231-V238 HydrophobicContact CD1-CG2 4.07Å; N234-V238 PolarHBondContact O-N 3.45Å; L235-V238 PolarHBondContact O-N 2.85Å; V238-G240 VanDerWaalsContact C-N 3.28Å; V238-G240 PolarHBondContact O-N 2.87Å; V238-I241 PolarHBondContact O-N 3.2Å; V238-I241 VanDerWaalsContact O-N 3.16Å; V238-F242 HydrophobicContact CG1-CD2 4.05Å; V238-F242 HydrophobicContact CG1-CE2 4.04Å; V238-F242 WeakPolarHBondContact O-CD2 3.31Å; V238-F242 PolarHBondContact O-N 3.33Å; V238-F242 VanDerWaalsContact O-N 3.1Å
239A92.7Very high94.4Very high49 Ų4977.1 Ų77.141%0.40543%0.425SS..Hα-helixtrans-60.2-39.3175.500000111.9L235 I241 F242 V243L235-A239 VanDerWaalsContact O-CB 3.22Å; L235-A239 WeakPolarHBondContact O-CB 3.09Å; L235-A239 PolarHBondContact O-N 3.05Å; A239-I241 VanDerWaalsContact C-N 3.35Å; A239-I241 PolarHBondContact O-N 2.99Å; A239-F242 PolarHBondContact O-N 2.9Å; A239-V243 WeakPolarHBondContact O-CG2 3.33Å; A239-V243 PolarHBondContact O-N 3.03Å
240G95.8Very high94.5Very high44 Ų4475.8 Ų75.845%0.45442%0.422SS..Hα-helixtrans-60.5-40.5174.800000113.1I236 V237 V238 G244I236-G240 PolarHBondContact O-N 3Å; V237-G240 PolarHBondContact O-N 3.49Å; V237-G240 VanDerWaalsContact O-N 3.17Å; V238-G240 VanDerWaalsContact C-N 3.28Å; V238-G240 PolarHBondContact O-N 2.87Å; G240-G244 PolarHBondContact O-N 3.37Å
241I94.9Very high94.6Very high105 Ų10575.4 Ų75.454%0.53842%0.423SS..Hα-helixtrans-64.7-45.8175.6-67.5166.6000110.9V237 V238 A239 G244 T245V237-I241 HydrophobicContact CG1-CD1 4.24Å; V237-I241 WeakPolarHBondContact O-CG1 3.37Å; V237-I241 PolarHBondContact O-N 3.04Å; V238-I241 PolarHBondContact O-N 3.2Å; V238-I241 VanDerWaalsContact O-N 3.16Å; A239-I241 VanDerWaalsContact C-N 3.35Å; A239-I241 PolarHBondContact O-N 2.99Å; I241-G244 PolarHBondContact O-N 2.04Å; I241-T245 WeakPolarHBondContact O-CB 3.36Å; I241-T245 PolarHBondContact O-N 2.04Å; I241-T245 PolarHBondContact O-OG1 3.17Å
242F93.5Very high94.7Very high99 Ų9972.4 Ų72.443%0.43441%0.407SS..Hα-helixtrans-61-49.6176.6-89.7-80.1000111.8E107 V238 A239 G244 T245 A246E107-F242 HydrophobicContact CG-CD1 3.94Å; E107-F242 HydrophobicContact CG-CE1 4.02Å; V238-F242 HydrophobicContact CG1-CD2 4.05Å; V238-F242 HydrophobicContact CG1-CE2 4.04Å; V238-F242 WeakPolarHBondContact O-CD2 3.31Å; V238-F242 PolarHBondContact O-N 3.33Å; V238-F242 VanDerWaalsContact O-N 3.1Å; A239-F242 PolarHBondContact O-N 2.9Å; F242-G244 VanDerWaalsContact C-N 3.35Å; F242-G244 PolarHBondContact O-N 3Å; F242-T245 PolarHBondContact O-N 3Å; F242-A246 WeakPolarHBondContact O-CB 3.3Å; F242-A246 PolarHBondContact O-N 3.26Å
243V95.4Very high94.9Very high86 Ų8668.4 Ų68.452%0.52139%0.39SS..Hα-helixtrans-64-41.4178.7173.30000111.2A239 A246 L247A239-V243 WeakPolarHBondContact O-CG2 3.33Å; A239-V243 PolarHBondContact O-N 3.03Å; V243-A246 PolarHBondContact O-N 3.05Å; V243-L247 HydrophobicContact CG1-CD1 4.04Å; V243-L247 HydrophobicContact CG1-CG 4.34Å; V243-L247 WeakPolarHBondContact O-CB 3.46Å; V243-L247 VanDerWaalsContact O-CG 3.3Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 3.49Å
244G96.4Very high94.9Very high38 Ų3866 Ų6639%0.39238%0.381SS..Hα-helixtrans-60.9-44.9176.500000112.2G240 I241 F242 L247 L248G240-G244 PolarHBondContact O-N 3.37Å; I241-G244 PolarHBondContact O-N 2.04Å; F242-G244 VanDerWaalsContact C-N 3.35Å; F242-G244 PolarHBondContact O-N 3Å; G244-L247 PolarHBondContact O-N 3.34Å; G244-L248 WeakPolarHBondContact O-CB 3.19Å; G244-L248 PolarHBondContact O-N 3.04Å
245T94.8Very high94.8Very high53 Ų5364.4 Ų64.433%0.32537%0.372SS..Hα-helixtrans-62.9-46.1177-55.90000111.4E107 I241 F242 L247 L248 Q249E107-T245 WeakPolarHBondContact OE1-CB 3.27Å; E107-T245 WeakPolarHBondContact OE2-CG2 3.06Å; I241-T245 WeakPolarHBondContact O-CB 3.36Å; I241-T245 PolarHBondContact O-N 2.04Å; I241-T245 PolarHBondContact O-OG1 3.17Å; F242-T245 PolarHBondContact O-N 3Å; T245-L247 PolarHBondContact O-N 2.92Å; T245-L248 WeakPolarHBondContact O-CB 3.17Å; T245-L248 PolarHBondContact O-N 2.85Å; T245-Q249 WeakPolarHBondContact O-CG 3.41Å; T245-Q249 PolarHBondContact O-N 3.38Å
246A95.8Very high94.9Very high22 Ų2259.4 Ų59.418%0.18235%0.346CS..Hα-helixtrans-57.8-47.317500000112.8F104 F242 V243 L248 Q249 I250F104-A246 HydrophobicContact CD2-CB 4.23Å; F104-A246 HydrophobicContact CE2-CB 3.88Å; F242-A246 WeakPolarHBondContact O-CB 3.3Å; F242-A246 PolarHBondContact O-N 3.26Å; V243-A246 PolarHBondContact O-N 3.05Å; A246-L248 VanDerWaalsContact C-N 3.31Å; A246-L248 PolarHBondContact O-N 3.01Å; A246-Q249 PolarHBondContact O-N 2.97Å; A246-I250 WeakPolarHBondContact O-CG1 3.46Å; A246-I250 PolarHBondContact O-N 3.3Å
247L96.1Very high94.8Very high107 Ų10756 Ų5656%0.5633%0.327SS*.Hα-helixtrans-63.2-38.7177.1-72.2175.6000111.9V243 G244 T245 I250 F251V243-L247 HydrophobicContact CG1-CD1 4.04Å; V243-L247 HydrophobicContact CG1-CG 4.34Å; V243-L247 WeakPolarHBondContact O-CB 3.46Å; V243-L247 VanDerWaalsContact O-CG 3.3Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 3.49Å; G244-L247 PolarHBondContact O-N 3.34Å; T245-L247 PolarHBondContact O-N 2.92Å; L247-I250 PolarHBondContact O-N 2.71Å; L247-F251 VanDerWaalsContact O-CB 3.26Å; L247-F251 WeakPolarHBondContact O-CB 3.45Å; L247-F251 PolarHBondContact O-N 3.48Å
248L94.6Very high94.7Very high63 Ų6356.1 Ų56.133%0.3332%0.324SS..Hα-helixtrans-63.5-42.3177.9-162.566.8000112F24 F28 G244 T245 A246 F251 G252F24-L248 HydrophobicContact CE2-CD1 3.5Å; F24-L248 HydrophobicContact CE2-CD2 3.9Å; F24-L248 HydrophobicContact CE2-CG 3.84Å; F24-L248 HydrophobicContact CZ-CD1 3.65Å; F24-L248 HydrophobicContact CZ-CD2 3.57Å; F24-L248 HydrophobicContact CZ-CG 3.45Å; F24-L248 VanDerWaalsContact CZ-CG 3.45Å; F28-L248 HydrophobicContact CE2-CD2 4.37Å; F28-L248 HydrophobicContact CZ-CD2 3.68Å; G244-L248 WeakPolarHBondContact O-CB 3.19Å; G244-L248 PolarHBondContact O-N 3.04Å; T245-L248 WeakPolarHBondContact O-CB 3.17Å; T245-L248 PolarHBondContact O-N 2.85Å; A246-L248 VanDerWaalsContact C-N 3.31Å; A246-L248 PolarHBondContact O-N 3.01Å; L248-F251 PolarHBondContact O-N 2.94Å; L248-G252 PolarHBondContact O-N 3.08Å
249Q95.8Very high94.5Very high19 Ų1954.5 Ų54.59%0.08932%0.315CS..Hα-helixtrans-63.6-48.6175-70.1166-3.800111.4F104 E107 T245 A246 F251 G252 I253F104-Q249 VanDerWaalsContact CB-OE1 3.24Å; E107-Q249 PolarHBondContact OE2-NE2 3.41Å; E107-Q249 PolarHBondContact OE2-OE1 3.31Å; T245-Q249 WeakPolarHBondContact O-CG 3.41Å; T245-Q249 PolarHBondContact O-N 3.38Å; A246-Q249 PolarHBondContact O-N 2.97Å; Q249-F251 VanDerWaalsContact C-N 3.28Å; Q249-F251 PolarHBondContact O-N 2.7Å; Q249-G252 PolarHBondContact O-N 2.92Å; Q249-I253 VanDerWaalsContact O-CG1 3.29Å; Q249-I253 WeakPolarHBondContact O-CG1 3.33Å; Q249-I253 PolarHBondContact O-N 3.39Å
250I96.1Very high94.6Very high74 Ų7452.3 Ų52.338%0.37930%0.296SS..Hα-helixtrans-57.2-45.6177.2-68.1166.5000110.1F104 A246 L247 I253 C254F104-I250 HydrophobicContact CD2-CG1 4.39Å; F104-I250 HydrophobicContact CE2-CD1 3.88Å; F104-I250 HydrophobicContact CE2-CG1 4.08Å; F104-I250 HydrophobicContact CZ-CD1 4.22Å; A246-I250 WeakPolarHBondContact O-CG1 3.46Å; A246-I250 PolarHBondContact O-N 3.3Å; L247-I250 PolarHBondContact O-N 2.71Å; I250-I253 PolarHBondContact O-N 2.65Å; I250-C254 WeakPolarHBondContact O-CB 3.32Å; I250-C254 PolarHBondContact O-N 3.15Å; I250-C254 PolarHBondContact O-SG 3.17Å
251F94.6Very high94.3Very high93 Ų9353.7 Ų53.741%0.40830%0.299SS..Hα-helixtrans-61.9-45.3178.4-177.9-120.8000112.1F20 L247 L248 Q249 I253 C254 L255F20-F251 HydrophobicContact CD1-CE1 4.45Å; F20-F251 AromaticContact CE1-CE1 3.44Å; F20-F251 HydrophobicContact CE1-CE1 3.44Å; F20-F251 VanDerWaalsContact CE1-CE1 3.44Å; F20-F251 AromaticContact CE1-CZ 3.79Å; F20-F251 HydrophobicContact CE1-CZ 3.79Å; F20-F251 AromaticContact CZ-CE1 3.92Å; F20-F251 HydrophobicContact CZ-CE1 3.92Å; F20-F251 HydrophobicContact CZ-CZ 4.25Å; L247-F251 VanDerWaalsContact O-CB 3.26Å; L247-F251 WeakPolarHBondContact O-CB 3.45Å; L247-F251 PolarHBondContact O-N 3.48Å; L248-F251 PolarHBondContact O-N 2.94Å; Q249-F251 VanDerWaalsContact C-N 3.28Å; Q249-F251 PolarHBondContact O-N 2.7Å; F251-I253 VanDerWaalsContact C-N 3.34Å; F251-I253 PolarHBondContact O-N 2.84Å; F251-C254 PolarHBondContact O-N 2.95Å; F251-L255 HydrophobicContact CD1-CD1 4.08Å; F251-L255 HydrophobicContact CD2-CG 4.43Å; F251-L255 HydrophobicContact CE1-CD1 3.69Å; F251-L255 HydrophobicContact CE2-CD1 4.16Å; F251-L255 HydrophobicContact CE2-CD2 4.22Å; F251-L255 HydrophobicContact CE2-CG 4.15Å; F251-L255 HydrophobicContact CZ-CD1 3.71Å; F251-L255 HydrophobicContact CZ-CD2 4.32Å; F251-L255 HydrophobicContact CZ-CG 4.2Å; F251-L255 WeakPolarHBondContact O-CG 2.86Å; F251-L255 PolarHBondContact O-N 2.64Å
252G94.2Very high94Very high1 Ų150.9 Ų50.91%0.0129%0.285CS..Hα-helixtrans-59.5-41.3174.500000113.2L248 Q249 A256L248-G252 PolarHBondContact O-N 3.08Å; Q249-G252 PolarHBondContact O-N 2.92Å; G252-A256 WeakPolarHBondContact O-CB 3.34Å; G252-A256 PolarHBondContact O-N 3.21Å
253I96Very high93.8Very high40 Ų4046.3 Ų46.321%0.20527%0.265CS..Hα-helixtrans-62.9-49.3175.3-67.1163.4000110.4L100 Q249 I250 F251 L255 A256 Q257L100-I253 HydrophobicContact CB-CD1 4.04Å; L100-I253 HydrophobicContact CB-CG1 3.79Å; L100-I253 HydrophobicContact CD1-CG1 4.26Å; Q249-I253 VanDerWaalsContact O-CG1 3.29Å; Q249-I253 WeakPolarHBondContact O-CG1 3.33Å; Q249-I253 PolarHBondContact O-N 3.39Å; I250-I253 PolarHBondContact O-N 2.65Å; F251-I253 VanDerWaalsContact C-N 3.34Å; F251-I253 PolarHBondContact O-N 2.84Å; I253-L255 PolarHBondContact O-N 3.05Å; I253-A256 PolarHBondContact O-N 3.1Å; I253-Q257 HydrophobicContact CG2-CG 4.19Å; I253-Q257 WeakPolarHBondContact O-CB 3.29Å; I253-Q257 WeakPolarHBondContact O-CG 3.44Å; I253-Q257 PolarHBondContact O-N 2.8Å
254C94.8Very high93.5Very high61 Ų6147.3 Ų47.341%0.41226%0.263SS..Hα-helixtrans-57.3-47.1178.8-73.20000111.9I250 F251 A256 Q257 N258I250-C254 WeakPolarHBondContact O-CB 3.32Å; I250-C254 PolarHBondContact O-N 3.15Å; I250-C254 PolarHBondContact O-SG 3.17Å; F251-C254 PolarHBondContact O-N 2.95Å; C254-A256 PolarHBondContact O-N 3.09Å; C254-Q257 PolarHBondContact O-N 3.26Å; C254-N258 WeakPolarHBondContact O-CB 3.28Å; C254-N258 PolarHBondContact O-N 3.16Å; C254-N258 PolarHBondContact O-ND2 3.49Å
255L93.5Very high93.1Very high20 Ų2047.4 Ų47.411%0.10526%0.259CS..Hα-helixtrans-62.3-44177.8-68.9178000112.1V17 F20 L21 F251 I253 N258 L259V17-L255 HydrophobicContact CG1-CD2 4.09Å; F20-L255 HydrophobicContact CD1-CD1 3.74Å; F20-L255 HydrophobicContact CE1-CD1 3.91Å; L21-L255 HydrophobicContact CD1-CB 4.01Å; L21-L255 HydrophobicContact CD1-CD1 4.37Å; F251-L255 HydrophobicContact CD1-CD1 4.08Å; F251-L255 HydrophobicContact CD2-CG 4.43Å; F251-L255 HydrophobicContact CE1-CD1 3.69Å; F251-L255 HydrophobicContact CE2-CD1 4.16Å; F251-L255 HydrophobicContact CE2-CD2 4.22Å; F251-L255 HydrophobicContact CE2-CG 4.15Å; F251-L255 HydrophobicContact CZ-CD1 3.71Å; F251-L255 HydrophobicContact CZ-CD2 4.32Å; F251-L255 HydrophobicContact CZ-CG 4.2Å; F251-L255 WeakPolarHBondContact O-CG 2.86Å; F251-L255 PolarHBondContact O-N 2.64Å; I253-L255 PolarHBondContact O-N 3.05Å; L255-N258 PolarHBondContact O-N 3.03Å; L255-L259 WeakPolarHBondContact O-CB 3.22Å; L255-L259 PolarHBondContact O-N 2.89Å
256A94Very high92.7Very high0 Ų046.4 Ų46.40%025%0.253CS..Hα-helixtrans-65.8-41.5178.400000112.3L21 L93 F96 S97 G252 I253 C254 L259 V260L21-A256 HydrophobicContact CD2-CB 4.42Å; L93-A256 HydrophobicContact CD2-CB 4.42Å; F96-A256 HydrophobicContact CD1-CB 3.82Å; F96-A256 HydrophobicContact CE1-CB 4.04Å; S97-A256 WeakPolarHBondContact OG-CB 3.42Å; G252-A256 WeakPolarHBondContact O-CB 3.34Å; G252-A256 PolarHBondContact O-N 3.21Å; I253-A256 PolarHBondContact O-N 3.1Å; C254-A256 PolarHBondContact O-N 3.09Å; A256-L259 PolarHBondContact O-N 3.05Å; A256-V260 VanDerWaalsContact O-CG2 3.26Å; A256-V260 WeakPolarHBondContact O-CG2 3.1Å; A256-V260 PolarHBondContact O-N 3.33Å
257Q93.6Very high92.1Very high82 Ų8251.6 Ų51.638%0.38327%0.272SS..Hα-helixtrans-67.4-40.2176.7-68.2-57.4-49.400112.2S97 I253 C254 L259 V260 S261S97-Q257 PolarHBondContact OG-NE2 2.79Å; I253-Q257 HydrophobicContact CG2-CG 4.19Å; I253-Q257 WeakPolarHBondContact O-CB 3.29Å; I253-Q257 WeakPolarHBondContact O-CG 3.44Å; I253-Q257 PolarHBondContact O-N 2.8Å; C254-Q257 PolarHBondContact O-N 3.26Å; Q257-L259 VanDerWaalsContact C-N 3.35Å; Q257-V260 PolarHBondContact O-N 2Å; Q257-S261 WeakPolarHBondContact O-CB 3.39Å; Q257-S261 PolarHBondContact O-N 3.42Å
258N91.9Very high91.5Very high89 Ų8950.3 Ų50.348%0.47628%0.276SS..Hα-helixtrans-59.2-47.9173.5-72.8-17.1000110.5C254 L255 V260 S261 D262C254-N258 WeakPolarHBondContact O-CB 3.28Å; C254-N258 PolarHBondContact O-N 3.16Å; C254-N258 PolarHBondContact O-ND2 3.49Å; L255-N258 PolarHBondContact O-N 3.03Å; N258-V260 VanDerWaalsContact C-N 3.33Å; N258-V260 PolarHBondContact O-N 3.08Å; N258-S261 WeakPolarHBondContact O-CB 3.1Å; N258-S261 PolarHBondContact O-N 3.46Å; N258-S261 VanDerWaalsContact O-N 3.11Å; N258-D262 PolarHBondContact O-N 3.25Å
259L90.9Very high90.6Very high0 Ų052.6 Ų52.60%029%0.289CS..Hα-helixtrans-62.5-39177.6-173.559.2000112.3V13 L21 A85 L93 L255 A256 Q257 S261 D262 V263V13-L259 HydrophobicContact CG1-CD1 3.36Å; L21-L259 HydrophobicContact CD2-CD2 3.92Å; A85-L259 HydrophobicContact CB-CD2 4.05Å; L93-L259 HydrophobicContact CD1-CB 4.26Å; L93-L259 HydrophobicContact CD1-CD2 3.74Å; L93-L259 HydrophobicContact CD1-CG 3.81Å; L93-L259 HydrophobicContact CD2-CD2 4.15Å; L255-L259 WeakPolarHBondContact O-CB 3.22Å; L255-L259 PolarHBondContact O-N 2.89Å; A256-L259 PolarHBondContact O-N 3.05Å; Q257-L259 VanDerWaalsContact C-N 3.35Å; L259-S261 VanDerWaalsContact C-N 3.34Å; L259-D262 PolarHBondContact O-N 3.26Å; L259-V263 VanDerWaalsContact O-CG2 3.24Å; L259-V263 WeakPolarHBondContact O-CG2 3.34Å; L259-V263 PolarHBondContact O-N 2.94Å
260V93.1Very high89Confident2 Ų264.7 Ų64.71%0.01233%0.334CS..Hα-helixtrans-63.2-40.5173.6168.70000111.6T90 L93 A256 Q257 N258 K264T90-V260 HydrophobicContact CG2-CG1 4.32Å; L93-V260 HydrophobicContact CB-CG2 3.44Å; L93-V260 VanDerWaalsContact CB-CG2 3.44Å; L93-V260 HydrophobicContact CD1-CG2 3.89Å; L93-V260 HydrophobicContact CG-CG2 4.32Å; A256-V260 VanDerWaalsContact O-CG2 3.26Å; A256-V260 WeakPolarHBondContact O-CG2 3.1Å; A256-V260 PolarHBondContact O-N 3.33Å; Q257-V260 PolarHBondContact O-N 2Å; N258-V260 VanDerWaalsContact C-N 3.33Å; N258-V260 PolarHBondContact O-N 3.08Å; V260-K264 HydrophobicContact CG1-CD 4.17Å; V260-K264 WeakPolarHBondContact O-CB 3.46Å; V260-K264 WeakPolarHBondContact O-CG 3.06Å; V260-K264 PolarHBondContact O-N 2.96Å; V260-K264 VanDerWaalsContact O-N 3.1Å
261S90.9Very high88.6Confident74 Ų7464.2 Ų64.252%0.51733%0.332SS..Hα-helixtrans-64.3-46.3177.1-172.10000111.2Q257 N258 L259 V263 K264 A265Q257-S261 WeakPolarHBondContact O-CB 3.39Å; Q257-S261 PolarHBondContact O-N 3.42Å; N258-S261 WeakPolarHBondContact O-CB 3.1Å; N258-S261 PolarHBondContact O-N 3.46Å; N258-S261 VanDerWaalsContact O-N 3.11Å; L259-S261 VanDerWaalsContact C-N 3.34Å; S261-V263 PolarHBondContact O-N 3.45Å; S261-K264 PolarHBondContact O-N 3.21Å; S261-A265 WeakPolarHBondContact O-CB 3.28Å; S261-A265 PolarHBondContact O-N 3.03Å
262D88.8Confident88.3Confident45 Ų4562.7 Ų62.724%0.24133%0.328CS..Hα-helixtrans-59.9-48.5178-71.4-4.4000111.3V13 S14 N258 L259 K264 A265 V266V13-D262 HydrophobicContact CG2-CB 4.38Å; S14-D262 PolarHBondContact N-OD2 3.22Å; N258-D262 PolarHBondContact O-N 3.25Å; L259-D262 PolarHBondContact O-N 3.26Å; D262-K264 VanDerWaalsContact C-N 3.3Å; D262-K264 PolarHBondContact O-N 3.45Å; D262-A265 PolarHBondContact O-N 3.1Å; D262-A265 VanDerWaalsContact O-N 3.17Å; D262-V266 VanDerWaalsContact O-CG2 3.25Å; D262-V266 WeakPolarHBondContact O-CG2 3.35Å; D262-V266 PolarHBondContact O-N 3.41Å
263V88.7Confident88Confident4 Ų466.1 Ų66.12%0.02435%0.345CS..Hα-helixtrans-61.4-39.3178.8172.40000111.6V13 E88 T90 L259 S261 K267V13-V263 HydrophobicContact CG2-CG2 4.14Å; E88-V263 HydrophobicContact CB-CG1 4.44Å; E88-V263 HydrophobicContact CB-CG2 3.76Å; E88-V263 HydrophobicContact CG-CG2 4.01Å; T90-V263 HydrophobicContact CG2-CB 4Å; T90-V263 HydrophobicContact CG2-CG1 3.63Å; L259-V263 VanDerWaalsContact O-CG2 3.24Å; L259-V263 WeakPolarHBondContact O-CG2 3.34Å; L259-V263 PolarHBondContact O-N 2.94Å; S261-V263 PolarHBondContact O-N 3.45Å; V263-K267 HydrophobicContact CG1-CD 4.39Å; V263-K267 WeakPolarHBondContact O-CG 2.9Å; V263-K267 PolarHBondContact O-N 3.39Å
264K89.6Confident87.5Confident107 Ų10767.6 Ų67.647%0.46535%0.354SS..Hα-helixtrans-67.7-41.5175.5-76.8172.61761790112.1V260 S261 D262 V266 K267 A268V260-K264 HydrophobicContact CG1-CD 4.17Å; V260-K264 WeakPolarHBondContact O-CB 3.46Å; V260-K264 WeakPolarHBondContact O-CG 3.06Å; V260-K264 PolarHBondContact O-N 2.96Å; V260-K264 VanDerWaalsContact O-N 3.1Å; S261-K264 PolarHBondContact O-N 3.21Å; D262-K264 VanDerWaalsContact C-N 3.3Å; D262-K264 PolarHBondContact O-N 3.45Å; K264-V266 VanDerWaalsContact C-N 3.34Å; K264-K267 PolarHBondContact O-N 3.45Å; K264-A268 WeakPolarHBondContact O-CB 3.4Å; K264-A268 PolarHBondContact O-N 2.92Å
265A87.6Confident87Confident39 Ų3968.1 Ų68.132%0.32235%0.35SS..Hα-helixtrans-64.9-4017900000111.4A11 S261 D262 A268 N269A11-A265 HydrophobicContact CB-CB 3.61Å; S261-A265 WeakPolarHBondContact O-CB 3.28Å; S261-A265 PolarHBondContact O-N 3.03Å; D262-A265 PolarHBondContact O-N 3.1Å; D262-A265 VanDerWaalsContact O-N 3.17Å; A265-A268 PolarHBondContact O-N 2.95Å; A265-N269 PolarHBondContact O-N 3.08Å; A265-N269 PolarHBondContact O-ND2 3.06Å; A265-N269 VanDerWaalsContact O-ND2 3.14Å
266V85.6Confident86.6Confident33 Ų3371.3 Ų71.320%0.237%0.366CS..Hα-helixtrans-58.4-55.6170.7175.10000109.2A11 V13 D262 K264 A268 N269A11-V266 HydrophobicContact CB-CG2 4.37Å; A11-V266 WeakPolarHBondContact O-CG2 3.34Å; V13-V266 HydrophobicContact CG2-CG2 4Å; D262-V266 VanDerWaalsContact O-CG2 3.25Å; D262-V266 WeakPolarHBondContact O-CG2 3.35Å; D262-V266 PolarHBondContact O-N 3.41Å; K264-V266 VanDerWaalsContact C-N 3.34Å; V266-A268 PolarHBondContact O-N 3.17Å; V266-N269 WeakPolarHBondContact O-CB 3.45Å; V266-N269 PolarHBondContact O-N 3.09Å
267K84.2Confident86.1Confident130 Ų13076.4 Ų76.457%0.56539%0.393SS*.Hα-helixtrans-59.1-29.7-178.8-75.3-179.2-177.9-176.40114.5V263 K264 N269V263-K267 HydrophobicContact CG1-CD 4.39Å; V263-K267 WeakPolarHBondContact O-CG 2.9Å; V263-K267 PolarHBondContact O-N 3.39Å; K264-K267 PolarHBondContact O-N 3.45Å; K267-N269 VanDerWaalsContact C-N 3.29Å
268A82.9Confident85.5Confident80 Ų8075.9 Ų75.966%0.66139%0.393SS*.Hα-helixtrans-76.7-16.8177.900000113.4K264 A265 V266K264-A268 WeakPolarHBondContact O-CB 3.4Å; K264-A268 PolarHBondContact O-N 2.92Å; A265-A268 PolarHBondContact O-N 2.95Å; V266-A268 PolarHBondContact O-N 3.17Å
269N76.4Confident85Confident112 Ų11274.8 Ų74.860%0.59939%0.386SS*.THydrogen-bonded Turntrans-91.9-2.9177.1-68.1-29000113.4A11 A265 V266 K267A11-N269 WeakPolarHBondContact CB-ND2 3.41Å; A265-N269 PolarHBondContact O-N 3.08Å; A265-N269 PolarHBondContact O-ND2 3.06Å; A265-N269 VanDerWaalsContact O-ND2 3.14Å; V266-N269 WeakPolarHBondContact O-CB 3.45Å; V266-N269 PolarHBondContact O-N 3.09Å; K267-N269 VanDerWaalsContact C-N 3.29Å
270W61.2Low84.4Confident272 Ų27281.6 Ų81.6100%1.0342%0.422SS*.  trans-105.60172.9-67.894.2000109.9

Retrieved 270 of 270 residues in 543.2 ms (Link to these results)

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