A0A087XYQ5_POEFO Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A087XYQ5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 253 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
1R41.8Very low48.3Very low279 Ų279153.2 Ų153.2100%1.05370%0.702SS**  058.10-155.7179-157167.15.6109.1E3R1-E3 VanDerWaalsContact C-N 3.26Å; R1-E3 PolarHBondContact O-N 2.86Å
2M39.7Very low50.5Low184 Ų184149.3 Ų149.391%0.90670%0.704SS**  trans-98.858.5173.1-68-176.1-163.600107.2T4M2-T4 PolarHBondContact O-N 3.34Å
3E43.1Very low52.8Low160 Ų160140.9 Ų140.975%0.74868%0.681SS**  trans-77.756.2167.1-68.5175.6143.100107.8R1 Q5R1-E3 VanDerWaalsContact C-N 3.26Å; R1-E3 PolarHBondContact O-N 2.86Å; E3-Q5 VanDerWaalsContact C-N 3.3Å; E3-Q5 PolarHBondContact O-N 3.47Å
4T43.8Very low54.7Low126 Ų126131.9 Ų131.977%0.77364%0.639SS**  trans-73.799.7164.3-41.50000104.7M2 R6M2-T4 PolarHBondContact O-N 3.34Å; T4-R6 PolarHBondContact O-N 3Å
5Q42.6Very low56.7Low145 Ų145127.7 Ų127.768%0.67862%0.62SS**  trans-48.798.5173.8-64.6-157.3-17.400110.2E3 K7E3-Q5 VanDerWaalsContact C-N 3.3Å; E3-Q5 PolarHBondContact O-N 3.47Å; Q5-K7 HydrophobicContact CB-CG 4.48Å; Q5-K7 PolarHBondContact O-N 2.96Å
6R43.4Very low58.5Low177 Ų177123.9 Ų123.967%0.66861%0.609SS**  trans-68.773.1148.6-162.2175.1-172.1169.16.9104.9T4 K8 D251 Y253T4-R6 PolarHBondContact O-N 3Å; R6-K8 VanDerWaalsContact C-N 3.29Å; R6-K8 PolarHBondContact O-N 3.2Å; R6-D251 PolarHBondContact NH1-O 3.37Å; R6-D251 PolarHBondContact NH2-O 3.08Å; R6-Y253 PolarHBondContact NH2-OXT 3.46Å
7K43.6Very low60.1Low158 Ų158118.5 Ų118.569%0.68758%0.583SS**  trans-50.3106.4160-98179.9176.8176.40103.7Q5 K9Q5-K7 HydrophobicContact CB-CG 4.48Å; Q5-K7 PolarHBondContact O-N 2.96Å; K7-K9 PolarHBondContact O-N 2.97Å
8K51.5Low61.6Low120 Ų120113.2 Ų113.252%0.52256%0.556SS.*  trans-48.996.3162.2-90.9180175.11750105.3R6 N10 E86R6-K8 VanDerWaalsContact C-N 3.29Å; R6-K8 PolarHBondContact O-N 3.2Å; K8-N10 PolarHBondContact O-N 2.85Å; K8-E86 IonicContact NZ-OE2 2.63Å; K8-E86 PolarHBondContact NZ-OE2 2.81Å
9K48.6Very low63Low189 Ų189116.2 Ų116.282%0.82256%0.562SS**  trans-74.471.6168.6-95.6-173.9174.3-179.80104.7K7 T11K7-K9 PolarHBondContact O-N 2.97Å; K9-T11 PolarHBondContact O-N 2.73Å
10N59.8Low64.3Low46 Ų46114.5 Ų114.525%0.24656%0.555CS.*  trans-60.9109.4167-67.1-24.4000105.1K8 I15K8-N10 PolarHBondContact O-N 2.85Å; N10-I15 HydrophobicContact CB-CD1 3.89Å; N10-I15 HydrophobicContact CB-CG1 3.54Å
11T73.6Confident65.5Low101 Ų101109 Ų10962%0.6253%0.529SS*.  trans-53.3145.4172.1-470000108.3K9 G13 T14 I15K9-T11 PolarHBondContact O-N 2.73Å; T11-G13 PolarHBondContact O-N 2.97Å; T11-T14 PolarHBondContact O-N 2.86Å; T11-I15 PolarHBondContact O-N 2.82Å
12C74.6Confident67.9Low107 Ų10799 Ų9972%0.72349%0.493SS*.Hα-helixtrans-48.5-35.5178.1-173.40000112I15 C16C12-I15 PolarHBondContact O-N 2.8Å; C12-C16 WeakPolarHBondContact O-CB 3.26Å; C12-C16 PolarHBondContact O-N 3.03Å
13G79.9Confident70.3Confident40 Ų4095.3 Ų95.341%0.41248%0.477SS..Hα-helixtrans-62.2-43.7173.800000114.4T11 I15 C16 L17T11-G13 PolarHBondContact O-N 2.97Å; G13-I15 VanDerWaalsContact C-N 3.33Å; G13-I15 PolarHBondContact O-N 3.45Å; G13-C16 PolarHBondContact O-N 3.32Å; G13-L17 WeakPolarHBondContact O-CB 3.37Å; G13-L17 VanDerWaalsContact O-CG 3.26Å; G13-L17 WeakPolarHBondContact O-CG 3.38Å; G13-L17 PolarHBondContact O-N 3.33Å
14T80.3Confident72.6Confident14 Ų1489.6 Ų89.69%0.08645%0.449CS..Hα-helixtrans-67.1-36.2178.5-49.80000111.7T11 K18 L244 N247T11-T14 PolarHBondContact O-N 2.86Å; T14-K18 VanDerWaalsContact O-CG 3.3Å; T14-K18 WeakPolarHBondContact O-CG 3.49Å; T14-K18 PolarHBondContact O-N 3.41Å; T14-K18 VanDerWaalsContact O-N 3.09Å; T14-L244 HydrophobicContact CG2-CD1 4.03Å; T14-N247 HydrophobicContact CG2-CB 4.4Å
15I83.6Confident74.9Confident70 Ų7083.6 Ų83.636%0.35941%0.413SS..Hα-helixtrans-65.3-49.1174.4-59.9178.3000109.8N10 T11 C12 G13 L17 K18 Y19N10-I15 HydrophobicContact CB-CD1 3.89Å; N10-I15 HydrophobicContact CB-CG1 3.54Å; T11-I15 PolarHBondContact O-N 2.82Å; C12-I15 PolarHBondContact O-N 2.8Å; G13-I15 VanDerWaalsContact C-N 3.33Å; G13-I15 PolarHBondContact O-N 3.45Å; I15-L17 PolarHBondContact O-N 3.2Å; I15-K18 PolarHBondContact O-N 3.46Å; I15-Y19 HydrophobicContact CG2-CD2 3.75Å; I15-Y19 HydrophobicContact CG2-CE2 3.47Å; I15-Y19 VanDerWaalsContact CG2-CE2 3.47Å; I15-Y19 WeakPolarHBondContact O-CD2 3.4Å; I15-Y19 PolarHBondContact O-N 3.3Å; I15-Y19 VanDerWaalsContact O-N 3.11Å
16C86.2Confident77.3Confident66 Ų6679.1 Ų79.145%0.44639%0.393SS..Hα-helixtrans-58.6-47.3177.2-176.60000112C12 G13 K18 Y19 L20C12-C16 WeakPolarHBondContact O-CB 3.26Å; C12-C16 PolarHBondContact O-N 3.03Å; G13-C16 PolarHBondContact O-N 3.32Å; C16-K18 VanDerWaalsContact C-N 3.31Å; C16-K18 PolarHBondContact O-N 3.03Å; C16-Y19 PolarHBondContact O-N 3.31Å; C16-L20 WeakPolarHBondContact O-CG 3.32Å; C16-L20 PolarHBondContact O-N 3.2Å
17L85.8Confident79.6Confident32 Ų3274 Ų7417%0.16838%0.384CS..Hα-helixtrans-57.8-40.9176.7-76.2169.5000112.4G13 I15 L21 F240 C243G13-L17 WeakPolarHBondContact O-CB 3.37Å; G13-L17 VanDerWaalsContact O-CG 3.26Å; G13-L17 WeakPolarHBondContact O-CG 3.38Å; G13-L17 PolarHBondContact O-N 3.33Å; I15-L17 PolarHBondContact O-N 3.2Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 WeakPolarHBondContact O-CG 3.32Å; L17-L21 PolarHBondContact O-N 3.33Å; L17-F240 HydrophobicContact CD2-CB 4.38Å; L17-F240 HydrophobicContact CD2-CD1 3.6Å; L17-F240 HydrophobicContact CD2-CE1 4Å; L17-F240 HydrophobicContact CD2-CG 4Å; L17-C243 HydrophobicContact CD1-CB 4.25Å
18K87.1Confident81.9Confident23 Ų2368.3 Ų68.310%0.136%0.359CS..Hα-helixtrans-62.9-47.1176.3-76.8173.8179.4177.30111.8T14 I15 C16 L21 F22 T83 E86 L244T14-K18 VanDerWaalsContact O-CG 3.3Å; T14-K18 WeakPolarHBondContact O-CG 3.49Å; T14-K18 PolarHBondContact O-N 3.41Å; T14-K18 VanDerWaalsContact O-N 3.09Å; I15-K18 PolarHBondContact O-N 3.46Å; C16-K18 VanDerWaalsContact C-N 3.31Å; C16-K18 PolarHBondContact O-N 3.03Å; K18-L21 PolarHBondContact O-N 3.28Å; K18-F22 VanDerWaalsContact O-CB 3.24Å; K18-F22 WeakPolarHBondContact O-CB 3.19Å; K18-F22 PolarHBondContact O-N 3.21Å; K18-T83 HydrophobicContact CB-CG2 4.23Å; K18-T83 HydrophobicContact CG-CG2 4.38Å; K18-T83 WeakPolarHBondContact O-CG2 3.37Å; K18-E86 IonicContact NZ-OE1 2.64Å; K18-E86 PolarHBondContact NZ-OE1 2.89Å; K18-E86 IonicContact NZ-OE2 3.62Å; K18-L244 HydrophobicContact CD-CD1 4.38Å; K18-L244 HydrophobicContact CG-CD1 3.81Å; K18-L244 HydrophobicContact CG-CD2 4.17Å
19Y88.8Confident84Confident171 Ų17167.5 Ų67.567%0.67135%0.353SS*.Hα-helixtrans-65.2-40.8178.8-77.2-68.6000112.3I15 C16 F22 L23I15-Y19 HydrophobicContact CG2-CD2 3.75Å; I15-Y19 HydrophobicContact CG2-CE2 3.47Å; I15-Y19 VanDerWaalsContact CG2-CE2 3.47Å; I15-Y19 WeakPolarHBondContact O-CD2 3.4Å; I15-Y19 PolarHBondContact O-N 3.3Å; I15-Y19 VanDerWaalsContact O-N 3.11Å; C16-Y19 PolarHBondContact O-N 3.31Å; Y19-F22 PolarHBondContact O-N 3.34Å; Y19-L23 VanDerWaalsContact O-CB 3.31Å; Y19-L23 WeakPolarHBondContact O-CB 3.45Å; Y19-L23 PolarHBondContact O-N 3.4Å
20L88.7Confident86.2Confident81 Ų8163.4 Ų63.442%0.42434%0.339SS..Hα-helixtrans-63-47.7175.9-71.1173.7000111.7C16 F22 L23 F24C16-L20 WeakPolarHBondContact O-CG 3.32Å; C16-L20 PolarHBondContact O-N 3.2Å; L20-F22 PolarHBondContact O-N 2.9Å; L20-L23 PolarHBondContact O-N 3.01Å; L20-F24 WeakPolarHBondContact O-CB 3.49Å; L20-F24 PolarHBondContact O-N 3.2Å
21L89.3Confident87.8Confident0 Ų063.8 Ų63.80%035%0.349CS..Hα-helixtrans-62.4-41.1176-84.1170.8000112.3L17 K18 N25 T83 F240 L244L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 WeakPolarHBondContact O-CG 3.32Å; L17-L21 PolarHBondContact O-N 3.33Å; K18-L21 PolarHBondContact O-N 3.28Å; L21-N25 WeakPolarHBondContact O-CB 3.45Å; L21-N25 PolarHBondContact O-N 3.47Å; L21-N25 PolarHBondContact O-ND2 2.93Å; L21-T83 HydrophobicContact CB-CG2 4.28Å; L21-F240 HydrophobicContact CD1-CB 3.88Å; L21-F240 HydrophobicContact CD2-CB 3.59Å; L21-F240 HydrophobicContact CD2-CD2 4.38Å; L21-F240 HydrophobicContact CG-CB 3.69Å; L21-F240 HydrophobicContact CG-CD2 4.46Å; L21-L244 HydrophobicContact CD1-CB 4.24Å; L21-L244 HydrophobicContact CD1-CD2 3.83Å
22F91.6Very high88.9Confident69 Ų6959 Ų5930%0.30332%0.32SS..Hα-helixtrans-65.1-48.8178.6-178.4-103.8000111.3K18 Y19 L20 F24 N25 I26 C80 T83 L84K18-F22 VanDerWaalsContact O-CB 3.24Å; K18-F22 WeakPolarHBondContact O-CB 3.19Å; K18-F22 PolarHBondContact O-N 3.21Å; Y19-F22 PolarHBondContact O-N 3.34Å; L20-F22 PolarHBondContact O-N 2.9Å; F22-F24 VanDerWaalsContact C-N 3.33Å; F22-F24 PolarHBondContact O-N 3.09Å; F22-N25 PolarHBondContact O-N 3.11Å; F22-I26 HydrophobicContact CD1-CG1 4.37Å; F22-I26 HydrophobicContact CE1-CD1 4.49Å; F22-I26 HydrophobicContact CE1-CG1 3.95Å; F22-I26 HydrophobicContact CE2-CD1 4.4Å; F22-I26 HydrophobicContact CE2-CG1 4.32Å; F22-I26 HydrophobicContact CZ-CD1 4.02Å; F22-I26 HydrophobicContact CZ-CG1 3.93Å; F22-I26 WeakPolarHBondContact O-CG1 3.3Å; F22-I26 PolarHBondContact O-N 2.91Å; F22-C80 HydrophobicContact CD2-CB 4.35Å; F22-C80 HydrophobicContact CE2-CB 4.07Å; F22-T83 HydrophobicContact CB-CG2 4.25Å; F22-L84 HydrophobicContact CD2-CD1 4.48Å; F22-L84 HydrophobicContact CD2-CD2 4.15Å; F22-L84 HydrophobicContact CD2-CG 4.12Å; F22-L84 HydrophobicContact CE2-CD1 3.8Å; F22-L84 HydrophobicContact CE2-CD2 4.03Å; F22-L84 HydrophobicContact CE2-CG 3.93Å
23L91.6Very high89.9Confident107 Ų10755.3 Ų55.356%0.5630%0.299SS*.Hα-helixtrans-59-46.1176.6179.462.9000111.3Y19 L20 N25 I26 C27Y19-L23 VanDerWaalsContact O-CB 3.31Å; Y19-L23 WeakPolarHBondContact O-CB 3.45Å; Y19-L23 PolarHBondContact O-N 3.4Å; L20-L23 PolarHBondContact O-N 3.01Å; L23-N25 VanDerWaalsContact C-N 3.34Å; L23-N25 PolarHBondContact O-N 3.24Å; L23-I26 PolarHBondContact O-N 3.47Å; L23-C27 PolarHBondContact O-N 3.08Å; L23-C27 PolarHBondContact O-SG 3.21Å; L23-C27 VanDerWaalsContact O-SG 3.36Å
24F89.8Confident90.7Very high39 Ų3956.1 Ų56.117%0.17130%0.302CS..Hα-helixtrans-54.9-49.2175.6179-97.6000111.5L20 F22 I26 C27 F28 L233L20-F24 WeakPolarHBondContact O-CB 3.49Å; L20-F24 PolarHBondContact O-N 3.2Å; F22-F24 VanDerWaalsContact C-N 3.33Å; F22-F24 PolarHBondContact O-N 3.09Å; F24-I26 VanDerWaalsContact C-N 3.34Å; F24-I26 PolarHBondContact O-N 2.94Å; F24-C27 WeakPolarHBondContact O-CB 3.44Å; F24-C27 PolarHBondContact O-N 3.31Å; F24-F28 HydrophobicContact CD1-CD2 4.08Å; F24-F28 HydrophobicContact CD1-CE2 4.17Å; F24-F28 HydrophobicContact CD2-CD2 4.23Å; F24-F28 AromaticContact CD2-CE2 3.84Å; F24-F28 HydrophobicContact CD2-CE2 3.84Å; F24-F28 AromaticContact CE1-CD2 3.82Å; F24-F28 HydrophobicContact CE1-CD2 3.82Å; F24-F28 AromaticContact CE1-CE2 3.58Å; F24-F28 HydrophobicContact CE1-CE2 3.58Å; F24-F28 HydrophobicContact CE1-CZ 4.05Å; F24-F28 HydrophobicContact CE2-CD2 4Å; F24-F28 AromaticContact CE2-CE2 3.22Å; F24-F28 HydrophobicContact CE2-CE2 3.22Å; F24-F28 AromaticContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CG-CD2 4.29Å; F24-F28 HydrophobicContact CG-CE2 4.29Å; F24-F28 AromaticContact CZ-CD2 3.8Å; F24-F28 HydrophobicContact CZ-CD2 3.8Å; F24-F28 HydrophobicContact CZ-CE1 4.41Å; F24-F28 AromaticContact CZ-CE2 3.06Å; F24-F28 HydrophobicContact CZ-CE2 3.06Å; F24-F28 AromaticContact CZ-CZ 3.42Å; F24-F28 HydrophobicContact CZ-CZ 3.42Å; F24-F28 VanDerWaalsContact CZ-CZ 3.42Å; F24-F28 VanDerWaalsContact O-CD2 3.29Å; F24-F28 WeakPolarHBondContact O-CD2 3.36Å; F24-F28 PolarHBondContact O-N 2.64Å; F24-L233 HydrophobicContact CE2-CB 4Å; F24-L233 HydrophobicContact CE2-CD2 4.34Å; F24-L233 HydrophobicContact CZ-CB 4.25Å; F24-L233 WeakPolarHBondContact CZ-O 3.36Å
25N92.8Very high91.4Very high1 Ų158.2 Ų58.21%0.00532%0.315CS..Hα-helixtrans-66.5-33.1179.7-80.5-69000113.6L21 F22 L23 F28 W29 G79 C80 Y94L21-N25 WeakPolarHBondContact O-CB 3.45Å; L21-N25 PolarHBondContact O-N 3.47Å; L21-N25 PolarHBondContact O-ND2 2.93Å; F22-N25 PolarHBondContact O-N 3.11Å; L23-N25 VanDerWaalsContact C-N 3.34Å; L23-N25 PolarHBondContact O-N 3.24Å; N25-F28 PolarHBondContact O-N 2.9Å; N25-W29 WeakPolarHBondContact O-CB 3.23Å; N25-W29 PolarHBondContact O-N 2.93Å; N25-G79 WeakPolarHBondContact OD1-CA 3.44Å; N25-C80 VanDerWaalsContact CB-SG 3.53Å; N25-Y94 PolarHBondContact ND2-OH 2.63Å; N25-Y94 WeakPolarHBondContact OD1-CE2 3.42Å; N25-Y94 PolarHBondContact OD1-OH 3.26Å
26I93.8Very high92Very high50 Ų5057.1 Ų57.126%0.25631%0.309SS..Hα-helixtrans-65.3-43.6172.6-69.7-67.5000110.8F22 L23 F24 F28 W29 L30F22-I26 HydrophobicContact CD1-CG1 4.37Å; F22-I26 HydrophobicContact CE1-CD1 4.49Å; F22-I26 HydrophobicContact CE1-CG1 3.95Å; F22-I26 HydrophobicContact CE2-CD1 4.4Å; F22-I26 HydrophobicContact CE2-CG1 4.32Å; F22-I26 HydrophobicContact CZ-CD1 4.02Å; F22-I26 HydrophobicContact CZ-CG1 3.93Å; F22-I26 WeakPolarHBondContact O-CG1 3.3Å; F22-I26 PolarHBondContact O-N 2.91Å; L23-I26 PolarHBondContact O-N 3.47Å; F24-I26 VanDerWaalsContact C-N 3.34Å; F24-I26 PolarHBondContact O-N 2.94Å; I26-F28 VanDerWaalsContact C-N 3.32Å; I26-F28 PolarHBondContact O-N 3.4Å; I26-W29 PolarHBondContact O-N 3.45Å; I26-L30 HydrophobicContact CG2-CD1 4.1Å; I26-L30 HydrophobicContact CG2-CG 4.47Å; I26-L30 WeakPolarHBondContact O-CG 3.48Å; I26-L30 PolarHBondContact O-N 3.19Å
27C92Very high92.5Very high71 Ų7156.7 Ų56.748%0.4831%0.311SS..Hα-helixtrans-59.7-43.5175.1-67.10000111.7L23 F24 L30 A31L23-C27 PolarHBondContact O-N 3.08Å; L23-C27 PolarHBondContact O-SG 3.21Å; L23-C27 VanDerWaalsContact O-SG 3.36Å; F24-C27 WeakPolarHBondContact O-CB 3.44Å; F24-C27 PolarHBondContact O-N 3.31Å; C27-L30 PolarHBondContact O-N 3.49Å; C27-A31 VanDerWaalsContact O-CB 3.31Å; C27-A31 WeakPolarHBondContact O-CB 3.48Å; C27-A31 PolarHBondContact O-N 3.34Å
28F90.7Very high92.8Very high37 Ų3759.1 Ų59.116%0.16233%0.327CS..Hα-helixtrans-63.9-42.5175.9-88.8-106.8000112.2F24 N25 I26 A31 G32 V72F24-F28 HydrophobicContact CD1-CD2 4.08Å; F24-F28 HydrophobicContact CD1-CE2 4.17Å; F24-F28 HydrophobicContact CD2-CD2 4.23Å; F24-F28 AromaticContact CD2-CE2 3.84Å; F24-F28 HydrophobicContact CD2-CE2 3.84Å; F24-F28 AromaticContact CE1-CD2 3.82Å; F24-F28 HydrophobicContact CE1-CD2 3.82Å; F24-F28 AromaticContact CE1-CE2 3.58Å; F24-F28 HydrophobicContact CE1-CE2 3.58Å; F24-F28 HydrophobicContact CE1-CZ 4.05Å; F24-F28 HydrophobicContact CE2-CD2 4Å; F24-F28 AromaticContact CE2-CE2 3.22Å; F24-F28 HydrophobicContact CE2-CE2 3.22Å; F24-F28 AromaticContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CE2-CZ 3.92Å; F24-F28 HydrophobicContact CG-CD2 4.29Å; F24-F28 HydrophobicContact CG-CE2 4.29Å; F24-F28 AromaticContact CZ-CD2 3.8Å; F24-F28 HydrophobicContact CZ-CD2 3.8Å; F24-F28 HydrophobicContact CZ-CE1 4.41Å; F24-F28 AromaticContact CZ-CE2 3.06Å; F24-F28 HydrophobicContact CZ-CE2 3.06Å; F24-F28 AromaticContact CZ-CZ 3.42Å; F24-F28 HydrophobicContact CZ-CZ 3.42Å; F24-F28 VanDerWaalsContact CZ-CZ 3.42Å; F24-F28 VanDerWaalsContact O-CD2 3.29Å; F24-F28 WeakPolarHBondContact O-CD2 3.36Å; F24-F28 PolarHBondContact O-N 2.64Å; N25-F28 PolarHBondContact O-N 2.9Å; I26-F28 VanDerWaalsContact C-N 3.32Å; I26-F28 PolarHBondContact O-N 3.4Å; F28-A31 PolarHBondContact O-N 3.38Å; F28-G32 PolarHBondContact O-N 3.4Å; F28-V72 HydrophobicContact CD1-CG1 4.22Å; F28-V72 WeakPolarHBondContact O-CG1 3.44Å
29W94.9Very high93Very high104 Ų10458 Ų5839%0.39432%0.322SS..Hα-helixtrans-60.4-46.3176.6176.367.6000112.1N25 I26 G32 G33 T73 I77N25-W29 WeakPolarHBondContact O-CB 3.23Å; N25-W29 PolarHBondContact O-N 2.93Å; I26-W29 PolarHBondContact O-N 3.45Å; W29-G32 PolarHBondContact O-N 3.49Å; W29-G33 PolarHBondContact O-N 2.94Å; W29-T73 VanDerWaalsContact CD1-CG2 3.48Å; W29-I77 VanDerWaalsContact CD1-CG1 3.48Å; W29-I77 HydrophobicContact CG-CG1 4.44Å
30L95.7Very high93.2Very high102 Ų10253.1 Ų53.153%0.53431%0.31SS..Hα-helixtrans-64.5-44.1176.8-69174.4000112I26 C27 G33 A34I26-L30 HydrophobicContact CG2-CD1 4.1Å; I26-L30 HydrophobicContact CG2-CG 4.47Å; I26-L30 WeakPolarHBondContact O-CG 3.48Å; I26-L30 PolarHBondContact O-N 3.19Å; C27-L30 PolarHBondContact O-N 3.49Å; L30-G33 PolarHBondContact O-N 2.88Å; L30-A34 PolarHBondContact O-N 3.36Å
31A93.6Very high93.3Very high54 Ų5458.3 Ų58.345%0.44632%0.324SS..Hα-helixtrans-63-44177.100000111.7C27 F28 G33 A34 V35C27-A31 VanDerWaalsContact O-CB 3.31Å; C27-A31 WeakPolarHBondContact O-CB 3.48Å; C27-A31 PolarHBondContact O-N 3.34Å; F28-A31 PolarHBondContact O-N 3.38Å; A31-G33 VanDerWaalsContact C-N 3.34Å; A31-G33 PolarHBondContact O-N 2.92Å; A31-A34 PolarHBondContact O-N 3.49Å; A31-V35 WeakPolarHBondContact O-CG2 3.21Å; A31-V35 PolarHBondContact O-N 2.92Å
32G95.4Very high93.1Very high1 Ų160.7 Ų60.71%0.0134%0.339CS..Hα-helixtrans-60.6-42.3174.900000112.3F28 W29 V35 L36 T73F28-G32 PolarHBondContact O-N 3.4Å; W29-G32 PolarHBondContact O-N 3.49Å; G32-V35 PolarHBondContact O-N 3.46Å; G32-L36 VanDerWaalsContact O-CB 3.31Å; G32-L36 WeakPolarHBondContact O-CB 3.31Å; G32-L36 PolarHBondContact O-N 3.33Å; G32-T73 WeakPolarHBondContact CA-OG1 3.23Å; G32-T73 PolarHBondContact O-OG1 3.2Å
33G97Very high92.7Very high29 Ų2960.1 Ų60.130%0.29934%0.339SS..Hα-helixtrans-62.8-41.4175.400000112.7W29 L30 A31 L36 A37 T73W29-G33 PolarHBondContact O-N 2.94Å; L30-G33 PolarHBondContact O-N 2.88Å; A31-G33 VanDerWaalsContact C-N 3.34Å; A31-G33 PolarHBondContact O-N 2.92Å; G33-L36 PolarHBondContact O-N 3.02Å; G33-A37 WeakPolarHBondContact O-CB 3.48Å; G33-A37 PolarHBondContact O-N 3.47Å; G33-T73 PolarHBondContact N-OG1 3.31Å
34A96.9Very high92.3Very high57 Ų5759 Ų5947%0.47134%0.336SS..Hα-helixtrans-64.1-45.8175.100000112L30 A31 L36 A37 V38L30-A34 PolarHBondContact O-N 3.36Å; A31-A34 PolarHBondContact O-N 3.49Å; A34-L36 VanDerWaalsContact C-N 3.34Å; A34-L36 PolarHBondContact O-N 2.96Å; A34-A37 PolarHBondContact O-N 3.28Å; A34-V38 WeakPolarHBondContact O-CG2 3.47Å; A34-V38 PolarHBondContact O-N 3.41Å
35V95.2Very high91.7Very high58 Ų5861 Ų6135%0.35235%0.348SS..Hα-helixtrans-61.8-43.2176.7171.40000111.1A31 G32 V38 G39 L65A31-V35 WeakPolarHBondContact O-CG2 3.21Å; A31-V35 PolarHBondContact O-N 2.92Å; G32-V35 PolarHBondContact O-N 3.46Å; V35-V38 PolarHBondContact O-N 2.86Å; V35-G39 PolarHBondContact O-N 3.17Å; V35-L65 HydrophobicContact CG1-CD2 4.24Å
36L96.1Very high90.3Very high47 Ų4764.4 Ų64.425%0.24636%0.363CS..Hα-helixtrans-60.7-45.4175.4179.158.1000111.4G32 G33 A34 V38 G39 V40 I66 V70G32-L36 VanDerWaalsContact O-CB 3.31Å; G32-L36 WeakPolarHBondContact O-CB 3.31Å; G32-L36 PolarHBondContact O-N 3.33Å; G33-L36 PolarHBondContact O-N 3.02Å; A34-L36 VanDerWaalsContact C-N 3.34Å; A34-L36 PolarHBondContact O-N 2.96Å; L36-V38 PolarHBondContact O-N 2.9Å; L36-G39 PolarHBondContact O-N 3.05Å; L36-V40 HydrophobicContact CD1-CG2 4.19Å; L36-V40 WeakPolarHBondContact O-CG2 3.24Å; L36-V40 PolarHBondContact O-N 2.91Å; L36-I66 HydrophobicContact CD1-CB 4.23Å; L36-I66 HydrophobicContact CD1-CG1 4.4Å; L36-I66 HydrophobicContact CD1-CG2 3.77Å; L36-V70 HydrophobicContact CD1-CG2 3.83Å; L36-V70 HydrophobicContact CD2-CG2 4.16Å
37A95.4Very high88.6Confident58 Ų5865 Ų6548%0.47937%0.372SS..Hα-helixtrans-60.7-44177.600000111.8G33 A34 V40 W41G33-A37 WeakPolarHBondContact O-CB 3.48Å; G33-A37 PolarHBondContact O-N 3.47Å; A34-A37 PolarHBondContact O-N 3.28Å; A37-V40 PolarHBondContact O-N 3.49Å; A37-W41 VanDerWaalsContact O-CB 3.25Å; A37-W41 WeakPolarHBondContact O-CB 3.44Å; A37-W41 PolarHBondContact O-N 3.14Å
38V93.5Very high87Confident83 Ų8367.7 Ų67.750%0.50338%0.381SS..Hα-helixtrans-62.5-43.1174.8172.70000111.2A34 V35 L36 W41 T42 L65A34-V38 WeakPolarHBondContact O-CG2 3.47Å; A34-V38 PolarHBondContact O-N 3.41Å; V35-V38 PolarHBondContact O-N 2.86Å; L36-V38 PolarHBondContact O-N 2.9Å; V38-W41 PolarHBondContact O-N 3.39Å; V38-T42 WeakPolarHBondContact O-CB 3.37Å; V38-T42 PolarHBondContact O-N 2.78Å; V38-T42 PolarHBondContact O-OG1 3.22Å; V38-L65 HydrophobicContact CG1-CD1 4.49Å
39G91.5Very high85Confident0 Ų072.1 Ų72.10%040%0.398CS..Hα-helixtrans-61.3-45.4177.400000112.6V35 L36 T42 L43V35-G39 PolarHBondContact O-N 3.17Å; L36-G39 PolarHBondContact O-N 3.05Å; G39-T42 PolarHBondContact O-N 2.98Å; G39-L43 PolarHBondContact O-N 3.02Å; G39-L43 VanDerWaalsContact O-N 3.17Å
40V91.4Very high82.7Confident68 Ų6873 Ų7341%0.41241%0.409SS..Hα-helixtrans-65.8-45.3175.9174.20000111L36 A37 T42 L43 V44 I66L36-V40 HydrophobicContact CD1-CG2 4.19Å; L36-V40 WeakPolarHBondContact O-CG2 3.24Å; L36-V40 PolarHBondContact O-N 2.91Å; A37-V40 PolarHBondContact O-N 3.49Å; V40-T42 VanDerWaalsContact C-N 3.3Å; V40-T42 PolarHBondContact O-N 2.81Å; V40-L43 PolarHBondContact O-N 3Å; V40-V44 HydrophobicContact CG1-CG2 4.17Å; V40-V44 WeakPolarHBondContact O-CG2 3.44Å; V40-V44 PolarHBondContact O-N 3.2Å; V40-I66 HydrophobicContact CG2-CD1 4.25Å; V40-I66 HydrophobicContact CG2-CG1 4.17Å
41W90.6Very high80.4Confident189 Ų18973.8 Ų73.872%0.71642%0.423SS*.Hα-helixtrans-56.2-45.9176.6-176-82.1000111.4A37 V38 L43 V44 D45A37-W41 VanDerWaalsContact O-CB 3.25Å; A37-W41 WeakPolarHBondContact O-CB 3.44Å; A37-W41 PolarHBondContact O-N 3.14Å; V38-W41 PolarHBondContact O-N 3.39Å; W41-L43 VanDerWaalsContact C-N 3.25Å; W41-L43 PolarHBondContact O-N 2.93Å; W41-V44 PolarHBondContact O-N 3.4Å; W41-D45 WeakPolarHBondContact O-CB 3.37Å; W41-D45 PolarHBondContact O-N 2.89Å
42T85.9Confident78.2Confident51 Ų5177.9 Ų77.931%0.31344%0.437SS..Hα-helixtrans-60.9-35.6177.9-53.10000111.9V38 G39 V40 A62V38-T42 WeakPolarHBondContact O-CB 3.37Å; V38-T42 PolarHBondContact O-N 2.78Å; V38-T42 PolarHBondContact O-OG1 3.22Å; G39-T42 PolarHBondContact O-N 2.98Å; V40-T42 VanDerWaalsContact C-N 3.3Å; V40-T42 PolarHBondContact O-N 2.81Å; T42-A62 HydrophobicContact CG2-CB 3.99Å
43L83.4Confident75.9Confident57 Ų5782.1 Ų82.130%0.29846%0.459SS..Hα-helixtrans-76.4-34.8178.1-169.467.3000112.6G39 V40 W41 K46 A62 F63 I66G39-L43 PolarHBondContact O-N 3.02Å; G39-L43 VanDerWaalsContact O-N 3.17Å; V40-L43 PolarHBondContact O-N 3Å; W41-L43 VanDerWaalsContact C-N 3.25Å; W41-L43 PolarHBondContact O-N 2.93Å; L43-K46 WeakPolarHBondContact O-CB 3.39Å; L43-A62 HydrophobicContact CB-CB 4.4Å; L43-F63 HydrophobicContact CD1-CE2 4.44Å; L43-F63 HydrophobicContact CD1-CZ 4.4Å; L43-F63 HydrophobicContact CD2-CE1 4.37Å; L43-F63 HydrophobicContact CD2-CZ 4.43Å; L43-I66 HydrophobicContact CB-CD1 4.47Å; L43-I66 HydrophobicContact CD2-CD1 4.07Å
44V83.7Confident73.7Confident83 Ų8388.8 Ų88.850%0.50349%0.487SS..Hα-helixtrans-74.9-41.7178.6173.50000111.2V40 W41 K46 S47V40-V44 HydrophobicContact CG1-CG2 4.17Å; V40-V44 WeakPolarHBondContact O-CG2 3.44Å; V40-V44 PolarHBondContact O-N 3.2Å; W41-V44 PolarHBondContact O-N 3.4Å; V44-K46 PolarHBondContact O-N 3.07Å; V44-K46 VanDerWaalsContact O-N 3.12Å; V44-S47 WeakPolarHBondContact O-CB 3.45Å; V44-S47 PolarHBondContact O-N 3.39Å; V44-S47 PolarHBondContact O-OG 3.38Å
45D77.3Confident71.9Confident81 Ų8187.5 Ų87.543%0.43348%0.475SS..Hα-helixtrans-58.1-30.3175.9-165.457.1000111.3W41 S47 D48 Y49W41-D45 WeakPolarHBondContact O-CB 3.37Å; W41-D45 PolarHBondContact O-N 2.89Å; D45-S47 VanDerWaalsContact C-N 3.3Å; D45-S47 PolarHBondContact O-N 3.35Å; D45-D48 PolarHBondContact O-N 3.17Å; D45-Y49 WeakPolarHBondContact O-CD2 3.32Å
46K63.3Low70.3Confident72 Ų7287.5 Ų87.531%0.31349%0.487SS..Hα-helixtrans-62.3-31.2171.3-171.5-172.7177.2-178.10113.2L43 V44 D48 Y49 I50 S59L43-K46 WeakPolarHBondContact O-CB 3.39Å; V44-K46 PolarHBondContact O-N 3.07Å; V44-K46 VanDerWaalsContact O-N 3.12Å; K46-D48 PolarHBondContact O-N 2.73Å; K46-Y49 CarbonylContact O-C 3.57Å; K46-Y49 PolarHBondContact O-N 2.99Å; K46-Y49 VanDerWaalsContact O-N 3.16Å; K46-I50 WeakPolarHBondContact O-CG1 3.3Å; K46-I50 PolarHBondContact O-N 2.82Å; K46-I50 VanDerWaalsContact O-N 3.16Å; K46-S59 PolarHBondContact NZ-OG 3.01Å
47S57.3Low69Low63 Ų6393.7 Ų93.744%0.44151%0.512SS..Hα-helixtrans-63-25.1-177.168.90000113.2V44 D45 I50V44-S47 WeakPolarHBondContact O-CB 3.45Å; V44-S47 PolarHBondContact O-N 3.39Å; V44-S47 PolarHBondContact O-OG 3.38Å; D45-S47 VanDerWaalsContact C-N 3.3Å; D45-S47 PolarHBondContact O-N 3.35Å; S47-I50 WeakPolarHBondContact O-CG1 3.4Å
48D57.8Low67.9Low128 Ų12898.2 Ų98.268%0.68452%0.518SS*.Hα-helixtrans-88.4-16.3-178.2-62.6-12.7000112.2D45 K46D45-D48 PolarHBondContact O-N 3.17Å; K46-D48 PolarHBondContact O-N 2.73Å
49Y50Low67.1Low129 Ų12995.3 Ų95.351%0.50650%0.501SS..SBendtrans-119.520.7-179.6-61.8-82.9000114.1D45 K46 S51 L52D45-Y49 WeakPolarHBondContact O-CD2 3.32Å; K46-Y49 CarbonylContact O-C 3.57Å; K46-Y49 PolarHBondContact O-N 2.99Å; K46-Y49 VanDerWaalsContact O-N 3.16Å; Y49-S51 PolarHBondContact O-N 3.39Å; Y49-L52 PolarHBondContact O-N 3.3Å
50I46.7Very low66.7Low122 Ų12297.6 Ų97.663%0.62652%0.52SS*.THydrogen-bonded Turntrans-50.8-23.5-175.1-69.6-177.8000113.5K46 S47K46-I50 WeakPolarHBondContact O-CG1 3.3Å; K46-I50 PolarHBondContact O-N 2.82Å; K46-I50 VanDerWaalsContact O-N 3.16Å; S47-I50 WeakPolarHBondContact O-CG1 3.4Å
51S46.2Very low66.4Low119 Ų11997 Ų9783%0.83252%0.519SS*.THydrogen-bonded Turntrans-85.8-10.5180-470000115.7Y49Y49-S51 PolarHBondContact O-N 3.39Å
52L47.5Very low66.3Low140 Ų14088 Ų8873%0.73349%0.485SS*.THydrogen-bonded Turntrans-120.3-19.2-167.5-65.2175.6000115.2Y49Y49-L52 PolarHBondContact O-N 3.3Å
53L47.8Very low66.5Low90 Ų9090.7 Ų90.747%0.47149%0.493SS..  trans-11779.1-176.6-66.2172.2000111.5S55L53-S55 VanDerWaalsContact C-N 3.3Å; L53-S55 PolarHBondContact O-N 2.98Å
54N50.5Low66.9Low169 Ų16993.5 Ų93.590%0.90451%0.506SS*.  trans-78.279.6165.6-171.831.2000110.3
55S58Low67.3Low31 Ų3192.7 Ų92.722%0.21750%0.499CS..  trans-142.1107.1168.8530000110.7L53 F57 Y58L53-S55 VanDerWaalsContact C-N 3.3Å; L53-S55 PolarHBondContact O-N 2.98Å; S55-F57 PolarHBondContact O-N 3.45Å; S55-Y58 PolarHBondContact O-N 3.33Å; S55-Y58 WeakPolarHBondContact OG-CD2 3.32Å
56G63Low68.2Low58 Ų5890.4 Ų90.460%0.59849%0.487SS*.Hα-helixtrans-53.7-2517400000113S59 A60G56-S59 PolarHBondContact O-N 3.08Å; G56-A60 VanDerWaalsContact O-CB 3.31Å; G56-A60 WeakPolarHBondContact O-CB 3.47Å; G56-A60 PolarHBondContact O-N 3.36Å
57F68.9Low69.7Low177 Ų17791 Ų9178%0.77650%0.496SS*.Hα-helixtrans-61.3-47.4177.2-65.6-73.5000114.1S55 S59 A60 S61S55-F57 PolarHBondContact O-N 3.45Å; F57-S59 VanDerWaalsContact C-N 3.31Å; F57-S59 PolarHBondContact O-N 2.92Å; F57-A60 PolarHBondContact O-N 3.27Å; F57-S61 PolarHBondContact O-N 3.21Å; F57-S61 PolarHBondContact O-OG 3.41Å
58Y70.6Confident71.4Confident153 Ų15390 Ų9060%0.649%0.492SS*.Hα-helixtrans-64.8-37.9179.3-84.3-97.2000111.8S55 S61 A62S55-Y58 PolarHBondContact O-N 3.33Å; S55-Y58 WeakPolarHBondContact OG-CD2 3.32Å; Y58-S61 WeakPolarHBondContact CA-OG 3.47Å; Y58-S61 PolarHBondContact O-OG 3.22Å; Y58-A62 PolarHBondContact O-N 3.39Å; Y58-A62 VanDerWaalsContact O-N 3.1Å
59S77.9Confident73.3Confident22 Ų2283.9 Ų83.915%0.15446%0.459CS..Hα-helixtrans-66.3-45.8175.3-146.60000111K46 G56 F57 S61 A62 F63K46-S59 PolarHBondContact NZ-OG 3.01Å; G56-S59 PolarHBondContact O-N 3.08Å; F57-S59 VanDerWaalsContact C-N 3.31Å; F57-S59 PolarHBondContact O-N 2.92Å; S59-S61 PolarHBondContact O-N 2.98Å; S59-A62 PolarHBondContact O-N 2.98Å; S59-F63 WeakPolarHBondContact O-CD2 3.47Å; S59-F63 PolarHBondContact O-N 3.44Å
60A83.3Confident75.5Confident47 Ų4780.5 Ų80.539%0.38845%0.452SS..Hα-helixtrans-60.6-44.2178.400000111.4G56 F57 A62 F63 I64G56-A60 VanDerWaalsContact O-CB 3.31Å; G56-A60 WeakPolarHBondContact O-CB 3.47Å; G56-A60 PolarHBondContact O-N 3.36Å; F57-A60 PolarHBondContact O-N 3.27Å; A60-A62 PolarHBondContact O-N 3.03Å; A60-F63 PolarHBondContact O-N 3.42Å; A60-I64 VanDerWaalsContact O-CG1 3.25Å; A60-I64 WeakPolarHBondContact O-CG1 3.4Å; A60-I64 PolarHBondContact O-N 3.22Å
61S84.4Confident77.7Confident55 Ų5577.9 Ų77.939%0.38544%0.438SS..Hα-helixtrans-63.1-41.6177.155.20000112.6F57 Y58 S59 I64 L65F57-S61 PolarHBondContact O-N 3.21Å; F57-S61 PolarHBondContact O-OG 3.41Å; Y58-S61 WeakPolarHBondContact CA-OG 3.47Å; Y58-S61 PolarHBondContact O-OG 3.22Å; S59-S61 PolarHBondContact O-N 2.98Å; S61-I64 PolarHBondContact O-N 3.23Å; S61-L65 WeakPolarHBondContact O-CG 3.41Å; S61-L65 PolarHBondContact O-N 2.94Å
62A88.9Confident80Confident1 Ų174.3 Ų74.31%0.00841%0.411CS..Hα-helixtrans-62.7-44.3176.200000111.7T42 L43 Y58 S59 A60 I64 L65 I66T42-A62 HydrophobicContact CG2-CB 3.99Å; L43-A62 HydrophobicContact CB-CB 4.4Å; Y58-A62 PolarHBondContact O-N 3.39Å; Y58-A62 VanDerWaalsContact O-N 3.1Å; S59-A62 PolarHBondContact O-N 2.98Å; A60-A62 PolarHBondContact O-N 3.03Å; A62-I64 PolarHBondContact O-N 3.25Å; A62-L65 PolarHBondContact O-N 3.5Å; A62-I66 VanDerWaalsContact O-CG1 3.3Å; A62-I66 WeakPolarHBondContact O-CG1 3.12Å; A62-I66 PolarHBondContact O-N 2.97Å
63F90.6Very high82.3Confident108 Ų10868.6 Ų68.647%0.47438%0.382SS..Hα-helixtrans-62.1-41.6175.6-79.5-64.2000112.6L43 S59 A60 L65 I66 V67L43-F63 HydrophobicContact CD1-CE2 4.44Å; L43-F63 HydrophobicContact CD1-CZ 4.4Å; L43-F63 HydrophobicContact CD2-CE1 4.37Å; L43-F63 HydrophobicContact CD2-CZ 4.43Å; S59-F63 WeakPolarHBondContact O-CD2 3.47Å; S59-F63 PolarHBondContact O-N 3.44Å; A60-F63 PolarHBondContact O-N 3.42Å; F63-L65 VanDerWaalsContact C-N 3.35Å; F63-L65 PolarHBondContact O-N 3.34Å; F63-I66 PolarHBondContact O-N 3.48Å; F63-V67 WeakPolarHBondContact O-CG2 3.29Å; F63-V67 PolarHBondContact O-N 3.43Å
64I91.8Very high84.5Confident115 Ų11568.7 Ų68.759%0.5938%0.382SS*.Hα-helixtrans-60.2-45.5175.8-69.4164.3000110.5A60 S61 A62 I66 V67 A68A60-I64 VanDerWaalsContact O-CG1 3.25Å; A60-I64 WeakPolarHBondContact O-CG1 3.4Å; A60-I64 PolarHBondContact O-N 3.22Å; S61-I64 PolarHBondContact O-N 3.23Å; A62-I64 PolarHBondContact O-N 3.25Å; I64-I66 PolarHBondContact O-N 3.24Å; I64-V67 PolarHBondContact O-N 2.8Å; I64-A68 VanDerWaalsContact O-CB 3.27Å; I64-A68 WeakPolarHBondContact O-CB 3.48Å; I64-A68 PolarHBondContact O-N 2.95Å
65L92.4Very high86.5Confident67 Ų6761 Ų6135%0.35134%0.341SS..Hα-helixtrans-61.4-42.9176.9-71.2174.9000112.2V35 V38 S61 A62 F63 G69V35-L65 HydrophobicContact CG1-CD2 4.24Å; V38-L65 HydrophobicContact CG1-CD1 4.49Å; S61-L65 WeakPolarHBondContact O-CG 3.41Å; S61-L65 PolarHBondContact O-N 2.94Å; A62-L65 PolarHBondContact O-N 3.5Å; F63-L65 VanDerWaalsContact C-N 3.35Å; F63-L65 PolarHBondContact O-N 3.34Å; L65-G69 PolarHBondContact O-N 2.69Å
66I94.9Very high88.2Confident33 Ų3359.5 Ų59.517%0.16933%0.331CS..Hα-helixtrans-61.7-51.4177.2-69.4168.6000110.4L36 V40 L43 A62 F63 I64 A68 G69 V70L36-I66 HydrophobicContact CD1-CB 4.23Å; L36-I66 HydrophobicContact CD1-CG1 4.4Å; L36-I66 HydrophobicContact CD1-CG2 3.77Å; V40-I66 HydrophobicContact CG2-CD1 4.25Å; V40-I66 HydrophobicContact CG2-CG1 4.17Å; L43-I66 HydrophobicContact CB-CD1 4.47Å; L43-I66 HydrophobicContact CD2-CD1 4.07Å; A62-I66 VanDerWaalsContact O-CG1 3.3Å; A62-I66 WeakPolarHBondContact O-CG1 3.12Å; A62-I66 PolarHBondContact O-N 2.97Å; F63-I66 PolarHBondContact O-N 3.48Å; I64-I66 PolarHBondContact O-N 3.24Å; I66-A68 PolarHBondContact O-N 3Å; I66-G69 PolarHBondContact O-N 3.21Å; I66-V70 WeakPolarHBondContact O-CG2 3.49Å; I66-V70 PolarHBondContact O-N 3.32Å
67V95.1Very high89.7Confident84 Ų8460.2 Ų60.251%0.50932%0.321SS..Hα-helixtrans-61.3-46.1-179172.10000110.8F63 I64 V70 I71F63-V67 WeakPolarHBondContact O-CG2 3.29Å; F63-V67 PolarHBondContact O-N 3.43Å; I64-V67 PolarHBondContact O-N 2.8Å; V67-V70 PolarHBondContact O-N 2.9Å; V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 2.91Å
68A93.8Very high90.9Very high42 Ų4254.1 Ų54.135%0.34730%0.295SS..Hα-helixtrans-60.6-46.3176.200000111.6I64 I66 V70 I71 V72I64-A68 VanDerWaalsContact O-CB 3.27Å; I64-A68 WeakPolarHBondContact O-CB 3.48Å; I64-A68 PolarHBondContact O-N 2.95Å; I66-A68 PolarHBondContact O-N 3Å; A68-V70 PolarHBondContact O-N 3.34Å; A68-I71 PolarHBondContact O-N 3.4Å; A68-V72 VanDerWaalsContact O-CG2 3.32Å; A68-V72 WeakPolarHBondContact O-CG2 3.44Å; A68-V72 PolarHBondContact O-N 2.95Å
69G96Very high91.9Very high0 Ų046.8 Ų46.80%027%0.267CS..Hα-helixtrans-59.9-42.7177.600000112.8L65 I66 T73L65-G69 PolarHBondContact O-N 2.69Å; I66-G69 PolarHBondContact O-N 3.21Å; G69-T73 VanDerWaalsContact O-CB 3.25Å; G69-T73 WeakPolarHBondContact O-CB 3.34Å; G69-T73 PolarHBondContact O-N 3.41Å; G69-T73 PolarHBondContact O-OG1 2.76Å
70V96.3Very high92.6Very high58 Ų5846.4 Ų46.435%0.35226%0.264SS..Hα-helixtrans-61.7-49.1174.7170.10000111L36 I66 V67 A68 V72 T73 L74L36-V70 HydrophobicContact CD1-CG2 3.83Å; L36-V70 HydrophobicContact CD2-CG2 4.16Å; I66-V70 WeakPolarHBondContact O-CG2 3.49Å; I66-V70 PolarHBondContact O-N 3.32Å; V67-V70 PolarHBondContact O-N 2.9Å; A68-V70 PolarHBondContact O-N 3.34Å; V70-V72 PolarHBondContact O-N 2.94Å; V70-T73 PolarHBondContact O-N 3.43Å; V70-L74 HydrophobicContact CG1-CD1 3.75Å; V70-L74 HydrophobicContact CG1-CG 4.24Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.3Å; V70-L74 WeakPolarHBondContact O-CG 3.45Å; V70-L74 PolarHBondContact O-N 2.76Å
71I94.5Very high93Very high66 Ų6646.5 Ų46.534%0.33826%0.261SS..Hα-helixtrans-58.2-49.2-180-69.5167.7000110.4V67 A68 T73 L74 T75 V101V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 2.91Å; A68-I71 PolarHBondContact O-N 3.4Å; I71-T73 PolarHBondContact O-N 2.92Å; I71-L74 PolarHBondContact O-N 2.99Å; I71-T75 WeakPolarHBondContact O-CB 3.5Å; I71-T75 PolarHBondContact O-N 3.38Å; I71-T75 PolarHBondContact O-OG1 3Å; I71-V101 HydrophobicContact CG2-CG2 3.99Å
72V94.1Very high93.3Very high45 Ų4543.9 Ų43.927%0.27324%0.243SC..Hα-helixtrans-64.8-41.9-179174.80000111.4F28 A68 V70 T75 G76F28-V72 HydrophobicContact CD1-CG1 4.22Å; F28-V72 WeakPolarHBondContact O-CG1 3.44Å; A68-V72 VanDerWaalsContact O-CG2 3.32Å; A68-V72 WeakPolarHBondContact O-CG2 3.44Å; A68-V72 PolarHBondContact O-N 2.95Å; V70-V72 PolarHBondContact O-N 2.94Å; V72-T75 WeakPolarHBondContact O-CB 3.31Å; V72-T75 PolarHBondContact O-N 3.26Å; V72-G76 PolarHBondContact O-N 3.49Å
73T95.6Very high93.3Very high20 Ų2044.1 Ų44.112%0.12324%0.244CC..Hα-helixtrans-62.5-48.3178-57.40000111.3W29 G32 G33 G69 V70 I71 T75 G76 I77W29-T73 VanDerWaalsContact CD1-CG2 3.48Å; G32-T73 WeakPolarHBondContact CA-OG1 3.23Å; G32-T73 PolarHBondContact O-OG1 3.2Å; G33-T73 PolarHBondContact N-OG1 3.31Å; G69-T73 VanDerWaalsContact O-CB 3.25Å; G69-T73 WeakPolarHBondContact O-CB 3.34Å; G69-T73 PolarHBondContact O-N 3.41Å; G69-T73 PolarHBondContact O-OG1 2.76Å; V70-T73 PolarHBondContact O-N 3.43Å; I71-T73 PolarHBondContact O-N 2.92Å; T73-T75 VanDerWaalsContact C-N 3.32Å; T73-T75 PolarHBondContact O-N 2.88Å; T73-G76 PolarHBondContact O-N 2.99Å; T73-I77 HydrophobicContact CG2-CD1 4.26Å; T73-I77 WeakPolarHBondContact O-CG1 3.47Å; T73-I77 PolarHBondContact O-N 2.88Å
74L94.6Very high93.2Very high91 Ų9144.4 Ų44.448%0.47625%0.25SS..Hα-helixtrans-62.9-40.3177.3-69.8176.8000111.7V70 I71 G76 I77 I78V70-L74 HydrophobicContact CG1-CD1 3.75Å; V70-L74 HydrophobicContact CG1-CG 4.24Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.3Å; V70-L74 WeakPolarHBondContact O-CG 3.45Å; V70-L74 PolarHBondContact O-N 2.76Å; I71-L74 PolarHBondContact O-N 2.99Å; L74-G76 VanDerWaalsContact C-N 3.33Å; L74-G76 PolarHBondContact O-N 3.35Å; L74-I77 PolarHBondContact O-N 3.31Å; L74-I78 WeakPolarHBondContact O-CB 3.2Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.46Å; L74-I78 PolarHBondContact O-N 2.81Å
75T92.7Very high92.8Very high7 Ų743.1 Ų43.14%0.04324%0.244CC..Hα-helixtrans-57.1-47.1174.6-57.80000111.3I71 V72 T73 I78 G79 Y94 L97 L98I71-T75 WeakPolarHBondContact O-CB 3.5Å; I71-T75 PolarHBondContact O-N 3.38Å; I71-T75 PolarHBondContact O-OG1 3Å; V72-T75 WeakPolarHBondContact O-CB 3.31Å; V72-T75 PolarHBondContact O-N 3.26Å; T73-T75 VanDerWaalsContact C-N 3.32Å; T73-T75 PolarHBondContact O-N 2.88Å; T75-I78 PolarHBondContact O-N 2.89Å; T75-G79 PolarHBondContact O-N 3.41Å; T75-Y94 HydrophobicContact CG2-CE2 3.98Å; T75-L97 HydrophobicContact CG2-CD2 3.27Å; T75-L97 WeakPolarHBondContact OG1-CD2 3.38Å; T75-L98 HydrophobicContact CG2-CD2 3.99Å
76G93.8Very high92.3Very high0 Ų042.5 Ų42.50%024%0.24CC..Hα-helixtrans-62.8-42.3177.500000113.2V72 T73 L74 G79 C80V72-G76 PolarHBondContact O-N 3.49Å; T73-G76 PolarHBondContact O-N 2.99Å; L74-G76 VanDerWaalsContact C-N 3.33Å; L74-G76 PolarHBondContact O-N 3.35Å; G76-G79 PolarHBondContact O-N 3.46Å; G76-C80 WeakPolarHBondContact O-CB 3.41Å; G76-C80 PolarHBondContact O-N 3.01Å; G76-C80 PolarHBondContact O-SG 3.28Å
77I93.4Very high91.8Very high74 Ų7446.8 Ų46.838%0.37926%0.257SS..Hα-helixtrans-63.2-48.6176-65.9167.4000110.5W29 T73 L74 G79 C80 C81W29-I77 VanDerWaalsContact CD1-CG1 3.48Å; W29-I77 HydrophobicContact CG-CG1 4.44Å; T73-I77 HydrophobicContact CG2-CD1 4.26Å; T73-I77 WeakPolarHBondContact O-CG1 3.47Å; T73-I77 PolarHBondContact O-N 2.88Å; L74-I77 PolarHBondContact O-N 3.31Å; I77-G79 VanDerWaalsContact C-N 3.31Å; I77-G79 PolarHBondContact O-N 3.32Å; I77-C80 PolarHBondContact O-N 3.49Å; I77-C81 WeakPolarHBondContact O-CB 3.48Å; I77-C81 PolarHBondContact O-N 2.93Å; I77-C81 PolarHBondContact O-SG 2.88Å; I77-C81 VanDerWaalsContact O-SG 3.33Å
78I93.6Very high91.4Very high48 Ų4847.7 Ų47.725%0.24625%0.251CS..Hα-helixtrans-61.4-42.5179.1-67.7166.9000110.1L74 T75 C81 A82 Y94 L97L74-I78 WeakPolarHBondContact O-CB 3.2Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.46Å; L74-I78 PolarHBondContact O-N 2.81Å; T75-I78 PolarHBondContact O-N 2.89Å; I78-C81 PolarHBondContact O-N 2.99Å; I78-A82 VanDerWaalsContact O-CB 3.23Å; I78-A82 WeakPolarHBondContact O-CB 3.38Å; I78-A82 PolarHBondContact O-N 3.2Å; I78-Y94 HydrophobicContact CG2-CD2 4.42Å; I78-L97 HydrophobicContact CD1-CD1 4.12Å
79G92.8Very high91.1Very high0 Ų049.6 Ų49.60%026%0.262CS..Hα-helixtrans-65.3-40.5177.500000113.6N25 T75 G76 I77 A82 T83 Y94N25-G79 WeakPolarHBondContact OD1-CA 3.44Å; T75-G79 PolarHBondContact O-N 3.41Å; G76-G79 PolarHBondContact O-N 3.46Å; I77-G79 VanDerWaalsContact C-N 3.31Å; I77-G79 PolarHBondContact O-N 3.32Å; G79-A82 PolarHBondContact O-N 3.42Å; G79-T83 WeakPolarHBondContact O-CB 3.37Å; G79-T83 PolarHBondContact O-N 3.37Å; G79-T83 PolarHBondContact O-OG1 2.91Å; G79-Y94 VanDerWaalsContact CA-CE2 3.43Å
80C92Very high90.8Very high13 Ų1351.7 Ų51.79%0.08827%0.273CS..Hα-helixtrans-61.5-50.1172-70.40000111F22 N25 G76 I77 A82 T83 L84F22-C80 HydrophobicContact CD2-CB 4.35Å; F22-C80 HydrophobicContact CE2-CB 4.07Å; N25-C80 VanDerWaalsContact CB-SG 3.53Å; G76-C80 WeakPolarHBondContact O-CB 3.41Å; G76-C80 PolarHBondContact O-N 3.01Å; G76-C80 PolarHBondContact O-SG 3.28Å; I77-C80 PolarHBondContact O-N 3.49Å; C80-A82 VanDerWaalsContact C-N 3.33Å; C80-A82 PolarHBondContact O-N 3.42Å; C80-T83 PolarHBondContact O-N 3.38Å; C80-L84 WeakPolarHBondContact O-CB 3.33Å; C80-L84 VanDerWaalsContact O-CG 3.31Å; C80-L84 WeakPolarHBondContact O-CG 3.44Å; C80-L84 PolarHBondContact O-N 3.46Å
81C91.6Very high90.6Very high50 Ų5049 Ų4934%0.33826%0.257SS..Hα-helixtrans-60.3-40.5176.7-72.30000112.1I77 I78 N85 L90I77-C81 WeakPolarHBondContact O-CB 3.48Å; I77-C81 PolarHBondContact O-N 2.93Å; I77-C81 PolarHBondContact O-SG 2.88Å; I77-C81 VanDerWaalsContact O-SG 3.33Å; I78-C81 PolarHBondContact O-N 2.99Å; C81-N85 WeakPolarHBondContact O-CB 3.37Å; C81-N85 PolarHBondContact O-N 2.96Å; C81-N85 PolarHBondContact O-ND2 3.25Å; C81-L90 HydrophobicContact CB-CD2 3.97Å; C81-L90 WeakPolarHBondContact O-CD2 3.31Å
82A90.4Very high90.5Very high0 Ų049.4 Ų49.40%026%0.259CS..Hα-helixtrans-62-43.4177.300000111.7I78 G79 C80 E86 L90 L91I78-A82 VanDerWaalsContact O-CB 3.23Å; I78-A82 WeakPolarHBondContact O-CB 3.38Å; I78-A82 PolarHBondContact O-N 3.2Å; G79-A82 PolarHBondContact O-N 3.42Å; C80-A82 VanDerWaalsContact C-N 3.33Å; C80-A82 PolarHBondContact O-N 3.42Å; A82-E86 PolarHBondContact O-N 3.36Å; A82-L90 HydrophobicContact CB-CB 4.35Å; A82-L90 HydrophobicContact CB-CD2 4.35Å; A82-L90 HydrophobicContact CB-CG 3.91Å; A82-L91 HydrophobicContact CB-CD2 3.87Å; A82-L91 HydrophobicContact CB-CG 4.17Å
83T89.1Confident90.4Very high6 Ų651 Ų514%0.03727%0.269CS..Hα-helixtrans-72-41.3-178.7-52.30000111.8K18 L21 F22 G79 C80 L244K18-T83 HydrophobicContact CB-CG2 4.23Å; K18-T83 HydrophobicContact CG-CG2 4.38Å; K18-T83 WeakPolarHBondContact O-CG2 3.37Å; L21-T83 HydrophobicContact CB-CG2 4.28Å; F22-T83 HydrophobicContact CB-CG2 4.25Å; G79-T83 WeakPolarHBondContact O-CB 3.37Å; G79-T83 PolarHBondContact O-N 3.37Å; G79-T83 PolarHBondContact O-OG1 2.91Å; C80-T83 PolarHBondContact O-N 3.38Å; T83-L244 HydrophobicContact CG2-CD2 4.4Å
84L87.9Confident90.3Very high114 Ų11450.1 Ų50.160%0.59726%0.263SS*.Hα-helixtrans-75-42.2-178.8-68.8175000113.4F22 C80 E86F22-L84 HydrophobicContact CD2-CD1 4.48Å; F22-L84 HydrophobicContact CD2-CD2 4.15Å; F22-L84 HydrophobicContact CD2-CG 4.12Å; F22-L84 HydrophobicContact CE2-CD1 3.8Å; F22-L84 HydrophobicContact CE2-CD2 4.03Å; F22-L84 HydrophobicContact CE2-CG 3.93Å; C80-L84 WeakPolarHBondContact O-CB 3.33Å; C80-L84 VanDerWaalsContact O-CG 3.31Å; C80-L84 WeakPolarHBondContact O-CG 3.44Å; C80-L84 PolarHBondContact O-N 3.46Å; L84-E86 VanDerWaalsContact C-N 3.26Å; L84-E86 PolarHBondContact O-N 3.29Å
85N85.2Confident90.3Very high87 Ų8747.9 Ų47.947%0.46525%0.252SS..Hα-helixtrans-77.4-14.5-176.6-71.6-64.3000113C81 K87 L90C81-N85 WeakPolarHBondContact O-CB 3.37Å; C81-N85 PolarHBondContact O-N 2.96Å; C81-N85 PolarHBondContact O-ND2 3.25Å; N85-K87 HydrophobicContact CB-CD 4.32Å; N85-K87 HydrophobicContact CB-CG 4.18Å; N85-K87 PolarHBondContact O-N 2.93Å; N85-L90 HydrophobicContact CB-CD2 4.38Å
86E81.8Confident90.4Very high54 Ų5451.4 Ų51.425%0.25227%0.273SS..  trans54.424.1-179-59.6-175.7179.600113.4K8 K18 A82 L84 L248K8-E86 IonicContact NZ-OE2 2.63Å; K8-E86 PolarHBondContact NZ-OE2 2.81Å; K18-E86 IonicContact NZ-OE1 2.64Å; K18-E86 PolarHBondContact NZ-OE1 2.89Å; K18-E86 IonicContact NZ-OE2 3.62Å; A82-E86 PolarHBondContact O-N 3.36Å; L84-E86 VanDerWaalsContact C-N 3.26Å; L84-E86 PolarHBondContact O-N 3.29Å; E86-L248 HydrophobicContact CB-CD2 3.95Å
87K83.8Confident90.4Very high124 Ų12453.5 Ų53.554%0.53928%0.284SS..  trans-87.2117.8179.6-72.6179.7-176.6176.30109.6N85 S89 L90 L91N85-K87 HydrophobicContact CB-CD 4.32Å; N85-K87 HydrophobicContact CB-CG 4.18Å; N85-K87 PolarHBondContact O-N 2.93Å; K87-S89 VanDerWaalsContact C-N 3.29Å; K87-S89 PolarHBondContact O-N 3.41Å; K87-L90 HydrophobicContact CB-CB 4.05Å; K87-L90 WeakPolarHBondContact O-CB 3.34Å; K87-L90 PolarHBondContact O-N 3.46Å; K87-L91 PolarHBondContact O-N 3.23Å; K87-L91 VanDerWaalsContact O-N 3.08Å
88R86.3Confident90.4Very high102 Ų10250.2 Ų50.239%0.38527%0.267SS..Hα-helixtrans-55.9-41.1179.9-172.3173.8176-156.8-8.9113.2L90 L91 I92R88-L90 VanDerWaalsContact C-N 3.29Å; R88-L90 PolarHBondContact O-N 3.46Å; R88-L91 PolarHBondContact O-N 2.95Å; R88-I92 HydrophobicContact CG-CD1 4.08Å; R88-I92 VanDerWaalsContact O-CG1 3.32Å; R88-I92 WeakPolarHBondContact O-CG1 3.34Å; R88-I92 PolarHBondContact O-N 2.76Å
89S88.5Confident90.5Very high83 Ų8351.8 Ų51.858%0.5828%0.276SS*.Hα-helixtrans-58.9-41.5176.4540000112K87 I92 V93K87-S89 VanDerWaalsContact C-N 3.29Å; K87-S89 PolarHBondContact O-N 3.41Å; S89-I92 PolarHBondContact O-N 3.01Å; S89-V93 WeakPolarHBondContact O-CG2 3.47Å; S89-V93 PolarHBondContact O-N 3.35Å
90L89.9Confident90.6Very high44 Ų4455 Ų5523%0.2330%0.297CS..Hα-helixtrans-71.3-36-179.1-163.961.1000112.1C81 A82 N85 K87 R88 V93 Y94C81-L90 HydrophobicContact CB-CD2 3.97Å; C81-L90 WeakPolarHBondContact O-CD2 3.31Å; A82-L90 HydrophobicContact CB-CB 4.35Å; A82-L90 HydrophobicContact CB-CD2 4.35Å; A82-L90 HydrophobicContact CB-CG 3.91Å; N85-L90 HydrophobicContact CB-CD2 4.38Å; K87-L90 HydrophobicContact CB-CB 4.05Å; K87-L90 WeakPolarHBondContact O-CB 3.34Å; K87-L90 PolarHBondContact O-N 3.46Å; R88-L90 VanDerWaalsContact C-N 3.29Å; R88-L90 PolarHBondContact O-N 3.46Å; L90-V93 PolarHBondContact O-N 2.99Å; L90-Y94 WeakPolarHBondContact O-CB 3.1Å; L90-Y94 PolarHBondContact O-N 3.3Å
91L90.8Very high90.7Very high1 Ų155.8 Ų55.81%0.00530%0.301CS..Hα-helixtrans-65.3-37.4170.9-75.7165.9000112.6A82 K87 R88 Y94 L95 T241 L244 L248A82-L91 HydrophobicContact CB-CD2 3.87Å; A82-L91 HydrophobicContact CB-CG 4.17Å; K87-L91 PolarHBondContact O-N 3.23Å; K87-L91 VanDerWaalsContact O-N 3.08Å; R88-L91 PolarHBondContact O-N 2.95Å; L91-Y94 PolarHBondContact O-N 2.98Å; L91-L95 WeakPolarHBondContact O-CB 3.39Å; L91-L95 PolarHBondContact O-N 2.96Å; L91-T241 HydrophobicContact CB-CG2 4.41Å; L91-T241 HydrophobicContact CD2-CG2 4.05Å; L91-L244 HydrophobicContact CD1-CD2 4.17Å; L91-L244 HydrophobicContact CD1-CG 4.07Å; L91-L244 HydrophobicContact CD2-CD2 3.99Å; L91-L248 HydrophobicContact CD1-CD1 3.26Å
92I92.4Very high90.9Very high75 Ų7555.1 Ų55.139%0.38529%0.293SS..Hα-helixtrans-66-44.1174.8-68.1166.7000110.3R88 S89 Y94 L95 V96R88-I92 HydrophobicContact CG-CD1 4.08Å; R88-I92 VanDerWaalsContact O-CG1 3.32Å; R88-I92 WeakPolarHBondContact O-CG1 3.34Å; R88-I92 PolarHBondContact O-N 2.76Å; S89-I92 PolarHBondContact O-N 3.01Å; I92-Y94 VanDerWaalsContact C-N 3.33Å; I92-Y94 PolarHBondContact O-N 2.93Å; I92-L95 PolarHBondContact O-N 2.91Å; I92-V96 HydrophobicContact CG2-CG2 4.45Å; I92-V96 WeakPolarHBondContact O-CG2 3.38Å; I92-V96 PolarHBondContact O-N 3.43Å
93V93Very high91.2Very high79 Ų7959.5 Ų59.548%0.47932%0.316SS..Hα-helixtrans-58.9-46175.11710000110.9S89 L90 L95 V96 L97S89-V93 WeakPolarHBondContact O-CG2 3.47Å; S89-V93 PolarHBondContact O-N 3.35Å; L90-V93 PolarHBondContact O-N 2.99Å; V93-L95 PolarHBondContact O-N 3.39Å; V93-V96 PolarHBondContact O-N 3.44Å; V93-L97 WeakPolarHBondContact O-CB 3.37Å; V93-L97 PolarHBondContact O-N 3.44Å
94Y93.6Very high91.4Very high1 Ų164.4 Ų64.40%0.00434%0.341CS..Hα-helixtrans-59.8-43.7175.8177.1-115.5000112.3N25 T75 I78 G79 L90 L91 I92 L97 L98 T241N25-Y94 PolarHBondContact ND2-OH 2.63Å; N25-Y94 WeakPolarHBondContact OD1-CE2 3.42Å; N25-Y94 PolarHBondContact OD1-OH 3.26Å; T75-Y94 HydrophobicContact CG2-CE2 3.98Å; I78-Y94 HydrophobicContact CG2-CD2 4.42Å; G79-Y94 VanDerWaalsContact CA-CE2 3.43Å; L90-Y94 WeakPolarHBondContact O-CB 3.1Å; L90-Y94 PolarHBondContact O-N 3.3Å; L91-Y94 PolarHBondContact O-N 2.98Å; I92-Y94 VanDerWaalsContact C-N 3.33Å; I92-Y94 PolarHBondContact O-N 2.93Å; Y94-L97 PolarHBondContact O-N 2.95Å; Y94-L98 HydrophobicContact CD1-CD1 4.15Å; Y94-L98 HydrophobicContact CD2-CG 4.44Å; Y94-L98 HydrophobicContact CE1-CD1 3.51Å; Y94-L98 HydrophobicContact CE1-CG 4.2Å; Y94-L98 HydrophobicContact CE2-CD1 4.2Å; Y94-L98 HydrophobicContact CE2-CD2 4.17Å; Y94-L98 HydrophobicContact CE2-CG 4.01Å; Y94-L98 PolarHBondContact O-N 2.87Å; Y94-T241 HydrophobicContact CD1-CG2 3.84Å; Y94-T241 HydrophobicContact CE1-CG2 4.41Å; Y94-T241 VanDerWaalsContact CE1-OG1 3.3Å; Y94-T241 WeakPolarHBondContact CE1-OG1 3.5Å
95L94.4Very high91.7Very high44 Ų4460.9 Ų60.923%0.2332%0.322CS..Hα-helixtrans-62-45.5177-177.767.1000112.5L91 I92 V93 L97 L98 L99 M238 T241L91-L95 WeakPolarHBondContact O-CB 3.39Å; L91-L95 PolarHBondContact O-N 2.96Å; I92-L95 PolarHBondContact O-N 2.91Å; V93-L95 PolarHBondContact O-N 3.39Å; L95-L97 VanDerWaalsContact C-N 3.29Å; L95-L97 PolarHBondContact O-N 3.26Å; L95-L98 PolarHBondContact O-N 3.35Å; L95-L99 PolarHBondContact O-N 3.29Å; L95-M238 HydrophobicContact CD1-CB 3.81Å; L95-M238 HydrophobicContact CD1-CG 3.85Å; L95-M238 HydrophobicContact CD1-SD 4.48Å; L95-T241 HydrophobicContact CB-CG2 4.06Å; L95-T241 HydrophobicContact CD1-CG2 4.42Å
96V94.9Very high92.2Very high81 Ų8160.6 Ų60.649%0.49132%0.319SS..Hα-helixtrans-61.6-41.5176.7170.50000110.4I92 V93 L99 C100I92-V96 HydrophobicContact CG2-CG2 4.45Å; I92-V96 WeakPolarHBondContact O-CG2 3.38Å; I92-V96 PolarHBondContact O-N 3.43Å; V93-V96 PolarHBondContact O-N 3.44Å; V96-L99 WeakPolarHBondContact O-CB 3.31Å; V96-L99 PolarHBondContact O-N 2.81Å; V96-C100 PolarHBondContact O-N 3.2Å; V96-C100 PolarHBondContact O-SG 2.97Å
97L93.6Very high92.9Very high44 Ų4461.6 Ų61.623%0.2333%0.329CS..Hα-helixtrans-66.6-42.4178.9178.9146000112.1T75 I78 V93 Y94 L95 L99 C100 V101T75-L97 HydrophobicContact CG2-CD2 3.27Å; T75-L97 WeakPolarHBondContact OG1-CD2 3.38Å; I78-L97 HydrophobicContact CD1-CD1 4.12Å; V93-L97 WeakPolarHBondContact O-CB 3.37Å; V93-L97 PolarHBondContact O-N 3.44Å; Y94-L97 PolarHBondContact O-N 2.95Å; L95-L97 VanDerWaalsContact C-N 3.29Å; L95-L97 PolarHBondContact O-N 3.26Å; L97-L99 VanDerWaalsContact C-N 3.3Å; L97-L99 PolarHBondContact O-N 3.48Å; L97-C100 PolarHBondContact O-N 2.9Å; L97-V101 HydrophobicContact CD2-CG2 4.47Å; L97-V101 WeakPolarHBondContact O-CG2 3.17Å; L97-V101 PolarHBondContact O-N 3.44Å
98L93.6Very high93.3Very high4 Ų458.5 Ų58.52%0.02133%0.326CS..Hα-helixtrans-59.3-41.2172.1-75.3-179.5000111.8T75 Y94 L95 V101 F102 M238T75-L98 HydrophobicContact CG2-CD2 3.99Å; Y94-L98 HydrophobicContact CD1-CD1 4.15Å; Y94-L98 HydrophobicContact CD2-CG 4.44Å; Y94-L98 HydrophobicContact CE1-CD1 3.51Å; Y94-L98 HydrophobicContact CE1-CG 4.2Å; Y94-L98 HydrophobicContact CE2-CD1 4.2Å; Y94-L98 HydrophobicContact CE2-CD2 4.17Å; Y94-L98 HydrophobicContact CE2-CG 4.01Å; Y94-L98 PolarHBondContact O-N 2.87Å; L95-L98 PolarHBondContact O-N 3.35Å; L98-V101 PolarHBondContact O-N 3.22Å; L98-F102 WeakPolarHBondContact O-CB 3.37Å; L98-F102 PolarHBondContact O-N 3.45Å; L98-M238 HydrophobicContact CB-CG 3.77Å; L98-M238 HydrophobicContact CB-SD 4.33Å; L98-M238 HydrophobicContact CD1-CG 3.89Å
99L95.4Very high93.6Very high82 Ų8255.6 Ų55.643%0.42933%0.329SS..Hα-helixtrans-63.2-43.5176.4179.463.8000111.8L95 V96 L97 V101 F102 L103 M238L95-L99 PolarHBondContact O-N 3.29Å; V96-L99 WeakPolarHBondContact O-CB 3.31Å; V96-L99 PolarHBondContact O-N 2.81Å; L97-L99 VanDerWaalsContact C-N 3.3Å; L97-L99 PolarHBondContact O-N 3.48Å; L99-V101 PolarHBondContact O-N 2.97Å; L99-F102 WeakPolarHBondContact O-CB 3.37Å; L99-F102 PolarHBondContact O-N 3.38Å; L99-L103 HydrophobicContact CD1-CG 4.48Å; L99-L103 HydrophobicContact CG-CD1 4.42Å; L99-L103 WeakPolarHBondContact O-CG 3.45Å; L99-L103 PolarHBondContact O-N 2.93Å; L99-M238 HydrophobicContact CB-SD 4.33Å
100C94.6Very high93.9Very high66 Ų6655.7 Ų55.745%0.44633%0.325SS..Hα-helixtrans-60.8-44.3176-69.60000111.7V96 L97 F102 L103 L104V96-C100 PolarHBondContact O-N 3.2Å; V96-C100 PolarHBondContact O-SG 2.97Å; L97-C100 PolarHBondContact O-N 2.9Å; C100-F102 VanDerWaalsContact C-N 3.35Å; C100-L103 PolarHBondContact O-N 2.82Å; C100-L104 WeakPolarHBondContact O-CG 3.38Å; C100-L104 PolarHBondContact O-N 3.26Å
101V94.3Very high94Very high30 Ų3057.5 Ų57.518%0.18234%0.335CS..Hα-helixtrans-62.7-42.9176.9175.70000110.8I71 L97 L98 L99 L103 L104 E105I71-V101 HydrophobicContact CG2-CG2 3.99Å; L97-V101 HydrophobicContact CD2-CG2 4.47Å; L97-V101 WeakPolarHBondContact O-CG2 3.17Å; L97-V101 PolarHBondContact O-N 3.44Å; L98-V101 PolarHBondContact O-N 3.22Å; L99-V101 PolarHBondContact O-N 2.97Å; V101-L103 PolarHBondContact O-N 3.3Å; V101-L104 WeakPolarHBondContact O-CB 3.48Å; V101-L104 PolarHBondContact O-N 3.41Å; V101-E105 WeakPolarHBondContact O-CB 3.32Å; V101-E105 PolarHBondContact O-N 2.86Å
102F95.8Very high93.9Very high37 Ų3759.9 Ų59.916%0.16235%0.354CS..Hα-helixtrans-59.9-42.6176.6-178.6-104.2000112.7L98 L99 C100 E105 I106 A231 Q234 L235 M238L98-F102 WeakPolarHBondContact O-CB 3.37Å; L98-F102 PolarHBondContact O-N 3.45Å; L99-F102 WeakPolarHBondContact O-CB 3.37Å; L99-F102 PolarHBondContact O-N 3.38Å; C100-F102 VanDerWaalsContact C-N 3.35Å; F102-E105 PolarHBondContact O-N 3.48Å; F102-I106 HydrophobicContact CD1-CD1 3.9Å; F102-I106 HydrophobicContact CE1-CD1 3.38Å; F102-I106 HydrophobicContact CE1-CG1 4.38Å; F102-I106 HydrophobicContact CE2-CD1 4.5Å; F102-I106 HydrophobicContact CZ-CD1 3.73Å; F102-I106 HydrophobicContact CZ-CG1 4.44Å; F102-I106 WeakPolarHBondContact O-CG1 3.03Å; F102-I106 PolarHBondContact O-N 3.33Å; F102-A231 HydrophobicContact CD2-CB 4.39Å; F102-A231 HydrophobicContact CE2-CB 4.03Å; F102-Q234 VanDerWaalsContact CB-OE1 3.31Å; F102-L235 HydrophobicContact CE2-CD1 4.22Å; F102-L235 HydrophobicContact CE2-CD2 4.14Å; F102-L235 HydrophobicContact CE2-CG 3.97Å; F102-L235 HydrophobicContact CZ-CD1 4.38Å; F102-L235 HydrophobicContact CZ-CD2 4.07Å; F102-L235 HydrophobicContact CZ-CG 4.31Å; F102-M238 HydrophobicContact CB-CE 4.06Å; F102-M238 HydrophobicContact CD1-CE 4.45Å; F102-M238 HydrophobicContact CD2-CE 4.26Å; F102-M238 HydrophobicContact CG-CE 4.01Å
103L96.1Very high93.7Very high92 Ų9263.5 Ų63.548%0.48237%0.365SS..Hα-helixtrans-67-37.9176.2-67.6175.6000112.3L99 C100 V101 E105 I106 T107L99-L103 HydrophobicContact CD1-CG 4.48Å; L99-L103 HydrophobicContact CG-CD1 4.42Å; L99-L103 WeakPolarHBondContact O-CG 3.45Å; L99-L103 PolarHBondContact O-N 2.93Å; C100-L103 PolarHBondContact O-N 2.82Å; V101-L103 PolarHBondContact O-N 3.3Å; L103-E105 VanDerWaalsContact C-N 3.32Å; L103-I106 PolarHBondContact O-N 2.89Å; L103-T107 WeakPolarHBondContact O-CB 3.41Å; L103-T107 PolarHBondContact O-N 3.04Å; L103-T107 PolarHBondContact O-OG1 2.97Å
104L94.3Very high93.5Very high109 Ų10962.9 Ų62.957%0.57136%0.361SS*.Hα-helixtrans-64.3-39.1173.7-72.6173000111.5C100 V101 T107 A108C100-L104 WeakPolarHBondContact O-CG 3.38Å; C100-L104 PolarHBondContact O-N 3.26Å; V101-L104 WeakPolarHBondContact O-CB 3.48Å; V101-L104 PolarHBondContact O-N 3.41Å; L104-T107 PolarHBondContact O-N 3.45Å; L104-A108 WeakPolarHBondContact O-CB 3.33Å; L104-A108 PolarHBondContact O-N 3.3Å
105E93.8Very high93.1Very high40 Ų4069.1 Ų69.119%0.18739%0.385CS..Hα-helixtrans-65.5-43.8177.2-174171.2178.800112V101 F102 L103 T107 A108 G109 I230 A231 Q234V101-E105 WeakPolarHBondContact O-CB 3.32Å; V101-E105 PolarHBondContact O-N 2.86Å; F102-E105 PolarHBondContact O-N 3.48Å; L103-E105 VanDerWaalsContact C-N 3.32Å; E105-T107 VanDerWaalsContact C-N 3.33Å; E105-T107 PolarHBondContact O-N 3.34Å; E105-A108 PolarHBondContact O-N 2.89Å; E105-G109 PolarHBondContact O-N 3.2Å; E105-I230 WeakPolarHBondContact OE1-CB 3.1Å; E105-A231 PolarHBondContact OE1-N 3.43Å; E105-Q234 VanDerWaalsContact OE2-CD 3.3Å; E105-Q234 PolarHBondContact OE2-NE2 3.43Å; E105-Q234 PolarHBondContact OE2-OE1 3.05Å
106I95.5Very high92.6Very high81 Ų8168.4 Ų68.442%0.41538%0.381SS..Hα-helixtrans-59.4-46.5171.9-70173.6000110.4F102 L103 A108 G109 V110F102-I106 HydrophobicContact CD1-CD1 3.9Å; F102-I106 HydrophobicContact CE1-CD1 3.38Å; F102-I106 HydrophobicContact CE1-CG1 4.38Å; F102-I106 HydrophobicContact CE2-CD1 4.5Å; F102-I106 HydrophobicContact CZ-CD1 3.73Å; F102-I106 HydrophobicContact CZ-CG1 4.44Å; F102-I106 WeakPolarHBondContact O-CG1 3.03Å; F102-I106 PolarHBondContact O-N 3.33Å; L103-I106 PolarHBondContact O-N 2.89Å; I106-A108 VanDerWaalsContact C-N 3.35Å; I106-A108 PolarHBondContact O-N 3.41Å; I106-G109 PolarHBondContact O-N 2.74Å; I106-V110 HydrophobicContact CG2-CG2 4.33Å; I106-V110 WeakPolarHBondContact O-CG2 3.27Å; I106-V110 PolarHBondContact O-N 2.87Å
107T95.4Very high91.9Very high75 Ų7569.5 Ų69.546%0.4638%0.38SS..Hα-helixtrans-61.3-45.1-179.9-55.20000110.9L103 L104 E105 G109 V110 L111L103-T107 WeakPolarHBondContact O-CB 3.41Å; L103-T107 PolarHBondContact O-N 3.04Å; L103-T107 PolarHBondContact O-OG1 2.97Å; L104-T107 PolarHBondContact O-N 3.45Å; E105-T107 VanDerWaalsContact C-N 3.33Å; E105-T107 PolarHBondContact O-N 3.34Å; T107-G109 PolarHBondContact O-N 3.32Å; T107-V110 PolarHBondContact O-N 3.41Å; T107-L111 HydrophobicContact CG2-CD1 4.15Å; T107-L111 HydrophobicContact CG2-CG 4.48Å; T107-L111 WeakPolarHBondContact O-CB 3.46Å; T107-L111 VanDerWaalsContact O-CG 3.3Å; T107-L111 WeakPolarHBondContact O-CG 3.36Å; T107-L111 PolarHBondContact O-N 2.91Å
108A92.8Very high91.3Very high58 Ų5872.2 Ų72.248%0.47939%0.392SS..Hα-helixtrans-62.1-42.4176.400000111.8L104 E105 I106 L111 A112L104-A108 WeakPolarHBondContact O-CB 3.33Å; L104-A108 PolarHBondContact O-N 3.3Å; E105-A108 PolarHBondContact O-N 2.89Å; I106-A108 VanDerWaalsContact C-N 3.35Å; I106-A108 PolarHBondContact O-N 3.41Å; A108-L111 PolarHBondContact O-N 3.37Å; A108-A112 VanDerWaalsContact O-CB 3.29Å; A108-A112 WeakPolarHBondContact O-CB 3.37Å; A108-A112 PolarHBondContact O-N 2.9Å
109G93.4Very high90.5Very high42 Ų4276.4 Ų76.443%0.43341%0.414SS..Hα-helixtrans-63.1-43.617600000113E105 I106 T107 A112 Y113E105-G109 PolarHBondContact O-N 3.2Å; I106-G109 PolarHBondContact O-N 2.74Å; T107-G109 PolarHBondContact O-N 3.32Å; G109-A112 PolarHBondContact O-N 3.42Å; G109-Y113 PolarHBondContact O-N 2.64Å
110V93.5Very high89.7Confident84 Ų8473.8 Ų73.851%0.50940%0.4SS..Hα-helixtrans-64-46.2175.9172.10000110.9I106 T107 A112 Y113 V114I106-V110 HydrophobicContact CG2-CG2 4.33Å; I106-V110 WeakPolarHBondContact O-CG2 3.27Å; I106-V110 PolarHBondContact O-N 2.87Å; T107-V110 PolarHBondContact O-N 3.41Å; V110-A112 PolarHBondContact O-N 3.42Å; V110-Y113 PolarHBondContact O-N 3.32Å; V110-V114 HydrophobicContact CG1-CG2 4.47Å; V110-V114 WeakPolarHBondContact O-CG2 3.09Å; V110-V114 PolarHBondContact O-N 3.4Å
111L92Very high89Confident83 Ų8375.6 Ų75.644%0.43541%0.405SS..Hα-helixtrans-60.9-45.3176.4-72175.1000111.2T107 A108 Y113 V114 Y115T107-L111 HydrophobicContact CG2-CD1 4.15Å; T107-L111 HydrophobicContact CG2-CG 4.48Å; T107-L111 WeakPolarHBondContact O-CB 3.46Å; T107-L111 VanDerWaalsContact O-CG 3.3Å; T107-L111 WeakPolarHBondContact O-CG 3.36Å; T107-L111 PolarHBondContact O-N 2.91Å; A108-L111 PolarHBondContact O-N 3.37Å; L111-Y113 VanDerWaalsContact C-N 3.3Å; L111-Y113 PolarHBondContact O-N 3.33Å; L111-V114 PolarHBondContact O-N 3.4Å; L111-Y115 HydrophobicContact CB-CD2 4.19Å; L111-Y115 HydrophobicContact CB-CE2 4.19Å; L111-Y115 HydrophobicContact CD2-CE2 4.11Å; L111-Y115 WeakPolarHBondContact O-CB 3.28Å; L111-Y115 WeakPolarHBondContact O-CD2 3.29Å; L111-Y115 PolarHBondContact O-N 3.45Å
112A89.4Confident88.5Confident50 Ų5079.4 Ų79.441%0.41342%0.421SS..Hα-helixtrans-58.9-41.9177.400000111.9A108 G109 V110 Q116A108-A112 VanDerWaalsContact O-CB 3.29Å; A108-A112 WeakPolarHBondContact O-CB 3.37Å; A108-A112 PolarHBondContact O-N 2.9Å; G109-A112 PolarHBondContact O-N 3.42Å; V110-A112 PolarHBondContact O-N 3.42Å; A112-Q116 VanDerWaalsContact O-CB 3.28Å; A112-Q116 WeakPolarHBondContact O-CB 3.43Å; A112-Q116 PolarHBondContact O-N 2.89Å
113Y89.1Confident87.9Confident152 Ų15279.5 Ų79.560%0.59642%0.423SS*.Hα-helixtrans-64.7-45.3176.3179.4-99.6000112.5G109 V110 L111 Q116 Q117G109-Y113 PolarHBondContact O-N 2.64Å; V110-Y113 PolarHBondContact O-N 3.32Å; L111-Y113 VanDerWaalsContact C-N 3.3Å; L111-Y113 PolarHBondContact O-N 3.33Å; Y113-Q116 PolarHBondContact O-N 3.38Å; Y113-Q117 PolarHBondContact O-N 3.5Å
114V89Confident87.3Confident66 Ų6679.7 Ų79.740%0.442%0.418SS..Hα-helixtrans-64.2-46.4178.6172.30000111V110 L111 Q117V110-V114 HydrophobicContact CG1-CG2 4.47Å; V110-V114 WeakPolarHBondContact O-CG2 3.09Å; V110-V114 PolarHBondContact O-N 3.4Å; L111-V114 PolarHBondContact O-N 3.4Å; V114-Q117 PolarHBondContact O-N 3.25Å
115Y83.9Confident86.9Confident131 Ų13180.9 Ų80.951%0.51442%0.42SS..Hα-helixtrans-68.1-33.6178.8-75.3-60.7000112.4L111 Q117 Q118 L119L111-Y115 HydrophobicContact CB-CD2 4.19Å; L111-Y115 HydrophobicContact CB-CE2 4.19Å; L111-Y115 HydrophobicContact CD2-CE2 4.11Å; L111-Y115 WeakPolarHBondContact O-CB 3.28Å; L111-Y115 WeakPolarHBondContact O-CD2 3.29Å; L111-Y115 PolarHBondContact O-N 3.45Å; Y115-Q117 VanDerWaalsContact C-N 3.26Å; Y115-Q117 PolarHBondContact O-N 3.44Å; Y115-Q118 PolarHBondContact O-N 3.43Å; Y115-Q118 VanDerWaalsContact O-N 3.11Å; Y115-L119 WeakPolarHBondContact O-CB 3.3Å; Y115-L119 WeakPolarHBondContact O-CG 3.36Å; Y115-L119 PolarHBondContact O-N 2.82Å
116Q83.9Confident86.6Confident30 Ų3082.6 Ų82.614%0.1443%0.431CS..Hα-helixtrans-56.2-42.6174.7-177.7-17814.800111.6A112 Y113 Q118 L119 D120 L220A112-Q116 VanDerWaalsContact O-CB 3.28Å; A112-Q116 WeakPolarHBondContact O-CB 3.43Å; A112-Q116 PolarHBondContact O-N 2.89Å; Y113-Q116 PolarHBondContact O-N 3.38Å; Q116-Q118 VanDerWaalsContact C-N 3.3Å; Q116-Q118 PolarHBondContact O-N 3.29Å; Q116-L119 PolarHBondContact O-N 2.85Å; Q116-D120 PolarHBondContact O-N 3.5Å; Q116-L220 HydrophobicContact CB-CD1 4.13Å; Q116-L220 VanDerWaalsContact CD-CD1 3.46Å; Q116-L220 HydrophobicContact CG-CD1 3.6Å
117Q79.6Confident86.3Confident103 Ų10379.8 Ų79.848%0.48142%0.416SS..Hα-helixtrans-64.7-34.1179-63-62.4-57.600112.6Y113 V114 Y115Y113-Q117 PolarHBondContact O-N 3.5Å; V114-Q117 PolarHBondContact O-N 3.25Å; Y115-Q117 VanDerWaalsContact C-N 3.26Å; Y115-Q117 PolarHBondContact O-N 3.44Å
118Q81.6Confident86.1Confident102 Ų10279.6 Ų79.648%0.47741%0.409SS..Hα-helixtrans-78.8-35.8178.4-67.4176.7-10.100112.3Y115 Q116 D120 E122Y115-Q118 PolarHBondContact O-N 3.43Å; Y115-Q118 VanDerWaalsContact O-N 3.11Å; Q116-Q118 VanDerWaalsContact C-N 3.3Å; Q116-Q118 PolarHBondContact O-N 3.29Å; Q118-D120 VanDerWaalsContact C-N 3.3Å; Q118-D120 PolarHBondContact O-N 3.3Å; Q118-E122 PolarHBondContact O-N 3.48Å
119L77Confident86Confident91 Ų9180.5 Ų80.548%0.47641%0.405SS..Hα-helixtrans-62.8-34.8-177.6-78.6169.6000112.4Y115 Q116 L123Y115-L119 WeakPolarHBondContact O-CB 3.3Å; Y115-L119 WeakPolarHBondContact O-CG 3.36Å; Y115-L119 PolarHBondContact O-N 2.82Å; Q116-L119 PolarHBondContact O-N 2.85Å; L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 PolarHBondContact O-N 3.46Å
120D78.4Confident85.9Confident27 Ų2780.6 Ų80.614%0.14440%0.396CS..Hα-helixtrans-58.1-54-178.7-73.5-8.3000110.5Q116 Q118 L123 R124 R217Q116-D120 PolarHBondContact O-N 3.5Å; Q118-D120 VanDerWaalsContact C-N 3.3Å; Q118-D120 PolarHBondContact O-N 3.3Å; D120-L123 PolarHBondContact O-N 2.86Å; D120-R124 WeakPolarHBondContact O-CG 3.37Å; D120-R124 PolarHBondContact O-N 3.26Å; D120-R217 IonicContact OD2-NH2 3.57Å; D120-R217 PolarHBondContact OD2-NH2 3.05Å
121D81.1Confident85.8Confident104 Ų10476.9 Ų76.956%0.55637%0.373SS*.Hα-helixtrans-70-41.9-177.9-74.7-28.9000113.6L123 R124 Q125D121-L123 VanDerWaalsContact C-N 3.31Å; D121-L123 PolarHBondContact O-N 2.98Å; D121-R124 PolarHBondContact O-N 2.91Å; D121-Q125 PolarHBondContact O-N 3.28Å
122E83.6Confident85.9Confident110 Ų11074.1 Ų74.151%0.51436%0.358SS..Hα-helixtrans-63.3-39.4176.7-77.1-168.5176.400111.4Q118 Q125 N126Q118-E122 PolarHBondContact O-N 3.48Å; E122-Q125 PolarHBondContact O-N 3.47Å; E122-N126 WeakPolarHBondContact O-CB 3.2Å; E122-N126 VanDerWaalsContact O-CG 3.25Å; E122-N126 PolarHBondContact O-N 2.95Å; E122-N126 PolarHBondContact O-ND2 3.38Å
123L83.1Confident86.1Confident39 Ų3976.3 Ų76.320%0.20436%0.36CS..Hα-helixtrans-62.4-45.1178.3-18063.6000111.1L119 D120 D121 Q125 L127 L212 E213 I216L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 PolarHBondContact O-N 3.46Å; D120-L123 PolarHBondContact O-N 2.86Å; D121-L123 VanDerWaalsContact C-N 3.31Å; D121-L123 PolarHBondContact O-N 2.98Å; L123-Q125 VanDerWaalsContact C-N 3.35Å; L123-Q125 PolarHBondContact O-N 3.32Å; L123-L127 WeakPolarHBondContact O-CB 3.48Å; L123-L127 PolarHBondContact O-N 2.95Å; L123-L212 HydrophobicContact CD1-CD2 3.81Å; L123-L212 HydrophobicContact CD2-CD2 4.03Å; L123-L212 HydrophobicContact CD2-CG 4.07Å; L123-L212 HydrophobicContact CG-CD2 4.33Å; L123-E213 HydrophobicContact CD2-CG 4.07Å; L123-I216 HydrophobicContact CD2-CD1 3.82Å
124R83.2Confident86.2Confident97 Ų9772.6 Ų72.637%0.36635%0.347SS..Hα-helixtrans-56.9-49.9178.5-54.1-152.2166131.6-5.8111.3D120 D121 K128 V209 E213D120-R124 WeakPolarHBondContact O-CG 3.37Å; D120-R124 PolarHBondContact O-N 3.26Å; D121-R124 PolarHBondContact O-N 2.91Å; R124-K128 PolarHBondContact O-N 3.27Å; R124-V209 HydrophobicContact CB-CG1 4.14Å; R124-V209 HydrophobicContact CG-CG1 3.57Å; R124-E213 VanDerWaalsContact CG-OE1 3.26Å; R124-E213 WeakPolarHBondContact CG-OE1 3.29Å; R124-E213 IonicContact CZ-OE1 3.98Å; R124-E213 VanDerWaalsContact CZ-OE1 3.32Å; R124-E213 IonicContact CZ-OE2 3.32Å; R124-E213 IonicContact NE-OE1 3.67Å; R124-E213 PolarHBondContact NE-OE1 3.44Å; R124-E213 IonicContact NE-OE2 2.69Å; R124-E213 IonicContact NH2-OE1 2.74Å; R124-E213 PolarHBondContact NH2-OE1 2.95Å; R124-E213 IonicContact NH2-OE2 3.42Å; R124-E213 PolarHBondContact NH2-OE2 3.47Å
125Q85.4Confident86.4Confident133 Ų13369.9 Ų69.962%0.62133%0.33SS*.Hα-helixtrans-68.7-48.6-177-67.5-174.7-6.500111.6D121 E122 L123 L127 K128 L129D121-Q125 PolarHBondContact O-N 3.28Å; E122-Q125 PolarHBondContact O-N 3.47Å; L123-Q125 VanDerWaalsContact C-N 3.35Å; L123-Q125 PolarHBondContact O-N 3.32Å; Q125-L127 PolarHBondContact O-N 3.06Å; Q125-K128 PolarHBondContact O-N 3.33Å; Q125-L129 WeakPolarHBondContact O-CB 3.47Å; Q125-L129 VanDerWaalsContact O-CG 3.3Å; Q125-L129 WeakPolarHBondContact O-CG 3.37Å; Q125-L129 PolarHBondContact O-N 3.34Å
126N87.6Confident86.7Confident77 Ų7768 Ų6841%0.41233%0.328SS..Hα-helixtrans-66.5-39-177.3-74.4-40.6000111.8E122 N130E122-N126 WeakPolarHBondContact O-CB 3.2Å; E122-N126 VanDerWaalsContact O-CG 3.25Å; E122-N126 PolarHBondContact O-N 2.95Å; E122-N126 PolarHBondContact O-ND2 3.38Å; N126-N130 WeakPolarHBondContact O-CB 3.28Å; N126-N130 PolarHBondContact O-N 3.46Å; N126-N130 PolarHBondContact O-ND2 3.24Å
127L89.4Confident87Confident21 Ų2169.2 Ų69.211%0.1133%0.334CS..Hα-helixtrans-64.4-46.6179.2-171.162.4000111L123 Q125 N130 M131 L150 C208 V209 L212L123-L127 WeakPolarHBondContact O-CB 3.48Å; L123-L127 PolarHBondContact O-N 2.95Å; Q125-L127 PolarHBondContact O-N 3.06Å; L127-N130 PolarHBondContact O-N 3.38Å; L127-M131 HydrophobicContact CD1-CE 3.7Å; L127-M131 HydrophobicContact CD2-CE 3.99Å; L127-M131 HydrophobicContact CG-CE 3.73Å; L127-M131 HydrophobicContact CG-SD 4.26Å; L127-M131 WeakPolarHBondContact O-CB 3.42Å; L127-M131 VanDerWaalsContact O-CG 3.31Å; L127-M131 WeakPolarHBondContact O-CG 3.26Å; L127-M131 PolarHBondContact O-N 3.39Å; L127-L150 HydrophobicContact CD1-CD2 3.89Å; L127-L150 HydrophobicContact CD2-CD2 3.95Å; L127-L150 HydrophobicContact CG-CD2 4.5Å; L127-C208 HydrophobicContact CD2-CB 4.32Å; L127-V209 HydrophobicContact CB-CG2 4.35Å; L127-V209 HydrophobicContact CD2-CG2 3.72Å; L127-V209 HydrophobicContact CG-CG2 4.47Å; L127-L212 HydrophobicContact CD2-CD2 4.35Å
128K91Very high87.4Confident71 Ų7170 Ų7031%0.30935%0.348SS..Hα-helixtrans-60.4-50.4177.1-172.7172.4179.1170.40111.7R124 Q125 N130 M131 Q132 S159 D164R124-K128 PolarHBondContact O-N 3.27Å; Q125-K128 PolarHBondContact O-N 3.33Å; K128-N130 PolarHBondContact O-N 3.41Å; K128-M131 PolarHBondContact O-N 2.88Å; K128-Q132 HydrophobicContact CG-CG 4.47Å; K128-Q132 WeakPolarHBondContact O-CB 3.35Å; K128-Q132 WeakPolarHBondContact O-CG 3.38Å; K128-Q132 PolarHBondContact O-N 2.96Å; K128-S159 WeakPolarHBondContact CB-OG 3.25Å; K128-D164 IonicContact NZ-OD1 3.89Å
129L91.3Very high87.7Confident77 Ų7768.6 Ų68.640%0.40336%0.36SS..Hα-helixtrans-61.4-44.9-180-72.5171.4000111.8Q125 Q132 Q133Q125-L129 WeakPolarHBondContact O-CB 3.47Å; Q125-L129 VanDerWaalsContact O-CG 3.3Å; Q125-L129 WeakPolarHBondContact O-CG 3.37Å; Q125-L129 PolarHBondContact O-N 3.34Å; L129-Q132 PolarHBondContact O-N 3.2Å; L129-Q133 VanDerWaalsContact O-CB 3.3Å; L129-Q133 WeakPolarHBondContact O-CB 3.5Å; L129-Q133 PolarHBondContact O-N 3.19Å
130N90.2Very high88.2Confident45 Ų4567.4 Ų67.424%0.24135%0.352CS..Hα-helixtrans-64.5-42.5178.5-71.6-38.6000111.8N126 L127 K128 Q132 K134 Y135 V143N126-N130 WeakPolarHBondContact O-CB 3.28Å; N126-N130 PolarHBondContact O-N 3.46Å; N126-N130 PolarHBondContact O-ND2 3.24Å; L127-N130 PolarHBondContact O-N 3.38Å; K128-N130 PolarHBondContact O-N 3.41Å; N130-Q132 VanDerWaalsContact C-N 3.34Å; N130-Q132 PolarHBondContact O-N 2.66Å; N130-K134 WeakPolarHBondContact O-CA 3.25Å; N130-K134 WeakPolarHBondContact O-CB 3.31Å; N130-K134 PolarHBondContact O-N 3.1Å; N130-K134 WeakPolarHBondContact OD1-CD 3.27Å; N130-K134 VanDerWaalsContact OD1-CE 3.32Å; N130-K134 WeakPolarHBondContact OD1-CE 3.32Å; N130-K134 PolarHBondContact OD1-NZ 2.92Å; N130-Y135 PolarHBondContact O-N 2.88Å; N130-V143 HydrophobicContact CB-CG1 4.13Å
131M92.7Very high88.6Confident5 Ų573.8 Ų73.83%0.02538%0.381CS..Hα-helixtrans-62.6-40.6174.8-74.5179.9178.900112L127 K128 Y135 V147 L150 W165 C208L127-M131 HydrophobicContact CD1-CE 3.7Å; L127-M131 HydrophobicContact CD2-CE 3.99Å; L127-M131 HydrophobicContact CG-CE 3.73Å; L127-M131 HydrophobicContact CG-SD 4.26Å; L127-M131 WeakPolarHBondContact O-CB 3.42Å; L127-M131 VanDerWaalsContact O-CG 3.31Å; L127-M131 WeakPolarHBondContact O-CG 3.26Å; L127-M131 PolarHBondContact O-N 3.39Å; K128-M131 PolarHBondContact O-N 2.88Å; M131-Y135 WeakPolarHBondContact O-CB 3.28Å; M131-V147 HydrophobicContact CE-CG1 4.15Å; M131-V147 HydrophobicContact CE-CG2 4.4Å; M131-V147 HydrophobicContact CG-CG1 4.06Å; M131-V147 HydrophobicContact CG-CG2 3.76Å; M131-L150 HydrophobicContact CE-CD2 3.62Å; M131-W165 HydrophobicContact CB-CH2 3.99Å; M131-W165 HydrophobicContact CB-CZ2 4.3Å; M131-W165 HydrophobicContact CG-CH2 4.27Å; M131-W165 HydrophobicContact CG-CZ2 4.31Å; M131-W165 WeakPolarHBondContact O-CZ3 3.34Å; M131-W165 HydrophobicContact SD-CZ2 4.31Å; M131-C208 HydrophobicContact CE-CB 4.12Å
132Q92.6Very high88.8Confident26 Ų2672.6 Ų72.612%0.12138%0.381CS..Hα-helixtrans-79.5-38.4-176.1-71.3-178-29.500113.3K128 L129 N130 D164 S168 E169K128-Q132 HydrophobicContact CG-CG 4.47Å; K128-Q132 WeakPolarHBondContact O-CB 3.35Å; K128-Q132 WeakPolarHBondContact O-CG 3.38Å; K128-Q132 PolarHBondContact O-N 2.96Å; L129-Q132 PolarHBondContact O-N 3.2Å; N130-Q132 VanDerWaalsContact C-N 3.34Å; N130-Q132 PolarHBondContact O-N 2.66Å; Q132-D164 PolarHBondContact NE2-O 2.69Å; Q132-S168 CarbonylContact O-C 3.51Å; Q132-S168 VanDerWaalsContact O-CA 3.3Å; Q132-S168 WeakPolarHBondContact O-CA 3.37Å; Q132-E169 PolarHBondContact O-N 3.28Å
133Q93.4Very high89Confident95 Ų9568.6 Ų68.644%0.44436%0.364SS..Hα-helixtrans-104.9-19.1-170.4-62.8-177.1-32.800114.5L129 Q137L129-Q133 VanDerWaalsContact O-CB 3.3Å; L129-Q133 WeakPolarHBondContact O-CB 3.5Å; L129-Q133 PolarHBondContact O-N 3.19Å; Q133-Q137 VanDerWaalsContact O-CG 3.23Å; Q133-Q137 WeakPolarHBondContact O-CG 3.3Å
134K92.3Very high89.3Confident74 Ų7467.7 Ų67.732%0.32236%0.36SS..THydrogen-bonded Turntrans-120.1-13.5-172.9-61.2-177.9-172.2164.40113.8N130 L136 Q137 Q140 V143N130-K134 WeakPolarHBondContact O-CA 3.25Å; N130-K134 WeakPolarHBondContact O-CB 3.31Å; N130-K134 PolarHBondContact O-N 3.1Å; N130-K134 WeakPolarHBondContact OD1-CD 3.27Å; N130-K134 VanDerWaalsContact OD1-CE 3.32Å; N130-K134 WeakPolarHBondContact OD1-CE 3.32Å; N130-K134 PolarHBondContact OD1-NZ 2.92Å; K134-L136 PolarHBondContact O-N 3.32Å; K134-Q137 PolarHBondContact O-N 3.41Å; K134-Q140 HydrophobicContact CB-CB 4.15Å; K134-Q140 HydrophobicContact CB-CG 4.05Å; K134-Q140 HydrophobicContact CG-CG 4.29Å; K134-Q140 VanDerWaalsContact O-CB 3.32Å; K134-Q140 WeakPolarHBondContact O-CB 3.49Å; K134-V143 HydrophobicContact CB-CB 4.24Å; K134-V143 HydrophobicContact CB-CG1 3.93Å; K134-V143 HydrophobicContact CB-CG2 4.23Å; K134-V143 HydrophobicContact CD-CG2 4.21Å
135Y92.4Very high89.7Confident10 Ų1069 Ų694%0.03937%0.374CS..THydrogen-bonded Turntrans-62.3129.2176.8-171-100.1000111.2N130 M131 Q137 T144 V147 D148 W165 W170 P181N130-Y135 PolarHBondContact O-N 2.88Å; M131-Y135 WeakPolarHBondContact O-CB 3.28Å; Y135-Q137 PolarHBondContact O-N 3.49Å; Y135-Q137 VanDerWaalsContact O-N 3.1Å; Y135-T144 HydrophobicContact CD2-CG2 4.27Å; Y135-T144 HydrophobicContact CE2-CG2 3.77Å; Y135-V147 HydrophobicContact CD2-CB 3.99Å; Y135-V147 HydrophobicContact CD2-CG1 3.84Å; Y135-V147 HydrophobicContact CD2-CG2 4.45Å; Y135-V147 HydrophobicContact CE2-CB 4.15Å; Y135-V147 HydrophobicContact CE2-CG1 3.88Å; Y135-D148 VanDerWaalsContact CE2-OD1 3.29Å; Y135-D148 WeakPolarHBondContact CE2-OD1 3.47Å; Y135-D148 PolarHBondContact OH-OD1 3.44Å; Y135-W165 AromaticContact CD1-CH2 3.91Å; Y135-W165 HydrophobicContact CD1-CH2 3.91Å; Y135-W165 AromaticContact CD1-CZ3 3.53Å; Y135-W165 HydrophobicContact CD1-CZ3 3.53Å; Y135-W165 AromaticContact CD2-CH2 3.78Å; Y135-W165 HydrophobicContact CD2-CH2 3.78Å; Y135-W165 HydrophobicContact CD2-CZ3 4.23Å; Y135-W165 HydrophobicContact CE1-CH2 4.34Å; Y135-W165 HydrophobicContact CE1-CZ3 4.17Å; Y135-W165 HydrophobicContact CE2-CH2 4.23Å; Y135-W165 AromaticContact CG-CH2 3.62Å; Y135-W165 HydrophobicContact CG-CH2 3.62Å; Y135-W165 AromaticContact CG-CZ3 3.58Å; Y135-W165 HydrophobicContact CG-CZ3 3.58Å; Y135-W170 HydrophobicContact CD1-CB 4.2Å; Y135-W170 AromaticContact CD1-CD2 3.97Å; Y135-W170 HydrophobicContact CD1-CD2 3.97Å; Y135-W170 HydrophobicContact CD1-CE3 4Å; Y135-W170 HydrophobicContact CD1-CG 4.04Å; Y135-W170 HydrophobicContact CE1-CD2 4.01Å; Y135-W170 HydrophobicContact CE1-CE3 4.02Å; Y135-W170 HydrophobicContact CE1-CG 4.44Å; Y135-W170 HydrophobicContact CE1-CZ3 4.39Å; Y135-P181 HydrophobicContact CD1-CG 4.38Å; Y135-P181 HydrophobicContact CE1-CB 4.16Å; Y135-P181 HydrophobicContact CE1-CG 3.65Å; Y135-P181 HydrophobicContact CE2-CG 4.39Å; Y135-P181 WeakPolarHBondContact OH-CB 3.49Å
136L90.7Very high89.9Confident92 Ų9266.3 Ų66.348%0.48237%0.37SS..THydrogen-bonded Turntrans53.721.5-175.3-108.485.3000115.5K134 T144 W170K134-L136 PolarHBondContact O-N 3.32Å; L136-T144 HydrophobicContact CD1-CG2 3.52Å; L136-T144 PolarHBondContact N-OG1 3.45Å; L136-W170 HydrophobicContact CB-CG 4.16Å
137Q90.4Very high90.2Very high55 Ų5563 Ų6326%0.25735%0.352SS..  trans-86.8148.8177.2-65-53.3-45.300112.6Q133 K134 Y135 G139 Q140Q133-Q137 VanDerWaalsContact O-CG 3.23Å; Q133-Q137 WeakPolarHBondContact O-CG 3.3Å; K134-Q137 PolarHBondContact O-N 3.41Å; Y135-Q137 PolarHBondContact O-N 3.49Å; Y135-Q137 VanDerWaalsContact O-N 3.1Å; Q137-G139 PolarHBondContact O-N 2.88Å; Q137-Q140 HydrophobicContact CB-CB 4.3Å; Q137-Q140 HydrophobicContact CB-CG 4.23Å; Q137-Q140 PolarHBondContact O-N 3.46Å; Q137-Q140 VanDerWaalsContact O-N 3.08Å
138P88.6Confident90.4Very high120 Ų12064.1 Ų64.178%0.77936%0.358SS*.THydrogen-bonded Turntrans-54.9128.6176.9-24.734000112.2Q140P138-Q140 VanDerWaalsContact C-N 3.29Å; P138-Q140 PolarHBondContact O-N 2.69Å
139G86.8Confident90.4Very high72 Ų7267.1 Ų67.174%0.74237%0.371SS*.THydrogen-bonded Turntrans77.16.2-179.700000115.6Q137Q137-G139 PolarHBondContact O-N 2.88Å
140Q88.3Confident90.5Very high66 Ų6664.3 Ų64.331%0.30836%0.357SS..  trans-115.828.2179.5-60.8-65.5-24.100113.1K134 Q137 P138 S142 V143 T144K134-Q140 HydrophobicContact CB-CB 4.15Å; K134-Q140 HydrophobicContact CB-CG 4.05Å; K134-Q140 HydrophobicContact CG-CG 4.29Å; K134-Q140 VanDerWaalsContact O-CB 3.32Å; K134-Q140 WeakPolarHBondContact O-CB 3.49Å; Q137-Q140 HydrophobicContact CB-CB 4.3Å; Q137-Q140 HydrophobicContact CB-CG 4.23Å; Q137-Q140 PolarHBondContact O-N 3.46Å; Q137-Q140 VanDerWaalsContact O-N 3.08Å; P138-Q140 VanDerWaalsContact C-N 3.29Å; P138-Q140 PolarHBondContact O-N 2.69Å; Q140-S142 PolarHBondContact O-N 3.27Å; Q140-S142 VanDerWaalsContact O-N 3.17Å; Q140-V143 HydrophobicContact CB-CB 4.44Å; Q140-V143 HydrophobicContact CB-CG2 4.39Å; Q140-V143 WeakPolarHBondContact O-CB 3.43Å; Q140-V143 PolarHBondContact O-N 2.9Å; Q140-T144 PolarHBondContact O-N 2.95Å
141E87.4Confident90.8Very high160 Ų16062.1 Ų62.175%0.74835%0.345SS*.Hα-helixtrans-55.7-35.4-177.7-65.4177.3-176.500113.2V143 T144 L145E141-V143 VanDerWaalsContact C-N 3.3Å; E141-V143 PolarHBondContact O-N 2.84Å; E141-T144 PolarHBondContact O-N 3.44Å; E141-L145 WeakPolarHBondContact O-CB 3.19Å; E141-L145 PolarHBondContact O-N 3.27Å
142S84.4Confident90.9Very high80 Ų8064.7 Ų64.756%0.55936%0.357SS*.Hα-helixtrans-63.8-34.4176.659.80000112.8Q140 S146Q140-S142 PolarHBondContact O-N 3.27Å; Q140-S142 VanDerWaalsContact O-N 3.17Å; S142-S146 VanDerWaalsContact O-CB 3.29Å; S142-S146 WeakPolarHBondContact O-CB 2.99Å; S142-S146 PolarHBondContact O-N 3.02Å; S142-S146 PolarHBondContact O-OG 2.91Å
143V87.9Confident91Very high25 Ų2568.7 Ų68.715%0.15238%0.376CS..Hα-helixtrans-69.4-46.5175.7-179.50000109.7N130 K134 Q140 E141 L145 S146 V147N130-V143 HydrophobicContact CB-CG1 4.13Å; K134-V143 HydrophobicContact CB-CB 4.24Å; K134-V143 HydrophobicContact CB-CG1 3.93Å; K134-V143 HydrophobicContact CB-CG2 4.23Å; K134-V143 HydrophobicContact CD-CG2 4.21Å; Q140-V143 HydrophobicContact CB-CB 4.44Å; Q140-V143 HydrophobicContact CB-CG2 4.39Å; Q140-V143 WeakPolarHBondContact O-CB 3.43Å; Q140-V143 PolarHBondContact O-N 2.9Å; E141-V143 VanDerWaalsContact C-N 3.3Å; E141-V143 PolarHBondContact O-N 2.84Å; V143-L145 PolarHBondContact O-N 3.47Å; V143-S146 PolarHBondContact O-N 3.44Å; V143-V147 HydrophobicContact CG1-CG2 4.21Å; V143-V147 WeakPolarHBondContact O-CB 3.2Å; V143-V147 VanDerWaalsContact O-CG2 3.3Å; V143-V147 WeakPolarHBondContact O-CG2 3.18Å; V143-V147 PolarHBondContact O-N 3.27Å
144T89.9Confident91Very high20 Ų2066.1 Ų66.112%0.12336%0.363CS..Hα-helixtrans-55.7-51.9176.2-59.50000111.3Y135 L136 Q140 E141 S146 V147 D148Y135-T144 HydrophobicContact CD2-CG2 4.27Å; Y135-T144 HydrophobicContact CE2-CG2 3.77Å; L136-T144 HydrophobicContact CD1-CG2 3.52Å; L136-T144 PolarHBondContact N-OG1 3.45Å; Q140-T144 PolarHBondContact O-N 2.95Å; E141-T144 PolarHBondContact O-N 3.44Å; T144-S146 VanDerWaalsContact C-N 3.31Å; T144-S146 PolarHBondContact O-N 3.37Å; T144-V147 PolarHBondContact O-N 3.38Å; T144-D148 WeakPolarHBondContact O-CB 3.31Å; T144-D148 VanDerWaalsContact O-CG 3.3Å; T144-D148 PolarHBondContact O-N 3.46Å
145L90.4Very high91.2Very high126 Ų12668.6 Ų68.666%0.6637%0.374SS*.Hα-helixtrans-59.5-42.2178.9-176.968.8000111.9E141 V143 K149E141-L145 WeakPolarHBondContact O-CB 3.19Å; E141-L145 PolarHBondContact O-N 3.27Å; V143-L145 PolarHBondContact O-N 3.47Å; L145-K149 VanDerWaalsContact O-CB 3.25Å; L145-K149 WeakPolarHBondContact O-CB 3.3Å; L145-K149 PolarHBondContact O-N 3.22Å
146S90.1Very high91.4Very high76 Ų7668.1 Ų68.153%0.53137%0.372SS..Hα-helixtrans-66.4-41.3179.2-59.50000111.9S142 V143 T144 L150S142-S146 VanDerWaalsContact O-CB 3.29Å; S142-S146 WeakPolarHBondContact O-CB 2.99Å; S142-S146 PolarHBondContact O-N 3.02Å; S142-S146 PolarHBondContact O-OG 2.91Å; V143-S146 PolarHBondContact O-N 3.44Å; T144-S146 VanDerWaalsContact C-N 3.31Å; T144-S146 PolarHBondContact O-N 3.37Å; S146-L150 VanDerWaalsContact O-CB 3.22Å; S146-L150 WeakPolarHBondContact O-CB 3.16Å; S146-L150 PolarHBondContact O-N 2.86Å
147V93.1Very high91.6Very high6 Ų664 Ų644%0.03635%0.35CS..Hα-helixtrans-66.6-46176.8169.20000110.9M131 Y135 V143 T144 K149 L150 Q151 W165M131-V147 HydrophobicContact CE-CG1 4.15Å; M131-V147 HydrophobicContact CE-CG2 4.4Å; M131-V147 HydrophobicContact CG-CG1 4.06Å; M131-V147 HydrophobicContact CG-CG2 3.76Å; Y135-V147 HydrophobicContact CD2-CB 3.99Å; Y135-V147 HydrophobicContact CD2-CG1 3.84Å; Y135-V147 HydrophobicContact CD2-CG2 4.45Å; Y135-V147 HydrophobicContact CE2-CB 4.15Å; Y135-V147 HydrophobicContact CE2-CG1 3.88Å; V143-V147 HydrophobicContact CG1-CG2 4.21Å; V143-V147 WeakPolarHBondContact O-CB 3.2Å; V143-V147 VanDerWaalsContact O-CG2 3.3Å; V143-V147 WeakPolarHBondContact O-CG2 3.18Å; V143-V147 PolarHBondContact O-N 3.27Å; T144-V147 PolarHBondContact O-N 3.38Å; V147-K149 VanDerWaalsContact C-N 3.32Å; V147-K149 PolarHBondContact O-N 3.38Å; V147-L150 WeakPolarHBondContact O-CB 3.37Å; V147-L150 PolarHBondContact O-N 2.85Å; V147-Q151 WeakPolarHBondContact O-CG 3.21Å; V147-Q151 PolarHBondContact O-N 3.32Å; V147-W165 HydrophobicContact CG1-CH2 3.91Å; V147-W165 HydrophobicContact CG1-CZ2 3.94Å
148D94.1Very high91.8Very high46 Ų4661.4 Ų61.425%0.24634%0.339CS..Hα-helixtrans-62.2-43.1179.6-71.3-17000111.3Y135 T144 Q151 Q152 S183Y135-D148 VanDerWaalsContact CE2-OD1 3.29Å; Y135-D148 WeakPolarHBondContact CE2-OD1 3.47Å; Y135-D148 PolarHBondContact OH-OD1 3.44Å; T144-D148 WeakPolarHBondContact O-CB 3.31Å; T144-D148 VanDerWaalsContact O-CG 3.3Å; T144-D148 PolarHBondContact O-N 3.46Å; D148-Q151 PolarHBondContact O-N 3.49Å; D148-Q152 PolarHBondContact O-N 2.77Å; D148-Q152 VanDerWaalsContact O-N 3.14Å; D148-S183 VanDerWaalsContact OD1-CB 3.27Å; D148-S183 WeakPolarHBondContact OD1-CB 3.16Å; D148-S183 PolarHBondContact OD1-OG 3.42Å
149K92Very high92Very high133 Ų13355.7 Ų55.758%0.57830%0.302SS*.Hα-helixtrans-63.1-47.5175-172.6178.6179.9-174.60111.4L145 V147 Q151 Q152 E153L145-K149 VanDerWaalsContact O-CB 3.25Å; L145-K149 WeakPolarHBondContact O-CB 3.3Å; L145-K149 PolarHBondContact O-N 3.22Å; V147-K149 VanDerWaalsContact C-N 3.32Å; V147-K149 PolarHBondContact O-N 3.38Å; K149-Q151 VanDerWaalsContact C-N 3.31Å; K149-Q151 PolarHBondContact O-N 3.03Å; K149-Q152 PolarHBondContact O-N 3.31Å; K149-E153 VanDerWaalsContact CE-OE2 3.23Å; K149-E153 WeakPolarHBondContact CE-OE2 3.32Å; K149-E153 WeakPolarHBondContact O-CB 3Å; K149-E153 PolarHBondContact O-N 2.64Å
150L92.8Very high92.3Very high18 Ų1855.9 Ų55.99%0.09428%0.283CS..Hα-helixtrans-55.1-47.9177.6-178.577.8000111.1L127 M131 S146 V147 Q152 F154 C208 L212L127-L150 HydrophobicContact CD1-CD2 3.89Å; L127-L150 HydrophobicContact CD2-CD2 3.95Å; L127-L150 HydrophobicContact CG-CD2 4.5Å; M131-L150 HydrophobicContact CE-CD2 3.62Å; S146-L150 VanDerWaalsContact O-CB 3.22Å; S146-L150 WeakPolarHBondContact O-CB 3.16Å; S146-L150 PolarHBondContact O-N 2.86Å; V147-L150 WeakPolarHBondContact O-CB 3.37Å; V147-L150 PolarHBondContact O-N 2.85Å; L150-Q152 PolarHBondContact O-N 3.11Å; L150-F154 HydrophobicContact CD1-CD2 3.43Å; L150-F154 VanDerWaalsContact CD1-CD2 3.43Å; L150-F154 HydrophobicContact CD1-CE2 3.71Å; L150-F154 HydrophobicContact CD1-CG 4.38Å; L150-F154 HydrophobicContact CG-CD2 4.18Å; L150-F154 WeakPolarHBondContact O-CB 3.03Å; L150-F154 WeakPolarHBondContact O-CD2 3.41Å; L150-F154 PolarHBondContact O-N 2.98Å; L150-C208 HydrophobicContact CD2-CB 3.81Å; L150-C208 HydrophobicContact CG-CB 4.3Å; L150-L212 HydrophobicContact CD1-CB 4.32Å; L150-L212 HydrophobicContact CD1-CD1 3.97Å; L150-L212 HydrophobicContact CD1-CD2 4.01Å; L150-L212 HydrophobicContact CD1-CG 4.33Å
151Q96.1Very high92.5Very high0 Ų055.9 Ų55.90%029%0.285CS..Hα-helixtrans-64-41.3-178.6-72.7-176.9-14.500113V147 D148 K149 K155 C156 S183 C184V147-Q151 WeakPolarHBondContact O-CG 3.21Å; V147-Q151 PolarHBondContact O-N 3.32Å; D148-Q151 PolarHBondContact O-N 3.49Å; K149-Q151 VanDerWaalsContact C-N 3.31Å; K149-Q151 PolarHBondContact O-N 3.03Å; Q151-K155 CarbonylContact O-C 3.11Å; Q151-K155 WeakPolarHBondContact O-CA 3.35Å; Q151-K155 PolarHBondContact O-N 2.03Å; Q151-C156 WeakPolarHBondContact CA-O 3.39Å; Q151-C156 WeakPolarHBondContact CB-O 3.37Å; Q151-C156 WeakPolarHBondContact CG-O 3.13Å; Q151-C156 PolarHBondContact O-N 3.35Å; Q151-S183 VanDerWaalsContact CB-O 3.31Å; Q151-S183 WeakPolarHBondContact CB-O 3.25Å; Q151-S183 PolarHBondContact OE1-OG 3.26Å; Q151-C184 VanDerWaalsContact CD-SG 3.51Å; Q151-C184 PolarHBondContact NE2-SG 3.3Å; Q151-C184 VanDerWaalsContact NE2-SG 3.37Å; Q151-C184 PolarHBondContact OE1-SG 2.88Å
152Q95.6Very high92.8Very high59 Ų5950.1 Ų50.128%0.27626%0.258SS..Hα-helixtrans-74.4-41.3178.9-73-65.3-50.500112.8D148 K149 L150 S183 C185D148-Q152 PolarHBondContact O-N 2.77Å; D148-Q152 VanDerWaalsContact O-N 3.14Å; K149-Q152 PolarHBondContact O-N 3.31Å; L150-Q152 PolarHBondContact O-N 3.11Å; Q152-S183 PolarHBondContact NE2-O 2.92Å; Q152-C185 PolarHBondContact NE2-O 2.84Å
153E94.1Very high93.2Very high110 Ų11047.7 Ų47.751%0.51424%0.241SC..Hα-helixtrans-70.6-44.4-177.9-171.2164.2-17300111.4K149K149-E153 VanDerWaalsContact CE-OE2 3.23Å; K149-E153 WeakPolarHBondContact CE-OE2 3.32Å; K149-E153 WeakPolarHBondContact O-CB 3Å; K149-E153 PolarHBondContact O-N 2.64Å
154F94.2Very high93.5Very high40 Ų4047.1 Ų47.118%0.17524%0.237CC..THydrogen-bonded Turntrans-93.91.8179.9-65.7-79.6000114L150 C156 K211 L212 Y215L150-F154 HydrophobicContact CD1-CD2 3.43Å; L150-F154 VanDerWaalsContact CD1-CD2 3.43Å; L150-F154 HydrophobicContact CD1-CE2 3.71Å; L150-F154 HydrophobicContact CD1-CG 4.38Å; L150-F154 HydrophobicContact CG-CD2 4.18Å; L150-F154 WeakPolarHBondContact O-CB 3.03Å; L150-F154 WeakPolarHBondContact O-CD2 3.41Å; L150-F154 PolarHBondContact O-N 2.98Å; F154-C156 VanDerWaalsContact C-N 3.32Å; F154-C156 PolarHBondContact O-N 3.05Å; F154-K211 HydrophobicContact CB-CB 3.98Å; F154-K211 HydrophobicContact CD1-CB 4.22Å; F154-K211 HydrophobicContact CG-CB 4.39Å; F154-L212 HydrophobicContact CE2-CD1 4.34Å; F154-L212 HydrophobicContact CZ-CD1 4.36Å; F154-Y215 VanDerWaalsContact CE1-CB 3.49Å; F154-Y215 HydrophobicContact CE1-CD1 4.16Å; F154-Y215 AromaticContact CE1-CD2 3.71Å; F154-Y215 HydrophobicContact CE1-CD2 3.71Å; F154-Y215 HydrophobicContact CE1-CE2 4.49Å; F154-Y215 AromaticContact CE1-CG 3.51Å; F154-Y215 HydrophobicContact CE1-CG 3.51Å; F154-Y215 AromaticContact CZ-CD1 3.81Å; F154-Y215 HydrophobicContact CZ-CD1 3.81Å; F154-Y215 HydrophobicContact CZ-CD2 4.01Å; F154-Y215 HydrophobicContact CZ-CE1 4.3Å; F154-Y215 HydrophobicContact CZ-CE2 4.47Å; F154-Y215 AromaticContact CZ-CG 3.65Å; F154-Y215 HydrophobicContact CZ-CG 3.65Å
155K95.8Very high93.6Very high127 Ų12746.2 Ų46.255%0.55223%0.231SC*.THydrogen-bonded Turntrans50.652.3177.4-60.6178.8-177.8173.60111.5Q151 Y202 V204Q151-K155 CarbonylContact O-C 3.11Å; Q151-K155 WeakPolarHBondContact O-CA 3.35Å; Q151-K155 PolarHBondContact O-N 2.03Å; K155-Y202 HydrophobicContact CB-CD1 3.65Å; K155-Y202 HydrophobicContact CB-CD2 4.49Å; K155-Y202 HydrophobicContact CB-CE1 3.58Å; K155-Y202 HydrophobicContact CB-CE2 4.43Å; K155-Y202 HydrophobicContact CB-CG 4.13Å; K155-Y202 HydrophobicContact CD-CE1 4.26Å; K155-Y202 HydrophobicContact CG-CD1 4.36Å; K155-Y202 HydrophobicContact CG-CE1 3.77Å; K155-Y202 VanDerWaalsContact O-CB 3.3Å; K155-Y202 WeakPolarHBondContact O-CB 3.3Å; K155-V204 WeakPolarHBondContact O-CG2 3.2Å
156C96.3Very high93.7Very high0 Ų047.4 Ų47.40%023%0.227CC..  trans-131.6165.2-175.362.40000110.3Q151 F154 C208Q151-C156 WeakPolarHBondContact CA-O 3.39Å; Q151-C156 WeakPolarHBondContact CB-O 3.37Å; Q151-C156 WeakPolarHBondContact CG-O 3.13Å; Q151-C156 PolarHBondContact O-N 3.35Å; F154-C156 VanDerWaalsContact C-N 3.32Å; F154-C156 PolarHBondContact O-N 3.05Å; C156-C208 VanDerWaalsContact C-SG 3.57Å; C156-C208 HydrophobicContact CB-CB 3.92Å; C156-C208 WeakPolarHBondContact CB-SG 3.16Å; C156-C208 WeakPolarHBondContact SG-CA 3.06Å; C156-C208 WeakPolarHBondContact SG-CB 3.31Å; C156-C208 CovalentContact SG-SG 2.03Å; C156-C208 PolarHBondContact SG-SG 2.95Å
157C96.3Very high93.6Very high4 Ų448.2 Ų48.23%0.02723%0.226CC..  trans-143.5123.4176.9-177.10000110.9N161 F162 C184 Y202C157-N161 CarbonylContact O-C 3.4Å; C157-F162 HydrophobicContact CB-CB 4.12Å; C157-F162 WeakPolarHBondContact O-CA 3.45Å; C157-F162 PolarHBondContact O-N 2.91Å; C157-C184 WeakPolarHBondContact CA-SG 2.95Å; C157-C184 HydrophobicContact CB-CB 3.64Å; C157-C184 WeakPolarHBondContact CB-SG 3.28Å; C157-C184 WeakPolarHBondContact SG-CB 3.02Å; C157-C184 CovalentContact SG-SG 2.03Å; C157-C184 PolarHBondContact SG-SG 3.03Å; C157-Y202 WeakPolarHBondContact CB-O 3.41Å
158G94.2Very high93.6Very high1 Ų148 Ų481%0.0122%0.224CC..SBendtrans73.5175.9-173.400000113.1N161 C208G158-N161 WeakPolarHBondContact CA-O 3.23Å; G158-C208 VanDerWaalsContact O-CB 3.25Å; G158-C208 WeakPolarHBondContact O-CB 3.27Å; G158-C208 PolarHBondContact O-N 2.93Å; G158-C208 PolarHBondContact O-SG 3.47Å
159S93.2Very high93.5Very high1 Ų149.7 Ų49.71%0.00723%0.23CC..SBendtrans-70.7-60.6-174.5166.20000110.9K128 D164 G207 C208 V209K128-S159 WeakPolarHBondContact CB-OG 3.25Å; S159-D164 PolarHBondContact N-OD2 3.05Å; S159-D164 VanDerWaalsContact N-OD2 3.15Å; S159-G207 CarbonylContact O-C 3.57Å; S159-G207 WeakPolarHBondContact O-CA 3.3Å; S159-C208 PolarHBondContact O-N 3.48Å; S159-V209 WeakPolarHBondContact O-CB 3.37Å; S159-V209 WeakPolarHBondContact O-CG2 3.43Å; S159-V209 PolarHBondContact O-N 3.1Å; S159-V209 WeakPolarHBondContact OG-CG2 3.43Å
160H92.8Very high93.4Very high76 Ų7644.8 Ų44.835%0.35221%0.208SC..SBendtrans-104.8-30.8171.8-66.9-73.8000111.9D164 G206 G207H160-D164 PolarHBondContact N-OD2 2.97Å; H160-G206 CarbonylContact O-C 3.58Å; H160-G207 VanDerWaalsContact O-CA 3.27Å; H160-G207 WeakPolarHBondContact O-CA 3.31Å; H160-G207 PolarHBondContact O-N 3.17Å
161N92.9Very high93.3Very high66 Ų6645.8 Ų45.835%0.35321%0.213SC..SBendtrans-157.1165176.870.165.7000112C157 G158 S163 D164C157-N161 CarbonylContact O-C 3.4Å; G158-N161 WeakPolarHBondContact CA-O 3.23Å; N161-S163 PolarHBondContact O-N 3.48Å; N161-S163 VanDerWaalsContact O-N 3.14Å; N161-S163 WeakPolarHBondContact OD1-CA 3.36Å; N161-S163 WeakPolarHBondContact OD1-CB 3.47Å; N161-S163 PolarHBondContact OD1-N 3.47Å; N161-D164 PolarHBondContact N-OD2 2.95Å; N161-D164 VanDerWaalsContact O-CB 3.31Å; N161-D164 WeakPolarHBondContact O-CB 3.39Å; N161-D164 VanDerWaalsContact O-CG 3.31Å; N161-D164 PolarHBondContact O-N 3.35Å; N161-D164 VanDerWaalsContact O-OD2 3.1Å; N161-D164 PolarHBondContact OD1-N 3.25Å; N161-D164 VanDerWaalsContact OD1-N 3.16Å
162F93.6Very high92.8Very high39 Ų3954 Ų5417%0.17124%0.244CC..G310 helixtrans-61.3-24.1-179.873.9-87.2000113.9C157 D164 W165 V180 D196 I201 R203C157-F162 HydrophobicContact CB-CB 4.12Å; C157-F162 WeakPolarHBondContact O-CA 3.45Å; C157-F162 PolarHBondContact O-N 2.91Å; F162-D164 VanDerWaalsContact C-N 3.28Å; F162-D164 PolarHBondContact O-N 3.45Å; F162-W165 VanDerWaalsContact O-CD1 3.32Å; F162-V180 HydrophobicContact CB-CG1 4.14Å; F162-V180 HydrophobicContact CD2-CG1 4.4Å; F162-D196 HydrophobicContact CD2-CB 4.06Å; F162-D196 HydrophobicContact CE2-CB 4.03Å; F162-D196 WeakPolarHBondContact CE2-OD2 3.35Å; F162-I201 HydrophobicContact CB-CD1 3.79Å; F162-I201 HydrophobicContact CD2-CD1 4.14Å; F162-I201 HydrophobicContact CG-CD1 3.9Å; F162-R203 HydrophobicContact CD1-CG 4.35Å
163S92.8Very high92Very high28 Ų2853.1 Ų53.120%0.19625%0.251CS..G310 helixtrans-75.3-13.7177.8-56.60000113.3N161 W165 R166N161-S163 PolarHBondContact O-N 3.48Å; N161-S163 VanDerWaalsContact O-N 3.14Å; N161-S163 WeakPolarHBondContact OD1-CA 3.36Å; N161-S163 WeakPolarHBondContact OD1-CB 3.47Å; N161-S163 PolarHBondContact OD1-N 3.47Å; S163-W165 PolarHBondContact O-N 3.25Å; S163-W165 VanDerWaalsContact O-N 3.09Å; S163-R166 WeakPolarHBondContact O-CB 3.13Å; S163-R166 WeakPolarHBondContact O-CG 3.38Å; S163-R166 PolarHBondContact O-N 3.06Å; S163-R166 PolarHBondContact OG-NE 3.07Å; S163-R166 PolarHBondContact OG-NH2 2.9Å
164D92.7Very high90.6Very high14 Ų1457.8 Ų57.88%0.07527%0.273CS..G310 helixtrans-57.3-24.4172.1-68.2-36.6000112.2K128 Q132 S159 H160 N161 F162 R166 D167K128-D164 IonicContact NZ-OD1 3.89Å; Q132-D164 PolarHBondContact NE2-O 2.69Å; S159-D164 PolarHBondContact N-OD2 3.05Å; S159-D164 VanDerWaalsContact N-OD2 3.15Å; H160-D164 PolarHBondContact N-OD2 2.97Å; N161-D164 PolarHBondContact N-OD2 2.95Å; N161-D164 VanDerWaalsContact O-CB 3.31Å; N161-D164 WeakPolarHBondContact O-CB 3.39Å; N161-D164 VanDerWaalsContact O-CG 3.31Å; N161-D164 PolarHBondContact O-N 3.35Å; N161-D164 VanDerWaalsContact O-OD2 3.1Å; N161-D164 PolarHBondContact OD1-N 3.25Å; N161-D164 VanDerWaalsContact OD1-N 3.16Å; F162-D164 VanDerWaalsContact C-N 3.28Å; F162-D164 PolarHBondContact O-N 3.45Å; D164-R166 VanDerWaalsContact C-N 3.29Å; D164-R166 PolarHBondContact O-N 3.16Å; D164-D167 PolarHBondContact O-N 3.14Å
165W93.8Very high89.4Confident1 Ų159.8 Ų59.80%0.00430%0.304CS..G310 helixtrans-65.7-27.7175.6-72.6111.8000113.4M131 Y135 V147 F162 S163 D167 S168 W170 I171 V180 P181M131-W165 HydrophobicContact CB-CH2 3.99Å; M131-W165 HydrophobicContact CB-CZ2 4.3Å; M131-W165 HydrophobicContact CG-CH2 4.27Å; M131-W165 HydrophobicContact CG-CZ2 4.31Å; M131-W165 WeakPolarHBondContact O-CZ3 3.34Å; M131-W165 HydrophobicContact SD-CZ2 4.31Å; Y135-W165 AromaticContact CD1-CH2 3.91Å; Y135-W165 HydrophobicContact CD1-CH2 3.91Å; Y135-W165 AromaticContact CD1-CZ3 3.53Å; Y135-W165 HydrophobicContact CD1-CZ3 3.53Å; Y135-W165 AromaticContact CD2-CH2 3.78Å; Y135-W165 HydrophobicContact CD2-CH2 3.78Å; Y135-W165 HydrophobicContact CD2-CZ3 4.23Å; Y135-W165 HydrophobicContact CE1-CH2 4.34Å; Y135-W165 HydrophobicContact CE1-CZ3 4.17Å; Y135-W165 HydrophobicContact CE2-CH2 4.23Å; Y135-W165 AromaticContact CG-CH2 3.62Å; Y135-W165 HydrophobicContact CG-CH2 3.62Å; Y135-W165 AromaticContact CG-CZ3 3.58Å; Y135-W165 HydrophobicContact CG-CZ3 3.58Å; V147-W165 HydrophobicContact CG1-CH2 3.91Å; V147-W165 HydrophobicContact CG1-CZ2 3.94Å; F162-W165 VanDerWaalsContact O-CD1 3.32Å; S163-W165 PolarHBondContact O-N 3.25Å; S163-W165 VanDerWaalsContact O-N 3.09Å; W165-D167 PolarHBondContact O-N 2.93Å; W165-S168 VanDerWaalsContact O-CB 3.27Å; W165-S168 WeakPolarHBondContact O-CB 3.14Å; W165-S168 PolarHBondContact O-N 2.9Å; W165-S168 PolarHBondContact O-OG 3.15Å; W165-W170 HydrophobicContact CE3-CE3 4.14Å; W165-W170 HydrophobicContact CE3-CZ3 4.42Å; W165-W170 HydrophobicContact CZ3-CE3 4.43Å; W165-I171 HydrophobicContact CB-CD1 3.9Å; W165-I171 VanDerWaalsContact O-CD1 3.28Å; W165-I171 WeakPolarHBondContact O-CD1 3.27Å; W165-I171 WeakPolarHBondContact O-CG1 3.31Å; W165-V180 HydrophobicContact CB-CG1 4.35Å; W165-V180 HydrophobicContact CG-CB 4.46Å; W165-V180 HydrophobicContact CG-CG1 4.3Å; W165-P181 HydrophobicContact CD2-CG 3.77Å; W165-P181 HydrophobicContact CE3-CG 3.89Å; W165-P181 HydrophobicContact CH2-CG 3.63Å; W165-P181 HydrophobicContact CZ2-CG 3.5Å; W165-P181 HydrophobicContact CZ3-CG 3.81Å
166R91.2Very high88.5Confident150 Ų15055.6 Ų55.657%0.56629%0.289SS*.G310 helixtrans-59.8-31.7-179.6-61.8-176.7-150.9-168.89.3112.4S163 D164S163-R166 WeakPolarHBondContact O-CB 3.13Å; S163-R166 WeakPolarHBondContact O-CG 3.38Å; S163-R166 PolarHBondContact O-N 3.06Å; S163-R166 PolarHBondContact OG-NE 3.07Å; S163-R166 PolarHBondContact OG-NH2 2.9Å; D164-R166 VanDerWaalsContact C-N 3.29Å; D164-R166 PolarHBondContact O-N 3.16Å
167D89.1Confident87.9Confident94 Ų9462 Ų6250%0.50332%0.319SS..G310 helixtrans-90.50.6-180-57.2-39.2000112.6D164 W165 R172D164-D167 PolarHBondContact O-N 3.14Å; W165-D167 PolarHBondContact O-N 2.93Å; D167-R172 PolarHBondContact O-NE 3.23Å; D167-R172 PolarHBondContact O-NH2 3.4Å
168S92.6Very high87.5Confident0 Ų063.1 Ų63.10%032%0.324CS..SBendtrans-70.8148.9-179.970.10000112.2Q132 W165 W170 I171 R172Q132-S168 CarbonylContact O-C 3.51Å; Q132-S168 VanDerWaalsContact O-CA 3.3Å; Q132-S168 WeakPolarHBondContact O-CA 3.37Å; W165-S168 VanDerWaalsContact O-CB 3.27Å; W165-S168 WeakPolarHBondContact O-CB 3.14Å; W165-S168 PolarHBondContact O-N 2.9Å; W165-S168 PolarHBondContact O-OG 3.15Å; S168-W170 PolarHBondContact O-N 2.9Å; S168-I171 PolarHBondContact O-N 3.34Å; S168-I171 WeakPolarHBondContact OG-CG1 3.46Å; S168-I171 PolarHBondContact OG-N 3.01Å; S168-R172 WeakPolarHBondContact O-CG 3.17Å; S168-R172 PolarHBondContact O-N 2.94Å; S168-R172 VanDerWaalsContact O-N 3.1Å; S168-R172 PolarHBondContact O-NE 2.73Å
169E92.1Very high87.5Confident82 Ų8267 Ų6738%0.38334%0.344SS..Hα-helixtrans-64.6-31.6173.7-66.7-173.2179.500111.4Q132 R172 G173Q132-E169 PolarHBondContact O-N 3.28Å; E169-R172 PolarHBondContact O-N 3.47Å; E169-G173 PolarHBondContact O-N 3.48Å
170W90.3Very high87.6Confident31 Ų3167 Ų6712%0.11734%0.344CS..Hα-helixtrans-60.9-44.1174.417061.8000112.6Y135 L136 W165 S168 Q178 P181Y135-W170 HydrophobicContact CD1-CB 4.2Å; Y135-W170 AromaticContact CD1-CD2 3.97Å; Y135-W170 HydrophobicContact CD1-CD2 3.97Å; Y135-W170 HydrophobicContact CD1-CE3 4Å; Y135-W170 HydrophobicContact CD1-CG 4.04Å; Y135-W170 HydrophobicContact CE1-CD2 4.01Å; Y135-W170 HydrophobicContact CE1-CE3 4.02Å; Y135-W170 HydrophobicContact CE1-CG 4.44Å; Y135-W170 HydrophobicContact CE1-CZ3 4.39Å; L136-W170 HydrophobicContact CB-CG 4.16Å; W165-W170 HydrophobicContact CE3-CE3 4.14Å; W165-W170 HydrophobicContact CE3-CZ3 4.42Å; W165-W170 HydrophobicContact CZ3-CE3 4.43Å; S168-W170 PolarHBondContact O-N 2.9Å; W170-Q178 HydrophobicContact CH2-CB 3.76Å; W170-Q178 HydrophobicContact CZ2-CB 4.16Å; W170-P181 HydrophobicContact CH2-CG 4.43Å; W170-P181 HydrophobicContact CZ3-CG 3.94Å
171I90Very high87.7Confident39 Ų3963.4 Ų63.420%0.233%0.327CS..Hα-helixtrans-72.8-35.4176.4-69.2-162.5000112.4W165 S168 G173 T176 L179W165-I171 HydrophobicContact CB-CD1 3.9Å; W165-I171 VanDerWaalsContact O-CD1 3.28Å; W165-I171 WeakPolarHBondContact O-CD1 3.27Å; W165-I171 WeakPolarHBondContact O-CG1 3.31Å; S168-I171 PolarHBondContact O-N 3.34Å; S168-I171 WeakPolarHBondContact OG-CG1 3.46Å; S168-I171 PolarHBondContact OG-N 3.01Å; I171-G173 VanDerWaalsContact C-N 3.32Å; I171-T176 HydrophobicContact CB-CG2 4.5Å; I171-T176 HydrophobicContact CG1-CG2 4.45Å; I171-L179 WeakPolarHBondContact CD1-O 3.34Å
172R86.1Confident87.8Confident173 Ų17362.1 Ų62.165%0.65332%0.321SS*.Hα-helixtrans-75-19.5179.3-72.5-173.5-79.8163.5-5.6113.8D167 S168 E169D167-R172 PolarHBondContact O-NE 3.23Å; D167-R172 PolarHBondContact O-NH2 3.4Å; S168-R172 WeakPolarHBondContact O-CG 3.17Å; S168-R172 PolarHBondContact O-N 2.94Å; S168-R172 VanDerWaalsContact O-N 3.1Å; S168-R172 PolarHBondContact O-NE 2.73Å; E169-R172 PolarHBondContact O-N 3.47Å
173G79.1Confident87.9Confident40 Ų4060.8 Ų60.841%0.41232%0.316SS..SBendtrans-64.4155.7172.600000112.6E169 I171 G175E169-G173 PolarHBondContact O-N 3.48Å; I171-G173 VanDerWaalsContact C-N 3.32Å; G173-G175 PolarHBondContact O-N 2.93Å
174E64.8Low88.1Confident208 Ų20859.5 Ų59.597%0.97231%0.307SS*.THydrogen-bonded Turntrans-66.1127.4178.2-72.1-172.7162.100111.4
175G67.2Low88.3Confident81 Ų8158.8 Ų58.884%0.83530%0.303SS*.THydrogen-bonded Turntrans112.2-2.3159.500000118G173G173-G175 PolarHBondContact O-N 2.93Å
176T77Confident88.4Confident39 Ų3963.2 Ų63.224%0.23932%0.323CS..  trans-89.2129.3175.1-171.50000112.8I171 Q178I171-T176 HydrophobicContact CB-CG2 4.5Å; I171-T176 HydrophobicContact CG1-CG2 4.45Å; T176-Q178 PolarHBondContact OG1-N 3.48Å; T176-Q178 VanDerWaalsContact OG1-N 3.15Å
177Q83.4Confident88.5Confident134 Ų13461.2 Ų61.263%0.62633%0.327SS*.  trans-94.31169.5-67.2-174.1-16.400112R194Q177-R194 HydrophobicContact CB-CG 4.42Å; Q177-R194 WeakPolarHBondContact O-CG 3.22Å
178Q89.6Confident88.6Confident29 Ų2960.3 Ų60.314%0.13633%0.327CS..  trans-86.2142.4-177.4-69.1162.9-81.500110.8W170 T176 D182 L191 R194W170-Q178 HydrophobicContact CH2-CB 3.76Å; W170-Q178 HydrophobicContact CZ2-CB 4.16Å; T176-Q178 PolarHBondContact OG1-N 3.48Å; T176-Q178 VanDerWaalsContact OG1-N 3.15Å; Q178-D182 PolarHBondContact NE2-OD1 2.97Å; Q178-D182 PolarHBondContact NE2-OD2 2.9Å; Q178-L191 HydrophobicContact CG-CD2 4.14Å; Q178-R194 HydrophobicContact CG-CG 4Å
179L93.1Very high88.7Confident82 Ų8263.6 Ų63.643%0.42935%0.349SS..SBendtrans-91.7-23.4175.1-61.3175.1000111.9I171 G193 D196I171-L179 WeakPolarHBondContact CD1-O 3.34Å; L179-G193 PolarHBondContact N-O 2.9Å; L179-D196 HydrophobicContact CD1-CB 4.19Å
180V95.1Very high88.7Confident1 Ų164.6 Ų64.61%0.00637%0.365CS..SBendtrans-148.9161.6178.3-61.80000109.5F162 W165 C184 G193 I201F162-V180 HydrophobicContact CB-CG1 4.14Å; F162-V180 HydrophobicContact CD2-CG1 4.4Å; W165-V180 HydrophobicContact CB-CG1 4.35Å; W165-V180 HydrophobicContact CG-CB 4.46Å; W165-V180 HydrophobicContact CG-CG1 4.3Å; V180-C184 HydrophobicContact CB-CB 4.07Å; V180-C184 HydrophobicContact CG2-CB 3.78Å; V180-G193 PolarHBondContact N-O 3.27Å; V180-G193 VanDerWaalsContact O-CA 3.31Å; V180-G193 WeakPolarHBondContact O-CA 3.47Å; V180-I201 HydrophobicContact CG2-CG2 4.01Å
181P95.3Very high88.7Confident0 Ų066.3 Ų66.30%038%0.376CS..  trans-55.5152.6169.8-31.840.4000114.1Y135 W165 W170 S183 C184Y135-P181 HydrophobicContact CD1-CG 4.38Å; Y135-P181 HydrophobicContact CE1-CB 4.16Å; Y135-P181 HydrophobicContact CE1-CG 3.65Å; Y135-P181 HydrophobicContact CE2-CG 4.39Å; Y135-P181 WeakPolarHBondContact OH-CB 3.49Å; W165-P181 HydrophobicContact CD2-CG 3.77Å; W165-P181 HydrophobicContact CE3-CG 3.89Å; W165-P181 HydrophobicContact CH2-CG 3.63Å; W165-P181 HydrophobicContact CZ2-CG 3.5Å; W165-P181 HydrophobicContact CZ3-CG 3.81Å; W170-P181 HydrophobicContact CH2-CG 4.43Å; W170-P181 HydrophobicContact CZ3-CG 3.94Å; P181-S183 VanDerWaalsContact CB-OG 3.23Å; P181-S183 WeakPolarHBondContact CB-OG 3.26Å; P181-S183 PolarHBondContact O-N 2.87Å; P181-C184 VanDerWaalsContact O-CB 3.28Å; P181-C184 WeakPolarHBondContact O-CB 3.49Å; P181-C184 PolarHBondContact O-N 3.45Å
182D95.3Very high88.9Confident40 Ų4065 Ų6521%0.21437%0.371CS..G310 helixtrans-66.3-23.4174.1-71.2-21.3000112.3Q178 C184 C185 L191 C192 G193Q178-D182 PolarHBondContact NE2-OD1 2.97Å; Q178-D182 PolarHBondContact NE2-OD2 2.9Å; D182-C184 PolarHBondContact O-N 3.3Å; D182-C185 VanDerWaalsContact O-CB 3.27Å; D182-C185 WeakPolarHBondContact O-CB 3.46Å; D182-C185 PolarHBondContact O-N 2.78Å; D182-C185 PolarHBondContact O-SG 3.36Å; D182-C185 VanDerWaalsContact O-SG 3.42Å; D182-L191 WeakPolarHBondContact OD1-CA 3.25Å; D182-L191 PolarHBondContact OD1-N 3.05Å; D182-L191 PolarHBondContact OD2-N 2.7Å; D182-C192 VanDerWaalsContact CA-SG 3.53Å; D182-C192 PolarHBondContact O-SG 3.29Å; D182-C192 PolarHBondContact OD1-N 2.03Å; D182-C192 PolarHBondContact OD1-SG 3.14Å; D182-C192 VanDerWaalsContact OD1-SG 3.38Å; D182-G193 PolarHBondContact OD1-N 3.38Å
183S95.7Very high89.3Confident11 Ų1156.8 Ų56.88%0.07734%0.34CS..G310 helixtrans-68.4-9.3170.248.80000114D148 Q151 Q152 P181 C185D148-S183 VanDerWaalsContact OD1-CB 3.27Å; D148-S183 WeakPolarHBondContact OD1-CB 3.16Å; D148-S183 PolarHBondContact OD1-OG 3.42Å; Q151-S183 VanDerWaalsContact CB-O 3.31Å; Q151-S183 WeakPolarHBondContact CB-O 3.25Å; Q151-S183 PolarHBondContact OE1-OG 3.26Å; Q152-S183 PolarHBondContact NE2-O 2.92Å; P181-S183 VanDerWaalsContact CB-OG 3.23Å; P181-S183 WeakPolarHBondContact CB-OG 3.26Å; P181-S183 PolarHBondContact O-N 2.87Å; S183-C185 VanDerWaalsContact C-N 3.34Å
184C96.3Very high90Very high0 Ų060 Ų600%034%0.34CS..G310 helixtrans-80.2-14.8166.9-77.90000113.5Q151 C157 V180 P181 D182 I201 Y202Q151-C184 VanDerWaalsContact CD-SG 3.51Å; Q151-C184 PolarHBondContact NE2-SG 3.3Å; Q151-C184 VanDerWaalsContact NE2-SG 3.37Å; Q151-C184 PolarHBondContact OE1-SG 2.88Å; C157-C184 WeakPolarHBondContact CA-SG 2.95Å; C157-C184 HydrophobicContact CB-CB 3.64Å; C157-C184 WeakPolarHBondContact CB-SG 3.28Å; C157-C184 WeakPolarHBondContact SG-CB 3.02Å; C157-C184 CovalentContact SG-SG 2.03Å; C157-C184 PolarHBondContact SG-SG 3.03Å; V180-C184 HydrophobicContact CB-CB 4.07Å; V180-C184 HydrophobicContact CG2-CB 3.78Å; P181-C184 VanDerWaalsContact O-CB 3.28Å; P181-C184 WeakPolarHBondContact O-CB 3.49Å; P181-C184 PolarHBondContact O-N 3.45Å; D182-C184 PolarHBondContact O-N 3.3Å; C184-I201 HydrophobicContact CB-CB 4.48Å; C184-I201 CarbonylContact O-C 3.55Å; C184-I201 VanDerWaalsContact O-CA 3.27Å; C184-I201 WeakPolarHBondContact O-CA 3.4Å; C184-I201 WeakPolarHBondContact O-CB 3.25Å; C184-Y202 VanDerWaalsContact O-CD2 3.26Å; C184-Y202 WeakPolarHBondContact O-CD2 3.42Å; C184-Y202 PolarHBondContact O-N 2.95Å
185C96.9Very high91.2Very high0 Ų059.5 Ų59.50%033%0.329CS..BIsolated β-bridgetrans-77.9142.9-175.1-56.20000111.6Q152 D182 S183 T187 C192 N200Q152-C185 PolarHBondContact NE2-O 2.84Å; D182-C185 VanDerWaalsContact O-CB 3.27Å; D182-C185 WeakPolarHBondContact O-CB 3.46Å; D182-C185 PolarHBondContact O-N 2.78Å; D182-C185 PolarHBondContact O-SG 3.36Å; D182-C185 VanDerWaalsContact O-SG 3.42Å; S183-C185 VanDerWaalsContact C-N 3.34Å; C185-T187 PolarHBondContact O-N 3.11Å; C185-C192 HydrophobicContact CB-CB 3.91Å; C185-C192 WeakPolarHBondContact CB-SG 3.4Å; C185-C192 WeakPolarHBondContact SG-CB 3.23Å; C185-C192 CovalentContact SG-SG 2.02Å; C185-C192 PolarHBondContact SG-SG 2.86Å; C185-N200 CarbonylContact C-O 3.43Å; C185-N200 WeakPolarHBondContact CA-O 3.42Å
186K96Very high92.3Very high93 Ų9357.9 Ų57.940%0.40430%0.301SS..SBendtrans-64.4-30.2173.9-59.9-173.4-168.7172.90112.3P198 S199 N200 I201 Y202K186-P198 VanDerWaalsContact CE-O 3.31Å; K186-P198 WeakPolarHBondContact CE-O 3.49Å; K186-P198 PolarHBondContact NZ-O 3.37Å; K186-S199 WeakPolarHBondContact CD-O 3.33Å; K186-N200 PolarHBondContact N-O 3.47Å; K186-I201 WeakPolarHBondContact CE-O 3.31Å; K186-Y202 HydrophobicContact CB-CE1 4.24Å; K186-Y202 HydrophobicContact CG-CD1 3.89Å; K186-Y202 HydrophobicContact CG-CE1 3.72Å
187T94.4Very high93.1Very high108 Ų10861.2 Ų61.266%0.66331%0.314SS*.SBendtrans-125.997.3173-52.90000107.2C185 S189C185-T187 PolarHBondContact O-N 3.11Å; T187-S189 PolarHBondContact O-N 2.82Å
188P91.5Very high93.5Very high76 Ų7657.7 Ų57.749%0.49430%0.302SS..  trans-59123-179.5-25.435.2000110.6
189S93.1Very high93.7Very high68 Ų6860.2 Ų60.248%0.47632%0.323SS..  trans-147.6155170.470.20000108.3T187 L191 C192T187-S189 PolarHBondContact O-N 2.82Å; S189-L191 PolarHBondContact O-N 2.83Å; S189-L191 VanDerWaalsContact O-N 3.17Å; S189-C192 WeakPolarHBondContact O-CB 3.25Å; S189-C192 PolarHBondContact O-N 3.37Å; S189-C192 VanDerWaalsContact O-N 3.09Å; S189-C192 PolarHBondContact O-SG 2.95Å; S189-C192 WeakPolarHBondContact OG-CB 3.36Å
190S92.1Very high93.8Very high103 Ų10358.5 Ų58.572%0.7232%0.315SS*.THydrogen-bonded Turntrans-51.4126.4177.1-176.50000110.8C192S190-C192 PolarHBondContact O-N 2.87Å
191L91.8Very high93.8Very high67 Ų6758.5 Ų58.535%0.35131%0.314SS..THydrogen-bonded Turntrans64.119.7176-56.2162.1000114.8Q178 D182 S189 G193 R194Q178-L191 HydrophobicContact CG-CD2 4.14Å; D182-L191 WeakPolarHBondContact OD1-CA 3.25Å; D182-L191 PolarHBondContact OD1-N 3.05Å; D182-L191 PolarHBondContact OD2-N 2.7Å; S189-L191 PolarHBondContact O-N 2.83Å; S189-L191 VanDerWaalsContact O-N 3.17Å; L191-G193 PolarHBondContact O-N 3.46Å; L191-R194 HydrophobicContact CB-CG 4.35Å; L191-R194 WeakPolarHBondContact O-CG 3.09Å; L191-R194 PolarHBondContact O-N 3.37Å
192C94.3Very high93.8Very high12 Ų1260 Ų608%0.08132%0.32CS..G310 helixtrans-62.2-29.1173.967.40000112D182 C185 S189 S190 R194 R195 N200D182-C192 VanDerWaalsContact CA-SG 3.53Å; D182-C192 PolarHBondContact O-SG 3.29Å; D182-C192 PolarHBondContact OD1-N 2.03Å; D182-C192 PolarHBondContact OD1-SG 3.14Å; D182-C192 VanDerWaalsContact OD1-SG 3.38Å; C185-C192 HydrophobicContact CB-CB 3.91Å; C185-C192 WeakPolarHBondContact CB-SG 3.4Å; C185-C192 WeakPolarHBondContact SG-CB 3.23Å; C185-C192 CovalentContact SG-SG 2.02Å; C185-C192 PolarHBondContact SG-SG 2.86Å; S189-C192 WeakPolarHBondContact O-CB 3.25Å; S189-C192 PolarHBondContact O-N 3.37Å; S189-C192 VanDerWaalsContact O-N 3.09Å; S189-C192 PolarHBondContact O-SG 2.95Å; S189-C192 WeakPolarHBondContact OG-CB 3.36Å; S190-C192 PolarHBondContact O-N 2.87Å; C192-R194 PolarHBondContact O-N 3.29Å; C192-R195 PolarHBondContact O-N 3.46Å; C192-N200 PolarHBondContact O-ND2 3.17Å
193G93.6Very high93.7Very high0 Ų063.3 Ų63.30%033%0.33CS..G310 helixtrans-67-1.3179.400000115.4L179 V180 D182 L191 R195L179-G193 PolarHBondContact N-O 2.9Å; V180-G193 PolarHBondContact N-O 3.27Å; V180-G193 VanDerWaalsContact O-CA 3.31Å; V180-G193 WeakPolarHBondContact O-CA 3.47Å; D182-G193 PolarHBondContact OD1-N 3.38Å; L191-G193 PolarHBondContact O-N 3.46Å; G193-R195 PolarHBondContact O-N 2.9Å
194R93.6Very high93.4Very high109 Ų10965.3 Ų65.341%0.41134%0.341SS..G310 helixtrans-66.5-20.4171.5-69.2-176.1175.3177.2-2.2113.6Q177 Q178 L191 C192Q177-R194 HydrophobicContact CB-CG 4.42Å; Q177-R194 WeakPolarHBondContact O-CG 3.22Å; Q178-R194 HydrophobicContact CG-CG 4Å; L191-R194 HydrophobicContact CB-CG 4.35Å; L191-R194 WeakPolarHBondContact O-CG 3.09Å; L191-R194 PolarHBondContact O-N 3.37Å; C192-R194 PolarHBondContact O-N 3.29Å
195R90.8Very high92.9Very high197 Ų19773.7 Ų73.774%0.74338%0.381SS*.  trans-124.1119-179.9-64.9179.6-178.6164.50.3109.5C192 G193 H197 N200C192-R195 PolarHBondContact O-N 3.46Å; G193-R195 PolarHBondContact O-N 2.9Å; R195-H197 VanDerWaalsContact C-N 3.27Å; R195-H197 PolarHBondContact O-N 3.39Å; R195-N200 PolarHBondContact O-ND2 3.09Å
196D90.8Very high92.5Very high47 Ų4774.5 Ų74.525%0.25139%0.389SS..  trans-88.313.9-179.267.8-17.9000113.3F162 L179 I201 R203F162-D196 HydrophobicContact CD2-CB 4.06Å; F162-D196 HydrophobicContact CE2-CB 4.03Å; F162-D196 WeakPolarHBondContact CE2-OD2 3.35Å; L179-D196 HydrophobicContact CD1-CB 4.19Å; D196-I201 HydrophobicContact CB-CD1 3.92Å; D196-I201 VanDerWaalsContact O-CD1 3.25Å; D196-I201 WeakPolarHBondContact O-CD1 3.36Å; D196-I201 VanDerWaalsContact O-CG1 3.31Å; D196-I201 WeakPolarHBondContact O-CG1 3.06Å; D196-R203 PolarHBondContact O-NE 2.97Å; D196-R203 PolarHBondContact O-NH2 2.96Å; D196-R203 IonicContact OD1-NH2 3.32Å; D196-R203 IonicContact OD2-NH2 3.55Å
197H93.5Very high92.3Very high109 Ų10970.1 Ų70.151%0.50537%0.37SS..  trans-58.2141.2-174.7-169-93.9000112.7R195 S199 N200 I201R195-H197 VanDerWaalsContact C-N 3.27Å; R195-H197 PolarHBondContact O-N 3.39Å; H197-S199 PolarHBondContact CE1-OG 2.83Å; H197-S199 PolarHBondContact ND1-N 3.42Å; H197-S199 PolarHBondContact ND1-OG 2.87Å; H197-S199 PolarHBondContact O-N 2.71Å; H197-N200 HydrophobicContact CB-CB 4.47Å; H197-N200 WeakPolarHBondContact O-CB 3.31Å; H197-N200 PolarHBondContact O-N 3.47Å; H197-I201 PolarHBondContact O-N 3.5Å; H197-I201 VanDerWaalsContact O-N 3.11Å
198P91.6Very high92.3Very high60 Ų6065 Ų6539%0.3934%0.339SS..THydrogen-bonded Turntrans-56.2-24.4-178.1-23.529.2000116K186K186-P198 VanDerWaalsContact CE-O 3.31Å; K186-P198 WeakPolarHBondContact CE-O 3.49Å; K186-P198 PolarHBondContact NZ-O 3.37Å
199S93Very high92.4Very high82 Ų8261.4 Ų61.457%0.57332%0.315SS*.THydrogen-bonded Turntrans-78.4-23.7174.965.20000113.1K186 H197K186-S199 WeakPolarHBondContact CD-O 3.33Å; H197-S199 PolarHBondContact CE1-OG 2.83Å; H197-S199 PolarHBondContact ND1-N 3.42Å; H197-S199 PolarHBondContact ND1-OG 2.87Å; H197-S199 PolarHBondContact O-N 2.71Å
200N94.5Very high92.3Very high46 Ų4662 Ų6225%0.24631%0.31CS..THydrogen-bonded Turntrans-94.4-41.5-174.5-172.254.5000112.5C185 K186 C192 R195 H197C185-N200 CarbonylContact C-O 3.43Å; C185-N200 WeakPolarHBondContact CA-O 3.42Å; K186-N200 PolarHBondContact N-O 3.47Å; C192-N200 PolarHBondContact O-ND2 3.17Å; R195-N200 PolarHBondContact O-ND2 3.09Å; H197-N200 HydrophobicContact CB-CB 4.47Å; H197-N200 WeakPolarHBondContact O-CB 3.31Å; H197-N200 PolarHBondContact O-N 3.47Å
201I96.7Very high92.3Very high0 Ų060.2 Ų60.20%029%0.29CS..BIsolated β-bridgetrans-113.1159.5-175.769163.7000112.1F162 V180 C184 K186 D196 H197 R203F162-I201 HydrophobicContact CB-CD1 3.79Å; F162-I201 HydrophobicContact CD2-CD1 4.14Å; F162-I201 HydrophobicContact CG-CD1 3.9Å; V180-I201 HydrophobicContact CG2-CG2 4.01Å; C184-I201 HydrophobicContact CB-CB 4.48Å; C184-I201 CarbonylContact O-C 3.55Å; C184-I201 VanDerWaalsContact O-CA 3.27Å; C184-I201 WeakPolarHBondContact O-CA 3.4Å; C184-I201 WeakPolarHBondContact O-CB 3.25Å; K186-I201 WeakPolarHBondContact CE-O 3.31Å; D196-I201 HydrophobicContact CB-CD1 3.92Å; D196-I201 VanDerWaalsContact O-CD1 3.25Å; D196-I201 WeakPolarHBondContact O-CD1 3.36Å; D196-I201 VanDerWaalsContact O-CG1 3.31Å; D196-I201 WeakPolarHBondContact O-CG1 3.06Å; H197-I201 PolarHBondContact O-N 3.5Å; H197-I201 VanDerWaalsContact O-N 3.11Å; I201-R203 HydrophobicContact CD1-CG 4.15Å; I201-R203 HydrophobicContact CG1-CG 3.98Å; I201-R203 PolarHBondContact O-N 3.44Å
202Y95.3Very high92.2Very high31 Ų3158.4 Ų58.412%0.12228%0.28CS..  trans-69.5116.3168.9-61.5-60.1000110.5K155 C157 C184 K186K155-Y202 HydrophobicContact CB-CD1 3.65Å; K155-Y202 HydrophobicContact CB-CD2 4.49Å; K155-Y202 HydrophobicContact CB-CE1 3.58Å; K155-Y202 HydrophobicContact CB-CE2 4.43Å; K155-Y202 HydrophobicContact CB-CG 4.13Å; K155-Y202 HydrophobicContact CD-CE1 4.26Å; K155-Y202 HydrophobicContact CG-CD1 4.36Å; K155-Y202 HydrophobicContact CG-CE1 3.77Å; K155-Y202 VanDerWaalsContact O-CB 3.3Å; K155-Y202 WeakPolarHBondContact O-CB 3.3Å; C157-Y202 WeakPolarHBondContact CB-O 3.41Å; C184-Y202 VanDerWaalsContact O-CD2 3.26Å; C184-Y202 WeakPolarHBondContact O-CD2 3.42Å; C184-Y202 PolarHBondContact O-N 2.95Å; K186-Y202 HydrophobicContact CB-CE1 4.24Å; K186-Y202 HydrophobicContact CG-CD1 3.89Å; K186-Y202 HydrophobicContact CG-CE1 3.72Å
203R91.9Very high92Very high111 Ų11158.5 Ų58.542%0.41928%0.28SS..  trans-117.698.5170.5-66.3-169.2178.5-160.1-5.6107.7F162 D196 I201F162-R203 HydrophobicContact CD1-CG 4.35Å; D196-R203 PolarHBondContact O-NE 2.97Å; D196-R203 PolarHBondContact O-NH2 2.96Å; D196-R203 IonicContact OD1-NH2 3.32Å; D196-R203 IonicContact OD2-NH2 3.55Å; I201-R203 HydrophobicContact CD1-CG 4.15Å; I201-R203 HydrophobicContact CG1-CG 3.98Å; I201-R203 PolarHBondContact O-N 3.44Å
204V89.4Confident91.8Very high52 Ų5262.1 Ų62.132%0.31530%0.299SS..  trans-121.7135.8-178.8-177.10000107.8K155 G207 K211K155-V204 WeakPolarHBondContact O-CG2 3.2Å; V204-G207 PolarHBondContact O-N 3.47Å; V204-K211 HydrophobicContact CG1-CD 4.49Å; V204-K211 HydrophobicContact CG1-CG 4.49Å
205E86.7Confident91.6Very high177 Ų17762 Ų6283%0.82730%0.299SS*.THydrogen-bonded Turntrans-61.2139.5174.1-163.7166.8-167.300109.5G207E205-G207 PolarHBondContact O-N 2.89Å
206G87.6Confident91.5Very high17 Ų1755.3 Ų55.318%0.17528%0.278CS..THydrogen-bonded Turntrans80-12.5-175.600000116.6H160 E210H160-G206 CarbonylContact O-C 3.58Å; G206-E210 WeakPolarHBondContact CA-OE2 3.27Å; G206-E210 PolarHBondContact O-N 2.87Å
207G93.1Very high91.4Very high1 Ų157.3 Ų57.31%0.0128%0.282CS..Hα-helixtrans64.7-156.2178.100000113.6S159 H160 V204 E205S159-G207 CarbonylContact O-C 3.57Å; S159-G207 WeakPolarHBondContact O-CA 3.3Å; H160-G207 VanDerWaalsContact O-CA 3.27Å; H160-G207 WeakPolarHBondContact O-CA 3.31Å; H160-G207 PolarHBondContact O-N 3.17Å; V204-G207 PolarHBondContact O-N 3.47Å; E205-G207 PolarHBondContact O-N 2.89Å
208C94.1Very high91.2Very high0 Ų055 Ų550%028%0.278CS..Hα-helixtrans-73.7-26.2178.4-66.80000113.7L127 M131 L150 C156 G158 S159 L212L127-C208 HydrophobicContact CD2-CB 4.32Å; M131-C208 HydrophobicContact CE-CB 4.12Å; L150-C208 HydrophobicContact CD2-CB 3.81Å; L150-C208 HydrophobicContact CG-CB 4.3Å; C156-C208 VanDerWaalsContact C-SG 3.57Å; C156-C208 HydrophobicContact CB-CB 3.92Å; C156-C208 WeakPolarHBondContact CB-SG 3.16Å; C156-C208 WeakPolarHBondContact SG-CA 3.06Å; C156-C208 WeakPolarHBondContact SG-CB 3.31Å; C156-C208 CovalentContact SG-SG 2.03Å; C156-C208 PolarHBondContact SG-SG 2.95Å; G158-C208 VanDerWaalsContact O-CB 3.25Å; G158-C208 WeakPolarHBondContact O-CB 3.27Å; G158-C208 PolarHBondContact O-N 2.93Å; G158-C208 PolarHBondContact O-SG 3.47Å; S159-C208 PolarHBondContact O-N 3.48Å; C208-L212 VanDerWaalsContact O-CB 3.23Å; C208-L212 WeakPolarHBondContact O-CB 3.31Å; C208-L212 PolarHBondContact O-N 3.33Å
209V92.2Very high91.1Very high1 Ų155.7 Ų55.71%0.00628%0.276CS..Hα-helixtrans-60.4-54.2178.3168.10000110.2R124 L127 S159 K211 L212 E213R124-V209 HydrophobicContact CB-CG1 4.14Å; R124-V209 HydrophobicContact CG-CG1 3.57Å; L127-V209 HydrophobicContact CB-CG2 4.35Å; L127-V209 HydrophobicContact CD2-CG2 3.72Å; L127-V209 HydrophobicContact CG-CG2 4.47Å; S159-V209 WeakPolarHBondContact O-CB 3.37Å; S159-V209 WeakPolarHBondContact O-CG2 3.43Å; S159-V209 PolarHBondContact O-N 3.1Å; S159-V209 WeakPolarHBondContact OG-CG2 3.43Å; V209-K211 VanDerWaalsContact C-N 3.33Å; V209-K211 PolarHBondContact O-N 3.26Å; V209-L212 PolarHBondContact O-N 3.01Å; V209-E213 HydrophobicContact CG1-CG 4.45Å; V209-E213 VanDerWaalsContact CG1-OE1 3.28Å; V209-E213 WeakPolarHBondContact CG1-OE1 3.46Å; V209-E213 WeakPolarHBondContact O-CB 3.02Å; V209-E213 WeakPolarHBondContact O-CG 2.92Å; V209-E213 PolarHBondContact O-N 3.32Å
210E91.8Very high90.9Very high80 Ų8054.1 Ų54.137%0.37426%0.261SS..Hα-helixtrans-62.9-41.2-177.9-171174.9144.200111.4G206 L212 E213 D214G206-E210 WeakPolarHBondContact CA-OE2 3.27Å; G206-E210 PolarHBondContact O-N 2.87Å; E210-L212 VanDerWaalsContact C-N 3.33Å; E210-L212 PolarHBondContact O-N 3.24Å; E210-E213 PolarHBondContact O-N 3.42Å; E210-D214 WeakPolarHBondContact O-CB 3.42Å; E210-D214 VanDerWaalsContact O-CG 3.31Å; E210-D214 PolarHBondContact O-N 2.87Å
211K92.1Very high90.7Very high66 Ų6659.4 Ų59.429%0.28728%0.278SS..Hα-helixtrans-64.1-37.6177.1-66.5-64.5165.5-1400113.4F154 V204 V209 Y215F154-K211 HydrophobicContact CB-CB 3.98Å; F154-K211 HydrophobicContact CD1-CB 4.22Å; F154-K211 HydrophobicContact CG-CB 4.39Å; V204-K211 HydrophobicContact CG1-CD 4.49Å; V204-K211 HydrophobicContact CG1-CG 4.49Å; V209-K211 VanDerWaalsContact C-N 3.33Å; V209-K211 PolarHBondContact O-N 3.26Å; K211-Y215 WeakPolarHBondContact O-CB 3.13Å; K211-Y215 PolarHBondContact O-N 3.22Å; K211-Y215 VanDerWaalsContact O-N 3.1Å
212L90.4Very high90.5Very high28 Ų2864 Ų6415%0.14730%0.302CS..Hα-helixtrans-71.9-40.5177.2-175.257.5000111.4L123 L127 L150 F154 C208 V209 E210 Y215 I216L123-L212 HydrophobicContact CD1-CD2 3.81Å; L123-L212 HydrophobicContact CD2-CD2 4.03Å; L123-L212 HydrophobicContact CD2-CG 4.07Å; L123-L212 HydrophobicContact CG-CD2 4.33Å; L127-L212 HydrophobicContact CD2-CD2 4.35Å; L150-L212 HydrophobicContact CD1-CB 4.32Å; L150-L212 HydrophobicContact CD1-CD1 3.97Å; L150-L212 HydrophobicContact CD1-CD2 4.01Å; L150-L212 HydrophobicContact CD1-CG 4.33Å; F154-L212 HydrophobicContact CE2-CD1 4.34Å; F154-L212 HydrophobicContact CZ-CD1 4.36Å; C208-L212 VanDerWaalsContact O-CB 3.23Å; C208-L212 WeakPolarHBondContact O-CB 3.31Å; C208-L212 PolarHBondContact O-N 3.33Å; V209-L212 PolarHBondContact O-N 3.01Å; E210-L212 VanDerWaalsContact C-N 3.33Å; E210-L212 PolarHBondContact O-N 3.24Å; L212-Y215 PolarHBondContact O-N 3.37Å; L212-I216 HydrophobicContact CD1-CD1 4.15Å; L212-I216 HydrophobicContact CD1-CG1 4.36Å; L212-I216 HydrophobicContact CG-CD1 3.95Å; L212-I216 WeakPolarHBondContact O-CB 3.38Å; L212-I216 VanDerWaalsContact O-CG1 3.28Å; L212-I216 WeakPolarHBondContact O-CG1 3.23Å; L212-I216 PolarHBondContact O-N 3.48Å
213E88.7Confident90.3Very high15 Ų1568 Ų687%0.0733%0.325CS..Hα-helixtrans-60.5-48.6173.6-76.4174.7-171.400111.7L123 R124 V209 E210 Y215 I216 R217L123-E213 HydrophobicContact CD2-CG 4.07Å; R124-E213 VanDerWaalsContact CG-OE1 3.26Å; R124-E213 WeakPolarHBondContact CG-OE1 3.29Å; R124-E213 IonicContact CZ-OE1 3.98Å; R124-E213 VanDerWaalsContact CZ-OE1 3.32Å; R124-E213 IonicContact CZ-OE2 3.32Å; R124-E213 IonicContact NE-OE1 3.67Å; R124-E213 PolarHBondContact NE-OE1 3.44Å; R124-E213 IonicContact NE-OE2 2.69Å; R124-E213 IonicContact NH2-OE1 2.74Å; R124-E213 PolarHBondContact NH2-OE1 2.95Å; R124-E213 IonicContact NH2-OE2 3.42Å; R124-E213 PolarHBondContact NH2-OE2 3.47Å; V209-E213 HydrophobicContact CG1-CG 4.45Å; V209-E213 VanDerWaalsContact CG1-OE1 3.28Å; V209-E213 WeakPolarHBondContact CG1-OE1 3.46Å; V209-E213 WeakPolarHBondContact O-CB 3.02Å; V209-E213 WeakPolarHBondContact O-CG 2.92Å; V209-E213 PolarHBondContact O-N 3.32Å; E210-E213 PolarHBondContact O-N 3.42Å; E213-Y215 VanDerWaalsContact C-N 3.27Å; E213-Y215 PolarHBondContact O-N 2.9Å; E213-I216 PolarHBondContact O-N 3.48Å; E213-R217 WeakPolarHBondContact O-CB 3.27Å; E213-R217 PolarHBondContact O-N 2.99Å
214D89.9Confident90.4Very high76 Ų7664.7 Ų64.741%0.40633%0.325SS..Hα-helixtrans-56.6-44.2176.3-78.6-19.8000111.3E210 S218E210-D214 WeakPolarHBondContact O-CB 3.42Å; E210-D214 VanDerWaalsContact O-CG 3.31Å; E210-D214 PolarHBondContact O-N 2.87Å; D214-S218 WeakPolarHBondContact O-CB 3.46Å; D214-S218 PolarHBondContact O-N 2.92Å
215Y89.6Confident90.6Very high105 Ų10564.5 Ų64.541%0.41233%0.334SS..Hα-helixtrans-63.7-51.7177.7179.3-99.8000111.9F154 K211 L212 E213 R217 S218 Q219F154-Y215 VanDerWaalsContact CE1-CB 3.49Å; F154-Y215 HydrophobicContact CE1-CD1 4.16Å; F154-Y215 AromaticContact CE1-CD2 3.71Å; F154-Y215 HydrophobicContact CE1-CD2 3.71Å; F154-Y215 HydrophobicContact CE1-CE2 4.49Å; F154-Y215 AromaticContact CE1-CG 3.51Å; F154-Y215 HydrophobicContact CE1-CG 3.51Å; F154-Y215 AromaticContact CZ-CD1 3.81Å; F154-Y215 HydrophobicContact CZ-CD1 3.81Å; F154-Y215 HydrophobicContact CZ-CD2 4.01Å; F154-Y215 HydrophobicContact CZ-CE1 4.3Å; F154-Y215 HydrophobicContact CZ-CE2 4.47Å; F154-Y215 AromaticContact CZ-CG 3.65Å; F154-Y215 HydrophobicContact CZ-CG 3.65Å; K211-Y215 WeakPolarHBondContact O-CB 3.13Å; K211-Y215 PolarHBondContact O-N 3.22Å; K211-Y215 VanDerWaalsContact O-N 3.1Å; L212-Y215 PolarHBondContact O-N 3.37Å; E213-Y215 VanDerWaalsContact C-N 3.27Å; E213-Y215 PolarHBondContact O-N 2.9Å; Y215-R217 VanDerWaalsContact C-N 3.31Å; Y215-R217 PolarHBondContact O-N 2.93Å; Y215-S218 PolarHBondContact O-N 2.02Å; Y215-Q219 HydrophobicContact CD1-CG 4.36Å; Y215-Q219 HydrophobicContact CE1-CG 3.98Å; Y215-Q219 HydrophobicContact CE2-CG 4.26Å; Y215-Q219 WeakPolarHBondContact O-CG 3.28Å; Y215-Q219 PolarHBondContact O-N 3.25Å; Y215-Q219 PolarHBondContact OH-NE2 3.37Å
216I87.8Confident91Very high58 Ų5860.1 Ų60.130%0.29732%0.319SS..Hα-helixtrans-58.6-46.5178.8-70.8167.8000110.1L123 L212 E213 S218 Q219 L220L123-I216 HydrophobicContact CD2-CD1 3.82Å; L212-I216 HydrophobicContact CD1-CD1 4.15Å; L212-I216 HydrophobicContact CD1-CG1 4.36Å; L212-I216 HydrophobicContact CG-CD1 3.95Å; L212-I216 WeakPolarHBondContact O-CB 3.38Å; L212-I216 VanDerWaalsContact O-CG1 3.28Å; L212-I216 WeakPolarHBondContact O-CG1 3.23Å; L212-I216 PolarHBondContact O-N 3.48Å; E213-I216 PolarHBondContact O-N 3.48Å; I216-S218 PolarHBondContact O-N 3.44Å; I216-Q219 PolarHBondContact O-N 3.38Å; I216-L220 HydrophobicContact CG2-CD1 3.84Å; I216-L220 HydrophobicContact CG2-CG 4.28Å; I216-L220 WeakPolarHBondContact O-CB 3.37Å; I216-L220 VanDerWaalsContact O-CG 3.31Å; I216-L220 WeakPolarHBondContact O-CG 3.3Å; I216-L220 PolarHBondContact O-N 2.83Å
217R88.6Confident91.3Very high88 Ų8860.4 Ų60.433%0.33232%0.322SS..Hα-helixtrans-59.8-44.5177.9-179.7178.7-68.8-99.2-2.7111.6D120 E213 Y215 Q219 L220 Y221D120-R217 IonicContact OD2-NH2 3.57Å; D120-R217 PolarHBondContact OD2-NH2 3.05Å; E213-R217 WeakPolarHBondContact O-CB 3.27Å; E213-R217 PolarHBondContact O-N 2.99Å; Y215-R217 VanDerWaalsContact C-N 3.31Å; Y215-R217 PolarHBondContact O-N 2.93Å; R217-Q219 PolarHBondContact O-N 3.42Å; R217-L220 PolarHBondContact O-N 3.3Å; R217-Y221 HydrophobicContact CG-CD2 3.94Å; R217-Y221 HydrophobicContact CG-CE2 3.43Å; R217-Y221 VanDerWaalsContact CG-CE2 3.43Å; R217-Y221 WeakPolarHBondContact O-CD2 3.37Å; R217-Y221 PolarHBondContact O-N 2.88Å
218S90.6Very high91.4Very high62 Ų6265.5 Ų65.543%0.43435%0.352SS..Hα-helixtrans-61.4-42.7175.9-173.40000112.1D214 Y215 I216 Y221 I222D214-S218 WeakPolarHBondContact O-CB 3.46Å; D214-S218 PolarHBondContact O-N 2.92Å; Y215-S218 PolarHBondContact O-N 2.02Å; I216-S218 PolarHBondContact O-N 3.44Å; S218-Y221 PolarHBondContact O-N 2.85Å; S218-I222 WeakPolarHBondContact O-CG1 3.38Å; S218-I222 PolarHBondContact O-N 2.75Å
219Q89.4Confident91.5Very high74 Ų7467 Ų6735%0.34637%0.368SS..Hα-helixtrans-66.7-39.4177.1-63.7-59.9-17.800111.6Y215 I216 R217 Y221 I222 L223Y215-Q219 HydrophobicContact CD1-CG 4.36Å; Y215-Q219 HydrophobicContact CE1-CG 3.98Å; Y215-Q219 HydrophobicContact CE2-CG 4.26Å; Y215-Q219 WeakPolarHBondContact O-CG 3.28Å; Y215-Q219 PolarHBondContact O-N 3.25Å; Y215-Q219 PolarHBondContact OH-NE2 3.37Å; I216-Q219 PolarHBondContact O-N 3.38Å; R217-Q219 PolarHBondContact O-N 3.42Å; Q219-Y221 VanDerWaalsContact C-N 3.33Å; Q219-Y221 PolarHBondContact O-N 2.99Å; Q219-I222 PolarHBondContact O-N 2.97Å; Q219-L223 WeakPolarHBondContact O-CG 3.29Å; Q219-L223 PolarHBondContact O-N 3.29Å
220L88.8Confident91.5Very high49 Ų4970.2 Ų70.226%0.25739%0.385SS..Hα-helixtrans-63.3-36.7175.4-73173.5000112.3Q116 I216 R217 L223 G224Q116-L220 HydrophobicContact CB-CD1 4.13Å; Q116-L220 VanDerWaalsContact CD-CD1 3.46Å; Q116-L220 HydrophobicContact CG-CD1 3.6Å; I216-L220 HydrophobicContact CG2-CD1 3.84Å; I216-L220 HydrophobicContact CG2-CG 4.28Å; I216-L220 WeakPolarHBondContact O-CB 3.37Å; I216-L220 VanDerWaalsContact O-CG 3.31Å; I216-L220 WeakPolarHBondContact O-CG 3.3Å; I216-L220 PolarHBondContact O-N 2.83Å; R217-L220 PolarHBondContact O-N 3.3Å; L220-L223 PolarHBondContact O-N 3.27Å; L220-G224 PolarHBondContact O-N 2.87Å
221Y90.4Very high91.7Very high156 Ų15667.4 Ų67.461%0.61238%0.375SS*.Hα-helixtrans-63-42.4173.4-78.3-58.5000112.3R217 S218 Q219 G224 G225R217-Y221 HydrophobicContact CG-CD2 3.94Å; R217-Y221 HydrophobicContact CG-CE2 3.43Å; R217-Y221 VanDerWaalsContact CG-CE2 3.43Å; R217-Y221 WeakPolarHBondContact O-CD2 3.37Å; R217-Y221 PolarHBondContact O-N 2.88Å; S218-Y221 PolarHBondContact O-N 2.85Å; Q219-Y221 VanDerWaalsContact C-N 3.33Å; Q219-Y221 PolarHBondContact O-N 2.99Å; Y221-G224 PolarHBondContact O-N 3.28Å; Y221-G225 PolarHBondContact O-N 2.56Å
222I92.7Very high91.9Very high98 Ų9870.4 Ų70.450%0.50339%0.388SS..Hα-helixtrans-64.3-49.5177.2-63.8168.1000110S218 Q219 G224 G225 V226S218-I222 WeakPolarHBondContact O-CG1 3.38Å; S218-I222 PolarHBondContact O-N 2.75Å; Q219-I222 PolarHBondContact O-N 2.97Å; I222-G224 VanDerWaalsContact C-N 3.33Å; I222-G224 PolarHBondContact O-N 2.88Å; I222-G225 PolarHBondContact O-N 3.22Å; I222-V226 WeakPolarHBondContact O-CG2 3.27Å; I222-V226 PolarHBondContact O-N 2.86Å
223L91.1Very high92Very high115 Ų11572.7 Ų72.760%0.60240%0.4SS*.Hα-helixtrans-60.3-42.6178-71171000112Q219 L220 V226 G227Q219-L223 WeakPolarHBondContact O-CG 3.29Å; Q219-L223 PolarHBondContact O-N 3.29Å; L220-L223 PolarHBondContact O-N 3.27Å; L223-V226 PolarHBondContact O-N 3.35Å; L223-G227 PolarHBondContact O-N 3.44Å
224G93.1Very high92.2Very high40 Ų4072.3 Ų72.341%0.41240%0.399SS..Hα-helixtrans-61.8-43.5175.900000112.2L220 Y221 I222 G227 V228L220-G224 PolarHBondContact O-N 2.87Å; Y221-G224 PolarHBondContact O-N 3.28Å; I222-G224 VanDerWaalsContact C-N 3.33Å; I222-G224 PolarHBondContact O-N 2.88Å; G224-G227 PolarHBondContact O-N 3.23Å; G224-V228 WeakPolarHBondContact O-CG2 3.35Å; G224-V228 PolarHBondContact O-N 3.32Å
225G94.9Very high92.4Very high49 Ų4972.4 Ų72.451%0.50540%0.398SS..Hα-helixtrans-61.8-43.517500000112.9Y221 I222 V228 G229Y221-G225 PolarHBondContact O-N 2.56Å; I222-G225 PolarHBondContact O-N 3.22Å; G225-V228 PolarHBondContact O-N 3.23Å; G225-G229 PolarHBondContact O-N 2.69Å
226V93.9Very high92.6Very high85 Ų8569.2 Ų69.252%0.51539%0.39SS..Hα-helixtrans-61.8-45.6175172.70000111I222 L223 G229 I230I222-V226 WeakPolarHBondContact O-CG2 3.27Å; I222-V226 PolarHBondContact O-N 2.86Å; L223-V226 PolarHBondContact O-N 3.35Å; V226-G229 PolarHBondContact O-N 3.07Å; V226-I230 HydrophobicContact CG1-CD1 3.85Å; V226-I230 HydrophobicContact CG1-CG1 4.46Å; V226-I230 WeakPolarHBondContact O-CG1 3.3Å; V226-I230 PolarHBondContact O-N 3.2Å
227G94.2Very high92.8Very high22 Ų2266.5 Ų66.523%0.22738%0.376CS..Hα-helixtrans-58.7-51.1175.900000112.3L223 G224 G229 I230 A231L223-G227 PolarHBondContact O-N 3.44Å; G224-G227 PolarHBondContact O-N 3.23Å; G227-G229 PolarHBondContact O-N 2.9Å; G227-G229 VanDerWaalsContact O-N 3.17Å; G227-I230 PolarHBondContact O-N 2.97Å; G227-A231 PolarHBondContact O-N 3.02Å
228V95.8Very high93.1Very high108 Ų10863.3 Ų63.366%0.65537%0.365SS*.Hα-helixtrans-56.7-38.4176.7172.70000112G224 G225 F232G224-V228 WeakPolarHBondContact O-CG2 3.35Å; G224-V228 PolarHBondContact O-N 3.32Å; G225-V228 PolarHBondContact O-N 3.23Å; V228-F232 WeakPolarHBondContact O-CB 3.46Å; V228-F232 PolarHBondContact O-N 3.47Å
229G95.4Very high93.3Very high33 Ų3366.3 Ų66.334%0.3437%0.374SS..Hα-helixtrans-62.9-44.2173.900000113.3G225 V226 G227 F232 L233G225-G229 PolarHBondContact O-N 2.69Å; V226-G229 PolarHBondContact O-N 3.07Å; G227-G229 PolarHBondContact O-N 2.9Å; G227-G229 VanDerWaalsContact O-N 3.17Å; G229-F232 PolarHBondContact O-N 2.7Å; G229-L233 WeakPolarHBondContact O-CG 3.43Å; G229-L233 PolarHBondContact O-N 2.93Å
230I93.2Very high93.4Very high68 Ų6865.9 Ų65.935%0.34937%0.371SS..Hα-helixtrans-63.6-47.7176.8-67.6166.8000110.5E105 V226 G227 F232 L233 Q234E105-I230 WeakPolarHBondContact OE1-CB 3.1Å; V226-I230 HydrophobicContact CG1-CD1 3.85Å; V226-I230 HydrophobicContact CG1-CG1 4.46Å; V226-I230 WeakPolarHBondContact O-CG1 3.3Å; V226-I230 PolarHBondContact O-N 3.2Å; G227-I230 PolarHBondContact O-N 2.97Å; I230-F232 VanDerWaalsContact C-N 3.3Å; I230-F232 PolarHBondContact O-N 3.2Å; I230-L233 PolarHBondContact O-N 3.29Å; I230-L233 VanDerWaalsContact O-N 3.14Å; I230-Q234 HydrophobicContact CG2-CG 4.49Å; I230-Q234 WeakPolarHBondContact O-CG 3.32Å; I230-Q234 PolarHBondContact O-N 3.32Å
231A95.1Very high93.5Very high20 Ų2063.7 Ų63.717%0.16536%0.36CS..Hα-helixtrans-56.2-42.8175.900000112.3F102 E105 G227 Q234 L235F102-A231 HydrophobicContact CD2-CB 4.39Å; F102-A231 HydrophobicContact CE2-CB 4.03Å; E105-A231 PolarHBondContact OE1-N 3.43Å; G227-A231 PolarHBondContact O-N 3.02Å; A231-Q234 PolarHBondContact O-N 2.99Å; A231-L235 WeakPolarHBondContact O-CG 3.47Å; A231-L235 PolarHBondContact O-N 3.23Å; A231-L235 VanDerWaalsContact O-N 3.07Å
232F95.6Very high93.6Very high130 Ų13058.5 Ų58.557%0.5735%0.346SS*.Hα-helixtrans-62.7-46.6175176.3-99.5000112.1V228 G229 I230 Q234 L235 V236V228-F232 WeakPolarHBondContact O-CB 3.46Å; V228-F232 PolarHBondContact O-N 3.47Å; G229-F232 PolarHBondContact O-N 2.7Å; I230-F232 VanDerWaalsContact C-N 3.3Å; I230-F232 PolarHBondContact O-N 3.2Å; F232-Q234 VanDerWaalsContact C-N 3.3Å; F232-Q234 PolarHBondContact O-N 3.06Å; F232-L235 WeakPolarHBondContact O-CB 3.32Å; F232-L235 PolarHBondContact O-N 2.75Å; F232-V236 HydrophobicContact CD1-CG2 4.44Å; F232-V236 HydrophobicContact CE1-CG2 3.98Å; F232-V236 HydrophobicContact CE2-CG2 4.42Å; F232-V236 HydrophobicContact CZ-CG2 3.96Å; F232-V236 WeakPolarHBondContact O-CG2 3.5Å; F232-V236 PolarHBondContact O-N 2.82Å; F232-V236 VanDerWaalsContact O-N 3.08Å
233L92.7Very high93.4Very high76 Ų7656.4 Ų56.440%0.39834%0.339SS..Hα-helixtrans-61.2-37.9177.2-73.9177.1000112.2F24 G229 I230 V236 G237F24-L233 HydrophobicContact CE2-CB 4Å; F24-L233 HydrophobicContact CE2-CD2 4.34Å; F24-L233 HydrophobicContact CZ-CB 4.25Å; F24-L233 WeakPolarHBondContact CZ-O 3.36Å; G229-L233 WeakPolarHBondContact O-CG 3.43Å; G229-L233 PolarHBondContact O-N 2.93Å; I230-L233 PolarHBondContact O-N 3.29Å; I230-L233 VanDerWaalsContact O-N 3.14Å; L233-V236 PolarHBondContact O-N 3.49Å; L233-G237 PolarHBondContact O-N 3.35Å
234Q93.6Very high93.3Very high7 Ų751 Ų513%0.03331%0.311CS..Hα-helixtrans-63.6-42.8174.2-73.5173.616.500112.2F102 E105 I230 A231 F232 V236 G237 M238F102-Q234 VanDerWaalsContact CB-OE1 3.31Å; E105-Q234 VanDerWaalsContact OE2-CD 3.3Å; E105-Q234 PolarHBondContact OE2-NE2 3.43Å; E105-Q234 PolarHBondContact OE2-OE1 3.05Å; I230-Q234 HydrophobicContact CG2-CG 4.49Å; I230-Q234 WeakPolarHBondContact O-CG 3.32Å; I230-Q234 PolarHBondContact O-N 3.32Å; A231-Q234 PolarHBondContact O-N 2.99Å; F232-Q234 VanDerWaalsContact C-N 3.3Å; F232-Q234 PolarHBondContact O-N 3.06Å; Q234-V236 VanDerWaalsContact C-N 3.33Å; Q234-V236 PolarHBondContact O-N 3.25Å; Q234-G237 PolarHBondContact O-N 2.98Å; Q234-G237 VanDerWaalsContact O-N 3.17Å; Q234-M238 HydrophobicContact CB-CE 4.47Å; Q234-M238 WeakPolarHBondContact O-CG 3.3Å; Q234-M238 PolarHBondContact O-N 3.17Å
235L94.9Very high93.1Very high77 Ų7749.9 Ų49.940%0.40330%0.297SS..Hα-helixtrans-59.3-44.3175.5-72.5169000111.6F102 A231 F232 G237 M238 M239F102-L235 HydrophobicContact CE2-CD1 4.22Å; F102-L235 HydrophobicContact CE2-CD2 4.14Å; F102-L235 HydrophobicContact CE2-CG 3.97Å; F102-L235 HydrophobicContact CZ-CD1 4.38Å; F102-L235 HydrophobicContact CZ-CD2 4.07Å; F102-L235 HydrophobicContact CZ-CG 4.31Å; A231-L235 WeakPolarHBondContact O-CG 3.47Å; A231-L235 PolarHBondContact O-N 3.23Å; A231-L235 VanDerWaalsContact O-N 3.07Å; F232-L235 WeakPolarHBondContact O-CB 3.32Å; F232-L235 PolarHBondContact O-N 2.75Å; L235-G237 VanDerWaalsContact C-N 3.35Å; L235-G237 PolarHBondContact O-N 3.22Å; L235-M238 HydrophobicContact CD2-CE 3.84Å; L235-M238 HydrophobicContact CG-CE 4.41Å; L235-M238 PolarHBondContact O-N 2.82Å; L235-M239 WeakPolarHBondContact O-CG 3.39Å; L235-M239 PolarHBondContact O-N 3.37Å
236V93.1Very high92.7Very high38 Ų3856.3 Ų56.323%0.2331%0.306CS..Hα-helixtrans-60.9-44.7174.5174.10000110.9F232 L233 Q234 M238 M239 F240F232-V236 HydrophobicContact CD1-CG2 4.44Å; F232-V236 HydrophobicContact CE1-CG2 3.98Å; F232-V236 HydrophobicContact CE2-CG2 4.42Å; F232-V236 HydrophobicContact CZ-CG2 3.96Å; F232-V236 WeakPolarHBondContact O-CG2 3.5Å; F232-V236 PolarHBondContact O-N 2.82Å; F232-V236 VanDerWaalsContact O-N 3.08Å; L233-V236 PolarHBondContact O-N 3.49Å; Q234-V236 VanDerWaalsContact C-N 3.33Å; Q234-V236 PolarHBondContact O-N 3.25Å; V236-M238 PolarHBondContact O-N 3.33Å; V236-M239 PolarHBondContact O-N 3.25Å; V236-F240 HydrophobicContact CG1-CD2 3.89Å; V236-F240 HydrophobicContact CG1-CE1 4.24Å; V236-F240 HydrophobicContact CG1-CE2 3.4Å; V236-F240 VanDerWaalsContact CG1-CE2 3.4Å; V236-F240 HydrophobicContact CG1-CG 4.5Å; V236-F240 HydrophobicContact CG1-CZ 3.6Å; V236-F240 WeakPolarHBondContact O-CG 3.41Å; V236-F240 PolarHBondContact O-N 3.09Å
237G92.3Very high92.2Very high1 Ų154.5 Ų54.51%0.0129%0.293CS..Hα-helixtrans-59.9-42.9175.500000113.2L233 Q234 L235 F240 T241L233-G237 PolarHBondContact O-N 3.35Å; Q234-G237 PolarHBondContact O-N 2.98Å; Q234-G237 VanDerWaalsContact O-N 3.17Å; L235-G237 VanDerWaalsContact C-N 3.35Å; L235-G237 PolarHBondContact O-N 3.22Å; G237-F240 PolarHBondContact O-N 3.15Å; G237-T241 WeakPolarHBondContact O-CB 3.47Å; G237-T241 PolarHBondContact O-N 3.16Å; G237-T241 PolarHBondContact O-OG1 3.35Å
238M95Very high91.5Very high21 Ų2154.1 Ų54.110%0.10329%0.286CS..Hα-helixtrans-64-42.4175-73.1-168.3-9200111.7L95 L98 L99 F102 Q234 L235 V236 T241 C242L95-M238 HydrophobicContact CD1-CB 3.81Å; L95-M238 HydrophobicContact CD1-CG 3.85Å; L95-M238 HydrophobicContact CD1-SD 4.48Å; L98-M238 HydrophobicContact CB-CG 3.77Å; L98-M238 HydrophobicContact CB-SD 4.33Å; L98-M238 HydrophobicContact CD1-CG 3.89Å; L99-M238 HydrophobicContact CB-SD 4.33Å; F102-M238 HydrophobicContact CB-CE 4.06Å; F102-M238 HydrophobicContact CD1-CE 4.45Å; F102-M238 HydrophobicContact CD2-CE 4.26Å; F102-M238 HydrophobicContact CG-CE 4.01Å; Q234-M238 HydrophobicContact CB-CE 4.47Å; Q234-M238 WeakPolarHBondContact O-CG 3.3Å; Q234-M238 PolarHBondContact O-N 3.17Å; L235-M238 HydrophobicContact CD2-CE 3.84Å; L235-M238 HydrophobicContact CG-CE 4.41Å; L235-M238 PolarHBondContact O-N 2.82Å; V236-M238 PolarHBondContact O-N 3.33Å; M238-T241 PolarHBondContact O-N 3.41Å; M238-C242 WeakPolarHBondContact O-CB 3.33Å; M238-C242 PolarHBondContact O-N 2.8Å; M238-C242 PolarHBondContact O-SG 2.84Å
239M93.6Very high90.5Very high125 Ų12553.8 Ų53.862%0.61628%0.276SS*.Hα-helixtrans-60.6-50.8175.7-75.8-178.163.200111.5L235 V236 T241 C242 C243L235-M239 WeakPolarHBondContact O-CG 3.39Å; L235-M239 PolarHBondContact O-N 3.37Å; V236-M239 PolarHBondContact O-N 3.25Å; M239-T241 VanDerWaalsContact C-N 3.31Å; M239-T241 PolarHBondContact O-N 3.2Å; M239-C242 WeakPolarHBondContact O-CB 3.39Å; M239-C242 PolarHBondContact O-N 3.12Å; M239-C243 PolarHBondContact O-N 2.77Å; M239-C243 PolarHBondContact O-SG 3.25Å
240F91.8Very high89.1Confident66 Ų6658.9 Ų58.929%0.28929%0.291SS..Hα-helixtrans-61.7-40178.4-68.5-17.1000112L17 L21 V236 G237 C243 L244L17-F240 HydrophobicContact CD2-CB 4.38Å; L17-F240 HydrophobicContact CD2-CD1 3.6Å; L17-F240 HydrophobicContact CD2-CE1 4Å; L17-F240 HydrophobicContact CD2-CG 4Å; L21-F240 HydrophobicContact CD1-CB 3.88Å; L21-F240 HydrophobicContact CD2-CB 3.59Å; L21-F240 HydrophobicContact CD2-CD2 4.38Å; L21-F240 HydrophobicContact CG-CB 3.69Å; L21-F240 HydrophobicContact CG-CD2 4.46Å; V236-F240 HydrophobicContact CG1-CD2 3.89Å; V236-F240 HydrophobicContact CG1-CE1 4.24Å; V236-F240 HydrophobicContact CG1-CE2 3.4Å; V236-F240 VanDerWaalsContact CG1-CE2 3.4Å; V236-F240 HydrophobicContact CG1-CG 4.5Å; V236-F240 HydrophobicContact CG1-CZ 3.6Å; V236-F240 WeakPolarHBondContact O-CG 3.41Å; V236-F240 PolarHBondContact O-N 3.09Å; G237-F240 PolarHBondContact O-N 3.15Å; F240-C243 PolarHBondContact O-N 2.8Å; F240-L244 WeakPolarHBondContact O-CB 3.18Å; F240-L244 PolarHBondContact O-N 3.41Å
241T92.1Very high87.6Confident2 Ų258.5 Ų58.51%0.01229%0.289CS..Hα-helixtrans-62.6-43.6175.5-58.80000111.5L91 Y94 L95 G237 M238 M239 L244 C245L91-T241 HydrophobicContact CB-CG2 4.41Å; L91-T241 HydrophobicContact CD2-CG2 4.05Å; Y94-T241 HydrophobicContact CD1-CG2 3.84Å; Y94-T241 HydrophobicContact CE1-CG2 4.41Å; Y94-T241 VanDerWaalsContact CE1-OG1 3.3Å; Y94-T241 WeakPolarHBondContact CE1-OG1 3.5Å; L95-T241 HydrophobicContact CB-CG2 4.06Å; L95-T241 HydrophobicContact CD1-CG2 4.42Å; G237-T241 WeakPolarHBondContact O-CB 3.47Å; G237-T241 PolarHBondContact O-N 3.16Å; G237-T241 PolarHBondContact O-OG1 3.35Å; M238-T241 PolarHBondContact O-N 3.41Å; M239-T241 VanDerWaalsContact C-N 3.31Å; M239-T241 PolarHBondContact O-N 3.2Å; T241-L244 PolarHBondContact O-N 3.17Å; T241-C245 VanDerWaalsContact O-CB 3.23Å; T241-C245 WeakPolarHBondContact O-CB 3.48Å; T241-C245 PolarHBondContact O-N 2.94Å
242C91.8Very high85.8Confident47 Ų4764 Ų6432%0.31832%0.315SS..Hα-helixtrans-60.9-45.7175-73.20000112M238 M239 C245 R246M238-C242 WeakPolarHBondContact O-CB 3.33Å; M238-C242 PolarHBondContact O-N 2.8Å; M238-C242 PolarHBondContact O-SG 2.84Å; M239-C242 WeakPolarHBondContact O-CB 3.39Å; M239-C242 PolarHBondContact O-N 3.12Å; C242-C245 PolarHBondContact O-N 3.16Å; C242-R246 WeakPolarHBondContact O-CG 3.46Å; C242-R246 PolarHBondContact O-N 3.35Å
243C89.4Confident83.4Confident54 Ų5469 Ų6937%0.36533%0.332SS..Hα-helixtrans-59.7-47.4176.4-69.50000111.4L17 M239 F240 C245 R246 N247L17-C243 HydrophobicContact CD1-CB 4.25Å; M239-C243 PolarHBondContact O-N 2.77Å; M239-C243 PolarHBondContact O-SG 3.25Å; F240-C243 PolarHBondContact O-N 2.8Å; C243-C245 VanDerWaalsContact C-N 3.35Å; C243-C245 PolarHBondContact O-N 2.94Å; C243-R246 PolarHBondContact O-N 2.94Å; C243-N247 PolarHBondContact O-N 3.3Å; C243-N247 PolarHBondContact O-ND2 3.37Å
244L88.3Confident82.9Confident1 Ų168.7 Ų68.71%0.00533%0.329CS..Hα-helixtrans-63.1-41.1178.1-176.559.3000111.8T14 K18 L21 T83 L91 F240 T241 R246 N247 L248T14-L244 HydrophobicContact CG2-CD1 4.03Å; K18-L244 HydrophobicContact CD-CD1 4.38Å; K18-L244 HydrophobicContact CG-CD1 3.81Å; K18-L244 HydrophobicContact CG-CD2 4.17Å; L21-L244 HydrophobicContact CD1-CB 4.24Å; L21-L244 HydrophobicContact CD1-CD2 3.83Å; T83-L244 HydrophobicContact CG2-CD2 4.4Å; L91-L244 HydrophobicContact CD1-CD2 4.17Å; L91-L244 HydrophobicContact CD1-CG 4.07Å; L91-L244 HydrophobicContact CD2-CD2 3.99Å; F240-L244 WeakPolarHBondContact O-CB 3.18Å; F240-L244 PolarHBondContact O-N 3.41Å; T241-L244 PolarHBondContact O-N 3.17Å; L244-R246 PolarHBondContact O-N 2.87Å; L244-N247 PolarHBondContact O-N 2.91Å; L244-L248 HydrophobicContact CD1-CD1 4.26Å; L244-L248 HydrophobicContact CG-CD1 4.04Å; L244-L248 WeakPolarHBondContact O-CD1 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.23Å; L244-L248 PolarHBondContact O-N 3.1Å
245C88.1Confident82.4Confident18 Ų1871.9 Ų71.912%0.12234%0.344CS..Hα-helixtrans-63.8-38177.1-173.20000112.6T241 C242 C243 K249T241-C245 VanDerWaalsContact O-CB 3.23Å; T241-C245 WeakPolarHBondContact O-CB 3.48Å; T241-C245 PolarHBondContact O-N 2.94Å; C242-C245 PolarHBondContact O-N 3.16Å; C243-C245 VanDerWaalsContact C-N 3.35Å; C243-C245 PolarHBondContact O-N 2.94Å; C245-K249 PolarHBondContact O-N 2.96Å
246R86.5Confident81.7Confident183 Ų18371.7 Ų71.769%0.69134%0.341SS*.Hα-helixtrans-66.7-47.7174.5-74179.5179.7-174.40.8111.8C242 C243 L244 L248 K249 E250C242-R246 WeakPolarHBondContact O-CG 3.46Å; C242-R246 PolarHBondContact O-N 3.35Å; C243-R246 PolarHBondContact O-N 2.94Å; L244-R246 PolarHBondContact O-N 2.87Å; R246-L248 VanDerWaalsContact C-N 3.31Å; R246-L248 PolarHBondContact O-N 3.22Å; R246-K249 WeakPolarHBondContact O-CB 3.41Å; R246-K249 PolarHBondContact O-N 3.1Å; R246-E250 PolarHBondContact O-N 3.36Å
247N83.3Confident81Confident47 Ų4773.6 Ų73.625%0.25135%0.347SS..Hα-helixtrans-60-41.3178.6-68.9-23.9000111.8T14 C243 L244 K249 E250 D251T14-N247 HydrophobicContact CG2-CB 4.4Å; C243-N247 PolarHBondContact O-N 3.3Å; C243-N247 PolarHBondContact O-ND2 3.37Å; L244-N247 PolarHBondContact O-N 2.91Å; N247-K249 VanDerWaalsContact C-N 3.25Å; N247-K249 PolarHBondContact O-N 3.47Å; N247-E250 PolarHBondContact O-N 3.44Å; N247-D251 PolarHBondContact O-N 2.8Å
248L80.4Confident80.3Confident15 Ų1578.2 Ų78.28%0.07937%0.368CS..Hα-helixtrans-64.4-27.3175.4-80.3158.5000113.6E86 L91 L244 R246E86-L248 HydrophobicContact CB-CD2 3.95Å; L91-L248 HydrophobicContact CD1-CD1 3.26Å; L244-L248 HydrophobicContact CD1-CD1 4.26Å; L244-L248 HydrophobicContact CG-CD1 4.04Å; L244-L248 WeakPolarHBondContact O-CD1 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.23Å; L244-L248 PolarHBondContact O-N 3.1Å; R246-L248 VanDerWaalsContact C-N 3.31Å; R246-L248 PolarHBondContact O-N 3.22Å
249K75Confident79.3Confident101 Ų10182 Ų8244%0.43939%0.386SS..Hα-helixtrans-71.9-39.3174.8-174.7-173.8177.1-169.50111.2C245 R246 N247 D251 L252C245-K249 PolarHBondContact O-N 2.96Å; R246-K249 WeakPolarHBondContact O-CB 3.41Å; R246-K249 PolarHBondContact O-N 3.1Å; N247-K249 VanDerWaalsContact C-N 3.25Å; N247-K249 PolarHBondContact O-N 3.47Å; K249-D251 VanDerWaalsContact C-N 3.32Å; K249-L252 PolarHBondContact O-N 3.31Å
250E66.4Low78.3Confident140 Ų14078.9 Ų78.965%0.65437%0.37SS*.Hα-helixtrans-66.3-33.6177.6-68.9179.2178.800112R246 N247 L252R246-E250 PolarHBondContact O-N 3.36Å; N247-E250 PolarHBondContact O-N 3.44Å; E250-L252 VanDerWaalsContact C-N 3.26Å; E250-L252 PolarHBondContact O-N 3.43Å
251D60.7Low77.2Confident60 Ų6079.9 Ų79.932%0.32138%0.376SS..THydrogen-bonded Turntrans-69.3-17.7175.3-75.9-30.9000114.4R6 N247 K249R6-D251 PolarHBondContact NH1-O 3.37Å; R6-D251 PolarHBondContact NH2-O 3.08Å; N247-D251 PolarHBondContact O-N 2.8Å; K249-D251 VanDerWaalsContact C-N 3.32Å
252L57Low76Confident134 Ų13486.4 Ų86.470%0.70241%0.406SS*.THydrogen-bonded Turntrans-92.6-23.7-178.8-91.1153.6000113.5K249 E250K249-L252 PolarHBondContact O-N 3.31Å; E250-L252 VanDerWaalsContact C-N 3.26Å; E250-L252 PolarHBondContact O-N 3.43Å
253Y45.3Very low74.6Confident237 Ų23790 Ų9093%0.92941%0.414SS*.  trans-87.10169-91.3-93.2000111R6R6-Y253 PolarHBondContact NH2-OXT 3.46Å

Retrieved 253 of 253 residues in 200.1 ms (Link to these results)