A0A087YDV8_POEFO Loading...

Non-SMC condensin II complex, subunit G2

AlphaFold DB , UniProt , Accession A0A087YDV8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,131 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M58.9Low83.2Confident168 Ų16859 Ų5983%0.82829%0.292SS*.  01440-78.1175.8-14800108.4D5 V6M1-D5 HydrophobicContact CB-CB 4.34Å; M1-V6 HydrophobicContact CB-CG2 3.55Å; M1-V6 HydrophobicContact CG-CG2 4.45Å; M1-V6 HydrophobicContact SD-CG2 4.01Å
2S78.6Confident83.3Confident51 Ų5157.6 Ų57.636%0.35729%0.292SS..  trans-67.5154.5171.176.60000109.4R4 D5 V6S2-R4 PolarHBondContact O-N 2.85Å; S2-D5 WeakPolarHBondContact CB-OD2 3.48Å; S2-D5 PolarHBondContact N-OD2 2.74Å; S2-D5 VanDerWaalsContact N-OD2 3.11Å; S2-D5 PolarHBondContact O-N 3.25Å; S2-D5 VanDerWaalsContact O-N 3.1Å; S2-D5 PolarHBondContact OG-N 3.28Å; S2-D5 PolarHBondContact OG-OD1 3.22Å; S2-D5 PolarHBondContact OG-OD2 3.05Å; S2-V6 PolarHBondContact O-N 3.21Å
3K81.3Confident82.8Confident139 Ų13960.1 Ų60.160%0.60430%0.3SS*.Hα-helixtrans-53.4-29.1176.4-69.8-177.4177.9-178.40112.2F7K3-F7 WeakPolarHBondContact O-CB 3.35Å; K3-F7 PolarHBondContact O-N 3.05Å; K3-F7 VanDerWaalsContact O-N 3.16Å
4R86.3Confident82.6Confident77 Ų7770.6 Ų70.629%0.29134%0.343SS..Hα-helixtrans-69.1-46.1178.8-54.1171.7-160.6173.4-0.2111.8S2 V6 F7 L8 V38 E41 M42S2-R4 PolarHBondContact O-N 2.85Å; R4-V6 VanDerWaalsContact C-N 3.34Å; R4-V6 PolarHBondContact O-N 3.11Å; R4-F7 PolarHBondContact O-N 3.49Å; R4-L8 WeakPolarHBondContact O-CB 3.48Å; R4-L8 PolarHBondContact O-N 2.89Å; R4-V38 HydrophobicContact CG-CG1 4.36Å; R4-E41 IonicContact CZ-OE2 3.31Å; R4-E41 VanDerWaalsContact CZ-OE2 3.31Å; R4-E41 PolarHBondContact NE-O 2.61Å; R4-E41 IonicContact NE-OE2 3.09Å; R4-E41 PolarHBondContact NE-OE2 3.32Å; R4-E41 PolarHBondContact NH1-O 3.5Å; R4-E41 IonicContact NH2-OE2 2.74Å; R4-E41 PolarHBondContact NH2-OE2 3.11Å; R4-M42 HydrophobicContact CB-CE 4.07Å; R4-M42 HydrophobicContact CB-CG 4.14Å; R4-M42 HydrophobicContact CG-CG 4.27Å; R4-M42 WeakPolarHBondContact O-CE 3.49Å
5D84.4Confident82.8Confident51 Ų5171 Ų7127%0.27334%0.342SS..Hα-helixtrans-66.6-39-179.6-50-44000111M1 S2 L8 E9 Q46M1-D5 HydrophobicContact CB-CB 4.34Å; S2-D5 WeakPolarHBondContact CB-OD2 3.48Å; S2-D5 PolarHBondContact N-OD2 2.74Å; S2-D5 VanDerWaalsContact N-OD2 3.11Å; S2-D5 PolarHBondContact O-N 3.25Å; S2-D5 VanDerWaalsContact O-N 3.1Å; S2-D5 PolarHBondContact OG-N 3.28Å; S2-D5 PolarHBondContact OG-OD1 3.22Å; S2-D5 PolarHBondContact OG-OD2 3.05Å; D5-L8 PolarHBondContact O-N 2.98Å; D5-E9 WeakPolarHBondContact O-CG 3.28Å; D5-E9 PolarHBondContact O-N 3.48Å; D5-Q46 PolarHBondContact OD1-NE2 2.93Å
6V86.5Confident83Confident55 Ų5567.5 Ų67.533%0.33333%0.326SS..Hα-helixtrans-66.6-41.3177.8-1750000111.3M1 S2 R4 E9 A10 F22M1-V6 HydrophobicContact CB-CG2 3.55Å; M1-V6 HydrophobicContact CG-CG2 4.45Å; M1-V6 HydrophobicContact SD-CG2 4.01Å; S2-V6 PolarHBondContact O-N 3.21Å; R4-V6 VanDerWaalsContact C-N 3.34Å; R4-V6 PolarHBondContact O-N 3.11Å; V6-E9 PolarHBondContact O-N 3.24Å; V6-A10 PolarHBondContact O-N 3.33Å; V6-F22 HydrophobicContact CG1-CE2 4.07Å; V6-F22 HydrophobicContact CG1-CZ 3.69Å
7F90.1Very high83.3Confident0 Ų070.6 Ų70.60%034%0.34CS..Hα-helixtrans-66.4-41.9176.4-175.9-110.3000111.7K3 R4 A10 F19 F22 F33 V35 V38 M42 L50 V96K3-F7 WeakPolarHBondContact O-CB 3.35Å; K3-F7 PolarHBondContact O-N 3.05Å; K3-F7 VanDerWaalsContact O-N 3.16Å; R4-F7 PolarHBondContact O-N 3.49Å; F7-A10 WeakPolarHBondContact O-CB 3.27Å; F7-A10 PolarHBondContact O-N 2.98Å; F7-F19 HydrophobicContact CE2-CD2 4.1Å; F7-F19 HydrophobicContact CE2-CE2 4.1Å; F7-F19 HydrophobicContact CZ-CD2 4.36Å; F7-F19 AromaticContact CZ-CE2 3.94Å; F7-F19 HydrophobicContact CZ-CE2 3.94Å; F7-F22 HydrophobicContact CD2-CB 3.82Å; F7-F22 HydrophobicContact CD2-CD1 4.45Å; F7-F22 HydrophobicContact CD2-CD2 4.01Å; F7-F22 AromaticContact CD2-CG 3.85Å; F7-F22 HydrophobicContact CD2-CG 3.85Å; F7-F22 HydrophobicContact CE2-CB 3.82Å; F7-F22 HydrophobicContact CE2-CG 4.37Å; F7-F33 HydrophobicContact CD2-CE1 4.46Å; F7-F33 AromaticContact CD2-CZ 3.8Å; F7-F33 HydrophobicContact CD2-CZ 3.8Å; F7-F33 HydrophobicContact CE2-CZ 4.26Å; F7-F33 HydrophobicContact CG-CZ 4.35Å; F7-V35 HydrophobicContact CE2-CG2 4.25Å; F7-V35 HydrophobicContact CZ-CG1 4.15Å; F7-V35 HydrophobicContact CZ-CG2 4.15Å; F7-V38 HydrophobicContact CB-CG1 4.19Å; F7-V38 HydrophobicContact CD1-CG1 4.03Å; F7-V38 HydrophobicContact CG-CG1 4.28Å; F7-M42 HydrophobicContact CD1-CE 4.01Å; F7-L50 HydrophobicContact CD1-CD1 4.41Å; F7-L50 HydrophobicContact CE1-CD1 4.19Å; F7-L50 HydrophobicContact CE1-CD2 4.35Å; F7-V96 HydrophobicContact CZ-CG2 4.08Å
8L88.8Confident83.5Confident24 Ų2470.8 Ų70.813%0.12634%0.343CS..Hα-helixtrans-63.1-41175.9-178.862.4000112.1R4 D5 A10 T11 M42 Q46 A49 L50 Q53R4-L8 WeakPolarHBondContact O-CB 3.48Å; R4-L8 PolarHBondContact O-N 2.89Å; D5-L8 PolarHBondContact O-N 2.98Å; L8-A10 VanDerWaalsContact C-N 3.25Å; L8-A10 PolarHBondContact O-N 3.29Å; L8-T11 PolarHBondContact O-N 3.31Å; L8-T11 PolarHBondContact O-OG1 3.1Å; L8-M42 HydrophobicContact CB-CE 4.28Å; L8-Q46 HydrophobicContact CD2-CG 4.47Å; L8-A49 HydrophobicContact CD1-CB 4.33Å; L8-A49 HydrophobicContact CD2-CB 4.38Å; L8-L50 VanDerWaalsContact CD1-CA 3.43Å; L8-L50 HydrophobicContact CD1-CB 3.74Å; L8-L50 HydrophobicContact CD1-CD1 3.99Å; L8-Q53 PolarHBondContact O-OE1 2.63Å
9E86.4Confident84Confident82 Ų8267.1 Ų67.138%0.38333%0.325SS..Hα-helixtrans-65.5-29.4176-78.4-171.5-166.900113.4D5 V6 T11 S12 K15D5-E9 WeakPolarHBondContact O-CG 3.28Å; D5-E9 PolarHBondContact O-N 3.48Å; V6-E9 PolarHBondContact O-N 3.24Å; E9-T11 VanDerWaalsContact C-N 3.27Å; E9-T11 PolarHBondContact O-N 3.06Å; E9-S12 PolarHBondContact O-OG 2.94Å; E9-K15 IonicContact OE2-NZ 2.71Å; E9-K15 PolarHBondContact OE2-NZ 3.48Å
10A87.8Confident84.3Confident2 Ų265.1 Ų65.12%0.01732%0.316CS..Hα-helixtrans-69.5-23.7-178.100000112.6V6 F7 L8 S12 K15 D18 F19 F22V6-A10 PolarHBondContact O-N 3.33Å; F7-A10 WeakPolarHBondContact O-CB 3.27Å; F7-A10 PolarHBondContact O-N 2.98Å; L8-A10 VanDerWaalsContact C-N 3.25Å; L8-A10 PolarHBondContact O-N 3.29Å; A10-S12 PolarHBondContact O-N 3.38Å; A10-K15 CarbonylContact O-C 3.47Å; A10-D18 HydrophobicContact CB-CB 4.05Å; A10-F19 HydrophobicContact CB-CB 4.22Å; A10-F19 WeakPolarHBondContact O-CB 3.49Å; A10-F22 HydrophobicContact CB-CD2 3.91Å; A10-F22 HydrophobicContact CB-CE2 3.97Å
11T86.4Confident84.5Confident0 Ų070 Ų700%033%0.331CS..THydrogen-bonded Turntrans-74.216.1-176.452.20000115.6L8 E9 F19 L50 Q53 L54L8-T11 PolarHBondContact O-N 3.31Å; L8-T11 PolarHBondContact O-OG1 3.1Å; E9-T11 VanDerWaalsContact C-N 3.27Å; E9-T11 PolarHBondContact O-N 3.06Å; T11-F19 HydrophobicContact CG2-CD2 3.64Å; T11-F19 HydrophobicContact CG2-CE2 3.72Å; T11-F19 HydrophobicContact CG2-CG 4.33Å; T11-F19 HydrophobicContact CG2-CZ 4.46Å; T11-L50 HydrophobicContact CG2-CD1 3.6Å; T11-Q53 PolarHBondContact OG1-OE1 3.35Å; T11-L54 HydrophobicContact CG2-CD2 3.68Å; T11-L54 HydrophobicContact CG2-CG 4.12Å
12S83.9Confident86.1Confident42 Ų4263.8 Ų63.829%0.29430%0.3SS..SBendtrans-99.7150.5176.266.50000112.1E9 A10 K14 K15 V16E9-S12 PolarHBondContact O-OG 2.94Å; A10-S12 PolarHBondContact O-N 3.38Å; S12-K14 PolarHBondContact O-N 3.46Å; S12-K14 VanDerWaalsContact O-N 3.08Å; S12-K15 CarbonylContact O-C 3.33Å; S12-K15 PolarHBondContact O-N 2.94Å; S12-V16 PolarHBondContact O-N 3.13Å
13K76.9Confident86.7Confident90 Ų9061.5 Ų61.539%0.39128%0.284SS..G310 helixtrans-54.4-33.3179.8-176.8169.4-178.1171.50113.4K15 L57 E60 D64K13-K15 VanDerWaalsContact C-N 3.26Å; K13-K15 PolarHBondContact O-N 3.35Å; K13-L57 HydrophobicContact CB-CD1 4.06Å; K13-E60 WeakPolarHBondContact CB-OE2 3.39Å; K13-E60 HydrophobicContact CD-CB 4.15Å; K13-E60 WeakPolarHBondContact CD-OE2 3.17Å; K13-D64 WeakPolarHBondContact CE-OD2 3.34Å; K13-D64 IonicContact NZ-OD1 3.26Å; K13-D64 IonicContact NZ-OD2 2.58Å; K13-D64 PolarHBondContact NZ-OD2 3.37Å
14K80.1Confident87Confident207 Ų20761.7 Ų61.790%0.929%0.286SS*.G310 helixtrans-70.1-19.1178.5-65.1-177.1-1791780113.9S12S12-K14 PolarHBondContact O-N 3.46Å; S12-K14 VanDerWaalsContact O-N 3.08Å
15K86Confident87.1Confident77 Ų7760.2 Ų60.234%0.33528%0.284SS..G310 helixtrans-124.725-178.2-63.9-171.3-177.8178.50112.2E9 A10 S12 K13 E17 D18 F19E9-K15 IonicContact OE2-NZ 2.71Å; E9-K15 PolarHBondContact OE2-NZ 3.48Å; A10-K15 CarbonylContact O-C 3.47Å; S12-K15 CarbonylContact O-C 3.33Å; S12-K15 PolarHBondContact O-N 2.94Å; K13-K15 VanDerWaalsContact C-N 3.26Å; K13-K15 PolarHBondContact O-N 3.35Å; K15-E17 PolarHBondContact O-N 3.07Å; K15-E17 VanDerWaalsContact O-N 3.14Å; K15-D18 HydrophobicContact CB-CB 4.37Å; K15-D18 WeakPolarHBondContact O-CB 3.49Å; K15-D18 PolarHBondContact O-N 2.93Å; K15-F19 PolarHBondContact O-N 3.34Å
16V85.9Confident87.3Confident15 Ų1559.9 Ų59.99%0.09128%0.281CS..Hα-helixtrans-60-30.9-172.988.60000113.2S12 F19 L20 L57 I61 V89S12-V16 PolarHBondContact O-N 3.13Å; V16-F19 WeakPolarHBondContact O-CB 3.36Å; V16-F19 PolarHBondContact O-N 3.04Å; V16-L20 WeakPolarHBondContact O-CG 3.32Å; V16-L20 PolarHBondContact O-N 3.2Å; V16-L57 HydrophobicContact CG2-CD1 3.88Å; V16-L57 HydrophobicContact CG2-CD2 4.12Å; V16-I61 HydrophobicContact CG2-CD1 4.29Å; V16-V89 HydrophobicContact CG2-CG1 4.22Å; V16-V89 HydrophobicContact CG2-CG2 3.74Å
17E87.4Confident87.3Confident120 Ų12062.4 Ų62.456%0.56129%0.287SS*.Hα-helixtrans-66.9-36.4174.8-64.2-60.6162.900112.5K15 F19 L20 R21 H85K15-E17 PolarHBondContact O-N 3.07Å; K15-E17 VanDerWaalsContact O-N 3.14Å; E17-F19 VanDerWaalsContact C-N 3.31Å; E17-L20 PolarHBondContact O-N 2.99Å; E17-R21 WeakPolarHBondContact O-CB 3.21Å; E17-R21 PolarHBondContact O-N 2.83Å; E17-H85 IonicContact OE1-CE1 2.85Å; E17-H85 PolarHBondContact OE1-CE1 2.96Å; E17-H85 IonicContact OE1-ND1 3.66Å; E17-H85 PolarHBondContact OE1-ND1 3.01Å
18D88.2Confident87.1Confident74 Ų7465.9 Ų65.940%0.39631%0.306SS..Hα-helixtrans-65.6-39.3173.8-65.1-34.8000110.1A10 K15 R21 F22A10-D18 HydrophobicContact CB-CB 4.05Å; K15-D18 HydrophobicContact CB-CB 4.37Å; K15-D18 WeakPolarHBondContact O-CB 3.49Å; K15-D18 PolarHBondContact O-N 2.93Å; D18-R21 WeakPolarHBondContact O-CB 3.49Å; D18-R21 PolarHBondContact O-N 3.05Å; D18-F22 WeakPolarHBondContact O-CD2 3.36Å; D18-F22 PolarHBondContact O-N 3.22Å
19F91.3Very high86.5Confident0 Ų074.6 Ų74.60%034%0.343CS..Hα-helixtrans-63.3-49.2175174.9-121.8000112F7 A10 T11 K15 V16 E17 R21 F22 I23 L54 L57 A92 V93 V96F7-F19 HydrophobicContact CE2-CD2 4.1Å; F7-F19 HydrophobicContact CE2-CE2 4.1Å; F7-F19 HydrophobicContact CZ-CD2 4.36Å; F7-F19 AromaticContact CZ-CE2 3.94Å; F7-F19 HydrophobicContact CZ-CE2 3.94Å; A10-F19 HydrophobicContact CB-CB 4.22Å; A10-F19 WeakPolarHBondContact O-CB 3.49Å; T11-F19 HydrophobicContact CG2-CD2 3.64Å; T11-F19 HydrophobicContact CG2-CE2 3.72Å; T11-F19 HydrophobicContact CG2-CG 4.33Å; T11-F19 HydrophobicContact CG2-CZ 4.46Å; K15-F19 PolarHBondContact O-N 3.34Å; V16-F19 WeakPolarHBondContact O-CB 3.36Å; V16-F19 PolarHBondContact O-N 3.04Å; E17-F19 VanDerWaalsContact C-N 3.31Å; F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 2.72Å; F19-F22 PolarHBondContact O-N 3.3Å; F19-F22 VanDerWaalsContact O-N 3.14Å; F19-I23 HydrophobicContact CD2-CG1 4.31Å; F19-I23 HydrophobicContact CE2-CD1 3.93Å; F19-I23 HydrophobicContact CE2-CG1 4.02Å; F19-I23 HydrophobicContact CZ-CD1 4.05Å; F19-I23 HydrophobicContact CZ-CG1 4.15Å; F19-I23 VanDerWaalsContact O-CG1 3.27Å; F19-I23 WeakPolarHBondContact O-CG1 3.49Å; F19-I23 PolarHBondContact O-N 2.86Å; F19-I23 VanDerWaalsContact O-N 3.07Å; F19-L54 HydrophobicContact CE1-CD2 4.14Å; F19-L54 HydrophobicContact CE2-CD2 4.15Å; F19-L54 HydrophobicContact CZ-CD2 3.68Å; F19-L57 HydrophobicContact CD1-CD2 4.21Å; F19-L57 HydrophobicContact CE1-CD2 4.34Å; F19-A92 HydrophobicContact CD1-CB 4.29Å; F19-A92 HydrophobicContact CE1-CB 3.5Å; F19-A92 HydrophobicContact CZ-CB 3.85Å; F19-V93 HydrophobicContact CE1-CG2 4.31Å; F19-V96 HydrophobicContact CE2-CG2 3.97Å; F19-V96 HydrophobicContact CZ-CG2 3.95Å
20L90.8Very high86.2Confident27 Ų2776.4 Ų76.414%0.14136%0.359CS..Hα-helixtrans-60.1-37.3176.3-70179.8000111.9V16 E17 I23 Q24 A88 V89 A92V16-L20 WeakPolarHBondContact O-CG 3.32Å; V16-L20 PolarHBondContact O-N 3.2Å; E17-L20 PolarHBondContact O-N 2.99Å; L20-I23 PolarHBondContact O-N 3.32Å; L20-Q24 PolarHBondContact O-N 2.76Å; L20-A88 HydrophobicContact CD1-CB 4.36Å; L20-A88 HydrophobicContact CD2-CB 4.11Å; L20-V89 HydrophobicContact CD1-CG2 4.06Å; L20-V89 HydrophobicContact CD2-CG2 4.04Å; L20-V89 HydrophobicContact CG-CG2 4.25Å; L20-A92 HydrophobicContact CD2-CB 3.98Å
21R89.3Confident85.9Confident168 Ų16880.9 Ų80.963%0.63438%0.38SS*.Hα-helixtrans-62.2-43.7174.1-174179.7179-178.50.6112.2E17 D18 F19 I23 Q24 L25E17-R21 WeakPolarHBondContact O-CB 3.21Å; E17-R21 PolarHBondContact O-N 2.83Å; D18-R21 WeakPolarHBondContact O-CB 3.49Å; D18-R21 PolarHBondContact O-N 3.05Å; F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 2.72Å; R21-I23 VanDerWaalsContact C-N 3.29Å; R21-I23 PolarHBondContact O-N 3.19Å; R21-Q24 WeakPolarHBondContact O-CB 3.49Å; R21-Q24 PolarHBondContact O-N 2.67Å; R21-L25 WeakPolarHBondContact O-CG 3.33Å; R21-L25 PolarHBondContact O-N 2.89Å
22F90.8Very high85.7Confident38 Ų3885.8 Ų85.817%0.16741%0.412CS..Hα-helixtrans-61.4-38.2174.3-80.2-62.2000112.6V6 F7 A10 D18 F19 Q24 L25 H26 F33V6-F22 HydrophobicContact CG1-CE2 4.07Å; V6-F22 HydrophobicContact CG1-CZ 3.69Å; F7-F22 HydrophobicContact CD2-CB 3.82Å; F7-F22 HydrophobicContact CD2-CD1 4.45Å; F7-F22 HydrophobicContact CD2-CD2 4.01Å; F7-F22 AromaticContact CD2-CG 3.85Å; F7-F22 HydrophobicContact CD2-CG 3.85Å; F7-F22 HydrophobicContact CE2-CB 3.82Å; F7-F22 HydrophobicContact CE2-CG 4.37Å; A10-F22 HydrophobicContact CB-CD2 3.91Å; A10-F22 HydrophobicContact CB-CE2 3.97Å; D18-F22 WeakPolarHBondContact O-CD2 3.36Å; D18-F22 PolarHBondContact O-N 3.22Å; F19-F22 PolarHBondContact O-N 3.3Å; F19-F22 VanDerWaalsContact O-N 3.14Å; F22-Q24 VanDerWaalsContact C-N 3.32Å; F22-L25 HydrophobicContact CD1-CD1 4.16Å; F22-L25 PolarHBondContact O-N 2.99Å; F22-H26 PolarHBondContact O-N 2.82Å; F22-F33 HydrophobicContact CB-CE1 3.85Å; F22-F33 HydrophobicContact CB-CZ 4.09Å; F22-F33 HydrophobicContact CD1-CD1 4.23Å; F22-F33 HydrophobicContact CD1-CD2 4.14Å; F22-F33 AromaticContact CD1-CE1 3.72Å; F22-F33 HydrophobicContact CD1-CE1 3.72Å; F22-F33 AromaticContact CD1-CE2 3.62Å; F22-F33 HydrophobicContact CD1-CE2 3.62Å; F22-F33 HydrophobicContact CD1-CG 4.43Å; F22-F33 AromaticContact CD1-CZ 3.4Å; F22-F33 HydrophobicContact CD1-CZ 3.4Å; F22-F33 HydrophobicContact CE1-CD2 4.38Å; F22-F33 AromaticContact CE1-CE2 3.89Å; F22-F33 HydrophobicContact CE1-CE2 3.89Å; F22-F33 HydrophobicContact CE1-CZ 4.11Å; F22-F33 HydrophobicContact CG-CE1 4.2Å; F22-F33 AromaticContact CG-CZ 4Å; F22-F33 HydrophobicContact CG-CZ 4Å; F22-F33 WeakPolarHBondContact O-CD1 3.09Å; F22-F33 WeakPolarHBondContact O-CE1 3.28Å
23I91.6Very high85.9Confident4 Ų484.9 Ų84.92%0.02140%0.403CS..Hα-helixtrans-68.1-35.8176.9-60.4-76.6000110.8F19 L20 R21 H26 K27 V35 A92 L95 V96F19-I23 HydrophobicContact CD2-CG1 4.31Å; F19-I23 HydrophobicContact CE2-CD1 3.93Å; F19-I23 HydrophobicContact CE2-CG1 4.02Å; F19-I23 HydrophobicContact CZ-CD1 4.05Å; F19-I23 HydrophobicContact CZ-CG1 4.15Å; F19-I23 VanDerWaalsContact O-CG1 3.27Å; F19-I23 WeakPolarHBondContact O-CG1 3.49Å; F19-I23 PolarHBondContact O-N 2.86Å; F19-I23 VanDerWaalsContact O-N 3.07Å; L20-I23 PolarHBondContact O-N 3.32Å; R21-I23 VanDerWaalsContact C-N 3.29Å; R21-I23 PolarHBondContact O-N 3.19Å; I23-H26 PolarHBondContact O-N 3.37Å; I23-K27 WeakPolarHBondContact O-CG 3.37Å; I23-K27 PolarHBondContact O-N 3.49Å; I23-K27 VanDerWaalsContact O-N 3.09Å; I23-V35 HydrophobicContact CD1-CG2 4.26Å; I23-A92 HydrophobicContact CB-CB 4.3Å; I23-A92 HydrophobicContact CD1-CB 4.05Å; I23-A92 HydrophobicContact CG1-CB 3.7Å; I23-A92 HydrophobicContact CG2-CB 4.1Å; I23-L95 HydrophobicContact CD1-CD2 3.98Å; I23-L95 HydrophobicContact CG2-CD2 3.97Å; I23-V96 HydrophobicContact CD1-CG2 3.77Å
24Q87.6Confident86.4Confident142 Ų14283.1 Ų83.166%0.66440%0.398SS*.Hα-helixtrans-66.4-40.8173.3-170.3170.17.300111.9L20 R21 F22 H26 K27 D28L20-Q24 PolarHBondContact O-N 2.76Å; R21-Q24 WeakPolarHBondContact O-CB 3.49Å; R21-Q24 PolarHBondContact O-N 2.67Å; F22-Q24 VanDerWaalsContact C-N 3.32Å; Q24-H26 VanDerWaalsContact C-N 3.32Å; Q24-H26 PolarHBondContact O-N 3.16Å; Q24-K27 PolarHBondContact O-N 3.19Å; Q24-K27 VanDerWaalsContact O-N 3.12Å; Q24-D28 PolarHBondContact O-N 2.93Å; Q24-D28 VanDerWaalsContact O-N 3.09Å
25L89.2Confident86.8Confident46 Ų4673.2 Ų73.224%0.24136%0.355CS..Hα-helixtrans-59.8-41173.3-68.5171.9000111.7R21 F22 K27 D28 E31 F33R21-L25 WeakPolarHBondContact O-CG 3.33Å; R21-L25 PolarHBondContact O-N 2.89Å; F22-L25 HydrophobicContact CD1-CD1 4.16Å; F22-L25 PolarHBondContact O-N 2.99Å; L25-K27 VanDerWaalsContact C-N 3.32Å; L25-K27 PolarHBondContact O-N 2.96Å; L25-D28 PolarHBondContact O-N 3.49Å; L25-E31 HydrophobicContact CD2-CB 4.24Å; L25-E31 HydrophobicContact CD2-CG 3.8Å; L25-F33 HydrophobicContact CB-CB 4.09Å; L25-F33 HydrophobicContact CB-CD1 4.02Å; L25-F33 HydrophobicContact CB-CG 4.33Å
26H88.6Confident87Confident44 Ų4472.6 Ų72.620%0.20435%0.353CS..Hα-helixtrans-66.1-31.9174.3168.183.1000113.6F22 I23 Q24 D28 F33 D34 V35F22-H26 PolarHBondContact O-N 2.82Å; I23-H26 PolarHBondContact O-N 3.37Å; Q24-H26 VanDerWaalsContact C-N 3.32Å; Q24-H26 PolarHBondContact O-N 3.16Å; H26-D28 VanDerWaalsContact C-N 3.31Å; H26-F33 WeakPolarHBondContact CA-O 3.39Å; H26-F33 HydrophobicContact CB-CD1 4.37Å; H26-D34 IonicContact CE1-OD1 3.41Å; H26-D34 PolarHBondContact CE1-OD1 2.86Å; H26-D34 VanDerWaalsContact CE1-OD1 3.26Å; H26-D34 IonicContact ND1-OD1 3.63Å; H26-D34 PolarHBondContact ND1-OD1 3.41Å; H26-D34 VanDerWaalsContact ND1-OD1 3.09Å; H26-V35 HydrophobicContact CB-CB 4.43Å; H26-V35 HydrophobicContact CB-CG2 3.72Å; H26-V35 PolarHBondContact ND1-N 2.83Å
27K85.4Confident87.1Confident108 Ų10877.2 Ų77.247%0.4737%0.373SS..Hα-helixtrans-73-24.8176-72.7173.7179.21750112.2I23 Q24 L25 K29 D91I23-K27 WeakPolarHBondContact O-CG 3.37Å; I23-K27 PolarHBondContact O-N 3.49Å; I23-K27 VanDerWaalsContact O-N 3.09Å; Q24-K27 PolarHBondContact O-N 3.19Å; Q24-K27 VanDerWaalsContact O-N 3.12Å; L25-K27 VanDerWaalsContact C-N 3.32Å; L25-K27 PolarHBondContact O-N 2.96Å; K27-K29 PolarHBondContact O-N 3.42Å; K27-D91 IonicContact NZ-OD2 2.83Å; K27-D91 PolarHBondContact NZ-OD2 2.94Å
28D86.1Confident87.2Confident73 Ų7371.9 Ų71.939%0.3935%0.349SS..  trans-86.6105.7176.7-166.3-22.4000111.3Q24 L25 H26 T30 E31Q24-D28 PolarHBondContact O-N 2.93Å; Q24-D28 VanDerWaalsContact O-N 3.09Å; L25-D28 PolarHBondContact O-N 3.49Å; H26-D28 VanDerWaalsContact C-N 3.31Å; D28-T30 VanDerWaalsContact CG-OG1 3.26Å; D28-T30 PolarHBondContact O-N 3.25Å; D28-T30 WeakPolarHBondContact OD1-CB 3.24Å; D28-T30 PolarHBondContact OD1-N 3.31Å; D28-T30 PolarHBondContact OD1-OG1 2.77Å; D28-T30 PolarHBondContact OD2-OG1 3Å; D28-E31 HydrophobicContact CB-CB 4.49Å; D28-E31 HydrophobicContact CB-CG 4.25Å; D28-E31 PolarHBondContact O-N 2.92Å; D28-E31 VanDerWaalsContact O-N 3.11Å
29K77.4Confident87.3Confident208 Ų20868.4 Ų68.490%0.90433%0.331SS*.THydrogen-bonded Turntrans-65.4-7.8-179.9-66.5-172176.7-173.30114.5K27K27-K29 PolarHBondContact O-N 3.42Å
30T78.4Confident87.1Confident119 Ų11974.6 Ų74.673%0.7336%0.36SS*.THydrogen-bonded Turntrans-88.9-15177.167.40000112.9D28D28-T30 VanDerWaalsContact CG-OG1 3.26Å; D28-T30 PolarHBondContact O-N 3.25Å; D28-T30 WeakPolarHBondContact OD1-CB 3.24Å; D28-T30 PolarHBondContact OD1-N 3.31Å; D28-T30 PolarHBondContact OD1-OG1 2.77Å; D28-T30 PolarHBondContact OD2-OG1 3Å
31E81.6Confident87.1Confident96 Ų9678.4 Ų78.445%0.44938%0.377SS..SBendtrans-94.2143178.9-70.9-69.7160.400111.2L25 D28 F33L25-E31 HydrophobicContact CD2-CB 4.24Å; L25-E31 HydrophobicContact CD2-CG 3.8Å; D28-E31 HydrophobicContact CB-CB 4.49Å; D28-E31 HydrophobicContact CB-CG 4.25Å; D28-E31 PolarHBondContact O-N 2.92Å; D28-E31 VanDerWaalsContact O-N 3.11Å; E31-F33 PolarHBondContact O-N 3.44Å; E31-F33 VanDerWaalsContact O-N 3.1Å
32P82.2Confident87.1Confident104 Ų10470.7 Ų70.768%0.67535%0.348SS*.SBendtrans-83.424.7-175.135.8-37.4000113.4
33F88.2Confident86.9Confident22 Ų2272.1 Ų72.110%0.09636%0.361CS..  trans-110.2115.5-177.1-176.8-92.9000110.8F7 F22 L25 H26 E31 V35 V38F7-F33 HydrophobicContact CD2-CE1 4.46Å; F7-F33 AromaticContact CD2-CZ 3.8Å; F7-F33 HydrophobicContact CD2-CZ 3.8Å; F7-F33 HydrophobicContact CE2-CZ 4.26Å; F7-F33 HydrophobicContact CG-CZ 4.35Å; F22-F33 HydrophobicContact CB-CE1 3.85Å; F22-F33 HydrophobicContact CB-CZ 4.09Å; F22-F33 HydrophobicContact CD1-CD1 4.23Å; F22-F33 HydrophobicContact CD1-CD2 4.14Å; F22-F33 AromaticContact CD1-CE1 3.72Å; F22-F33 HydrophobicContact CD1-CE1 3.72Å; F22-F33 AromaticContact CD1-CE2 3.62Å; F22-F33 HydrophobicContact CD1-CE2 3.62Å; F22-F33 HydrophobicContact CD1-CG 4.43Å; F22-F33 AromaticContact CD1-CZ 3.4Å; F22-F33 HydrophobicContact CD1-CZ 3.4Å; F22-F33 HydrophobicContact CE1-CD2 4.38Å; F22-F33 AromaticContact CE1-CE2 3.89Å; F22-F33 HydrophobicContact CE1-CE2 3.89Å; F22-F33 HydrophobicContact CE1-CZ 4.11Å; F22-F33 HydrophobicContact CG-CE1 4.2Å; F22-F33 AromaticContact CG-CZ 4Å; F22-F33 HydrophobicContact CG-CZ 4Å; F22-F33 WeakPolarHBondContact O-CD1 3.09Å; F22-F33 WeakPolarHBondContact O-CE1 3.28Å; L25-F33 HydrophobicContact CB-CB 4.09Å; L25-F33 HydrophobicContact CB-CD1 4.02Å; L25-F33 HydrophobicContact CB-CG 4.33Å; H26-F33 WeakPolarHBondContact CA-O 3.39Å; H26-F33 HydrophobicContact CB-CD1 4.37Å; E31-F33 PolarHBondContact O-N 3.44Å; E31-F33 VanDerWaalsContact O-N 3.1Å; F33-V35 HydrophobicContact CE1-CG2 3.83Å; F33-V38 HydrophobicContact CD2-CG2 4.45Å; F33-V38 HydrophobicContact CE2-CG2 3.79Å; F33-V38 HydrophobicContact CZ-CG2 4.05Å
34D88Confident86.7Confident53 Ų5377 Ų7728%0.28338%0.379SS..  trans-121.8118.6176.7-165-30.1000111.1H26 E36 E37 V38H26-D34 IonicContact CE1-OD1 3.41Å; H26-D34 PolarHBondContact CE1-OD1 2.86Å; H26-D34 VanDerWaalsContact CE1-OD1 3.26Å; H26-D34 IonicContact ND1-OD1 3.63Å; H26-D34 PolarHBondContact ND1-OD1 3.41Å; H26-D34 VanDerWaalsContact ND1-OD1 3.09Å; D34-E36 PolarHBondContact O-N 3.27Å; D34-E36 VanDerWaalsContact OD1-CB 3.29Å; D34-E36 WeakPolarHBondContact OD1-CB 3.41Å; D34-E36 PolarHBondContact OD1-N 3.03Å; D34-E37 HydrophobicContact CB-CB 4.12Å; D34-E37 HydrophobicContact CB-CG 3.87Å; D34-E37 PolarHBondContact O-N 3.35Å; D34-V38 WeakPolarHBondContact O-CG2 3.43Å; D34-V38 PolarHBondContact O-N 2.84Å
35V89.8Confident86.6Confident0 Ų078.1 Ų78.10%038%0.384CS..Hα-helixtrans-57.9-34.4175.3172.50000111.6F7 I23 H26 F33 V38 V39 V96 V99F7-V35 HydrophobicContact CE2-CG2 4.25Å; F7-V35 HydrophobicContact CZ-CG1 4.15Å; F7-V35 HydrophobicContact CZ-CG2 4.15Å; I23-V35 HydrophobicContact CD1-CG2 4.26Å; H26-V35 HydrophobicContact CB-CB 4.43Å; H26-V35 HydrophobicContact CB-CG2 3.72Å; H26-V35 PolarHBondContact ND1-N 2.83Å; F33-V35 HydrophobicContact CE1-CG2 3.83Å; V35-V38 PolarHBondContact O-N 3.02Å; V35-V39 HydrophobicContact CG1-CG2 4.1Å; V35-V39 WeakPolarHBondContact O-CB 3.37Å; V35-V39 VanDerWaalsContact O-CG2 3.24Å; V35-V39 WeakPolarHBondContact O-CG2 3.32Å; V35-V39 PolarHBondContact O-N 3Å; V35-V96 HydrophobicContact CG1-CG2 4.05Å; V35-V99 HydrophobicContact CG1-CG1 4.4Å; V35-V99 HydrophobicContact CG1-CG2 4.47Å
36E88.8Confident86.6Confident64 Ų6478 Ų7830%0.29938%0.382SS..Hα-helixtrans-64.7-45.9177.3-171161.3-179.400111.8D34 Q40 V99 K102D34-E36 PolarHBondContact O-N 3.27Å; D34-E36 VanDerWaalsContact OD1-CB 3.29Å; D34-E36 WeakPolarHBondContact OD1-CB 3.41Å; D34-E36 PolarHBondContact OD1-N 3.03Å; E36-Q40 WeakPolarHBondContact O-CB 3.47Å; E36-Q40 PolarHBondContact O-N 3.31Å; E36-V99 HydrophobicContact CB-CG1 4.05Å; E36-V99 HydrophobicContact CB-CG2 4.42Å; E36-V99 HydrophobicContact CG-CG1 4.24Å; E36-K102 WeakPolarHBondContact OE1-CD 3.45Å; E36-K102 IonicContact OE1-NZ 3.48Å; E36-K102 PolarHBondContact OE1-NZ 2.94Å; E36-K102 IonicContact OE2-NZ 3.54Å; E36-K102 PolarHBondContact OE2-NZ 3.5Å
37E87.8Confident86.6Confident111 Ų11176.5 Ų76.552%0.51938%0.375SS..Hα-helixtrans-62.3-46.2174.3-65.7-178.1170.300111.2D34 V39 Q40 E41D34-E37 HydrophobicContact CB-CB 4.12Å; D34-E37 HydrophobicContact CB-CG 3.87Å; D34-E37 PolarHBondContact O-N 3.35Å; E37-V39 PolarHBondContact O-N 3.43Å; E37-Q40 PolarHBondContact O-N 3.31Å; E37-E41 VanDerWaalsContact O-CB 3.27Å; E37-E41 WeakPolarHBondContact O-CB 3.29Å; E37-E41 VanDerWaalsContact O-CG 3.28Å; E37-E41 WeakPolarHBondContact O-CG 3.36Å; E37-E41 PolarHBondContact O-N 3.45Å
38V90.8Very high86.8Confident9 Ų973.9 Ų73.96%0.05536%0.364CS..Hα-helixtrans-61.6-47.2-179.2175.30000111.7R4 F7 F33 D34 V35 E41 M42R4-V38 HydrophobicContact CG-CG1 4.36Å; F7-V38 HydrophobicContact CB-CG1 4.19Å; F7-V38 HydrophobicContact CD1-CG1 4.03Å; F7-V38 HydrophobicContact CG-CG1 4.28Å; F33-V38 HydrophobicContact CD2-CG2 4.45Å; F33-V38 HydrophobicContact CE2-CG2 3.79Å; F33-V38 HydrophobicContact CZ-CG2 4.05Å; D34-V38 WeakPolarHBondContact O-CG2 3.43Å; D34-V38 PolarHBondContact O-N 2.84Å; V35-V38 PolarHBondContact O-N 3.02Å; V38-E41 PolarHBondContact O-N 3.23Å; V38-M42 HydrophobicContact CG1-CE 4.01Å; V38-M42 WeakPolarHBondContact O-CG 3.01Å; V38-M42 PolarHBondContact O-N 2.95Å
39V89.5Confident87Confident0 Ų072.2 Ų72.20%036%0.361CS..Hα-helixtrans-69.3-36179.91750000111.2V35 E37 E41 M42 L50 V96 V99 V103V35-V39 HydrophobicContact CG1-CG2 4.1Å; V35-V39 WeakPolarHBondContact O-CB 3.37Å; V35-V39 VanDerWaalsContact O-CG2 3.24Å; V35-V39 WeakPolarHBondContact O-CG2 3.32Å; V35-V39 PolarHBondContact O-N 3Å; E37-V39 PolarHBondContact O-N 3.43Å; V39-E41 VanDerWaalsContact C-N 3.29Å; V39-E41 PolarHBondContact O-N 3.48Å; V39-M42 PolarHBondContact O-N 3.28Å; V39-L50 HydrophobicContact CG2-CD2 4.06Å; V39-V96 HydrophobicContact CG2-CG1 4.47Å; V39-V99 HydrophobicContact CB-CG1 3.91Å; V39-V99 HydrophobicContact CG1-CG1 4.22Å; V39-V99 HydrophobicContact CG2-CG1 4.15Å; V39-V103 HydrophobicContact CG1-CG2 4.21Å
40Q88.2Confident87.7Confident131 Ų13162.3 Ų62.361%0.61232%0.318SS*.Hα-helixtrans-63.3-37.3175.5-176.5175.7-2.100112.4E36 E37 M42 V103E36-Q40 WeakPolarHBondContact O-CB 3.47Å; E36-Q40 PolarHBondContact O-N 3.31Å; E37-Q40 PolarHBondContact O-N 3.31Å; Q40-M42 VanDerWaalsContact C-N 3.34Å; Q40-V103 HydrophobicContact CB-CG1 4.47Å; Q40-V103 HydrophobicContact CB-CG2 4.03Å
41E88.9Confident88.4Confident107 Ų10756.8 Ų56.850%0.528%0.283SS..Hα-helixtrans-78.3-14.7-179.4-82.1-167.2-176.400114.3R4 E37 V38 V39R4-E41 IonicContact CZ-OE2 3.31Å; R4-E41 VanDerWaalsContact CZ-OE2 3.31Å; R4-E41 PolarHBondContact NE-O 2.61Å; R4-E41 IonicContact NE-OE2 3.09Å; R4-E41 PolarHBondContact NE-OE2 3.32Å; R4-E41 PolarHBondContact NH1-O 3.5Å; R4-E41 IonicContact NH2-OE2 2.74Å; R4-E41 PolarHBondContact NH2-OE2 3.11Å; E37-E41 VanDerWaalsContact O-CB 3.27Å; E37-E41 WeakPolarHBondContact O-CB 3.29Å; E37-E41 VanDerWaalsContact O-CG 3.28Å; E37-E41 WeakPolarHBondContact O-CG 3.36Å; E37-E41 PolarHBondContact O-N 3.45Å; V38-E41 PolarHBondContact O-N 3.23Å; V39-E41 VanDerWaalsContact C-N 3.29Å; V39-E41 PolarHBondContact O-N 3.48Å
42M89.8Confident88.9Confident6 Ų655.2 Ų55.23%0.0328%0.283CS..SBendtrans-71.3130.8-179.3-80.2176.3172.300112.3R4 F7 L8 V38 V39 Q40 Q46 R47 L50R4-M42 HydrophobicContact CB-CE 4.07Å; R4-M42 HydrophobicContact CB-CG 4.14Å; R4-M42 HydrophobicContact CG-CG 4.27Å; R4-M42 WeakPolarHBondContact O-CE 3.49Å; F7-M42 HydrophobicContact CD1-CE 4.01Å; L8-M42 HydrophobicContact CB-CE 4.28Å; V38-M42 HydrophobicContact CG1-CE 4.01Å; V38-M42 WeakPolarHBondContact O-CG 3.01Å; V38-M42 PolarHBondContact O-N 2.95Å; V39-M42 PolarHBondContact O-N 3.28Å; Q40-M42 VanDerWaalsContact C-N 3.34Å; M42-Q46 HydrophobicContact CB-CB 4.09Å; M42-Q46 HydrophobicContact CG-CB 4.16Å; M42-Q46 HydrophobicContact SD-CB 4.48Å; M42-R47 HydrophobicContact CB-CG 3.59Å; M42-R47 PolarHBondContact O-NE 2.97Å; M42-L50 HydrophobicContact SD-CD2 3.95Å
43P87.9Confident89.4Confident68 Ų6853.6 Ų53.644%0.44227%0.267SS..  trans-62.5159.4168.728.8-34.4000110.8E45 Q46 R47P43-E45 VanDerWaalsContact C-N 3.32Å; P43-E45 PolarHBondContact O-N 3.24Å; P43-Q46 VanDerWaalsContact CD-OE1 3.29Å; P43-Q46 HydrophobicContact CG-CB 4.02Å; P43-Q46 HydrophobicContact CG-CG 3.8Å; P43-Q46 PolarHBondContact O-N 3.5Å; P43-R47 PolarHBondContact O-N 2.73Å
44R85.8Confident89.6Confident107 Ų10752.6 Ų52.640%0.40426%0.263SS..Hα-helixtrans-48.3-48.9-175.9179.8179171.1158.75.4113.4Q46 R47 E48 G107 D108 T109R44-Q46 VanDerWaalsContact C-N 3.3Å; R44-Q46 PolarHBondContact O-N 2.83Å; R44-R47 PolarHBondContact O-N 3.29Å; R44-R47 VanDerWaalsContact O-N 3.13Å; R44-E48 HydrophobicContact CG-CG 4.49Å; R44-E48 WeakPolarHBondContact CG-OE1 3.49Å; R44-E48 IonicContact CZ-OE1 3.39Å; R44-E48 IonicContact NE-OE1 2.7Å; R44-E48 PolarHBondContact NE-OE1 3.3Å; R44-E48 IonicContact NH2-OE1 2.63Å; R44-E48 WeakPolarHBondContact O-CG 3.46Å; R44-E48 PolarHBondContact O-N 3.06Å; R44-G107 PolarHBondContact NH1-O 3.05Å; R44-G107 VanDerWaalsContact NH1-O 3.11Å; R44-G107 PolarHBondContact NH2-O 3.17Å; R44-D108 IonicContact NE-OD1 3.66Å; R44-T109 PolarHBondContact NH2-OG1 3.2Å
45E85.6Confident89.9Confident164 Ų16450.8 Ų50.877%0.76625%0.253SS*.Hα-helixtrans-61.1-36.9-179.5-64.1178.7-177.800112.7P43 A49P43-E45 VanDerWaalsContact C-N 3.32Å; P43-E45 PolarHBondContact O-N 3.24Å; E45-A49 WeakPolarHBondContact O-CB 3.25Å; E45-A49 PolarHBondContact O-N 3.24Å
46Q88.7Confident90Very high43 Ų4353.5 Ų53.520%0.20127%0.272CS..Hα-helixtrans-71.6-35.9176.3-73.6-169.3-15.200111.9D5 L8 M42 P43 R44 L50D5-Q46 PolarHBondContact OD1-NE2 2.93Å; L8-Q46 HydrophobicContact CD2-CG 4.47Å; M42-Q46 HydrophobicContact CB-CB 4.09Å; M42-Q46 HydrophobicContact CG-CB 4.16Å; M42-Q46 HydrophobicContact SD-CB 4.48Å; P43-Q46 VanDerWaalsContact CD-OE1 3.29Å; P43-Q46 HydrophobicContact CG-CB 4.02Å; P43-Q46 HydrophobicContact CG-CG 3.8Å; P43-Q46 PolarHBondContact O-N 3.5Å; R44-Q46 VanDerWaalsContact C-N 3.3Å; R44-Q46 PolarHBondContact O-N 2.83Å; Q46-L50 VanDerWaalsContact O-CB 3.32Å; Q46-L50 WeakPolarHBondContact O-CB 3.35Å; Q46-L50 PolarHBondContact O-N 2.98Å
47R89.9Confident90.1Very high13 Ų1350.6 Ų50.65%0.04926%0.258CS..Hα-helixtrans-65.8-44175.1-67.5-173.3-73.4140.610.2111.4M42 P43 R44 L50 W51 V103 D108M42-R47 HydrophobicContact CB-CG 3.59Å; M42-R47 PolarHBondContact O-NE 2.97Å; P43-R47 PolarHBondContact O-N 2.73Å; R44-R47 PolarHBondContact O-N 3.29Å; R44-R47 VanDerWaalsContact O-N 3.13Å; R47-L50 WeakPolarHBondContact O-CB 3.37Å; R47-L50 PolarHBondContact O-N 3.11Å; R47-W51 HydrophobicContact CB-CH2 4.11Å; R47-W51 HydrophobicContact CB-CZ2 3.87Å; R47-W51 PolarHBondContact O-N 3.42Å; R47-V103 PolarHBondContact NH1-O 3.1Å; R47-D108 IonicContact CZ-OD2 3.18Å; R47-D108 IonicContact NH1-OD2 3.98Å; R47-D108 PolarHBondContact NH1-OD2 3.33Å; R47-D108 IonicContact NH2-OD1 3.12Å; R47-D108 PolarHBondContact NH2-OD1 3.44Å; R47-D108 IonicContact NH2-OD2 3.22Å; R47-D108 PolarHBondContact NH2-OD2 2.96Å
48E89Confident90.3Very high53 Ų5345.4 Ų45.425%0.24823%0.234CC..Hα-helixtrans-64-44.5176.5-70.2175.1-178.300111.6R44 L50 W51 S52 T109R44-E48 HydrophobicContact CG-CG 4.49Å; R44-E48 WeakPolarHBondContact CG-OE1 3.49Å; R44-E48 IonicContact CZ-OE1 3.39Å; R44-E48 IonicContact NE-OE1 2.7Å; R44-E48 PolarHBondContact NE-OE1 3.3Å; R44-E48 IonicContact NH2-OE1 2.63Å; R44-E48 WeakPolarHBondContact O-CG 3.46Å; R44-E48 PolarHBondContact O-N 3.06Å; E48-L50 VanDerWaalsContact C-N 3.33Å; E48-L50 PolarHBondContact O-N 3.12Å; E48-W51 HydrophobicContact CG-CE3 4.23Å; E48-W51 HydrophobicContact CG-CZ3 4.04Å; E48-W51 PolarHBondContact O-N 3.47Å; E48-S52 PolarHBondContact O-N 2.95Å; E48-S52 PolarHBondContact O-OG 3.06Å; E48-T109 PolarHBondContact OE1-OG1 3.39Å
49A89.7Confident90.3Very high38 Ų3849.1 Ų49.131%0.31425%0.251SS..Hα-helixtrans-60.7-40.8174.700000112.4L8 E45 S52 Q53L8-A49 HydrophobicContact CD1-CB 4.33Å; L8-A49 HydrophobicContact CD2-CB 4.38Å; E45-A49 WeakPolarHBondContact O-CB 3.25Å; E45-A49 PolarHBondContact O-N 3.24Å; A49-S52 PolarHBondContact O-N 3.45Å; A49-Q53 WeakPolarHBondContact O-CG 3.42Å; A49-Q53 PolarHBondContact O-N 3.47Å
50L92.3Very high90.2Very high0 Ų053.1 Ų53.10%027%0.27CS..Hα-helixtrans-59.2-49.1175.4179.966.8000111F7 L8 T11 V39 M42 Q46 R47 E48 S52 Q53 L54 V96F7-L50 HydrophobicContact CD1-CD1 4.41Å; F7-L50 HydrophobicContact CE1-CD1 4.19Å; F7-L50 HydrophobicContact CE1-CD2 4.35Å; L8-L50 VanDerWaalsContact CD1-CA 3.43Å; L8-L50 HydrophobicContact CD1-CB 3.74Å; L8-L50 HydrophobicContact CD1-CD1 3.99Å; T11-L50 HydrophobicContact CG2-CD1 3.6Å; V39-L50 HydrophobicContact CG2-CD2 4.06Å; M42-L50 HydrophobicContact SD-CD2 3.95Å; Q46-L50 VanDerWaalsContact O-CB 3.32Å; Q46-L50 WeakPolarHBondContact O-CB 3.35Å; Q46-L50 PolarHBondContact O-N 2.98Å; R47-L50 WeakPolarHBondContact O-CB 3.37Å; R47-L50 PolarHBondContact O-N 3.11Å; E48-L50 VanDerWaalsContact C-N 3.33Å; E48-L50 PolarHBondContact O-N 3.12Å; L50-S52 PolarHBondContact O-N 3.25Å; L50-Q53 PolarHBondContact O-N 3.43Å; L50-L54 HydrophobicContact CD1-CD1 3.99Å; L50-L54 HydrophobicContact CD1-CG 4.36Å; L50-L54 HydrophobicContact CG-CD1 3.83Å; L50-L54 WeakPolarHBondContact O-CB 3.5Å; L50-L54 VanDerWaalsContact O-CG 3.28Å; L50-L54 WeakPolarHBondContact O-CG 3.48Å; L50-L54 PolarHBondContact O-N 3.12Å; L50-V96 HydrophobicContact CD2-CG1 4.08Å
51W93.5Very high90.1Very high3 Ų347.4 Ų47.41%0.01124%0.243CC..Hα-helixtrans-63.7-42.2-179.9-56-28.8000112R47 E48 Q53 L54 D55 S100 L104 T109 A112 L113 I116R47-W51 HydrophobicContact CB-CH2 4.11Å; R47-W51 HydrophobicContact CB-CZ2 3.87Å; R47-W51 PolarHBondContact O-N 3.42Å; E48-W51 HydrophobicContact CG-CE3 4.23Å; E48-W51 HydrophobicContact CG-CZ3 4.04Å; E48-W51 PolarHBondContact O-N 3.47Å; W51-Q53 PolarHBondContact O-N 3.03Å; W51-L54 PolarHBondContact O-N 3.43Å; W51-D55 PolarHBondContact O-N 3.17Å; W51-S100 VanDerWaalsContact NE1-CB 3.28Å; W51-S100 PolarHBondContact NE1-OG 3Å; W51-L104 HydrophobicContact CH2-CD1 3.77Å; W51-L104 HydrophobicContact CZ2-CD1 4.43Å; W51-L104 HydrophobicContact CZ3-CD1 4.44Å; W51-T109 WeakPolarHBondContact CZ3-O 3.37Å; W51-A112 HydrophobicContact CB-CB 3.84Å; W51-L113 HydrophobicContact CD2-CB 4.35Å; W51-L113 HydrophobicContact CG-CB 4.39Å; W51-L113 HydrophobicContact CG-CD1 4.3Å; W51-I116 WeakPolarHBondContact O-CD1 3.5Å
52S92.3Very high90Very high64 Ų6443.5 Ų43.545%0.44823%0.225SC..Hα-helixtrans-64-38.9176.8-65.70000113E48 A49 L50 S56E48-S52 PolarHBondContact O-N 2.95Å; E48-S52 PolarHBondContact O-OG 3.06Å; A49-S52 PolarHBondContact O-N 3.45Å; L50-S52 PolarHBondContact O-N 3.25Å; S52-S56 PolarHBondContact O-N 2.96Å; S52-S56 VanDerWaalsContact O-N 3.12Å; S52-S56 PolarHBondContact O-OG 3.35Å
53Q92.7Very high89.8Confident69 Ų6948.1 Ų48.132%0.32225%0.254SS..Hα-helixtrans-68-41.2175.4-73.2-172.618.800112L8 T11 A49 L50 W51 S56 L57L8-Q53 PolarHBondContact O-OE1 2.63Å; T11-Q53 PolarHBondContact OG1-OE1 3.35Å; A49-Q53 WeakPolarHBondContact O-CG 3.42Å; A49-Q53 PolarHBondContact O-N 3.47Å; L50-Q53 PolarHBondContact O-N 3.43Å; W51-Q53 PolarHBondContact O-N 3.03Å; Q53-S56 PolarHBondContact O-N 3.21Å; Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.28Å
54L93.3Very high89.6Confident2 Ų249 Ų491%0.0126%0.255CS..Hα-helixtrans-67.1-36.9176.9-71.8168.8000112.5T11 F19 L50 W51 L57 L58 V93 V96 I116T11-L54 HydrophobicContact CG2-CD2 3.68Å; T11-L54 HydrophobicContact CG2-CG 4.12Å; F19-L54 HydrophobicContact CE1-CD2 4.14Å; F19-L54 HydrophobicContact CE2-CD2 4.15Å; F19-L54 HydrophobicContact CZ-CD2 3.68Å; L50-L54 HydrophobicContact CD1-CD1 3.99Å; L50-L54 HydrophobicContact CD1-CG 4.36Å; L50-L54 HydrophobicContact CG-CD1 3.83Å; L50-L54 WeakPolarHBondContact O-CB 3.5Å; L50-L54 VanDerWaalsContact O-CG 3.28Å; L50-L54 WeakPolarHBondContact O-CG 3.48Å; L50-L54 PolarHBondContact O-N 3.12Å; W51-L54 PolarHBondContact O-N 3.43Å; L54-L57 HydrophobicContact CD2-CD2 4.44Å; L54-L57 PolarHBondContact O-N 3.06Å; L54-L58 VanDerWaalsContact O-CB 3.24Å; L54-L58 WeakPolarHBondContact O-CB 3.35Å; L54-L58 PolarHBondContact O-N 2.89Å; L54-V93 HydrophobicContact CD2-CG2 4.06Å; L54-V96 HydrophobicContact CD1-CB 4.08Å; L54-V96 HydrophobicContact CD1-CG1 3.55Å; L54-I116 HydrophobicContact CB-CD1 3.83Å
55D93.4Very high89.4Confident15 Ų1544.7 Ų44.78%0.0824%0.24CC..Hα-helixtrans-62.9-46.4173.3-173.757.8000111W51 L57 L58 Q59 D115 I116 R119W51-D55 PolarHBondContact O-N 3.17Å; D55-L57 PolarHBondContact O-N 3.23Å; D55-L58 PolarHBondContact O-N 3.3Å; D55-Q59 WeakPolarHBondContact O-CB 3.41Å; D55-Q59 PolarHBondContact O-N 3.26Å; D55-D115 WeakPolarHBondContact OD1-CB 3.43Å; D55-I116 HydrophobicContact CB-CD1 4.27Å; D55-I116 HydrophobicContact CB-CG1 3.77Å; D55-I116 PolarHBondContact OD1-N 3.37Å; D55-R119 IonicContact OD1-CZ 3.77Å; D55-R119 IonicContact OD1-NE 3.77Å; D55-R119 PolarHBondContact OD1-NE 3.05Å; D55-R119 IonicContact OD1-NH2 3.46Å; D55-R119 IonicContact OD2-CZ 3.38Å; D55-R119 IonicContact OD2-NE 2.73Å; D55-R119 IonicContact OD2-NH2 3.18Å; D55-R119 PolarHBondContact OD2-NH2 3.15Å
56S91.8Very high89.2Confident57 Ų5739.5 Ų39.540%0.39922%0.22SC..Hα-helixtrans-60.9-45.2177.2-56.20000111.1S52 Q53 Q59 E60S52-S56 PolarHBondContact O-N 2.96Å; S52-S56 VanDerWaalsContact O-N 3.12Å; S52-S56 PolarHBondContact O-OG 3.35Å; Q53-S56 PolarHBondContact O-N 3.21Å; S56-Q59 PolarHBondContact O-N 3.1Å; S56-E60 WeakPolarHBondContact O-CB 3.48Å; S56-E60 VanDerWaalsContact O-CG 3.32Å; S56-E60 WeakPolarHBondContact O-CG 3.11Å; S56-E60 PolarHBondContact O-N 3.23Å
57L91.3Very high88.4Confident3 Ų338.4 Ų38.42%0.01622%0.217CC..Hα-helixtrans-60.3-48.1176.4178.864.8000111.6K13 V16 F19 Q53 L54 D55 Q59 E60 I61 V89K13-L57 HydrophobicContact CB-CD1 4.06Å; V16-L57 HydrophobicContact CG2-CD1 3.88Å; V16-L57 HydrophobicContact CG2-CD2 4.12Å; F19-L57 HydrophobicContact CD1-CD2 4.21Å; F19-L57 HydrophobicContact CE1-CD2 4.34Å; Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.28Å; L54-L57 HydrophobicContact CD2-CD2 4.44Å; L54-L57 PolarHBondContact O-N 3.06Å; D55-L57 PolarHBondContact O-N 3.23Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; L57-E60 PolarHBondContact O-N 3.42Å; L57-I61 HydrophobicContact CD1-CD1 3.61Å; L57-I61 HydrophobicContact CD1-CG1 4.29Å; L57-I61 HydrophobicContact CG-CD1 3.91Å; L57-I61 WeakPolarHBondContact O-CB 3.45Å; L57-I61 WeakPolarHBondContact O-CG1 3.29Å; L57-I61 PolarHBondContact O-N 3.29Å; L57-V89 HydrophobicContact CD2-CG1 4.03Å; L57-V89 HydrophobicContact CG-CG1 4.26Å
58L91.6Very high87.4Confident1 Ų141 Ų411%0.00525%0.248CC..Hα-helixtrans-63.6-42179.3-176.363.2000110.9L54 D55 L62 V90 V93 I116 R119 L120L54-L58 VanDerWaalsContact O-CB 3.24Å; L54-L58 WeakPolarHBondContact O-CB 3.35Å; L54-L58 PolarHBondContact O-N 2.89Å; D55-L58 PolarHBondContact O-N 3.3Å; L58-L62 HydrophobicContact CD1-CD1 3.82Å; L58-L62 HydrophobicContact CD1-CG 4.06Å; L58-L62 HydrophobicContact CG-CD1 3.8Å; L58-L62 HydrophobicContact CG-CG 4.38Å; L58-L62 WeakPolarHBondContact O-CB 3.32Å; L58-L62 WeakPolarHBondContact O-CG 3.36Å; L58-L62 PolarHBondContact O-N 3.28Å; L58-V90 HydrophobicContact CD1-CG2 3.95Å; L58-V93 HydrophobicContact CB-CG1 4.46Å; L58-V93 HydrophobicContact CD2-CG1 4.12Å; L58-I116 HydrophobicContact CD2-CG2 4.06Å; L58-R119 HydrophobicContact CD2-CB 3.83Å; L58-R119 HydrophobicContact CG-CB 4.42Å; L58-L120 HydrophobicContact CD2-CD2 4.07Å; L58-L120 HydrophobicContact CD2-CG 4.08Å
59Q90.3Very high86.5Confident87 Ų8745.4 Ų45.441%0.40726%0.262SS..Hα-helixtrans-61.4-49.8176.2179.9170.6-5.700112D55 S56 L57 I61 L62 T63D55-Q59 WeakPolarHBondContact O-CB 3.41Å; D55-Q59 PolarHBondContact O-N 3.26Å; S56-Q59 PolarHBondContact O-N 3.1Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; Q59-I61 VanDerWaalsContact C-N 3.35Å; Q59-I61 PolarHBondContact O-N 2.68Å; Q59-L62 PolarHBondContact O-N 3.35Å; Q59-T63 WeakPolarHBondContact O-CB 3.4Å; Q59-T63 PolarHBondContact O-N 2.87Å; Q59-T63 PolarHBondContact O-OG1 3.09Å
60E87.9Confident85.8Confident85 Ų8544.5 Ų44.540%0.39725%0.251SS..Hα-helixtrans-62-43.7-178.6-73.9177.1-168.300111.2K13 S56 L57 T63 D64K13-E60 WeakPolarHBondContact CB-OE2 3.39Å; K13-E60 HydrophobicContact CD-CB 4.15Å; K13-E60 WeakPolarHBondContact CD-OE2 3.17Å; S56-E60 WeakPolarHBondContact O-CB 3.48Å; S56-E60 VanDerWaalsContact O-CG 3.32Å; S56-E60 WeakPolarHBondContact O-CG 3.11Å; S56-E60 PolarHBondContact O-N 3.23Å; L57-E60 PolarHBondContact O-N 3.42Å; E60-T63 PolarHBondContact O-N 2.89Å; E60-D64 VanDerWaalsContact O-CG 3.28Å; E60-D64 PolarHBondContact O-N 2.95Å
61I86.8Confident84.3Confident11 Ų1151 Ų516%0.05628%0.281CS..Hα-helixtrans-68.3-42.2-179.7-72.5174.1000112.2V16 L57 Q59 T63 D64 L65 V86 V89V16-I61 HydrophobicContact CG2-CD1 4.29Å; L57-I61 HydrophobicContact CD1-CD1 3.61Å; L57-I61 HydrophobicContact CD1-CG1 4.29Å; L57-I61 HydrophobicContact CG-CD1 3.91Å; L57-I61 WeakPolarHBondContact O-CB 3.45Å; L57-I61 WeakPolarHBondContact O-CG1 3.29Å; L57-I61 PolarHBondContact O-N 3.29Å; Q59-I61 VanDerWaalsContact C-N 3.35Å; Q59-I61 PolarHBondContact O-N 2.68Å; I61-T63 VanDerWaalsContact C-N 3.26Å; I61-T63 PolarHBondContact O-N 2.86Å; I61-D64 PolarHBondContact O-N 3.03Å; I61-L65 PolarHBondContact O-N 3.48Å; I61-L65 VanDerWaalsContact O-N 3.1Å; I61-V86 HydrophobicContact CG2-CB 4.18Å; I61-V86 HydrophobicContact CG2-CG1 3.71Å; I61-V86 HydrophobicContact CG2-CG2 4.05Å; I61-V89 HydrophobicContact CD1-CB 3.77Å; I61-V89 HydrophobicContact CD1-CG1 3.33Å; I61-V89 HydrophobicContact CD1-CG2 3.89Å
62L86.8Confident82.7Confident24 Ų2457.4 Ų57.413%0.12631%0.311CS..Hα-helixtrans-70.1-24.2177.2-68175.8000112.7L58 Q59 L65 P66 P67 W70 V90 R119 V123L58-L62 HydrophobicContact CD1-CD1 3.82Å; L58-L62 HydrophobicContact CD1-CG 4.06Å; L58-L62 HydrophobicContact CG-CD1 3.8Å; L58-L62 HydrophobicContact CG-CG 4.38Å; L58-L62 WeakPolarHBondContact O-CB 3.32Å; L58-L62 WeakPolarHBondContact O-CG 3.36Å; L58-L62 PolarHBondContact O-N 3.28Å; Q59-L62 PolarHBondContact O-N 3.35Å; L62-L65 CarbonylContact O-C 3.59Å; L62-P66 WeakPolarHBondContact O-CA 3.31Å; L62-P67 HydrophobicContact CD2-CG 4.16Å; L62-W70 HydrophobicContact CD2-CH2 4.35Å; L62-W70 HydrophobicContact CD2-CZ2 3.85Å; L62-V90 HydrophobicContact CD2-CG2 4.23Å; L62-R119 HydrophobicContact CD1-CB 4.15Å; L62-V123 HydrophobicContact CD1-CG2 3.68Å; L62-V123 HydrophobicContact CD2-CG2 3.66Å; L62-V123 HydrophobicContact CG-CG2 4.35Å
63T85.9Confident80.6Confident104 Ų10461.7 Ų61.764%0.63833%0.329SS*.Hα-helixtrans-74.4-39.2172.9-53.40000111Q59 E60 I61Q59-T63 WeakPolarHBondContact O-CB 3.4Å; Q59-T63 PolarHBondContact O-N 2.87Å; Q59-T63 PolarHBondContact O-OG1 3.09Å; E60-T63 PolarHBondContact O-N 2.89Å; I61-T63 VanDerWaalsContact C-N 3.26Å; I61-T63 PolarHBondContact O-N 2.86Å
64D83.4Confident78.5Confident85 Ų8563.6 Ų63.646%0.45536%0.357SS..Hα-helixtrans-66.5-39.3177.6-69.2-15.2000111.9K13 E60 I61 P81K13-D64 WeakPolarHBondContact CE-OD2 3.34Å; K13-D64 IonicContact NZ-OD1 3.26Å; K13-D64 IonicContact NZ-OD2 2.58Å; K13-D64 PolarHBondContact NZ-OD2 3.37Å; E60-D64 VanDerWaalsContact O-CG 3.28Å; E60-D64 PolarHBondContact O-N 2.95Å; I61-D64 PolarHBondContact O-N 3.03Å; D64-P81 HydrophobicContact CB-CG 3.9Å
65L81.6Confident76.4Confident17 Ų1771.8 Ų71.89%0.08940%0.397CS..SBendtrans-144.5101175.9-171.672000112.4I61 L62 R69 W70 P81 P83 V86I61-L65 PolarHBondContact O-N 3.48Å; I61-L65 VanDerWaalsContact O-N 3.1Å; L62-L65 CarbonylContact O-C 3.59Å; L65-R69 HydrophobicContact CD1-CB 4.13Å; L65-W70 PolarHBondContact O-NE1 3.44Å; L65-W70 VanDerWaalsContact O-NE1 3.13Å; L65-P81 HydrophobicContact CB-CB 4.49Å; L65-P81 HydrophobicContact CB-CG 4.3Å; L65-P83 HydrophobicContact CD2-CB 4.15Å; L65-P83 HydrophobicContact CD2-CG 4.02Å; L65-V86 HydrophobicContact CB-CG2 4.1Å; L65-V86 HydrophobicContact CD2-CB 4.45Å; L65-V86 HydrophobicContact CD2-CG2 3.97Å
66P80.9Confident74.4Confident55 Ų5579.7 Ų79.736%0.35743%0.433SS..  trans-70151.7-177.926.6-33.6000112.9L62 G68 R69 W70L62-P66 WeakPolarHBondContact O-CA 3.31Å; P66-G68 VanDerWaalsContact C-N 3.28Å; P66-G68 PolarHBondContact O-N 3.12Å; P66-G68 VanDerWaalsContact O-N 3.1Å; P66-R69 HydrophobicContact CG-CG 4.46Å; P66-R69 PolarHBondContact O-N 3.44Å; P66-R69 VanDerWaalsContact O-N 3.08Å; P66-W70 PolarHBondContact O-NE1 2.84Å
67P72.9Confident72.2Confident21 Ų2184.2 Ų84.214%0.13645%0.448CS..G310 helixtrans-52.8-34.7-174.1-30.136.6000116.5L62 R69 W70 V123L62-P67 HydrophobicContact CD2-CG 4.16Å; P67-R69 PolarHBondContact O-N 2.96Å; P67-R69 VanDerWaalsContact O-N 3.13Å; P67-W70 VanDerWaalsContact CA-CE2 3.47Å; P67-W70 HydrophobicContact CB-CD2 4.45Å; P67-W70 HydrophobicContact CB-CH2 4.3Å; P67-W70 HydrophobicContact CB-CZ2 4.15Å; P67-W70 HydrophobicContact CG-CH2 4.21Å; P67-W70 HydrophobicContact CG-CZ2 3.94Å; P67-W70 PolarHBondContact O-N 2.94Å; P67-V123 HydrophobicContact CG-CB 4.31Å; P67-V123 HydrophobicContact CG-CG1 4.48Å; P67-V123 HydrophobicContact CG-CG2 3.82Å
68G67.8Low70Confident68 Ų6894.4 Ų94.470%0.70150%0.496SS*.G310 helixtrans-67.2-9.5-179.400000115.3P66P66-G68 VanDerWaalsContact C-N 3.28Å; P66-G68 PolarHBondContact O-N 3.12Å; P66-G68 VanDerWaalsContact O-N 3.1Å
69R71.2Confident68.1Low144 Ų14499.5 Ų99.554%0.54353%0.531SS..G310 helixtrans-106.78.3180-64.8-171-178.4-173.6-0.6113.9L65 P66 P67 E71L65-R69 HydrophobicContact CD1-CB 4.13Å; P66-R69 HydrophobicContact CG-CG 4.46Å; P66-R69 PolarHBondContact O-N 3.44Å; P66-R69 VanDerWaalsContact O-N 3.08Å; P67-R69 PolarHBondContact O-N 2.96Å; P67-R69 VanDerWaalsContact O-N 3.13Å; R69-E71 PolarHBondContact O-N 3.22Å
70W74.1Confident66.6Low19 Ų1998 Ų987%0.07253%0.534CS..THydrogen-bonded Turntrans-75.7-7.8-175.8-63.2-4.2000114.2L62 L65 P66 P67 V86 M87 V90 V123 L127L62-W70 HydrophobicContact CD2-CH2 4.35Å; L62-W70 HydrophobicContact CD2-CZ2 3.85Å; L65-W70 PolarHBondContact O-NE1 3.44Å; L65-W70 VanDerWaalsContact O-NE1 3.13Å; P66-W70 PolarHBondContact O-NE1 2.84Å; P67-W70 VanDerWaalsContact CA-CE2 3.47Å; P67-W70 HydrophobicContact CB-CD2 4.45Å; P67-W70 HydrophobicContact CB-CH2 4.3Å; P67-W70 HydrophobicContact CB-CZ2 4.15Å; P67-W70 HydrophobicContact CG-CH2 4.21Å; P67-W70 HydrophobicContact CG-CZ2 3.94Å; P67-W70 PolarHBondContact O-N 2.94Å; W70-V86 HydrophobicContact CZ2-CG1 3.59Å; W70-M87 HydrophobicContact CD2-CG 4.25Å; W70-M87 HydrophobicContact CE3-CG 3.79Å; W70-M87 HydrophobicContact CE3-SD 4.46Å; W70-M87 HydrophobicContact CZ3-CG 4.03Å; W70-V90 HydrophobicContact CH2-CG2 4.04Å; W70-V90 HydrophobicContact CZ2-CG2 4.42Å; W70-V123 HydrophobicContact CH2-CG1 3.7Å; W70-V123 HydrophobicContact CZ3-CG1 4.05Å; W70-L127 HydrophobicContact CZ3-CD1 3.86Å
71E61.2Low65.4Low137 Ų13796.2 Ų96.264%0.6453%0.53SS*.THydrogen-bonded Turntrans-107-3.4177.5-70.6-163.7148.900114.9R69 D73 P128R69-E71 PolarHBondContact O-N 3.22Å; E71-D73 PolarHBondContact O-N 3.48Å; E71-P128 HydrophobicContact CG-CB 3.88Å; E71-P128 HydrophobicContact CG-CG 4.03Å; E71-P128 WeakPolarHBondContact OE1-CB 3.45Å
72E59Low64.9Low137 Ų137100 Ų10064%0.6455%0.55SS**SBendtrans-69.6122.5179.5-71.5-179.3172.600110.4A74E72-A74 PolarHBondContact O-N 2.97Å
73D47.8Very low64.4Low155 Ų155100.7 Ų100.783%0.82956%0.556SS**  trans-51.3130.8177.8-88.2-38000110.4E71 M75E71-D73 PolarHBondContact O-N 3.48Å; D73-M75 PolarHBondContact O-N 2.89Å
74A49.3Very low64.1Low108 Ų108103.2 Ų103.289%0.89356%0.558SS**THydrogen-bonded Turntrans-65.733.4-174.400000115.2E72E72-A74 PolarHBondContact O-N 2.97Å
75M49.5Very low64.2Low174 Ų174101.8 Ų101.886%0.85755%0.548SS*.THydrogen-bonded Turntrans-96.3-2.2-177.7-81.4-164.575.400115.3D73D73-M75 PolarHBondContact O-N 2.89Å
76Q50.4Low64.4Low181 Ų181101 Ų10185%0.84655%0.545SS*.SBendtrans-145.976.5177.3-66.9-173.1-1.300114.2
77Q46.4Very low64.7Low153 Ų15399.9 Ų99.972%0.71554%0.535SS*.  trans166.8116.3138.8-97.9170.8-13.600111S79 A80Q77-S79 PolarHBondContact O-N 2.76Å; Q77-A80 HydrophobicContact CB-CB 4.39Å
78E45.3Very low65.4Low217 Ų217100.8 Ų100.8100%1.01454%0.544SS*.THydrogen-bonded Turntrans-67.66.1177.4-76.618015000114.7
79S52.3Low66.4Low107 Ų10797.5 Ų97.575%0.74851%0.511SS*.THydrogen-bonded Turntrans-131.18.6-177.772.70000115.3Q77Q77-S79 PolarHBondContact O-N 2.76Å
80A58.2Low67.3Low55 Ų5590.7 Ų90.746%0.45549%0.485SS..SBendtrans-86.9144.3177.400000111.3Q77Q77-A80 HydrophobicContact CB-CB 4.39Å
81P63.7Low68.1Low49 Ų4990.5 Ų90.532%0.31849%0.485SS..PPolyproline II helixtrans-58.6138174.6-15.325.7000111.4D64 L65 P83 V86D64-P81 HydrophobicContact CB-CG 3.9Å; L65-P81 HydrophobicContact CB-CB 4.49Å; L65-P81 HydrophobicContact CB-CG 4.3Å; P81-P83 WeakPolarHBondContact O-CD 3.29Å; P81-V86 HydrophobicContact CB-CG2 4.14Å
82D76.1Confident69.5Low91 Ų9184 Ų8449%0.48746%0.455SS..PPolyproline II helixtrans-61.3120.5175.9177.44.4000110.3K84 H85 V86D82-K84 PolarHBondContact O-N 2.86Å; D82-K84 VanDerWaalsContact O-N 3.15Å; D82-K84 WeakPolarHBondContact OD1-CB 3.48Å; D82-K84 PolarHBondContact OD1-N 3.41Å; D82-H85 HydrophobicContact CB-CB 4.01Å; D82-H85 WeakPolarHBondContact O-CB 3.45Å; D82-H85 PolarHBondContact O-N 2.84Å; D82-V86 PolarHBondContact O-N 3.12Å; D82-V86 VanDerWaalsContact O-N 3.13Å
83P76.3Confident71.1Confident37 Ų3777.5 Ų77.524%0.2442%0.424CS..Hα-helixtrans-53.1-34.6177-25.833000113.4L65 P81 H85 V86 M87L65-P83 HydrophobicContact CD2-CB 4.15Å; L65-P83 HydrophobicContact CD2-CG 4.02Å; P81-P83 WeakPolarHBondContact O-CD 3.29Å; P83-H85 VanDerWaalsContact C-N 3.33Å; P83-H85 PolarHBondContact O-N 3.5Å; P83-V86 PolarHBondContact O-N 3.18Å; P83-M87 WeakPolarHBondContact O-CB 3.5Å; P83-M87 VanDerWaalsContact O-CG 3.29Å; P83-M87 WeakPolarHBondContact O-CG 3.49Å; P83-M87 PolarHBondContact O-N 2.99Å
84K79.9Confident73.3Confident158 Ų15870.1 Ų70.169%0.68739%0.385SS*.Hα-helixtrans-67.2-36.2177.6-67.5179.8178.9173.50112.2D82 A88D82-K84 PolarHBondContact O-N 2.86Å; D82-K84 VanDerWaalsContact O-N 3.15Å; D82-K84 WeakPolarHBondContact OD1-CB 3.48Å; D82-K84 PolarHBondContact OD1-N 3.41Å; K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 3Å
85H85.1Confident75.4Confident54 Ų5466.4 Ų66.425%0.2535%0.35CS..Hα-helixtrans-67.3-46.5176.5-179.285.6000110.7E17 D82 P83 M87 A88 V89E17-H85 IonicContact OE1-CE1 2.85Å; E17-H85 PolarHBondContact OE1-CE1 2.96Å; E17-H85 IonicContact OE1-ND1 3.66Å; E17-H85 PolarHBondContact OE1-ND1 3.01Å; D82-H85 HydrophobicContact CB-CB 4.01Å; D82-H85 WeakPolarHBondContact O-CB 3.45Å; D82-H85 PolarHBondContact O-N 2.84Å; P83-H85 VanDerWaalsContact C-N 3.33Å; P83-H85 PolarHBondContact O-N 3.5Å; H85-M87 VanDerWaalsContact C-N 3.34Å; H85-M87 PolarHBondContact O-N 3.42Å; H85-A88 WeakPolarHBondContact O-CB 3.43Å; H85-A88 PolarHBondContact O-N 3.42Å; H85-A88 VanDerWaalsContact O-N 3.16Å; H85-V89 WeakPolarHBondContact O-CG2 3.32Å; H85-V89 PolarHBondContact O-N 3.15Å; H85-V89 VanDerWaalsContact O-N 3.07Å
86V86.2Confident77.4Confident2 Ų258.1 Ų58.11%0.01231%0.309CS..Hα-helixtrans-57.3-47.8176.7171.70000111.2I61 L65 W70 P81 D82 P83 A88 V89 V90I61-V86 HydrophobicContact CG2-CB 4.18Å; I61-V86 HydrophobicContact CG2-CG1 3.71Å; I61-V86 HydrophobicContact CG2-CG2 4.05Å; L65-V86 HydrophobicContact CB-CG2 4.1Å; L65-V86 HydrophobicContact CD2-CB 4.45Å; L65-V86 HydrophobicContact CD2-CG2 3.97Å; W70-V86 HydrophobicContact CZ2-CG1 3.59Å; P81-V86 HydrophobicContact CB-CG2 4.14Å; D82-V86 PolarHBondContact O-N 3.12Å; D82-V86 VanDerWaalsContact O-N 3.13Å; P83-V86 PolarHBondContact O-N 3.18Å; V86-A88 PolarHBondContact O-N 2.85Å; V86-V89 PolarHBondContact O-N 3.46Å; V86-V90 WeakPolarHBondContact O-CG2 3.5Å; V86-V90 PolarHBondContact O-N 3.37Å
87M85.4Confident79.5Confident30 Ų3049.6 Ų49.615%0.14827%0.27CS..Hα-helixtrans-62.4-39176.9-73.1167.433.800113.2W70 P83 H85 V89 V90 D91 E131W70-M87 HydrophobicContact CD2-CG 4.25Å; W70-M87 HydrophobicContact CE3-CG 3.79Å; W70-M87 HydrophobicContact CE3-SD 4.46Å; W70-M87 HydrophobicContact CZ3-CG 4.03Å; P83-M87 WeakPolarHBondContact O-CB 3.5Å; P83-M87 VanDerWaalsContact O-CG 3.29Å; P83-M87 WeakPolarHBondContact O-CG 3.49Å; P83-M87 PolarHBondContact O-N 2.99Å; H85-M87 VanDerWaalsContact C-N 3.34Å; H85-M87 PolarHBondContact O-N 3.42Å; M87-V89 VanDerWaalsContact C-N 3.29Å; M87-V89 PolarHBondContact O-N 2.91Å; M87-V90 PolarHBondContact O-N 2.89Å; M87-D91 WeakPolarHBondContact O-CB 3.46Å; M87-D91 PolarHBondContact O-N 2.9Å; M87-E131 HydrophobicContact CE-CG 3.66Å; M87-E131 WeakPolarHBondContact CE-OE1 3.47Å; M87-E131 VanDerWaalsContact CE-OE2 3.3Å; M87-E131 WeakPolarHBondContact CE-OE2 3.31Å; M87-E131 HydrophobicContact SD-CG 4.13Å
88A87.6Confident81.7Confident40 Ų4043.8 Ų43.833%0.33125%0.248SC..Hα-helixtrans-62.4-38.4176.600000111.6L20 K84 H85 V86 A92L20-A88 HydrophobicContact CD1-CB 4.36Å; L20-A88 HydrophobicContact CD2-CB 4.11Å; K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 3Å; H85-A88 WeakPolarHBondContact O-CB 3.43Å; H85-A88 PolarHBondContact O-N 3.42Å; H85-A88 VanDerWaalsContact O-N 3.16Å; V86-A88 PolarHBondContact O-N 2.85Å; A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 3.1Å
89V89.6Confident83.9Confident0 Ų033.7 Ų33.70%020%0.201CC..Hα-helixtrans-70.3-42.7175.7-176.90000111.4V16 L20 L57 I61 H85 V86 M87 D91 A92 V93V16-V89 HydrophobicContact CG2-CG1 4.22Å; V16-V89 HydrophobicContact CG2-CG2 3.74Å; L20-V89 HydrophobicContact CD1-CG2 4.06Å; L20-V89 HydrophobicContact CD2-CG2 4.04Å; L20-V89 HydrophobicContact CG-CG2 4.25Å; L57-V89 HydrophobicContact CD2-CG1 4.03Å; L57-V89 HydrophobicContact CG-CG1 4.26Å; I61-V89 HydrophobicContact CD1-CB 3.77Å; I61-V89 HydrophobicContact CD1-CG1 3.33Å; I61-V89 HydrophobicContact CD1-CG2 3.89Å; H85-V89 WeakPolarHBondContact O-CG2 3.32Å; H85-V89 PolarHBondContact O-N 3.15Å; H85-V89 VanDerWaalsContact O-N 3.07Å; V86-V89 PolarHBondContact O-N 3.46Å; M87-V89 VanDerWaalsContact C-N 3.29Å; M87-V89 PolarHBondContact O-N 2.91Å; V89-D91 VanDerWaalsContact C-N 3.31Å; V89-D91 PolarHBondContact O-N 2.77Å; V89-A92 WeakPolarHBondContact O-CB 3.45Å; V89-A92 PolarHBondContact O-N 3.35Å; V89-V93 HydrophobicContact CG1-CG2 4.13Å; V89-V93 VanDerWaalsContact O-CG2 3.28Å; V89-V93 WeakPolarHBondContact O-CG2 3.32Å; V89-V93 PolarHBondContact O-N 3.24Å
90V90.4Very high85.8Confident0 Ų028.7 Ų28.70%017%0.166CC..Hα-helixtrans-60.6-41.1174.81760000111.2L58 L62 W70 V86 M87 V93 T94 L120 V123 L134L58-V90 HydrophobicContact CD1-CG2 3.95Å; L62-V90 HydrophobicContact CD2-CG2 4.23Å; W70-V90 HydrophobicContact CH2-CG2 4.04Å; W70-V90 HydrophobicContact CZ2-CG2 4.42Å; V86-V90 WeakPolarHBondContact O-CG2 3.5Å; V86-V90 PolarHBondContact O-N 3.37Å; M87-V90 PolarHBondContact O-N 2.89Å; V90-V93 PolarHBondContact O-N 2.9Å; V90-T94 VanDerWaalsContact O-CB 3.31Å; V90-T94 WeakPolarHBondContact O-CB 3.34Å; V90-T94 PolarHBondContact O-N 3.2Å; V90-T94 PolarHBondContact O-OG1 2.96Å; V90-L120 HydrophobicContact CG1-CD2 3.82Å; V90-V123 HydrophobicContact CG1-CG1 4.17Å; V90-L134 HydrophobicContact CG1-CD1 4.27Å; V90-L134 HydrophobicContact CG1-CD2 4.08Å
91D89.5Confident87.4Confident16 Ų1626 Ų269%0.08614%0.144CC..Hα-helixtrans-62.1-43.4174.9-172.957.3000112.2K27 M87 V89 T94 L95 L134 R137K27-D91 IonicContact NZ-OD2 2.83Å; K27-D91 PolarHBondContact NZ-OD2 2.94Å; M87-D91 WeakPolarHBondContact O-CB 3.46Å; M87-D91 PolarHBondContact O-N 2.9Å; V89-D91 VanDerWaalsContact C-N 3.31Å; V89-D91 PolarHBondContact O-N 2.77Å; D91-T94 PolarHBondContact O-N 3.43Å; D91-L95 WeakPolarHBondContact O-CB 3.22Å; D91-L95 PolarHBondContact O-N 3.44Å; D91-L134 HydrophobicContact CB-CD1 4.03Å; D91-R137 VanDerWaalsContact CG-NH2 3.29Å; D91-R137 WeakPolarHBondContact OD1-CD 3.42Å; D91-R137 IonicContact OD1-CZ 2.86Å; D91-R137 IonicContact OD1-NE 3.1Å; D91-R137 PolarHBondContact OD1-NE 3.07Å; D91-R137 IonicContact OD1-NH1 2.83Å; D91-R137 PolarHBondContact OD1-NH1 2.9Å; D91-R137 IonicContact OD1-NH2 2.67Å; D91-R137 PolarHBondContact OD1-NH2 3.09Å; D91-R137 IonicContact OD2-CZ 3.37Å; D91-R137 IonicContact OD2-NH1 2.82Å; D91-R137 PolarHBondContact OD2-NH1 3.08Å; D91-R137 IonicContact OD2-NH2 2.76Å; D91-R137 PolarHBondContact OD2-NH2 3.07Å
92A91.1Very high88.5Confident0 Ų029.4 Ų29.40%015%0.154CC..Hα-helixtrans-64.4-47.7176.500000112.3F19 L20 I23 A88 V89 T94 L95 V96F19-A92 HydrophobicContact CD1-CB 4.29Å; F19-A92 HydrophobicContact CE1-CB 3.5Å; F19-A92 HydrophobicContact CZ-CB 3.85Å; L20-A92 HydrophobicContact CD2-CB 3.98Å; I23-A92 HydrophobicContact CB-CB 4.3Å; I23-A92 HydrophobicContact CD1-CB 4.05Å; I23-A92 HydrophobicContact CG1-CB 3.7Å; I23-A92 HydrophobicContact CG2-CB 4.1Å; A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 3.1Å; V89-A92 WeakPolarHBondContact O-CB 3.45Å; V89-A92 PolarHBondContact O-N 3.35Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 2.86Å; A92-L95 WeakPolarHBondContact O-CB 3.25Å; A92-L95 PolarHBondContact O-N 2.67Å; A92-V96 WeakPolarHBondContact O-CG2 2.96Å; A92-V96 PolarHBondContact O-N 2.87Å
93V93.9Very high89.1Confident0 Ų026 Ų260%014%0.136CC..Hα-helixtrans-61.7-43.3176.5174.70000110.4F19 L54 L58 V89 V90 L95 V96 A97 I116F19-V93 HydrophobicContact CE1-CG2 4.31Å; L54-V93 HydrophobicContact CD2-CG2 4.06Å; L58-V93 HydrophobicContact CB-CG1 4.46Å; L58-V93 HydrophobicContact CD2-CG1 4.12Å; V89-V93 HydrophobicContact CG1-CG2 4.13Å; V89-V93 VanDerWaalsContact O-CG2 3.28Å; V89-V93 WeakPolarHBondContact O-CG2 3.32Å; V89-V93 PolarHBondContact O-N 3.24Å; V90-V93 PolarHBondContact O-N 2.9Å; V93-L95 VanDerWaalsContact C-N 3.32Å; V93-L95 PolarHBondContact O-N 2.98Å; V93-V96 PolarHBondContact O-N 3.16Å; V93-A97 VanDerWaalsContact O-CB 3.31Å; V93-A97 WeakPolarHBondContact O-CB 3.25Å; V93-A97 PolarHBondContact O-N 3.33Å; V93-I116 HydrophobicContact CG1-CG2 3.87Å
94T93.6Very high89.7Confident0 Ų025 Ų250%013%0.129CC..Hα-helixtrans-60.1-42176.9-57.60000111.6V90 D91 A92 A97 A98 L120 R137 I138V90-T94 VanDerWaalsContact O-CB 3.31Å; V90-T94 WeakPolarHBondContact O-CB 3.34Å; V90-T94 PolarHBondContact O-N 3.2Å; V90-T94 PolarHBondContact O-OG1 2.96Å; D91-T94 PolarHBondContact O-N 3.43Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 2.86Å; T94-A97 PolarHBondContact O-N 3.16Å; T94-A98 WeakPolarHBondContact O-CB 3.43Å; T94-A98 PolarHBondContact O-N 3.23Å; T94-L120 HydrophobicContact CG2-CD1 4.48Å; T94-L120 WeakPolarHBondContact OG1-CD2 3.49Å; T94-R137 HydrophobicContact CG2-CB 3.91Å; T94-I138 HydrophobicContact CG2-CB 4.44Å; T94-I138 HydrophobicContact CG2-CG1 3.76Å
95L92.4Very high89.8Confident30 Ų3023.8 Ų23.816%0.15713%0.126CC..Hα-helixtrans-61.1-50.7176.1178.674.7000111.2I23 D91 A92 V93 A97 A98 V99I23-L95 HydrophobicContact CD1-CD2 3.98Å; I23-L95 HydrophobicContact CG2-CD2 3.97Å; D91-L95 WeakPolarHBondContact O-CB 3.22Å; D91-L95 PolarHBondContact O-N 3.44Å; A92-L95 WeakPolarHBondContact O-CB 3.25Å; A92-L95 PolarHBondContact O-N 2.67Å; V93-L95 VanDerWaalsContact C-N 3.32Å; V93-L95 PolarHBondContact O-N 2.98Å; L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 2.54Å; L95-A98 PolarHBondContact O-N 3.28Å; L95-V99 WeakPolarHBondContact O-CG2 3.41Å; L95-V99 PolarHBondContact O-N 3.18Å
96V92.8Very high89.3Confident0 Ų029.7 Ų29.70%016%0.159CC..Hα-helixtrans-65-37.6-179.4-178.80000111.2F7 F19 I23 V35 V39 L50 L54 A92 V93 V99 S100F7-V96 HydrophobicContact CZ-CG2 4.08Å; F19-V96 HydrophobicContact CE2-CG2 3.97Å; F19-V96 HydrophobicContact CZ-CG2 3.95Å; I23-V96 HydrophobicContact CD1-CG2 3.77Å; V35-V96 HydrophobicContact CG1-CG2 4.05Å; V39-V96 HydrophobicContact CG2-CG1 4.47Å; L50-V96 HydrophobicContact CD2-CG1 4.08Å; L54-V96 HydrophobicContact CD1-CB 4.08Å; L54-V96 HydrophobicContact CD1-CG1 3.55Å; A92-V96 WeakPolarHBondContact O-CG2 2.96Å; A92-V96 PolarHBondContact O-N 2.87Å; V93-V96 PolarHBondContact O-N 3.16Å; V96-V99 PolarHBondContact O-N 2.68Å; V96-S100 VanDerWaalsContact O-CB 3.29Å; V96-S100 WeakPolarHBondContact O-CB 3.4Å; V96-S100 PolarHBondContact O-N 3.36Å; V96-S100 PolarHBondContact O-OG 2.81Å
97A93.9Very high88.6Confident3 Ų332.6 Ų32.63%0.02519%0.189CC..Hα-helixtrans-62.9-43.2174.200000111.7V93 T94 L95 S100 L101 L113 I116 L141V93-A97 VanDerWaalsContact O-CB 3.31Å; V93-A97 WeakPolarHBondContact O-CB 3.25Å; V93-A97 PolarHBondContact O-N 3.33Å; T94-A97 PolarHBondContact O-N 3.16Å; L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 2.54Å; A97-S100 WeakPolarHBondContact O-CB 3.37Å; A97-S100 PolarHBondContact O-N 3.3Å; A97-L101 PolarHBondContact O-N 2.93Å; A97-L113 HydrophobicContact CB-CD1 4.04Å; A97-I116 HydrophobicContact CB-CG2 4.2Å; A97-L141 HydrophobicContact CB-CD1 4.13Å; A97-L141 HydrophobicContact CB-CD2 4.28Å
98A91.9Very high88.4Confident30 Ų3032 Ų3225%0.24819%0.186CC..Hα-helixtrans-65.5-40.5178.200000112.2T94 L95 L101 L141T94-A98 WeakPolarHBondContact O-CB 3.43Å; T94-A98 PolarHBondContact O-N 3.23Å; L95-A98 PolarHBondContact O-N 3.28Å; A98-L101 PolarHBondContact O-N 2.78Å; A98-L141 HydrophobicContact CB-CD1 3.96Å
99V91.9Very high88.3Confident6 Ų634.1 Ų34.14%0.03620%0.196CC..Hα-helixtrans-63.3-44.5172.1167.10000110.8V35 E36 V39 L95 V96 L101 K102 V103V35-V99 HydrophobicContact CG1-CG1 4.4Å; V35-V99 HydrophobicContact CG1-CG2 4.47Å; E36-V99 HydrophobicContact CB-CG1 4.05Å; E36-V99 HydrophobicContact CB-CG2 4.42Å; E36-V99 HydrophobicContact CG-CG1 4.24Å; V39-V99 HydrophobicContact CB-CG1 3.91Å; V39-V99 HydrophobicContact CG1-CG1 4.22Å; V39-V99 HydrophobicContact CG2-CG1 4.15Å; L95-V99 WeakPolarHBondContact O-CG2 3.41Å; L95-V99 PolarHBondContact O-N 3.18Å; V96-V99 PolarHBondContact O-N 2.68Å; V99-L101 VanDerWaalsContact C-N 3.26Å; V99-L101 PolarHBondContact O-N 3.01Å; V99-K102 WeakPolarHBondContact O-CB 3.4Å; V99-K102 PolarHBondContact O-N 2.89Å; V99-V103 PolarHBondContact O-N 2.93Å
100S92.1Very high88.4Confident1 Ų136.3 Ų36.31%0.00720%0.204CC..Hα-helixtrans-59.3-37-179.8-64.60000112.3W51 V96 A97 K102 V103 L104W51-S100 VanDerWaalsContact NE1-CB 3.28Å; W51-S100 PolarHBondContact NE1-OG 3Å; V96-S100 VanDerWaalsContact O-CB 3.29Å; V96-S100 WeakPolarHBondContact O-CB 3.4Å; V96-S100 PolarHBondContact O-N 3.36Å; V96-S100 PolarHBondContact O-OG 2.81Å; A97-S100 WeakPolarHBondContact O-CB 3.37Å; A97-S100 PolarHBondContact O-N 3.3Å; S100-K102 VanDerWaalsContact C-N 3.26Å; S100-K102 PolarHBondContact O-N 3.3Å; S100-V103 PolarHBondContact O-N 3.14Å; S100-L104 PolarHBondContact O-N 3.16Å
101L91.3Very high88.3Confident0 Ų038.2 Ų38.20%022%0.224CC..Hα-helixtrans-60.1-34.2173.9-73.8-174.3000113.1A97 A98 V99 V103 L113 L141 T144 W145 K148 L150A97-L101 PolarHBondContact O-N 2.93Å; A98-L101 PolarHBondContact O-N 2.78Å; V99-L101 VanDerWaalsContact C-N 3.26Å; V99-L101 PolarHBondContact O-N 3.01Å; L101-V103 VanDerWaalsContact C-N 3.31Å; L101-V103 PolarHBondContact O-N 2.89Å; L101-L113 HydrophobicContact CD2-CD2 3.76Å; L101-L113 HydrophobicContact CG-CD2 4.43Å; L101-L141 HydrophobicContact CD1-CD1 3.47Å; L101-L141 VanDerWaalsContact CD1-CD1 3.47Å; L101-L141 HydrophobicContact CD1-CG 4.39Å; L101-L141 HydrophobicContact CG-CD1 4.08Å; L101-T144 HydrophobicContact CB-CG2 4.2Å; L101-T144 HydrophobicContact CD1-CG2 3.96Å; L101-W145 HydrophobicContact CD1-CB 4.43Å; L101-W145 HydrophobicContact CD1-CE3 3.88Å; L101-W145 HydrophobicContact CD2-CD2 4.5Å; L101-W145 HydrophobicContact CD2-CE3 3.73Å; L101-W145 HydrophobicContact CD2-CZ3 3.76Å; L101-W145 HydrophobicContact CG-CE3 4.27Å; L101-W145 HydrophobicContact CG-CZ3 4.47Å; L101-K148 WeakPolarHBondContact O-CD 3.32Å; L101-K148 WeakPolarHBondContact O-CE 3.43Å; L101-K148 PolarHBondContact O-NZ 2.96Å; L101-L150 HydrophobicContact CD2-CD1 3.6Å
102K88.1Confident88.4Confident119 Ų11938.3 Ų38.352%0.51723%0.227SC..Hα-helixtrans-67.2-36.1179.4-61.4179.9177.5-179.20111.9E36 V99 S100E36-K102 WeakPolarHBondContact OE1-CD 3.45Å; E36-K102 IonicContact OE1-NZ 3.48Å; E36-K102 PolarHBondContact OE1-NZ 2.94Å; E36-K102 IonicContact OE2-NZ 3.54Å; E36-K102 PolarHBondContact OE2-NZ 3.5Å; V99-K102 WeakPolarHBondContact O-CB 3.4Å; V99-K102 PolarHBondContact O-N 2.89Å; S100-K102 VanDerWaalsContact C-N 3.26Å; S100-K102 PolarHBondContact O-N 3.3Å
103V88.4Confident88.5Confident19 Ų1938.3 Ų38.312%0.11523%0.227CC..Hα-helixtrans-87.5-14.9-176.8-1720000112.3V39 Q40 R47 V99 S100 L101 Q105V39-V103 HydrophobicContact CG1-CG2 4.21Å; Q40-V103 HydrophobicContact CB-CG1 4.47Å; Q40-V103 HydrophobicContact CB-CG2 4.03Å; R47-V103 PolarHBondContact NH1-O 3.1Å; V99-V103 PolarHBondContact O-N 2.93Å; S100-V103 PolarHBondContact O-N 3.14Å; L101-V103 VanDerWaalsContact C-N 3.31Å; L101-V103 PolarHBondContact O-N 2.89Å; V103-Q105 WeakPolarHBondContact O-CG 3.49Å; V103-Q105 PolarHBondContact O-N 2.98Å
104L88.2Confident88.4Confident18 Ų1839.7 Ų39.79%0.09423%0.234CC..  trans-57.9125.2-179.9-167.672.5000112.1W51 S100 D108 Y110 K148 L150W51-L104 HydrophobicContact CH2-CD1 3.77Å; W51-L104 HydrophobicContact CZ2-CD1 4.43Å; W51-L104 HydrophobicContact CZ3-CD1 4.44Å; S100-L104 PolarHBondContact O-N 3.16Å; L104-D108 HydrophobicContact CD1-CB 3.73Å; L104-Y110 HydrophobicContact CD2-CD1 4.31Å; L104-Y110 HydrophobicContact CD2-CG 4.46Å; L104-K148 PolarHBondContact O-NZ 3.41Å; L104-L150 HydrophobicContact CD2-CD1 4.11Å; L104-L150 HydrophobicContact CD2-CD2 3.84Å
105Q82.8Confident88.4Confident131 Ų13143.4 Ų43.461%0.61225%0.254SS*.  trans-109.3161.6-179.5-60.3-177.84.400111.9V103 G107 D108V103-Q105 WeakPolarHBondContact O-CG 3.49Å; V103-Q105 PolarHBondContact O-N 2.98Å; Q105-G107 PolarHBondContact O-N 2.7Å; Q105-D108 PolarHBondContact N-OD2 2.93Å; Q105-D108 WeakPolarHBondContact O-CB 3.3Å; Q105-D108 PolarHBondContact O-N 2.93Å
106D73.9Confident88.5Confident179 Ų17942 Ų4296%0.95725%0.247SC*.THydrogen-bonded Turntrans-63.2121.1177.5-67.5-22.2000110.9
107G72.3Confident88.5Confident62 Ų6242.1 Ų42.164%0.63925%0.247SC*.THydrogen-bonded Turntrans96.3-0.6-17900000115.9R44 Q105R44-G107 PolarHBondContact NH1-O 3.05Å; R44-G107 VanDerWaalsContact NH1-O 3.11Å; R44-G107 PolarHBondContact NH2-O 3.17Å; Q105-G107 PolarHBondContact O-N 2.7Å
108D81.8Confident88.5Confident17 Ų1743.4 Ų43.49%0.09126%0.256CS..  trans-67.9141.2168.6-78-22.8000110.9R44 R47 L104 Q105R44-D108 IonicContact NE-OD1 3.66Å; R47-D108 IonicContact CZ-OD2 3.18Å; R47-D108 IonicContact NH1-OD2 3.98Å; R47-D108 PolarHBondContact NH1-OD2 3.33Å; R47-D108 IonicContact NH2-OD1 3.12Å; R47-D108 PolarHBondContact NH2-OD1 3.44Å; R47-D108 IonicContact NH2-OD2 3.22Å; R47-D108 PolarHBondContact NH2-OD2 2.96Å; L104-D108 HydrophobicContact CD1-CB 3.73Å; Q105-D108 PolarHBondContact N-OD2 2.93Å; Q105-D108 WeakPolarHBondContact O-CB 3.3Å; Q105-D108 PolarHBondContact O-N 2.93Å
109T84.8Confident88.5Confident85 Ų8545 Ų4552%0.52126%0.255SS..  trans-89.7106.5175.514.90000110R44 E48 W51R44-T109 PolarHBondContact NH2-OG1 3.2Å; E48-T109 PolarHBondContact OE1-OG1 3.39Å; W51-T109 WeakPolarHBondContact CZ3-O 3.37Å
110Y90.9Very high88.5Confident46 Ų4644.7 Ų44.718%0.1825%0.254CS..  trans-107.923-172.361.1-92.9000114.3L104 A112 L113 L114 W145 L150 L151L104-Y110 HydrophobicContact CD2-CD1 4.31Å; L104-Y110 HydrophobicContact CD2-CG 4.46Å; Y110-A112 PolarHBondContact O-N 3.39Å; Y110-L113 WeakPolarHBondContact O-CA 3.39Å; Y110-L113 WeakPolarHBondContact O-CB 3.32Å; Y110-L113 PolarHBondContact O-N 3.47Å; Y110-L114 HydrophobicContact CD2-CB 4.34Å; Y110-L114 PolarHBondContact O-N 3.45Å; Y110-W145 HydrophobicContact CD2-CH2 4.47Å; Y110-W145 HydrophobicContact CD2-CZ2 4.36Å; Y110-W145 HydrophobicContact CE2-CZ2 4.36Å; Y110-L150 HydrophobicContact CE1-CD2 4.34Å; Y110-L151 HydrophobicContact CE2-CB 4.26Å; Y110-L151 HydrophobicContact CE2-CD1 4.3Å; Y110-L151 WeakPolarHBondContact OH-CD1 3.38Å; Y110-L151 WeakPolarHBondContact OH-CG 3.5Å; Y110-L151 PolarHBondContact OH-N 2.75Å
111G89.8Confident88.5Confident40 Ų4045.7 Ų45.741%0.41226%0.258SS..Hα-helixtrans-52-49.9-177.300000113.4L113 L114 D115G111-L113 VanDerWaalsContact C-N 3.27Å; G111-L113 PolarHBondContact O-N 2.99Å; G111-L114 WeakPolarHBondContact O-CA 3.5Å; G111-L114 WeakPolarHBondContact O-CB 3.23Å; G111-L114 PolarHBondContact O-N 3.48Å; G111-D115 PolarHBondContact O-N 2.93Å
112A90.8Very high88.4Confident18 Ų1850 Ų5015%0.14928%0.281CS..Hα-helixtrans-62.7-32.5176.900000113.2W51 Y110 D115 I116W51-A112 HydrophobicContact CB-CB 3.84Å; Y110-A112 PolarHBondContact O-N 3.39Å; A112-D115 PolarHBondContact O-N 2.91Å; A112-I116 VanDerWaalsContact O-CG1 3.29Å; A112-I116 WeakPolarHBondContact O-CG1 3.46Å; A112-I116 PolarHBondContact O-N 3.03Å
113L92.1Very high88.3Confident1 Ų144.4 Ų44.41%0.00526%0.257CS..Hα-helixtrans-71.2-33.4175.5-165.670.7000111.7W51 A97 L101 Y110 G111 I116 A117 W145W51-L113 HydrophobicContact CD2-CB 4.35Å; W51-L113 HydrophobicContact CG-CB 4.39Å; W51-L113 HydrophobicContact CG-CD1 4.3Å; A97-L113 HydrophobicContact CB-CD1 4.04Å; L101-L113 HydrophobicContact CD2-CD2 3.76Å; L101-L113 HydrophobicContact CG-CD2 4.43Å; Y110-L113 WeakPolarHBondContact O-CA 3.39Å; Y110-L113 WeakPolarHBondContact O-CB 3.32Å; Y110-L113 PolarHBondContact O-N 3.47Å; G111-L113 VanDerWaalsContact C-N 3.27Å; G111-L113 PolarHBondContact O-N 2.99Å; L113-I116 HydrophobicContact CD1-CD1 4.49Å; L113-A117 WeakPolarHBondContact O-CB 3.36Å; L113-A117 PolarHBondContact O-N 2.8Å; L113-W145 HydrophobicContact CB-CH2 4.45Å; L113-W145 HydrophobicContact CD2-CH2 4.37Å; L113-W145 HydrophobicContact CD2-CZ3 4.16Å; L113-W145 HydrophobicContact CG-CH2 4.13Å; L113-W145 HydrophobicContact CG-CZ3 3.98Å
114L93.2Very high88.3Confident29 Ų2943.8 Ų43.815%0.15225%0.253CS..Hα-helixtrans-67.4-41.1172.3174.663.7000111.1Y110 G111 A117 C118 W145 L151 E152 F156Y110-L114 HydrophobicContact CD2-CB 4.34Å; Y110-L114 PolarHBondContact O-N 3.45Å; G111-L114 WeakPolarHBondContact O-CA 3.5Å; G111-L114 WeakPolarHBondContact O-CB 3.23Å; G111-L114 PolarHBondContact O-N 3.48Å; L114-A117 WeakPolarHBondContact O-CB 3.46Å; L114-A117 PolarHBondContact O-N 2.89Å; L114-C118 PolarHBondContact O-N 3.44Å; L114-W145 HydrophobicContact CB-CH2 4.26Å; L114-W145 HydrophobicContact CB-CZ2 4.15Å; L114-W145 HydrophobicContact CD1-CZ2 3.77Å; L114-L151 HydrophobicContact CD2-CB 4.25Å; L114-E152 HydrophobicContact CD1-CB 3.99Å; L114-E152 HydrophobicContact CD1-CG 4.16Å; L114-F156 HydrophobicContact CD1-CE2 3.72Å; L114-F156 HydrophobicContact CD1-CZ 3.97Å
115D93.3Very high87.9Confident78 Ų7847.8 Ų47.842%0.41728%0.278SS..Hα-helixtrans-62.6-43.8175.2-65.9-35.3000111.3D55 G111 A112 A117 C118 R119D55-D115 WeakPolarHBondContact OD1-CB 3.43Å; G111-D115 PolarHBondContact O-N 2.93Å; A112-D115 PolarHBondContact O-N 2.91Å; D115-A117 VanDerWaalsContact C-N 3.34Å; D115-A117 PolarHBondContact O-N 3.26Å; D115-C118 WeakPolarHBondContact O-CB 3.47Å; D115-C118 PolarHBondContact O-N 3.21Å; D115-R119 WeakPolarHBondContact O-CG 3.37Å; D115-R119 PolarHBondContact O-N 3.38Å
116I94.2Very high87.7Confident1 Ų144.6 Ų44.61%0.00527%0.27CS..Hα-helixtrans-55.7-49.2170.7-69.9165.1000110.5W51 L54 D55 L58 V93 A97 A112 L113 C118 R119 L120W51-I116 WeakPolarHBondContact O-CD1 3.5Å; L54-I116 HydrophobicContact CB-CD1 3.83Å; D55-I116 HydrophobicContact CB-CD1 4.27Å; D55-I116 HydrophobicContact CB-CG1 3.77Å; D55-I116 PolarHBondContact OD1-N 3.37Å; L58-I116 HydrophobicContact CD2-CG2 4.06Å; V93-I116 HydrophobicContact CG1-CG2 3.87Å; A97-I116 HydrophobicContact CB-CG2 4.2Å; A112-I116 VanDerWaalsContact O-CG1 3.29Å; A112-I116 WeakPolarHBondContact O-CG1 3.46Å; A112-I116 PolarHBondContact O-N 3.03Å; L113-I116 HydrophobicContact CD1-CD1 4.49Å; I116-C118 VanDerWaalsContact C-N 3.33Å; I116-C118 PolarHBondContact O-N 3.11Å; I116-R119 PolarHBondContact O-N 3.29Å; I116-L120 HydrophobicContact CG2-CD1 3.75Å; I116-L120 HydrophobicContact CG2-CG 4.16Å; I116-L120 WeakPolarHBondContact O-CB 3.39Å; I116-L120 VanDerWaalsContact O-CG 3.29Å; I116-L120 WeakPolarHBondContact O-CG 3.47Å; I116-L120 PolarHBondContact O-N 3.11Å
117A93.6Very high87.9Confident1 Ų137 Ų371%0.00823%0.229CC..Hα-helixtrans-62-38.9179.700000112.4L113 L114 D115 L120 H121 F142 W145 F156L113-A117 WeakPolarHBondContact O-CB 3.36Å; L113-A117 PolarHBondContact O-N 2.8Å; L114-A117 WeakPolarHBondContact O-CB 3.46Å; L114-A117 PolarHBondContact O-N 2.89Å; D115-A117 VanDerWaalsContact C-N 3.34Å; D115-A117 PolarHBondContact O-N 3.26Å; A117-L120 PolarHBondContact O-N 3.42Å; A117-H121 WeakPolarHBondContact O-CB 3.33Å; A117-H121 PolarHBondContact O-N 2.63Å; A117-F142 HydrophobicContact CB-CE1 4.21Å; A117-W145 HydrophobicContact CB-CD2 4.49Å; A117-W145 HydrophobicContact CB-CE3 3.99Å; A117-W145 HydrophobicContact CB-CH2 3.9Å; A117-W145 HydrophobicContact CB-CZ2 4.34Å; A117-W145 HydrophobicContact CB-CZ3 3.68Å; A117-F156 HydrophobicContact CB-CE1 4.05Å; A117-F156 HydrophobicContact CB-CE2 4Å; A117-F156 HydrophobicContact CB-CZ 3.61Å; A117-F156 WeakPolarHBondContact O-CE1 3.04Å
118C92.5Very high87.8Confident30 Ų3034.9 Ų34.920%0.20321%0.205CC..Hα-helixtrans-61.6-45.7173.9-80.60000112L114 D115 I116 H121 D122L114-C118 PolarHBondContact O-N 3.44Å; D115-C118 WeakPolarHBondContact O-CB 3.47Å; D115-C118 PolarHBondContact O-N 3.21Å; I116-C118 VanDerWaalsContact C-N 3.33Å; I116-C118 PolarHBondContact O-N 3.11Å; C118-H121 WeakPolarHBondContact O-CB 3.36Å; C118-H121 PolarHBondContact O-N 2.92Å; C118-D122 PolarHBondContact O-N 2.87Å
119R92Very high87Confident64 Ų6440.6 Ų40.624%0.24224%0.24CC..Hα-helixtrans-66.1-43.1176.7-65.4176.3-155.7-85.68.8111.9D55 L58 L62 D115 I116 H121 D122 V123D55-R119 IonicContact OD1-CZ 3.77Å; D55-R119 IonicContact OD1-NE 3.77Å; D55-R119 PolarHBondContact OD1-NE 3.05Å; D55-R119 IonicContact OD1-NH2 3.46Å; D55-R119 IonicContact OD2-CZ 3.38Å; D55-R119 IonicContact OD2-NE 2.73Å; D55-R119 IonicContact OD2-NH2 3.18Å; D55-R119 PolarHBondContact OD2-NH2 3.15Å; L58-R119 HydrophobicContact CD2-CB 3.83Å; L58-R119 HydrophobicContact CG-CB 4.42Å; L62-R119 HydrophobicContact CD1-CB 4.15Å; D115-R119 WeakPolarHBondContact O-CG 3.37Å; D115-R119 PolarHBondContact O-N 3.38Å; I116-R119 PolarHBondContact O-N 3.29Å; R119-H121 PolarHBondContact O-N 3.1Å; R119-D122 PolarHBondContact O-N 3.2Å; R119-D122 VanDerWaalsContact O-N 3.16Å; R119-V123 VanDerWaalsContact O-CG2 3.28Å; R119-V123 WeakPolarHBondContact O-CG2 3.4Å; R119-V123 PolarHBondContact O-N 3.24Å
120L92.3Very high86.1Confident0 Ų040.2 Ų40.20%024%0.241CC..Hα-helixtrans-63.1-30.5175.7-70.3178.1000112.1L58 V90 T94 I116 A117 L124 I138 L141 F142L58-L120 HydrophobicContact CD2-CD2 4.07Å; L58-L120 HydrophobicContact CD2-CG 4.08Å; V90-L120 HydrophobicContact CG1-CD2 3.82Å; T94-L120 HydrophobicContact CG2-CD1 4.48Å; T94-L120 WeakPolarHBondContact OG1-CD2 3.49Å; I116-L120 HydrophobicContact CG2-CD1 3.75Å; I116-L120 HydrophobicContact CG2-CG 4.16Å; I116-L120 WeakPolarHBondContact O-CB 3.39Å; I116-L120 VanDerWaalsContact O-CG 3.29Å; I116-L120 WeakPolarHBondContact O-CG 3.47Å; I116-L120 PolarHBondContact O-N 3.11Å; A117-L120 PolarHBondContact O-N 3.42Å; L120-L124 VanDerWaalsContact O-CB 3.31Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 PolarHBondContact O-N 3.04Å; L120-I138 HydrophobicContact CB-CG2 4.19Å; L120-L141 HydrophobicContact CD1-CD2 3.64Å; L120-F142 HydrophobicContact CB-CZ 4.4Å
121H92.3Very high85.4Confident21 Ų2140.8 Ų40.810%0.09725%0.245CC..Hα-helixtrans-65.2-45.5173.6169-79.6000110.8A117 C118 R119 V123 L124 V125 F142 K155 F156 T159A117-H121 WeakPolarHBondContact O-CB 3.33Å; A117-H121 PolarHBondContact O-N 2.63Å; C118-H121 WeakPolarHBondContact O-CB 3.36Å; C118-H121 PolarHBondContact O-N 2.92Å; R119-H121 PolarHBondContact O-N 3.1Å; H121-V123 VanDerWaalsContact C-N 3.32Å; H121-V123 PolarHBondContact O-N 3.09Å; H121-L124 WeakPolarHBondContact O-CB 3.42Å; H121-L124 PolarHBondContact O-N 3.44Å; H121-L124 VanDerWaalsContact O-N 3.16Å; H121-V125 WeakPolarHBondContact O-CG2 3.38Å; H121-V125 PolarHBondContact O-N 3.03Å; H121-V125 VanDerWaalsContact O-N 3.11Å; H121-F142 HydrophobicContact CB-CE2 4.01Å; H121-F142 HydrophobicContact CB-CZ 3.66Å; H121-K155 WeakPolarHBondContact ND1-CE 3.27Å; H121-F156 HydrophobicContact CB-CD1 4.05Å; H121-F156 HydrophobicContact CB-CE1 3.85Å; H121-T159 PolarHBondContact CD2-OG1 3.5Å; H121-T159 PolarHBondContact NE2-OG1 3.5Å
122D88.2Confident84.9Confident90 Ų9041.3 Ų41.348%0.48125%0.246SC..Hα-helixtrans-66.8-38.1179.4-59.4-18.6000111.1C118 R119 L124 V125 S126C118-D122 PolarHBondContact O-N 2.87Å; R119-D122 PolarHBondContact O-N 3.2Å; R119-D122 VanDerWaalsContact O-N 3.16Å; D122-L124 VanDerWaalsContact C-N 3.35Å; D122-L124 PolarHBondContact O-N 3.12Å; D122-V125 PolarHBondContact O-N 3.31Å; D122-S126 PolarHBondContact O-N 2.93Å
123V88Confident84.6Confident2 Ų244.1 Ų44.11%0.01226%0.262CS..Hα-helixtrans-58.9-44.6170.2171.50000111.4L62 P67 W70 V90 R119 H121 V125 S126 L127 I138L62-V123 HydrophobicContact CD1-CG2 3.68Å; L62-V123 HydrophobicContact CD2-CG2 3.66Å; L62-V123 HydrophobicContact CG-CG2 4.35Å; P67-V123 HydrophobicContact CG-CB 4.31Å; P67-V123 HydrophobicContact CG-CG1 4.48Å; P67-V123 HydrophobicContact CG-CG2 3.82Å; W70-V123 HydrophobicContact CH2-CG1 3.7Å; W70-V123 HydrophobicContact CZ3-CG1 4.05Å; V90-V123 HydrophobicContact CG1-CG1 4.17Å; R119-V123 VanDerWaalsContact O-CG2 3.28Å; R119-V123 WeakPolarHBondContact O-CG2 3.4Å; R119-V123 PolarHBondContact O-N 3.24Å; H121-V123 VanDerWaalsContact C-N 3.32Å; H121-V123 PolarHBondContact O-N 3.09Å; V123-V125 VanDerWaalsContact C-N 3.33Å; V123-V125 PolarHBondContact O-N 3.45Å; V123-S126 CarbonylContact O-C 3.5Å; V123-S126 PolarHBondContact O-N 3.4Å; V123-L127 HydrophobicContact CG1-CD1 3.38Å; V123-L127 WeakPolarHBondContact O-CD1 3.45Å; V123-L127 PolarHBondContact O-N 2.9Å; V123-I138 HydrophobicContact CG1-CD1 4.41Å
124L86.5Confident84.3Confident6 Ų644.3 Ų44.33%0.03126%0.263CS..Hα-helixtrans-64.2-36-178.4-175.562000113L120 H121 D122 S126 Q135 I138 F142 T159 I163L120-L124 VanDerWaalsContact O-CB 3.31Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 PolarHBondContact O-N 3.04Å; H121-L124 WeakPolarHBondContact O-CB 3.42Å; H121-L124 PolarHBondContact O-N 3.44Å; H121-L124 VanDerWaalsContact O-N 3.16Å; D122-L124 VanDerWaalsContact C-N 3.35Å; D122-L124 PolarHBondContact O-N 3.12Å; L124-S126 PolarHBondContact O-N 3.2Å; L124-Q135 HydrophobicContact CD1-CB 4.31Å; L124-Q135 HydrophobicContact CD1-CG 3.47Å; L124-Q135 VanDerWaalsContact CD1-CG 3.47Å; L124-I138 HydrophobicContact CB-CG2 4.16Å; L124-I138 HydrophobicContact CD1-CB 4.24Å; L124-I138 HydrophobicContact CD1-CD1 4.46Å; L124-I138 HydrophobicContact CD1-CG2 4.39Å; L124-I138 HydrophobicContact CD2-CB 4.45Å; L124-I138 HydrophobicContact CD2-CG2 3.88Å; L124-I138 HydrophobicContact CG-CG2 4.39Å; L124-F142 HydrophobicContact CD2-CD2 3.88Å; L124-F142 HydrophobicContact CD2-CE2 3.61Å; L124-T159 HydrophobicContact CD2-CG2 3.81Å; L124-T159 HydrophobicContact CG-CG2 4.47Å; L124-I163 HydrophobicContact CD1-CD1 3.92Å; L124-I163 HydrophobicContact CD2-CD1 3.45Å; L124-I163 VanDerWaalsContact CD2-CD1 3.45Å; L124-I163 HydrophobicContact CG-CD1 3.62Å
125V80Confident84Confident102 Ų10244.8 Ų44.862%0.61826%0.264SS*.Hα-helixtrans-68-27.6177.7174.40000111.5H121 D122 V123H121-V125 WeakPolarHBondContact O-CG2 3.38Å; H121-V125 PolarHBondContact O-N 3.03Å; H121-V125 VanDerWaalsContact O-N 3.11Å; D122-V125 PolarHBondContact O-N 3.31Å; V123-V125 VanDerWaalsContact C-N 3.33Å; V123-V125 PolarHBondContact O-N 3.45Å
126S79.9Confident83.8Confident64 Ų6444 Ų4445%0.44826%0.26SS..THydrogen-bonded Turntrans-1054.2-178.1-60.20000114.3D122 V123 L124D122-S126 PolarHBondContact O-N 2.93Å; V123-S126 CarbonylContact O-C 3.5Å; V123-S126 PolarHBondContact O-N 3.4Å; L124-S126 PolarHBondContact O-N 3.2Å
127L78.1Confident83.5Confident19 Ų1947.7 Ų47.710%0.09927%0.274CS..  trans-73.7132.4-174.7-137.298.6000111.6W70 V123 E131 L134 Q135W70-L127 HydrophobicContact CZ3-CD1 3.86Å; V123-L127 HydrophobicContact CG1-CD1 3.38Å; V123-L127 WeakPolarHBondContact O-CD1 3.45Å; V123-L127 PolarHBondContact O-N 2.9Å; L127-E131 HydrophobicContact CD2-CB 3.78Å; L127-L134 HydrophobicContact CD1-CD2 4.06Å; L127-L134 HydrophobicContact CD1-CG 4.48Å; L127-L134 HydrophobicContact CD2-CB 4.25Å; L127-L134 HydrophobicContact CD2-CD2 4.36Å; L127-L134 HydrophobicContact CD2-CG 4.27Å; L127-Q135 HydrophobicContact CD2-CB 3.94Å
128P68.9Low83.4Confident19 Ų1947.6 Ų47.612%0.12327%0.274CS..  trans-69.3157.7174.926.6-34000113.2E71 S130 E131E71-P128 HydrophobicContact CG-CB 3.88Å; E71-P128 HydrophobicContact CG-CG 4.03Å; E71-P128 WeakPolarHBondContact OE1-CB 3.45Å; P128-S130 PolarHBondContact O-N 3.14Å; P128-E131 HydrophobicContact CG-CG 4.46Å; P128-E131 PolarHBondContact O-N 3.42Å
129V65.7Low83.4Confident137 Ų13746.2 Ų46.283%0.8326%0.264SS*.G310 helixtrans-66.7-23.3-178-176.60000112.3E131V129-E131 PolarHBondContact O-N 3.38Å
130S66.5Low83.4Confident77 Ų7745.8 Ų45.854%0.53827%0.268SS..G310 helixtrans-60.3-28.5176.247.30000113P128 A132P128-S130 PolarHBondContact O-N 3.14Å; S130-A132 PolarHBondContact O-N 3.02Å
131E76Confident83.4Confident57 Ų5745.8 Ų45.827%0.26627%0.268SS..G310 helixtrans-99.147.7-175.1-67.5-54.9140.800114.1M87 L127 P128 V129 P133 L134 Q135M87-E131 HydrophobicContact CE-CG 3.66Å; M87-E131 WeakPolarHBondContact CE-OE1 3.47Å; M87-E131 VanDerWaalsContact CE-OE2 3.3Å; M87-E131 WeakPolarHBondContact CE-OE2 3.31Å; M87-E131 HydrophobicContact SD-CG 4.13Å; L127-E131 HydrophobicContact CD2-CB 3.78Å; P128-E131 HydrophobicContact CG-CG 4.46Å; P128-E131 PolarHBondContact O-N 3.42Å; V129-E131 PolarHBondContact O-N 3.38Å; E131-P133 VanDerWaalsContact C-N 3.34Å; E131-L134 PolarHBondContact O-N 3.26Å; E131-Q135 PolarHBondContact O-N 3.19Å; E131-Q135 VanDerWaalsContact O-N 3.15Å
132A78.6Confident83.5Confident52 Ų5244.8 Ų44.843%0.4326%0.264SS..Hα-helixtrans-53-37.117800000115.2S130 L136S130-A132 PolarHBondContact O-N 3.02Å; A132-L136 WeakPolarHBondContact O-CB 3.43Å; A132-L136 PolarHBondContact O-N 2.94Å; A132-L136 VanDerWaalsContact O-N 3.13Å
133P84.6Confident83.7Confident77 Ų7741.1 Ų41.150%0.524%0.244SC..Hα-helixtrans-66.8-41178.9-22.134.6000113.8E131 L136 R137E131-P133 VanDerWaalsContact C-N 3.34Å; P133-L136 PolarHBondContact O-N 2.93Å; P133-R137 PolarHBondContact O-N 3.34Å
134L86.6Confident83.9Confident5 Ų543 Ų433%0.02626%0.255CS..Hα-helixtrans-69.5-45.1179.1177.956.6000110.4V90 D91 L127 E131 L136 R137 I138V90-L134 HydrophobicContact CG1-CD1 4.27Å; V90-L134 HydrophobicContact CG1-CD2 4.08Å; D91-L134 HydrophobicContact CB-CD1 4.03Å; L127-L134 HydrophobicContact CD1-CD2 4.06Å; L127-L134 HydrophobicContact CD1-CG 4.48Å; L127-L134 HydrophobicContact CD2-CB 4.25Å; L127-L134 HydrophobicContact CD2-CD2 4.36Å; L127-L134 HydrophobicContact CD2-CG 4.27Å; E131-L134 PolarHBondContact O-N 3.26Å; L134-L136 PolarHBondContact O-N 3.19Å; L134-R137 PolarHBondContact O-N 3.14Å; L134-I138 HydrophobicContact CD1-CD1 4.16Å; L134-I138 HydrophobicContact CD1-CG1 4.25Å; L134-I138 HydrophobicContact CG-CD1 4.1Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 2.92Å
135Q87.3Confident84.2Confident38 Ų3842.8 Ų42.818%0.17825%0.254CS..Hα-helixtrans-53.3-42.3174.8-162.1-168.93800111.8L124 L127 E131 Q139L124-Q135 HydrophobicContact CD1-CB 4.31Å; L124-Q135 HydrophobicContact CD1-CG 3.47Å; L124-Q135 VanDerWaalsContact CD1-CG 3.47Å; L127-Q135 HydrophobicContact CD2-CB 3.94Å; E131-Q135 PolarHBondContact O-N 3.19Å; E131-Q135 VanDerWaalsContact O-N 3.15Å; Q135-Q139 VanDerWaalsContact O-CB 3.23Å; Q135-Q139 WeakPolarHBondContact O-CB 3.47Å; Q135-Q139 PolarHBondContact O-N 3.5Å
136L88Confident84.8Confident63 Ų6339 Ų3933%0.3323%0.229SC..Hα-helixtrans-64.6-39.3178.5-175.264.5000112.9A132 P133 L134 T140 R180A132-L136 WeakPolarHBondContact O-CB 3.43Å; A132-L136 PolarHBondContact O-N 2.94Å; A132-L136 VanDerWaalsContact O-N 3.13Å; P133-L136 PolarHBondContact O-N 2.93Å; L134-L136 PolarHBondContact O-N 3.19Å; L136-T140 WeakPolarHBondContact O-CB 3.32Å; L136-T140 PolarHBondContact O-N 3.47Å; L136-T140 PolarHBondContact O-OG1 3.04Å; L136-R180 VanDerWaalsContact CD1-NH1 3.3Å; L136-R180 VanDerWaalsContact CD1-NH2 3.32Å
137R88.8Confident85.3Confident77 Ų7741.9 Ų41.929%0.29123%0.233SC..Hα-helixtrans-69.4-43.9178.8-68.8-170.1-147.9171.726.4111.6D91 T94 P133 L134 Q139 T140 L141D91-R137 VanDerWaalsContact CG-NH2 3.29Å; D91-R137 WeakPolarHBondContact OD1-CD 3.42Å; D91-R137 IonicContact OD1-CZ 2.86Å; D91-R137 IonicContact OD1-NE 3.1Å; D91-R137 PolarHBondContact OD1-NE 3.07Å; D91-R137 IonicContact OD1-NH1 2.83Å; D91-R137 PolarHBondContact OD1-NH1 2.9Å; D91-R137 IonicContact OD1-NH2 2.67Å; D91-R137 PolarHBondContact OD1-NH2 3.09Å; D91-R137 IonicContact OD2-CZ 3.37Å; D91-R137 IonicContact OD2-NH1 2.82Å; D91-R137 PolarHBondContact OD2-NH1 3.08Å; D91-R137 IonicContact OD2-NH2 2.76Å; D91-R137 PolarHBondContact OD2-NH2 3.07Å; T94-R137 HydrophobicContact CG2-CB 3.91Å; P133-R137 PolarHBondContact O-N 3.34Å; L134-R137 PolarHBondContact O-N 3.14Å; R137-Q139 VanDerWaalsContact C-N 3.33Å; R137-Q139 PolarHBondContact O-N 3.36Å; R137-T140 PolarHBondContact O-N 3.25Å; R137-L141 PolarHBondContact O-N 3.44Å
138I91.9Very high85.9Confident0 Ų044.8 Ų44.80%025%0.245CC..Hα-helixtrans-63.9-41.7176-55.6171.1000110.2T94 L120 V123 L124 L134 T140 L141 F142T94-I138 HydrophobicContact CG2-CB 4.44Å; T94-I138 HydrophobicContact CG2-CG1 3.76Å; L120-I138 HydrophobicContact CB-CG2 4.19Å; V123-I138 HydrophobicContact CG1-CD1 4.41Å; L124-I138 HydrophobicContact CB-CG2 4.16Å; L124-I138 HydrophobicContact CD1-CB 4.24Å; L124-I138 HydrophobicContact CD1-CD1 4.46Å; L124-I138 HydrophobicContact CD1-CG2 4.39Å; L124-I138 HydrophobicContact CD2-CB 4.45Å; L124-I138 HydrophobicContact CD2-CG2 3.88Å; L124-I138 HydrophobicContact CG-CG2 4.39Å; L134-I138 HydrophobicContact CD1-CD1 4.16Å; L134-I138 HydrophobicContact CD1-CG1 4.25Å; L134-I138 HydrophobicContact CG-CD1 4.1Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 2.92Å; I138-T140 VanDerWaalsContact C-N 3.33Å; I138-T140 PolarHBondContact O-N 2.87Å; I138-L141 WeakPolarHBondContact O-CB 3.28Å; I138-L141 PolarHBondContact O-N 3.47Å; I138-F142 HydrophobicContact CG2-CD2 4.15Å; I138-F142 HydrophobicContact CG2-CE1 4.35Å; I138-F142 HydrophobicContact CG2-CE2 3.61Å; I138-F142 HydrophobicContact CG2-CZ 3.71Å; I138-F142 PolarHBondContact O-N 3Å
139Q90.8Very high86.9Confident0 Ų050.7 Ų50.70%027%0.271CS..Hα-helixtrans-58.7-43.7173.8-175.4-175.9-10.800111.8Q135 R137 F142 E143 A160 S164 E177Q135-Q139 VanDerWaalsContact O-CB 3.23Å; Q135-Q139 WeakPolarHBondContact O-CB 3.47Å; Q135-Q139 PolarHBondContact O-N 3.5Å; R137-Q139 VanDerWaalsContact C-N 3.33Å; R137-Q139 PolarHBondContact O-N 3.36Å; Q139-F142 PolarHBondContact O-N 2.83Å; Q139-E143 WeakPolarHBondContact O-CG 3.41Å; Q139-E143 PolarHBondContact O-N 2.71Å; Q139-A160 HydrophobicContact CG-CB 4.38Å; Q139-S164 PolarHBondContact NE2-OG 3.48Å; Q139-E177 PolarHBondContact NE2-OE2 3.02Å
140T91.6Very high88.1Confident55 Ų5545 Ų4534%0.33724%0.236SC..Hα-helixtrans-67-35.9178-54.90000112.3L136 R137 I138 E143 T144L136-T140 WeakPolarHBondContact O-CB 3.32Å; L136-T140 PolarHBondContact O-N 3.47Å; L136-T140 PolarHBondContact O-OG1 3.04Å; R137-T140 PolarHBondContact O-N 3.25Å; I138-T140 VanDerWaalsContact C-N 3.33Å; I138-T140 PolarHBondContact O-N 2.87Å; T140-E143 PolarHBondContact O-N 3.46Å; T140-T144 PolarHBondContact O-N 3.31Å; T140-T144 PolarHBondContact O-OG1 3.06Å
141L93.8Very high89.2Confident0 Ų046.6 Ų46.60%024%0.238CC..Hα-helixtrans-58.7-50.3171.6174.972.8000110.2A97 A98 L101 L120 R137 I138 E143 T144 W145A97-L141 HydrophobicContact CB-CD1 4.13Å; A97-L141 HydrophobicContact CB-CD2 4.28Å; A98-L141 HydrophobicContact CB-CD1 3.96Å; L101-L141 HydrophobicContact CD1-CD1 3.47Å; L101-L141 VanDerWaalsContact CD1-CD1 3.47Å; L101-L141 HydrophobicContact CD1-CG 4.39Å; L101-L141 HydrophobicContact CG-CD1 4.08Å; L120-L141 HydrophobicContact CD1-CD2 3.64Å; R137-L141 PolarHBondContact O-N 3.44Å; I138-L141 WeakPolarHBondContact O-CB 3.28Å; I138-L141 PolarHBondContact O-N 3.47Å; L141-E143 PolarHBondContact O-N 2.93Å; L141-T144 WeakPolarHBondContact O-CB 3.46Å; L141-T144 PolarHBondContact O-N 3.37Å; L141-T144 VanDerWaalsContact O-N 3.12Å; L141-W145 WeakPolarHBondContact O-CB 3.24Å; L141-W145 PolarHBondContact O-N 3.41Å
142F94.3Very high89.9Confident0 Ų049.1 Ų49.10%025%0.25CC..Hα-helixtrans-68-33.4179.6-66.5-19.2000113.8A117 L120 H121 L124 I138 Q139 T144 W145 W146 F156 A160A117-F142 HydrophobicContact CB-CE1 4.21Å; L120-F142 HydrophobicContact CB-CZ 4.4Å; H121-F142 HydrophobicContact CB-CE2 4.01Å; H121-F142 HydrophobicContact CB-CZ 3.66Å; L124-F142 HydrophobicContact CD2-CD2 3.88Å; L124-F142 HydrophobicContact CD2-CE2 3.61Å; I138-F142 HydrophobicContact CG2-CD2 4.15Å; I138-F142 HydrophobicContact CG2-CE1 4.35Å; I138-F142 HydrophobicContact CG2-CE2 3.61Å; I138-F142 HydrophobicContact CG2-CZ 3.71Å; I138-F142 PolarHBondContact O-N 3Å; Q139-F142 PolarHBondContact O-N 2.83Å; F142-T144 VanDerWaalsContact C-N 3.29Å; F142-T144 PolarHBondContact O-N 2.83Å; F142-W145 WeakPolarHBondContact O-CB 3.31Å; F142-W145 PolarHBondContact O-N 2.94Å; F142-W146 WeakPolarHBondContact O-CB 3.34Å; F142-W146 PolarHBondContact O-N 3.24Å; F142-F156 HydrophobicContact CB-CB 4Å; F142-F156 HydrophobicContact CD1-CB 3.77Å; F142-F156 AromaticContact CD1-CD1 3.87Å; F142-F156 HydrophobicContact CD1-CD1 3.87Å; F142-F156 AromaticContact CD1-CG 3.88Å; F142-F156 HydrophobicContact CD1-CG 3.88Å; F142-F156 HydrophobicContact CD2-CB 4.35Å; F142-F156 HydrophobicContact CE1-CB 4.35Å; F142-F156 AromaticContact CE1-CD1 3.55Å; F142-F156 HydrophobicContact CE1-CD1 3.55Å; F142-F156 HydrophobicContact CE1-CE1 4.03Å; F142-F156 HydrophobicContact CE1-CG 4.02Å; F142-F156 HydrophobicContact CE2-CD1 4.25Å; F142-F156 HydrophobicContact CG-CB 3.79Å; F142-F156 HydrophobicContact CG-CD1 4.38Å; F142-F156 HydrophobicContact CG-CG 4.35Å; F142-F156 AromaticContact CZ-CD1 3.77Å; F142-F156 HydrophobicContact CZ-CD1 3.77Å; F142-F156 HydrophobicContact CZ-CE1 4.25Å; F142-A160 HydrophobicContact CB-CB 3.93Å
143E91.7Very high90.5Very high13 Ų1350.1 Ų50.16%0.06124%0.242CC..Hα-helixtrans-59.8-41.1168.9-77.3172.5-15000112.1Q139 T140 L141 K147 R180 L184Q139-E143 WeakPolarHBondContact O-CG 3.41Å; Q139-E143 PolarHBondContact O-N 2.71Å; T140-E143 PolarHBondContact O-N 3.46Å; L141-E143 PolarHBondContact O-N 2.93Å; E143-K147 VanDerWaalsContact O-CG 3.31Å; E143-K147 WeakPolarHBondContact O-CG 3.43Å; E143-K147 PolarHBondContact O-N 3.02Å; E143-K147 VanDerWaalsContact O-N 3.15Å; E143-R180 WeakPolarHBondContact OE1-CD 3.32Å; E143-R180 WeakPolarHBondContact OE1-CG 3.29Å; E143-R180 IonicContact OE1-NE 3.96Å; E143-R180 PolarHBondContact OE1-NE 2.9Å; E143-R180 VanDerWaalsContact OE1-NE 3.11Å; E143-R180 IonicContact OE2-NE 3.71Å; E143-L184 HydrophobicContact CG-CD1 3.91Å; E143-L184 HydrophobicContact CG-CD2 4.25Å; E143-L184 HydrophobicContact CG-CG 4.27Å
144T91.7Very high90.8Very high42 Ų4249.7 Ų49.726%0.25823%0.234SC..Hα-helixtrans-71.5-40178.4-53.30000110.9L101 T140 L141 F142 W146 K147 K148L101-T144 HydrophobicContact CB-CG2 4.2Å; L101-T144 HydrophobicContact CD1-CG2 3.96Å; T140-T144 PolarHBondContact O-N 3.31Å; T140-T144 PolarHBondContact O-OG1 3.06Å; L141-T144 WeakPolarHBondContact O-CB 3.46Å; L141-T144 PolarHBondContact O-N 3.37Å; L141-T144 VanDerWaalsContact O-N 3.12Å; F142-T144 VanDerWaalsContact C-N 3.29Å; F142-T144 PolarHBondContact O-N 2.83Å; T144-W146 VanDerWaalsContact C-N 3.32Å; T144-W146 PolarHBondContact O-N 2.75Å; T144-K147 PolarHBondContact O-N 3.48Å; T144-K148 PolarHBondContact O-N 3.49Å
145W94.1Very high91Very high1 Ų152.7 Ų52.70%0.00425%0.246CC..Hα-helixtrans-57.3-45.8174.1-158.8-75.6000111.6L101 Y110 L113 L114 A117 L141 F142 K148 E149 L150 L151 F156L101-W145 HydrophobicContact CD1-CB 4.43Å; L101-W145 HydrophobicContact CD1-CE3 3.88Å; L101-W145 HydrophobicContact CD2-CD2 4.5Å; L101-W145 HydrophobicContact CD2-CE3 3.73Å; L101-W145 HydrophobicContact CD2-CZ3 3.76Å; L101-W145 HydrophobicContact CG-CE3 4.27Å; L101-W145 HydrophobicContact CG-CZ3 4.47Å; Y110-W145 HydrophobicContact CD2-CH2 4.47Å; Y110-W145 HydrophobicContact CD2-CZ2 4.36Å; Y110-W145 HydrophobicContact CE2-CZ2 4.36Å; L113-W145 HydrophobicContact CB-CH2 4.45Å; L113-W145 HydrophobicContact CD2-CH2 4.37Å; L113-W145 HydrophobicContact CD2-CZ3 4.16Å; L113-W145 HydrophobicContact CG-CH2 4.13Å; L113-W145 HydrophobicContact CG-CZ3 3.98Å; L114-W145 HydrophobicContact CB-CH2 4.26Å; L114-W145 HydrophobicContact CB-CZ2 4.15Å; L114-W145 HydrophobicContact CD1-CZ2 3.77Å; A117-W145 HydrophobicContact CB-CD2 4.49Å; A117-W145 HydrophobicContact CB-CE3 3.99Å; A117-W145 HydrophobicContact CB-CH2 3.9Å; A117-W145 HydrophobicContact CB-CZ2 4.34Å; A117-W145 HydrophobicContact CB-CZ3 3.68Å; L141-W145 WeakPolarHBondContact O-CB 3.24Å; L141-W145 PolarHBondContact O-N 3.41Å; F142-W145 WeakPolarHBondContact O-CB 3.31Å; F142-W145 PolarHBondContact O-N 2.94Å; W145-K148 PolarHBondContact O-N 2.87Å; W145-E149 PolarHBondContact O-N 3.41Å; W145-L150 HydrophobicContact CD2-CB 4.42Å; W145-L150 HydrophobicContact CD2-CD1 3.78Å; W145-L150 HydrophobicContact CE3-CD1 4.19Å; W145-L150 HydrophobicContact CG-CB 4.36Å; W145-L150 HydrophobicContact CG-CD1 4.11Å; W145-L150 HydrophobicContact CH2-CD1 4.36Å; W145-L150 HydrophobicContact CZ2-CB 4.24Å; W145-L150 HydrophobicContact CZ2-CD1 4.03Å; W145-L150 HydrophobicContact CZ3-CD1 4.46Å; W145-L150 VanDerWaalsContact NE1-CB 3.35Å; W145-L151 PolarHBondContact NE1-O 3.21Å; W145-F156 AromaticContact CD1-CD2 3.49Å; W145-F156 VanDerWaalsContact CD1-CD2 3.49Å; W145-F156 HydrophobicContact CD2-CD2 4.18Å; W145-F156 HydrophobicContact CD2-CE2 4.32Å; W145-F156 AromaticContact CE2-CE2 3.83Å; W145-F156 AromaticContact CG-CD2 3.93Å; W145-F156 HydrophobicContact CG-CD2 3.93Å; W145-F156 HydrophobicContact CZ2-CE2 4.29Å; W145-F156 AromaticContact NE1-CD2 3.47Å; W145-F156 AromaticContact NE1-CE2 3.58Å
146W92.6Very high91.2Very high23 Ų2350.9 Ų50.99%0.08724%0.238CC..Hα-helixtrans-59.3-49.1175.1178.7-98.1000112F142 T144 K148 E149 R153 E154 L184 N186 V187F142-W146 WeakPolarHBondContact O-CB 3.34Å; F142-W146 PolarHBondContact O-N 3.24Å; T144-W146 VanDerWaalsContact C-N 3.32Å; T144-W146 PolarHBondContact O-N 2.75Å; W146-K148 VanDerWaalsContact C-N 3.26Å; W146-K148 PolarHBondContact O-N 3.46Å; W146-E149 PolarHBondContact O-N 2.9Å; W146-E149 VanDerWaalsContact O-N 3.11Å; W146-R153 HydrophobicContact CE3-CB 3.85Å; W146-R153 HydrophobicContact CE3-CG 4.06Å; W146-R153 HydrophobicContact CZ3-CB 4.17Å; W146-R153 HydrophobicContact CZ3-CG 3.9Å; W146-E154 VanDerWaalsContact CH2-OE2 3.25Å; W146-E154 WeakPolarHBondContact CH2-OE2 3.45Å; W146-E154 VanDerWaalsContact CZ3-OE2 3.22Å; W146-E154 WeakPolarHBondContact CZ3-OE2 3.42Å; W146-L184 HydrophobicContact CB-CD2 4.06Å; W146-L184 HydrophobicContact CG-CD2 3.83Å; W146-N186 HydrophobicContact CZ2-CB 4.1Å; W146-V187 HydrophobicContact CD2-CG2 3.8Å; W146-V187 HydrophobicContact CE3-CG2 3.91Å; W146-V187 HydrophobicContact CH2-CB 4.29Å; W146-V187 HydrophobicContact CH2-CG2 3.71Å; W146-V187 HydrophobicContact CZ2-CB 4.3Å; W146-V187 HydrophobicContact CZ2-CG2 3.58Å; W146-V187 HydrophobicContact CZ3-CG2 3.87Å
147K90.3Very high91.5Very high125 Ų12547.9 Ų47.954%0.54322%0.222SC..Hα-helixtrans-64.1-28-178.5-72.8169.8-173.3167.70113.6E143 T144 E149E143-K147 VanDerWaalsContact O-CG 3.31Å; E143-K147 WeakPolarHBondContact O-CG 3.43Å; E143-K147 PolarHBondContact O-N 3.02Å; E143-K147 VanDerWaalsContact O-N 3.15Å; T144-K147 PolarHBondContact O-N 3.48Å; K147-E149 VanDerWaalsContact C-N 3.32Å
148K90Very high91.6Very high80 Ų8048 Ų4835%0.34822%0.223SC..THydrogen-bonded Turntrans-85.71.4176.8-77-158.3163.5-144.10114.3L101 L104 T144 W145 W146 L150L101-K148 WeakPolarHBondContact O-CD 3.32Å; L101-K148 WeakPolarHBondContact O-CE 3.43Å; L101-K148 PolarHBondContact O-NZ 2.96Å; L104-K148 PolarHBondContact O-NZ 3.41Å; T144-K148 PolarHBondContact O-N 3.49Å; W145-K148 PolarHBondContact O-N 2.87Å; W146-K148 VanDerWaalsContact C-N 3.26Å; W146-K148 PolarHBondContact O-N 3.46Å; K148-L150 HydrophobicContact CB-CD1 4.16Å; K148-L150 HydrophobicContact CB-CD2 4.22Å; K148-L150 HydrophobicContact CB-CG 3.82Å; K148-L150 PolarHBondContact O-N 3.25Å
149E89.5Confident91.5Very high142 Ų14249 Ų4966%0.66423%0.229SC*.THydrogen-bonded Turntrans5633.5177.4-52.1-157.6122.600114.9W145 W146 K147 R153W145-E149 PolarHBondContact O-N 3.41Å; W146-E149 PolarHBondContact O-N 2.9Å; W146-E149 VanDerWaalsContact O-N 3.11Å; K147-E149 VanDerWaalsContact C-N 3.32Å; E149-R153 VanDerWaalsContact CG-NH1 3.29Å; E149-R153 IonicContact OE1-NH1 2.84Å; E149-R153 PolarHBondContact OE1-NH1 3.21Å
150L91.2Very high91.6Very high19 Ų1949 Ų4910%0.09923%0.229CC..  trans-74168.6-177.1-59177.9000112.7L101 L104 Y110 W145 K148 R153L101-L150 HydrophobicContact CD2-CD1 3.6Å; L104-L150 HydrophobicContact CD2-CD1 4.11Å; L104-L150 HydrophobicContact CD2-CD2 3.84Å; Y110-L150 HydrophobicContact CE1-CD2 4.34Å; W145-L150 HydrophobicContact CD2-CB 4.42Å; W145-L150 HydrophobicContact CD2-CD1 3.78Å; W145-L150 HydrophobicContact CE3-CD1 4.19Å; W145-L150 HydrophobicContact CG-CB 4.36Å; W145-L150 HydrophobicContact CG-CD1 4.11Å; W145-L150 HydrophobicContact CH2-CD1 4.36Å; W145-L150 HydrophobicContact CZ2-CB 4.24Å; W145-L150 HydrophobicContact CZ2-CD1 4.03Å; W145-L150 HydrophobicContact CZ3-CD1 4.46Å; W145-L150 VanDerWaalsContact NE1-CB 3.35Å; K148-L150 HydrophobicContact CB-CD1 4.16Å; K148-L150 HydrophobicContact CB-CD2 4.22Å; K148-L150 HydrophobicContact CB-CG 3.82Å; K148-L150 PolarHBondContact O-N 3.25Å; L150-R153 VanDerWaalsContact O-CB 3.25Å; L150-R153 WeakPolarHBondContact O-CB 3.35Å; L150-R153 PolarHBondContact O-N 3.11Å
151L90.9Very high91.7Very high110 Ų11046.4 Ų46.458%0.57621%0.213SC*.THydrogen-bonded Turntrans-54.9147.8173-74.5167000111.4Y110 L114 W145 R153Y110-L151 HydrophobicContact CE2-CB 4.26Å; Y110-L151 HydrophobicContact CE2-CD1 4.3Å; Y110-L151 WeakPolarHBondContact OH-CD1 3.38Å; Y110-L151 WeakPolarHBondContact OH-CG 3.5Å; Y110-L151 PolarHBondContact OH-N 2.75Å; L114-L151 HydrophobicContact CD2-CB 4.25Å; W145-L151 PolarHBondContact NE1-O 3.21Å; L151-R153 PolarHBondContact O-N 2.9Å; L151-R153 VanDerWaalsContact O-N 3.12Å
152E90.1Very high91.6Very high109 Ų10948 Ų4851%0.50922%0.222SC..THydrogen-bonded Turntrans57.418-176.6-65.5-66.6139.700114.7L114 E154 K155 F156L114-E152 HydrophobicContact CD1-CB 3.99Å; L114-E152 HydrophobicContact CD1-CG 4.16Å; E152-E154 PolarHBondContact O-N 3.19Å; E152-E154 VanDerWaalsContact O-N 3.1Å; E152-K155 WeakPolarHBondContact O-CB 3.29Å; E152-K155 PolarHBondContact O-N 2.95Å; E152-F156 HydrophobicContact CB-CD2 4.29Å; E152-F156 HydrophobicContact CB-CE2 3.75Å; E152-F156 HydrophobicContact CB-CZ 4.31Å; E152-F156 WeakPolarHBondContact O-CD2 3.37Å; E152-F156 PolarHBondContact O-N 3.27Å
153R90.5Very high91.4Very high74 Ų7448.7 Ų48.728%0.27923%0.225SC..Hα-helixtrans-53.2-35.7179.467.3179.4-165.6-175.6-2.8113.4W146 E149 L150 L151 K155 F156 G157W146-R153 HydrophobicContact CE3-CB 3.85Å; W146-R153 HydrophobicContact CE3-CG 4.06Å; W146-R153 HydrophobicContact CZ3-CB 4.17Å; W146-R153 HydrophobicContact CZ3-CG 3.9Å; E149-R153 VanDerWaalsContact CG-NH1 3.29Å; E149-R153 IonicContact OE1-NH1 2.84Å; E149-R153 PolarHBondContact OE1-NH1 3.21Å; L150-R153 VanDerWaalsContact O-CB 3.25Å; L150-R153 WeakPolarHBondContact O-CB 3.35Å; L150-R153 PolarHBondContact O-N 3.11Å; L151-R153 PolarHBondContact O-N 2.9Å; L151-R153 VanDerWaalsContact O-N 3.12Å; R153-K155 VanDerWaalsContact C-N 3.34Å; R153-K155 PolarHBondContact O-N 3.35Å; R153-F156 PolarHBondContact O-N 2.89Å; R153-G157 WeakPolarHBondContact O-CA 3.43Å; R153-G157 PolarHBondContact O-N 3.26Å
154E90.8Very high91.4Very high68 Ų6848.1 Ų48.132%0.31822%0.222SC..Hα-helixtrans-62.5-40.9-179.2-57.5-57.3160.800111.8W146 E152 R158 S190W146-E154 VanDerWaalsContact CH2-OE2 3.25Å; W146-E154 WeakPolarHBondContact CH2-OE2 3.45Å; W146-E154 VanDerWaalsContact CZ3-OE2 3.22Å; W146-E154 WeakPolarHBondContact CZ3-OE2 3.42Å; E152-E154 PolarHBondContact O-N 3.19Å; E152-E154 VanDerWaalsContact O-N 3.1Å; E154-R158 WeakPolarHBondContact O-CB 3.41Å; E154-R158 PolarHBondContact O-N 3.36Å; E154-S190 VanDerWaalsContact CD-CB 3.44Å; E154-S190 WeakPolarHBondContact OE2-CB 3.42Å; E154-S190 PolarHBondContact OE2-OG 3.39Å
155K90.5Very high91.5Very high67 Ų6746.1 Ų46.129%0.29121%0.21SC..Hα-helixtrans-62.1-54.8176.4-178.8-177.3175.9-175.10110.8H121 E152 R153 T159H121-K155 WeakPolarHBondContact ND1-CE 3.27Å; E152-K155 WeakPolarHBondContact O-CB 3.29Å; E152-K155 PolarHBondContact O-N 2.95Å; R153-K155 VanDerWaalsContact C-N 3.34Å; R153-K155 PolarHBondContact O-N 3.35Å; K155-T159 PolarHBondContact O-N 3.36Å; K155-T159 PolarHBondContact O-OG1 2.92Å
156F92.8Very high91.4Very high0 Ų049 Ų490%022%0.223CC..Hα-helixtrans-69-40.4-176.7-56.5-50.4000112.7L114 A117 H121 F142 W145 E152 R153 T159 A160L114-F156 HydrophobicContact CD1-CE2 3.72Å; L114-F156 HydrophobicContact CD1-CZ 3.97Å; A117-F156 HydrophobicContact CB-CE1 4.05Å; A117-F156 HydrophobicContact CB-CE2 4Å; A117-F156 HydrophobicContact CB-CZ 3.61Å; A117-F156 WeakPolarHBondContact O-CE1 3.04Å; H121-F156 HydrophobicContact CB-CD1 4.05Å; H121-F156 HydrophobicContact CB-CE1 3.85Å; F142-F156 HydrophobicContact CB-CB 4Å; F142-F156 HydrophobicContact CD1-CB 3.77Å; F142-F156 AromaticContact CD1-CD1 3.87Å; F142-F156 HydrophobicContact CD1-CD1 3.87Å; F142-F156 AromaticContact CD1-CG 3.88Å; F142-F156 HydrophobicContact CD1-CG 3.88Å; F142-F156 HydrophobicContact CD2-CB 4.35Å; F142-F156 HydrophobicContact CE1-CB 4.35Å; F142-F156 AromaticContact CE1-CD1 3.55Å; F142-F156 HydrophobicContact CE1-CD1 3.55Å; F142-F156 HydrophobicContact CE1-CE1 4.03Å; F142-F156 HydrophobicContact CE1-CG 4.02Å; F142-F156 HydrophobicContact CE2-CD1 4.25Å; F142-F156 HydrophobicContact CG-CB 3.79Å; F142-F156 HydrophobicContact CG-CD1 4.38Å; F142-F156 HydrophobicContact CG-CG 4.35Å; F142-F156 AromaticContact CZ-CD1 3.77Å; F142-F156 HydrophobicContact CZ-CD1 3.77Å; F142-F156 HydrophobicContact CZ-CE1 4.25Å; W145-F156 AromaticContact CD1-CD2 3.49Å; W145-F156 VanDerWaalsContact CD1-CD2 3.49Å; W145-F156 HydrophobicContact CD2-CD2 4.18Å; W145-F156 HydrophobicContact CD2-CE2 4.32Å; W145-F156 AromaticContact CE2-CE2 3.83Å; W145-F156 AromaticContact CG-CD2 3.93Å; W145-F156 HydrophobicContact CG-CD2 3.93Å; W145-F156 HydrophobicContact CZ2-CE2 4.29Å; W145-F156 AromaticContact NE1-CD2 3.47Å; W145-F156 AromaticContact NE1-CE2 3.58Å; E152-F156 HydrophobicContact CB-CD2 4.29Å; E152-F156 HydrophobicContact CB-CE2 3.75Å; E152-F156 HydrophobicContact CB-CZ 4.31Å; E152-F156 WeakPolarHBondContact O-CD2 3.37Å; E152-F156 PolarHBondContact O-N 3.27Å; R153-F156 PolarHBondContact O-N 2.89Å; F156-T159 PolarHBondContact O-N 3.38Å; F156-A160 WeakPolarHBondContact O-CB 3.45Å; F156-A160 PolarHBondContact O-N 3.28Å
157G92.8Very high91.2Very high0 Ų049.1 Ų49.10%023%0.225CC..Hα-helixtrans-62.2-44.7176.500000112.1R153 T159 A160 F161R153-G157 WeakPolarHBondContact O-CA 3.43Å; R153-G157 PolarHBondContact O-N 3.26Å; G157-T159 PolarHBondContact O-N 2.72Å; G157-A160 PolarHBondContact O-N 2.94Å; G157-F161 WeakPolarHBondContact O-CB 3.37Å; G157-F161 PolarHBondContact O-N 3.48Å
158R91.6Very high91.3Very high80 Ų8043.3 Ų43.330%0.30220%0.2SC..Hα-helixtrans-56.1-47.8174.2178-175.5173.9121.46.3111.9E154 F161 L162 V187 L191 H197 N198 I201E154-R158 WeakPolarHBondContact O-CB 3.41Å; E154-R158 PolarHBondContact O-N 3.36Å; R158-F161 PolarHBondContact O-N 2.96Å; R158-L162 WeakPolarHBondContact O-CB 3.35Å; R158-L162 PolarHBondContact O-N 2.96Å; R158-V187 HydrophobicContact CB-CG1 4.36Å; R158-L191 HydrophobicContact CG-CD2 4.32Å; R158-H197 PolarHBondContact NH2-O 3.02Å; R158-N198 PolarHBondContact NH1-OD1 3.41Å; R158-N198 PolarHBondContact NH2-OD1 3.23Å; R158-I201 HydrophobicContact CG-CD1 4.46Å
159T90.8Very high91.4Very high22 Ų2241.6 Ų41.614%0.13519%0.192CC..Hα-helixtrans-66.9-45.7-178.7-59.70000111.5H121 L124 K155 F156 G157 F161 L162 I163H121-T159 PolarHBondContact CD2-OG1 3.5Å; H121-T159 PolarHBondContact NE2-OG1 3.5Å; L124-T159 HydrophobicContact CD2-CG2 3.81Å; L124-T159 HydrophobicContact CG-CG2 4.47Å; K155-T159 PolarHBondContact O-N 3.36Å; K155-T159 PolarHBondContact O-OG1 2.92Å; F156-T159 PolarHBondContact O-N 3.38Å; G157-T159 PolarHBondContact O-N 2.72Å; T159-F161 VanDerWaalsContact C-N 3.31Å; T159-F161 PolarHBondContact O-N 3.42Å; T159-L162 PolarHBondContact O-N 3.36Å; T159-I163 HydrophobicContact CG2-CD1 3.98Å; T159-I163 WeakPolarHBondContact O-CG1 3.34Å; T159-I163 PolarHBondContact O-N 3.28Å; T159-I163 VanDerWaalsContact O-N 3.08Å
160A92.3Very high91.3Very high0 Ų041.3 Ų41.30%019%0.194CC..Hα-helixtrans-61.4-39.4175.700000112.4Q139 F142 F156 G157 S164 L184Q139-A160 HydrophobicContact CG-CB 4.38Å; F142-A160 HydrophobicContact CB-CB 3.93Å; F156-A160 WeakPolarHBondContact O-CB 3.45Å; F156-A160 PolarHBondContact O-N 3.28Å; G157-A160 PolarHBondContact O-N 2.94Å; A160-S164 WeakPolarHBondContact O-CB 3.48Å; A160-S164 PolarHBondContact O-N 3.26Å; A160-S164 PolarHBondContact O-OG 3.44Å; A160-L184 HydrophobicContact CB-CD1 3.88Å
161F93.6Very high91Very high0 Ų044.2 Ų44.20%021%0.209CC..Hα-helixtrans-64.7-49.3177179.7-94.3000111.8G157 R158 T159 I163 S164 L165 L181 L184 V187 L188 I201 L205 F223G157-F161 WeakPolarHBondContact O-CB 3.37Å; G157-F161 PolarHBondContact O-N 3.48Å; R158-F161 PolarHBondContact O-N 2.96Å; T159-F161 VanDerWaalsContact C-N 3.31Å; T159-F161 PolarHBondContact O-N 3.42Å; F161-I163 VanDerWaalsContact C-N 3.35Å; F161-I163 PolarHBondContact O-N 3.45Å; F161-S164 PolarHBondContact O-N 2.98Å; F161-L165 HydrophobicContact CE1-CD2 4.12Å; F161-L165 WeakPolarHBondContact O-CB 3.36Å; F161-L165 PolarHBondContact O-N 2.85Å; F161-L181 HydrophobicContact CD2-CD2 3.91Å; F161-L181 HydrophobicContact CE2-CD2 3.7Å; F161-L181 HydrophobicContact CZ-CD2 4.15Å; F161-L184 HydrophobicContact CB-CB 4.49Å; F161-L184 HydrophobicContact CB-CD1 4.33Å; F161-L184 HydrophobicContact CD2-CB 3.95Å; F161-V187 HydrophobicContact CB-CB 4.4Å; F161-V187 HydrophobicContact CB-CG1 4.11Å; F161-V187 HydrophobicContact CG-CG1 4.38Å; F161-L188 HydrophobicContact CD1-CD2 4.44Å; F161-L188 HydrophobicContact CE1-CD2 3.61Å; F161-L188 HydrophobicContact CE1-CG 4.33Å; F161-L188 HydrophobicContact CE2-CD2 4.49Å; F161-L188 HydrophobicContact CE2-CG 4.36Å; F161-L188 HydrophobicContact CZ-CD1 4.06Å; F161-L188 HydrophobicContact CZ-CD2 3.64Å; F161-L188 HydrophobicContact CZ-CG 3.88Å; F161-I201 HydrophobicContact CE1-CG2 3.99Å; F161-L205 HydrophobicContact CE1-CD2 4.34Å; F161-L205 HydrophobicContact CZ-CD2 4Å; F161-F223 AromaticContact CE2-CE2 3.96Å; F161-F223 HydrophobicContact CE2-CE2 3.96Å; F161-F223 HydrophobicContact CE2-CZ 4.1Å; F161-F223 HydrophobicContact CZ-CE2 4.12Å; F161-F223 AromaticContact CZ-CZ 3.87Å; F161-F223 HydrophobicContact CZ-CZ 3.87Å
162L91.8Very high90.7Very high34 Ų3449 Ų4918%0.17823%0.225CC..Hα-helixtrans-60.2-43.3179.4175.959.9000111.8R158 T159 L165 Q166 I201 L204R158-L162 WeakPolarHBondContact O-CB 3.35Å; R158-L162 PolarHBondContact O-N 2.96Å; T159-L162 PolarHBondContact O-N 3.36Å; L162-L165 WeakPolarHBondContact O-CB 3.17Å; L162-L165 PolarHBondContact O-N 3.22Å; L162-Q166 HydrophobicContact CD1-CG 4.17Å; L162-Q166 WeakPolarHBondContact O-CG 3.36Å; L162-Q166 PolarHBondContact O-N 2.87Å; L162-I201 HydrophobicContact CD1-CG1 3.84Å; L162-L204 HydrophobicContact CD1-CD1 4.03Å
163I89.6Confident90.6Very high14 Ų1452.7 Ų52.77%0.07224%0.24CC..Hα-helixtrans-64.3-45.4177.7-68.3167.7000110.8L124 T159 F161 L165 Q166 K167L124-I163 HydrophobicContact CD1-CD1 3.92Å; L124-I163 HydrophobicContact CD2-CD1 3.45Å; L124-I163 VanDerWaalsContact CD2-CD1 3.45Å; L124-I163 HydrophobicContact CG-CD1 3.62Å; T159-I163 HydrophobicContact CG2-CD1 3.98Å; T159-I163 WeakPolarHBondContact O-CG1 3.34Å; T159-I163 PolarHBondContact O-N 3.28Å; T159-I163 VanDerWaalsContact O-N 3.08Å; F161-I163 VanDerWaalsContact C-N 3.35Å; F161-I163 PolarHBondContact O-N 3.45Å; I163-L165 PolarHBondContact O-N 3.4Å; I163-Q166 PolarHBondContact O-N 3.25Å; I163-K167 HydrophobicContact CG2-CD 3.96Å; I163-K167 HydrophobicContact CG2-CG 4.33Å; I163-K167 WeakPolarHBondContact O-CB 3.19Å; I163-K167 WeakPolarHBondContact O-CG 3.24Å; I163-K167 PolarHBondContact O-N 3.47Å
164S92.3Very high90.7Very high0 Ų049.7 Ų49.70%023%0.229CC..Hα-helixtrans-57.9-41.1175.5-540000110.9Q139 A160 F161 S168Q139-S164 PolarHBondContact NE2-OG 3.48Å; A160-S164 WeakPolarHBondContact O-CB 3.48Å; A160-S164 PolarHBondContact O-N 3.26Å; A160-S164 PolarHBondContact O-OG 3.44Å; F161-S164 PolarHBondContact O-N 2.98Å; S164-S168 WeakPolarHBondContact O-CB 3.38Å; S164-S168 PolarHBondContact O-N 3Å
165L93.5Very high90.7Very high0 Ų049 Ų490%024%0.235CC..Hα-helixtrans-64.9-50.7-179.3-172.456.8000110.8F161 L162 I163 S168 F169 L181 I201 L204 L205 C208F161-L165 HydrophobicContact CE1-CD2 4.12Å; F161-L165 WeakPolarHBondContact O-CB 3.36Å; F161-L165 PolarHBondContact O-N 2.85Å; L162-L165 WeakPolarHBondContact O-CB 3.17Å; L162-L165 PolarHBondContact O-N 3.22Å; I163-L165 PolarHBondContact O-N 3.4Å; L165-S168 WeakPolarHBondContact O-CB 3.43Å; L165-S168 PolarHBondContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.13Å; L165-F169 HydrophobicContact CD1-CE2 3.97Å; L165-F169 HydrophobicContact CG-CE2 4.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.38Å; L165-F169 WeakPolarHBondContact O-CE2 3.46Å; L165-L181 HydrophobicContact CB-CD2 3.86Å; L165-L181 HydrophobicContact CD1-CD1 4Å; L165-L181 HydrophobicContact CD1-CD2 4.23Å; L165-I201 HydrophobicContact CD2-CG2 4.36Å; L165-L204 HydrophobicContact CD1-CB 4.46Å; L165-L204 HydrophobicContact CD2-CB 3.44Å; L165-L204 VanDerWaalsContact CD2-CB 3.44Å; L165-L204 HydrophobicContact CD2-CD1 4.14Å; L165-L204 HydrophobicContact CD2-CG 4.45Å; L165-L204 HydrophobicContact CG-CB 3.77Å; L165-L204 HydrophobicContact CG-CD1 4.23Å; L165-L205 HydrophobicContact CD2-CD2 4.11Å; L165-L205 HydrophobicContact CD2-CG 4.38Å; L165-C208 VanDerWaalsContact CD1-SG 3.6Å
166Q91.6Very high90.7Very high62 Ų6248.3 Ų48.329%0.2924%0.242SC..Hα-helixtrans-60.1-48176.8-71172.2-17.700111.9L162 I163 S168 F169 I170 L204L162-Q166 HydrophobicContact CD1-CG 4.17Å; L162-Q166 WeakPolarHBondContact O-CG 3.36Å; L162-Q166 PolarHBondContact O-N 2.87Å; I163-Q166 PolarHBondContact O-N 3.25Å; Q166-S168 PolarHBondContact O-N 2.63Å; Q166-F169 PolarHBondContact O-N 3Å; Q166-I170 PolarHBondContact O-N 3.3Å; Q166-L204 HydrophobicContact CG-CD1 3.84Å
167K89.6Confident90.7Very high26 Ų2648.8 Ų48.811%0.11324%0.244CC..Hα-helixtrans-61.5-31.1178.5-74.6-178176.8173.80112.8I163 F169 I170 L171 E177I163-K167 HydrophobicContact CG2-CD 3.96Å; I163-K167 HydrophobicContact CG2-CG 4.33Å; I163-K167 WeakPolarHBondContact O-CB 3.19Å; I163-K167 WeakPolarHBondContact O-CG 3.24Å; I163-K167 PolarHBondContact O-N 3.47Å; K167-F169 PolarHBondContact O-N 3Å; K167-F169 VanDerWaalsContact O-N 3.14Å; K167-I170 PolarHBondContact O-N 3.46Å; K167-L171 HydrophobicContact CB-CD1 4.15Å; K167-L171 HydrophobicContact CB-CG 4.41Å; K167-L171 WeakPolarHBondContact O-CB 3.15Å; K167-L171 WeakPolarHBondContact O-CG 3.29Å; K167-L171 PolarHBondContact O-N 3.11Å; K167-E177 HydrophobicContact CB-CG 3.82Å
168S92.8Very high90.9Very high3 Ų348.9 Ų48.92%0.02125%0.245CC..Hα-helixtrans-61.4-21.1176.7850000113.7S164 L165 Q166 P174 H214S164-S168 WeakPolarHBondContact O-CB 3.38Å; S164-S168 PolarHBondContact O-N 3Å; L165-S168 WeakPolarHBondContact O-CB 3.43Å; L165-S168 PolarHBondContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.13Å; Q166-S168 PolarHBondContact O-N 2.63Å; S168-P174 VanDerWaalsContact O-CB 3.27Å; S168-P174 WeakPolarHBondContact O-CB 3.34Å; S168-H214 PolarHBondContact OG-CE1 3.43Å; S168-H214 PolarHBondContact OG-NE2 2.88Å
169F90.4Very high91Very high44 Ų4450.8 Ų50.819%0.19326%0.257CS..Hα-helixtrans-95.8-28176.3-63.9-75.5000113.8L165 Q166 K167 L204 Q207 R211L165-F169 HydrophobicContact CD1-CE2 3.97Å; L165-F169 HydrophobicContact CG-CE2 4.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.38Å; L165-F169 WeakPolarHBondContact O-CE2 3.46Å; Q166-F169 PolarHBondContact O-N 3Å; K167-F169 PolarHBondContact O-N 3Å; K167-F169 VanDerWaalsContact O-N 3.14Å; F169-L204 HydrophobicContact CD2-CD2 4Å; F169-L204 HydrophobicContact CE2-CB 4.23Å; F169-L204 HydrophobicContact CE2-CD2 3.86Å; F169-L204 WeakPolarHBondContact CZ-O 3.13Å; F169-Q207 HydrophobicContact CE1-CB 3.72Å; F169-Q207 HydrophobicContact CZ-CB 3.64Å; F169-R211 HydrophobicContact CD1-CG 3.72Å; F169-R211 HydrophobicContact CE1-CG 3.47Å; F169-R211 VanDerWaalsContact CE1-CG 3.47Å
170I87.4Confident91.1Very high136 Ų13652 Ų5270%0.69726%0.26SS*.Hα-helixtrans-86.1-39.6-174.9-61.6167.4000111.1Q166 K167Q166-I170 PolarHBondContact O-N 3.3Å; K167-I170 PolarHBondContact O-N 3.46Å
171L86.5Confident91.2Very high79 Ų7952 Ų5241%0.41426%0.26SS..  trans-75.1137.2-173.2-64.3177.7000112.2K167 K173 E177K167-L171 HydrophobicContact CB-CD1 4.15Å; K167-L171 HydrophobicContact CB-CG 4.41Å; K167-L171 WeakPolarHBondContact O-CB 3.15Å; K167-L171 WeakPolarHBondContact O-CG 3.29Å; K167-L171 PolarHBondContact O-N 3.11Å; L171-K173 PolarHBondContact O-N 3.34Å; L171-E177 HydrophobicContact CD1-CG 3.71Å
172K83.8Confident91.3Very high211 Ų21155.1 Ų55.192%0.91727%0.271SS*.SBendtrans-60.8-29.8173-69.7-175.2179.6178.60113
173K88.2Confident91.3Very high187 Ų18755.6 Ų55.681%0.81328%0.277SS*.SBendtrans-127.281.3179-68.5-175.1-179.9179.60110.2L171 A175L171-K173 PolarHBondContact O-N 3.34Å; K173-A175 VanDerWaalsContact C-N 3.27Å; K173-A175 PolarHBondContact O-N 3.48Å
174P91.8Very high91.6Very high10 Ų1054.9 Ų54.97%0.06527%0.274CS..THydrogen-bonded Turntrans-82.98.9-170.933.5-36.6000114.6S168 A176 E177 I178 T213S168-P174 VanDerWaalsContact O-CB 3.27Å; S168-P174 WeakPolarHBondContact O-CB 3.34Å; P174-A176 VanDerWaalsContact C-N 3.34Å; P174-A176 PolarHBondContact O-N 2.83Å; P174-E177 PolarHBondContact O-N 3.42Å; P174-I178 HydrophobicContact CB-CD1 4.32Å; P174-I178 HydrophobicContact CB-CG1 4.48Å; P174-I178 HydrophobicContact CG-CD1 4.11Å; P174-I178 WeakPolarHBondContact O-CG1 3.5Å; P174-I178 PolarHBondContact O-N 3.41Å; P174-T213 HydrophobicContact CG-CG2 4.07Å
175A91.6Very high91.6Very high53 Ų5356.3 Ų56.344%0.43828%0.281SS..Hα-helixtrans-57.5-41.7-170.300000113.8K173 I178 Q179K173-A175 VanDerWaalsContact C-N 3.27Å; K173-A175 PolarHBondContact O-N 3.48Å; A175-I178 PolarHBondContact O-N 3.14Å; A175-Q179 PolarHBondContact O-N 2.75Å
176A91.2Very high91.6Very high53 Ų5359.2 Ų59.244%0.43830%0.296SS..Hα-helixtrans-65.6-38.817700000112.2P174 Q179 R180P174-A176 VanDerWaalsContact C-N 3.34Å; P174-A176 PolarHBondContact O-N 2.83Å; A176-Q179 PolarHBondContact O-N 2.79Å; A176-R180 WeakPolarHBondContact O-CG 3.45Å; A176-R180 PolarHBondContact O-N 2.94Å
177E92.8Very high91.7Very high10 Ų1056.2 Ų56.25%0.04728%0.282CS..Hα-helixtrans-70.2-36.2176.7-57.6-56.3151.600111.8Q139 K167 L171 P174 Q179 R180 L181Q139-E177 PolarHBondContact NE2-OE2 3.02Å; K167-E177 HydrophobicContact CB-CG 3.82Å; L171-E177 HydrophobicContact CD1-CG 3.71Å; P174-E177 PolarHBondContact O-N 3.42Å; E177-Q179 VanDerWaalsContact C-N 3.32Å; E177-Q179 PolarHBondContact O-N 2.86Å; E177-R180 WeakPolarHBondContact O-CB 3.32Å; E177-R180 PolarHBondContact O-N 3.41Å; E177-R180 IonicContact OE1-CZ 3.09Å; E177-R180 IonicContact OE1-NH1 3.78Å; E177-R180 PolarHBondContact OE1-NH1 3.25Å; E177-R180 WeakPolarHBondContact OE2-CD 3.38Å; E177-R180 IonicContact OE2-NH1 2.68Å; E177-R180 PolarHBondContact OE2-NH1 2.87Å; E177-L181 WeakPolarHBondContact O-CG 3.31Å; E177-L181 PolarHBondContact O-N 3.19Å
178I95.1Very high91.8Very high3 Ų355 Ų552%0.01528%0.277CS..Hα-helixtrans-62.9-41.5173.7-66.2169.4000110.6P174 A175 R180 L181 W182 N217 D219 G220P174-I178 HydrophobicContact CB-CD1 4.32Å; P174-I178 HydrophobicContact CB-CG1 4.48Å; P174-I178 HydrophobicContact CG-CD1 4.11Å; P174-I178 WeakPolarHBondContact O-CG1 3.5Å; P174-I178 PolarHBondContact O-N 3.41Å; A175-I178 PolarHBondContact O-N 3.14Å; I178-R180 VanDerWaalsContact C-N 3.34Å; I178-R180 PolarHBondContact O-N 3.26Å; I178-L181 WeakPolarHBondContact O-CB 3.48Å; I178-L181 PolarHBondContact O-N 2.93Å; I178-W182 PolarHBondContact O-N 3.18Å; I178-N217 HydrophobicContact CD1-CB 4.48Å; I178-D219 HydrophobicContact CG2-CB 4.42Å; I178-G220 VanDerWaalsContact CG2-CA 3.46Å; I178-G220 VanDerWaalsContact CG2-N 3.32Å
179Q94.4Very high91.6Very high120 Ų12061.8 Ų61.856%0.56131%0.306SS*.Hα-helixtrans-63.2-40.3174.9-173.2-178-1.300111.6A175 A176 E177 W182 S183A175-Q179 PolarHBondContact O-N 2.75Å; A176-Q179 PolarHBondContact O-N 2.79Å; E177-Q179 VanDerWaalsContact C-N 3.32Å; E177-Q179 PolarHBondContact O-N 2.86Å; Q179-W182 PolarHBondContact O-N 3.37Å; Q179-S183 PolarHBondContact O-N 3.29Å
180R93.2Very high91.5Very high48 Ų4862.3 Ų62.318%0.18132%0.315CS..Hα-helixtrans-63.8-45.3174.3-75.4171.81701367.7112.6L136 E143 A176 E177 I178 W182 S183 L184L136-R180 VanDerWaalsContact CD1-NH1 3.3Å; L136-R180 VanDerWaalsContact CD1-NH2 3.32Å; E143-R180 WeakPolarHBondContact OE1-CD 3.32Å; E143-R180 WeakPolarHBondContact OE1-CG 3.29Å; E143-R180 IonicContact OE1-NE 3.96Å; E143-R180 PolarHBondContact OE1-NE 2.9Å; E143-R180 VanDerWaalsContact OE1-NE 3.11Å; E143-R180 IonicContact OE2-NE 3.71Å; A176-R180 WeakPolarHBondContact O-CG 3.45Å; A176-R180 PolarHBondContact O-N 2.94Å; E177-R180 WeakPolarHBondContact O-CB 3.32Å; E177-R180 PolarHBondContact O-N 3.41Å; E177-R180 IonicContact OE1-CZ 3.09Å; E177-R180 IonicContact OE1-NH1 3.78Å; E177-R180 PolarHBondContact OE1-NH1 3.25Å; E177-R180 WeakPolarHBondContact OE2-CD 3.38Å; E177-R180 IonicContact OE2-NH1 2.68Å; E177-R180 PolarHBondContact OE2-NH1 2.87Å; I178-R180 VanDerWaalsContact C-N 3.34Å; I178-R180 PolarHBondContact O-N 3.26Å; R180-W182 VanDerWaalsContact C-N 3.27Å; R180-W182 PolarHBondContact O-N 3.04Å; R180-S183 CarbonylContact O-C 3.54Å; R180-S183 WeakPolarHBondContact O-CA 3.46Å; R180-S183 WeakPolarHBondContact O-CB 3.41Å; R180-S183 PolarHBondContact O-N 3.1Å; R180-S183 PolarHBondContact O-OG 3.37Å; R180-L184 PolarHBondContact O-N 2.91Å
181L94.6Very high91.5Very high0 Ų056.6 Ų56.60%029%0.286CS..Hα-helixtrans-54.8-45.3173.9-75.8173.1000111.4F161 L165 E177 I178 S183 L184 H185F161-L181 HydrophobicContact CD2-CD2 3.91Å; F161-L181 HydrophobicContact CE2-CD2 3.7Å; F161-L181 HydrophobicContact CZ-CD2 4.15Å; L165-L181 HydrophobicContact CB-CD2 3.86Å; L165-L181 HydrophobicContact CD1-CD1 4Å; L165-L181 HydrophobicContact CD1-CD2 4.23Å; E177-L181 WeakPolarHBondContact O-CG 3.31Å; E177-L181 PolarHBondContact O-N 3.19Å; I178-L181 WeakPolarHBondContact O-CB 3.48Å; I178-L181 PolarHBondContact O-N 2.93Å; L181-S183 VanDerWaalsContact C-N 3.33Å; L181-S183 PolarHBondContact O-N 2.93Å; L181-L184 CarbonylContact O-C 3.58Å; L181-L184 PolarHBondContact O-N 3.35Å; L181-H185 PolarHBondContact O-N 3.14Å
182W95Very high91.6Very high64 Ų6458.7 Ų58.724%0.24229%0.293CS..Hα-helixtrans-62.8-39.2173.5177.2-114.8000112I178 Q179 R180 L184 H185 D219 R222 F223 F226I178-W182 PolarHBondContact O-N 3.18Å; Q179-W182 PolarHBondContact O-N 3.37Å; R180-W182 VanDerWaalsContact C-N 3.27Å; R180-W182 PolarHBondContact O-N 3.04Å; W182-L184 VanDerWaalsContact C-N 3.29Å; W182-L184 PolarHBondContact O-N 2.91Å; W182-H185 HydrophobicContact CE3-CB 4.42Å; W182-H185 PolarHBondContact O-ND1 3.15Å; W182-D219 HydrophobicContact CB-CB 4.13Å; W182-D219 HydrophobicContact CG-CB 4.37Å; W182-R222 HydrophobicContact CD2-CB 3.92Å; W182-R222 HydrophobicContact CE3-CB 3.8Å; W182-R222 HydrophobicContact CH2-CB 3.9Å; W182-R222 HydrophobicContact CZ2-CB 4Å; W182-R222 VanDerWaalsContact CZ3-C 3.47Å; W182-R222 HydrophobicContact CZ3-CB 3.79Å; W182-R222 WeakPolarHBondContact CZ3-O 3.47Å; W182-F223 HydrophobicContact CE3-CB 4.05Å; W182-F226 HydrophobicContact CZ3-CB 4.02Å
183S93.2Very high91.6Very high44 Ų4451.1 Ų51.131%0.30826%0.259SS..Hα-helixtrans-67-28.7176.9800000114Q179 R180 L181Q179-S183 PolarHBondContact O-N 3.29Å; R180-S183 CarbonylContact O-C 3.54Å; R180-S183 WeakPolarHBondContact O-CA 3.46Å; R180-S183 WeakPolarHBondContact O-CB 3.41Å; R180-S183 PolarHBondContact O-N 3.1Å; R180-S183 PolarHBondContact O-OG 3.37Å; L181-S183 VanDerWaalsContact C-N 3.33Å; L181-S183 PolarHBondContact O-N 2.93Å
184L94Very high91.4Very high0 Ų047.3 Ų47.30%025%0.252CS..Hα-helixtrans-99.52.9-178.1-69.2176.2000113.9E143 W146 A160 F161 R180 L181 W182 N186 V187E143-L184 HydrophobicContact CG-CD1 3.91Å; E143-L184 HydrophobicContact CG-CD2 4.25Å; E143-L184 HydrophobicContact CG-CG 4.27Å; W146-L184 HydrophobicContact CB-CD2 4.06Å; W146-L184 HydrophobicContact CG-CD2 3.83Å; A160-L184 HydrophobicContact CB-CD1 3.88Å; F161-L184 HydrophobicContact CB-CB 4.49Å; F161-L184 HydrophobicContact CB-CD1 4.33Å; F161-L184 HydrophobicContact CD2-CB 3.95Å; R180-L184 PolarHBondContact O-N 2.91Å; L181-L184 CarbonylContact O-C 3.58Å; L181-L184 PolarHBondContact O-N 3.35Å; W182-L184 VanDerWaalsContact C-N 3.29Å; W182-L184 PolarHBondContact O-N 2.91Å; L184-N186 PolarHBondContact O-N 3.18Å; L184-V187 HydrophobicContact CB-CG2 4.32Å; L184-V187 VanDerWaalsContact O-CB 3.24Å; L184-V187 WeakPolarHBondContact O-CB 3.37Å; L184-V187 WeakPolarHBondContact O-CG2 3.48Å; L184-V187 PolarHBondContact O-N 2.68Å
185H93.9Very high91.3Very high30 Ų3048.3 Ų48.314%0.13926%0.259CS..G310 helixtrans-53.3-30.6-171.471-77.2000114.9L181 W182 V187 L188 F223 F226L181-H185 PolarHBondContact O-N 3.14Å; W182-H185 HydrophobicContact CE3-CB 4.42Å; W182-H185 PolarHBondContact O-ND1 3.15Å; H185-V187 PolarHBondContact O-N 3.03Å; H185-L188 WeakPolarHBondContact O-CB 3.42Å; H185-L188 PolarHBondContact O-N 3.23Å; H185-L188 VanDerWaalsContact O-N 3.1Å; H185-F223 HydrophobicContact CB-CD2 4.06Å; H185-F223 HydrophobicContact CB-CE2 4.22Å; H185-F226 HydrophobicContact CB-CD1 4.04Å; H185-F226 HydrophobicContact CB-CE1 4.1Å; H185-F226 AromaticContact CD2-CD1 3.99Å; H185-F226 AromaticContact CD2-CD2 3.73Å; H185-F226 AromaticContact CD2-CE1 3.9Å; H185-F226 AromaticContact CD2-CE2 3.65Å; H185-F226 AromaticContact CD2-CG 3.9Å; H185-F226 AromaticContact CD2-CZ 3.74Å; H185-F226 WeakPolarHBondContact O-CE1 3.24Å
186N92.4Very high90.9Very high60 Ų6052.5 Ų52.532%0.32127%0.27SS..G310 helixtrans-65.4-18.2178.2-78.5-44.6000113.6W146 L184 L188 K189W146-N186 HydrophobicContact CZ2-CB 4.1Å; L184-N186 PolarHBondContact O-N 3.18Å; N186-L188 PolarHBondContact O-N 3.07Å; N186-K189 WeakPolarHBondContact O-CB 3.49Å; N186-K189 PolarHBondContact O-N 2.95Å; N186-K189 WeakPolarHBondContact OD1-CE 3.47Å; N186-K189 PolarHBondContact OD1-NZ 3.19Å
187V93Very high90.6Very high0 Ų057.5 Ų57.50%028%0.284CS..G310 helixtrans-54.5-32.9170.3172.50000110.7W146 R158 F161 L184 H185 K189 S190W146-V187 HydrophobicContact CD2-CG2 3.8Å; W146-V187 HydrophobicContact CE3-CG2 3.91Å; W146-V187 HydrophobicContact CH2-CB 4.29Å; W146-V187 HydrophobicContact CH2-CG2 3.71Å; W146-V187 HydrophobicContact CZ2-CB 4.3Å; W146-V187 HydrophobicContact CZ2-CG2 3.58Å; W146-V187 HydrophobicContact CZ3-CG2 3.87Å; R158-V187 HydrophobicContact CB-CG1 4.36Å; F161-V187 HydrophobicContact CB-CB 4.4Å; F161-V187 HydrophobicContact CB-CG1 4.11Å; F161-V187 HydrophobicContact CG-CG1 4.38Å; L184-V187 HydrophobicContact CB-CG2 4.32Å; L184-V187 VanDerWaalsContact O-CB 3.24Å; L184-V187 WeakPolarHBondContact O-CB 3.37Å; L184-V187 WeakPolarHBondContact O-CG2 3.48Å; L184-V187 PolarHBondContact O-N 2.68Å; H185-V187 PolarHBondContact O-N 3.03Å; V187-K189 PolarHBondContact O-N 3.48Å; V187-K189 VanDerWaalsContact O-N 3.16Å; V187-S190 PolarHBondContact O-N 3.39Å; V187-S190 VanDerWaalsContact O-N 3.16Å; V187-S190 PolarHBondContact O-OG 3.3Å
188L92.1Very high90.3Very high0 Ų057.3 Ų57.30%028%0.283CS..G310 helixtrans-61.5-26177.5-64.8-179.3000112.8F161 H185 N186 S190 L191 I201 L205 F223 F226 L227 W230F161-L188 HydrophobicContact CD1-CD2 4.44Å; F161-L188 HydrophobicContact CE1-CD2 3.61Å; F161-L188 HydrophobicContact CE1-CG 4.33Å; F161-L188 HydrophobicContact CE2-CD2 4.49Å; F161-L188 HydrophobicContact CE2-CG 4.36Å; F161-L188 HydrophobicContact CZ-CD1 4.06Å; F161-L188 HydrophobicContact CZ-CD2 3.64Å; F161-L188 HydrophobicContact CZ-CG 3.88Å; H185-L188 WeakPolarHBondContact O-CB 3.42Å; H185-L188 PolarHBondContact O-N 3.23Å; H185-L188 VanDerWaalsContact O-N 3.1Å; N186-L188 PolarHBondContact O-N 3.07Å; L188-S190 PolarHBondContact O-N 2.92Å; L188-L191 HydrophobicContact CD2-CD1 3.67Å; L188-L191 PolarHBondContact O-N 2.98Å; L188-L191 VanDerWaalsContact O-N 3.14Å; L188-I201 HydrophobicContact CD2-CG2 4.37Å; L188-L205 HydrophobicContact CD1-CD1 4.21Å; L188-L205 HydrophobicContact CD1-CD2 4.3Å; L188-L205 HydrophobicContact CD2-CD1 3.94Å; L188-F223 HydrophobicContact CD1-CE2 4.21Å; L188-F223 HydrophobicContact CD1-CZ 4.41Å; L188-F226 HydrophobicContact CB-CE1 4.26Å; L188-F226 HydrophobicContact CD1-CD1 4.45Å; L188-F226 HydrophobicContact CD1-CE1 4Å; L188-L227 HydrophobicContact CD1-CD2 3.39Å; L188-W230 HydrophobicContact CB-CG 4.41Å; L188-W230 PolarHBondContact O-NE1 3.31Å
189K89.6Confident90Very high146 Ų14662.4 Ų62.464%0.63531%0.305SS*.G310 helixtrans-68.9-21.4179.4-66177.6174.9163.50113.5N186 V187 F226N186-K189 WeakPolarHBondContact O-CB 3.49Å; N186-K189 PolarHBondContact O-N 2.95Å; N186-K189 WeakPolarHBondContact OD1-CE 3.47Å; N186-K189 PolarHBondContact OD1-NZ 3.19Å; V187-K189 PolarHBondContact O-N 3.48Å; V187-K189 VanDerWaalsContact O-N 3.16Å; K189-F226 HydrophobicContact CG-CZ 4.49Å
190S87.8Confident89.8Confident55 Ų5561.9 Ų61.939%0.38530%0.302SS..G310 helixtrans-92.3-7.4173.963.90000113.3E154 V187 L188E154-S190 VanDerWaalsContact CD-CB 3.44Å; E154-S190 WeakPolarHBondContact OE2-CB 3.42Å; E154-S190 PolarHBondContact OE2-OG 3.39Å; V187-S190 PolarHBondContact O-N 3.39Å; V187-S190 VanDerWaalsContact O-N 3.16Å; V187-S190 PolarHBondContact O-OG 3.3Å; L188-S190 PolarHBondContact O-N 2.92Å
191L88.3Confident89.8Confident15 Ų1559.8 Ų59.88%0.07930%0.295CS..SBendtrans-86.6126.5176.8-60.3-175.5000110.9R158 L188 I201 W230R158-L191 HydrophobicContact CG-CD2 4.32Å; L188-L191 HydrophobicContact CD2-CD1 3.67Å; L188-L191 PolarHBondContact O-N 2.98Å; L188-L191 VanDerWaalsContact O-N 3.14Å; L191-I201 HydrophobicContact CD1-CD1 3.94Å; L191-I201 HydrophobicContact CD1-CG2 4.14Å; L191-W230 HydrophobicContact CB-CZ2 4.21Å
192E86.8Confident89.7Confident124 Ų12460.5 Ų60.558%0.57930%0.299SS*.  trans-78.3121.6171.2-170.2-179.8-171.600110.8T194 S195 N198E192-T194 VanDerWaalsContact C-N 3.34Å; E192-T194 WeakPolarHBondContact CG-OG1 3.47Å; E192-T194 PolarHBondContact O-N 2.59Å; E192-T194 PolarHBondContact OE1-OG1 3.42Å; E192-S195 PolarHBondContact O-N 2.86Å; E192-N198 PolarHBondContact N-ND2 3.29Å; E192-N198 PolarHBondContact O-ND2 2.81Å
193Y84.7Confident89.6Confident51 Ų5161.2 Ų61.220%0.231%0.307CS..THydrogen-bonded Turntrans-62.5-36.6-177.9168.2-111.6000113.4S195 I202 W230 N231 D233 F234 L237Y193-S195 VanDerWaalsContact C-N 3.3Å; Y193-S195 PolarHBondContact O-N 3.49Å; Y193-I202 HydrophobicContact CD2-CD1 3.95Å; Y193-I202 HydrophobicContact CE2-CD1 4.31Å; Y193-I202 HydrophobicContact CE2-CG2 4.47Å; Y193-I202 VanDerWaalsContact O-CD1 3.25Å; Y193-I202 WeakPolarHBondContact O-CD1 3.43Å; Y193-W230 HydrophobicContact CD2-CH2 4.12Å; Y193-W230 HydrophobicContact CD2-CZ3 4.13Å; Y193-N231 HydrophobicContact CG-CB 4.38Å; Y193-D233 HydrophobicContact CE1-CB 3.85Å; Y193-F234 HydrophobicContact CD2-CD2 4.4Å; Y193-F234 HydrophobicContact CE2-CB 4.2Å; Y193-F234 AromaticContact CE2-CD2 3.8Å; Y193-F234 HydrophobicContact CE2-CD2 3.8Å; Y193-F234 HydrophobicContact CE2-CG 4.42Å; Y193-L237 HydrophobicContact CE2-CD1 4.36Å; Y193-L237 VanDerWaalsContact OH-CD1 3.23Å; Y193-L237 WeakPolarHBondContact OH-CD1 3.4Å
194T84.2Confident89.6Confident107 Ų10760.2 Ų60.266%0.65630%0.298SS*.THydrogen-bonded Turntrans-80-5.1-176.341.60000114.3E192E192-T194 VanDerWaalsContact C-N 3.34Å; E192-T194 WeakPolarHBondContact CG-OG1 3.47Å; E192-T194 PolarHBondContact O-N 2.59Å; E192-T194 PolarHBondContact OE1-OG1 3.42Å
195S88.5Confident89.7Confident31 Ų3160.2 Ų60.222%0.21730%0.298CS..  trans-82.2125.2-176.5-173.70000112.2E192 Y193 H197 N198E192-S195 PolarHBondContact O-N 2.86Å; Y193-S195 VanDerWaalsContact C-N 3.3Å; Y193-S195 PolarHBondContact O-N 3.49Å; S195-H197 PolarHBondContact O-N 3.45Å; S195-H197 VanDerWaalsContact O-N 3.14Å; S195-N198 PolarHBondContact O-N 3.2Å
196E84.9Confident89.8Confident142 Ų14259.9 Ų59.966%0.66430%0.297SS*.G310 helixtrans-56.7-29.2175.4-74.1-6715400112.8N198 K199E196-N198 PolarHBondContact O-N 3.28Å; E196-N198 VanDerWaalsContact O-N 3.12Å; E196-K199 VanDerWaalsContact O-CB 3.3Å; E196-K199 WeakPolarHBondContact O-CB 3.17Å; E196-K199 PolarHBondContact O-N 2.97Å; E196-K199 VanDerWaalsContact O-N 3.17Å; E196-K199 IonicContact OE2-NZ 3.59Å
197H83.8Confident89.8Confident158 Ų15860.4 Ų60.473%0.73130%0.298SS*.G310 helixtrans-64.7-15.8176.6-61.187.7000113.3R158 S195R158-H197 PolarHBondContact NH2-O 3.02Å; S195-H197 PolarHBondContact O-N 3.45Å; S195-H197 VanDerWaalsContact O-N 3.14Å
198N86.7Confident89.9Confident5 Ų560.4 Ų60.43%0.02730%0.298CS..G310 helixtrans-102.9-1.9-179.3-64.1-22.2000112.9R158 E192 S195 E196 Q200 I201 I202R158-N198 PolarHBondContact NH1-OD1 3.41Å; R158-N198 PolarHBondContact NH2-OD1 3.23Å; E192-N198 PolarHBondContact N-ND2 3.29Å; E192-N198 PolarHBondContact O-ND2 2.81Å; S195-N198 PolarHBondContact O-N 3.2Å; E196-N198 PolarHBondContact O-N 3.28Å; E196-N198 VanDerWaalsContact O-N 3.12Å; N198-Q200 VanDerWaalsContact C-N 3.3Å; N198-Q200 PolarHBondContact O-N 3.11Å; N198-I201 WeakPolarHBondContact O-CB 3.42Å; N198-I201 PolarHBondContact O-N 3.5Å; N198-I202 HydrophobicContact CB-CD1 4.25Å; N198-I202 WeakPolarHBondContact O-CG1 3.48Å; N198-I202 PolarHBondContact O-N 2.91Å
199K88.4Confident90Very high110 Ų11060.4 Ų60.448%0.47830%0.298SS..Hα-helixtrans-55-43-175.5-170.4171-172.7166.70113.2E196 I201 I202 D203E196-K199 VanDerWaalsContact O-CB 3.3Å; E196-K199 WeakPolarHBondContact O-CB 3.17Å; E196-K199 PolarHBondContact O-N 2.97Å; E196-K199 VanDerWaalsContact O-N 3.17Å; E196-K199 IonicContact OE2-NZ 3.59Å; K199-I201 VanDerWaalsContact C-N 3.33Å; K199-I201 PolarHBondContact O-N 3.39Å; K199-I202 PolarHBondContact O-N 3.47Å; K199-D203 PolarHBondContact O-N 2.97Å
200Q91.3Very high89.8Confident109 Ų10955.7 Ų55.751%0.50928%0.278SS..Hα-helixtrans-58.9-42.9176.1-173.1-173.224.800112.5N198 L204N198-Q200 VanDerWaalsContact C-N 3.3Å; N198-Q200 PolarHBondContact O-N 3.11Å; Q200-L204 HydrophobicContact CG-CD1 4.33Å; Q200-L204 VanDerWaalsContact O-CG 3.28Å; Q200-L204 WeakPolarHBondContact O-CG 3.46Å; Q200-L204 PolarHBondContact O-N 2.73Å; Q200-L204 VanDerWaalsContact O-N 3.14Å
201I92.4Very high89.9Confident4 Ų457.9 Ų57.92%0.02128%0.278CS..Hα-helixtrans-65.6-47.5177.4-68.3170000109.2R158 F161 L162 L165 L188 L191 N198 K199 D203 L204 L205R158-I201 HydrophobicContact CG-CD1 4.46Å; F161-I201 HydrophobicContact CE1-CG2 3.99Å; L162-I201 HydrophobicContact CD1-CG1 3.84Å; L165-I201 HydrophobicContact CD2-CG2 4.36Å; L188-I201 HydrophobicContact CD2-CG2 4.37Å; L191-I201 HydrophobicContact CD1-CD1 3.94Å; L191-I201 HydrophobicContact CD1-CG2 4.14Å; N198-I201 WeakPolarHBondContact O-CB 3.42Å; N198-I201 PolarHBondContact O-N 3.5Å; K199-I201 VanDerWaalsContact C-N 3.33Å; K199-I201 PolarHBondContact O-N 3.39Å; I201-D203 VanDerWaalsContact C-N 3.34Å; I201-D203 PolarHBondContact O-N 3.27Å; I201-L204 PolarHBondContact O-N 2.89Å; I201-L204 VanDerWaalsContact O-N 3.16Å; I201-L205 HydrophobicContact CG2-CD1 4.02Å; I201-L205 HydrophobicContact CG2-CG 4.13Å; I201-L205 VanDerWaalsContact O-CG 3.27Å; I201-L205 WeakPolarHBondContact O-CG 3.31Å; I201-L205 PolarHBondContact O-N 3.43Å
202I92.3Very high90Very high16 Ų1660 Ų608%0.08229%0.292CS..Hα-helixtrans-56.7-47.2-179.9-66.5168.5000111.1Y193 N198 K199 L204 L205 L206 W230 F234Y193-I202 HydrophobicContact CD2-CD1 3.95Å; Y193-I202 HydrophobicContact CE2-CD1 4.31Å; Y193-I202 HydrophobicContact CE2-CG2 4.47Å; Y193-I202 VanDerWaalsContact O-CD1 3.25Å; Y193-I202 WeakPolarHBondContact O-CD1 3.43Å; N198-I202 HydrophobicContact CB-CD1 4.25Å; N198-I202 WeakPolarHBondContact O-CG1 3.48Å; N198-I202 PolarHBondContact O-N 2.91Å; K199-I202 PolarHBondContact O-N 3.47Å; I202-L204 PolarHBondContact O-N 3.09Å; I202-L205 WeakPolarHBondContact O-CB 3.37Å; I202-L205 PolarHBondContact O-N 3.13Å; I202-L206 PolarHBondContact O-N 3.17Å; I202-W230 HydrophobicContact CD1-CH2 4.5Å; I202-W230 HydrophobicContact CG1-CH2 3.97Å; I202-W230 HydrophobicContact CG1-CZ3 4.36Å; I202-F234 HydrophobicContact CG2-CD2 4.39Å; I202-F234 HydrophobicContact CG2-CE2 3.81Å
203D92.4Very high90.3Very high79 Ų7957.2 Ų57.242%0.42228%0.284SS..Hα-helixtrans-60.4-45.8177.5-70.9-22.8000111.1K199 I201 L205 L206 Q207K199-D203 PolarHBondContact O-N 2.97Å; I201-D203 VanDerWaalsContact C-N 3.34Å; I201-D203 PolarHBondContact O-N 3.27Å; D203-L205 VanDerWaalsContact C-N 3.34Å; D203-L205 PolarHBondContact O-N 3.41Å; D203-L206 PolarHBondContact O-N 3.14Å; D203-Q207 WeakPolarHBondContact O-CG 3.47Å; D203-Q207 PolarHBondContact O-N 2.84Å
204L94.7Very high90.7Very high22 Ų2254.8 Ų54.812%0.11527%0.274CS..Hα-helixtrans-65.5-33.5177.3-70.9172.7000112.9L162 L165 Q166 F169 Q200 I201 I202 Q207 C208L162-L204 HydrophobicContact CD1-CD1 4.03Å; L165-L204 HydrophobicContact CD1-CB 4.46Å; L165-L204 HydrophobicContact CD2-CB 3.44Å; L165-L204 VanDerWaalsContact CD2-CB 3.44Å; L165-L204 HydrophobicContact CD2-CD1 4.14Å; L165-L204 HydrophobicContact CD2-CG 4.45Å; L165-L204 HydrophobicContact CG-CB 3.77Å; L165-L204 HydrophobicContact CG-CD1 4.23Å; Q166-L204 HydrophobicContact CG-CD1 3.84Å; F169-L204 HydrophobicContact CD2-CD2 4Å; F169-L204 HydrophobicContact CE2-CB 4.23Å; F169-L204 HydrophobicContact CE2-CD2 3.86Å; F169-L204 WeakPolarHBondContact CZ-O 3.13Å; Q200-L204 HydrophobicContact CG-CD1 4.33Å; Q200-L204 VanDerWaalsContact O-CG 3.28Å; Q200-L204 WeakPolarHBondContact O-CG 3.46Å; Q200-L204 PolarHBondContact O-N 2.73Å; Q200-L204 VanDerWaalsContact O-N 3.14Å; I201-L204 PolarHBondContact O-N 2.89Å; I201-L204 VanDerWaalsContact O-N 3.16Å; I202-L204 PolarHBondContact O-N 3.09Å; L204-Q207 WeakPolarHBondContact O-CB 2.93Å; L204-Q207 PolarHBondContact O-N 2.98Å; L204-C208 PolarHBondContact O-N 2.88Å; L204-C208 PolarHBondContact O-SG 3.22Å
205L95.9Very high91.2Very high0 Ų049.7 Ų49.70%024%0.243CC..Hα-helixtrans-64.2-44.5174.3-69.8176.9000111.2F161 L165 L188 I201 I202 D203 Q207 C208 F223 L227 W230 F234F161-L205 HydrophobicContact CE1-CD2 4.34Å; F161-L205 HydrophobicContact CZ-CD2 4Å; L165-L205 HydrophobicContact CD2-CD2 4.11Å; L165-L205 HydrophobicContact CD2-CG 4.38Å; L188-L205 HydrophobicContact CD1-CD1 4.21Å; L188-L205 HydrophobicContact CD1-CD2 4.3Å; L188-L205 HydrophobicContact CD2-CD1 3.94Å; I201-L205 HydrophobicContact CG2-CD1 4.02Å; I201-L205 HydrophobicContact CG2-CG 4.13Å; I201-L205 VanDerWaalsContact O-CG 3.27Å; I201-L205 WeakPolarHBondContact O-CG 3.31Å; I201-L205 PolarHBondContact O-N 3.43Å; I202-L205 WeakPolarHBondContact O-CB 3.37Å; I202-L205 PolarHBondContact O-N 3.13Å; D203-L205 VanDerWaalsContact C-N 3.34Å; D203-L205 PolarHBondContact O-N 3.41Å; L205-Q207 VanDerWaalsContact C-N 3.26Å; L205-Q207 PolarHBondContact O-N 3.33Å; L205-C208 VanDerWaalsContact O-CB 3.29Å; L205-C208 WeakPolarHBondContact O-CB 3.35Å; L205-C208 PolarHBondContact O-N 2.85Å; L205-F223 HydrophobicContact CD2-CE1 4.07Å; L205-F223 HydrophobicContact CD2-CZ 3.62Å; L205-L227 HydrophobicContact CB-CD1 4.38Å; L205-L227 HydrophobicContact CD1-CD2 4.31Å; L205-L227 HydrophobicContact CD2-CD1 4.26Å; L205-L227 HydrophobicContact CD2-CD2 4.04Å; L205-W230 HydrophobicContact CD1-CE3 4.33Å; L205-W230 HydrophobicContact CD1-CH2 4.32Å; L205-W230 HydrophobicContact CD1-CZ3 3.89Å; L205-F234 HydrophobicContact CB-CE1 4.49Å; L205-F234 HydrophobicContact CB-CZ 3.9Å; L205-F234 HydrophobicContact CD1-CZ 4.48Å
206L94.8Very high91.4Very high24 Ų2453.9 Ų53.913%0.12625%0.254CS..Hα-helixtrans-61.6-38.8173.8-68.1174.6000111I202 D203 C208 F209 F234 L237 I238I202-L206 PolarHBondContact O-N 3.17Å; D203-L206 PolarHBondContact O-N 3.14Å; L206-C208 PolarHBondContact O-N 2.89Å; L206-C208 VanDerWaalsContact O-N 3.16Å; L206-F209 WeakPolarHBondContact O-CB 3.48Å; L206-F209 PolarHBondContact O-N 3.05Å; L206-F234 HydrophobicContact CD1-CE2 4.34Å; L206-F234 HydrophobicContact CD2-CD2 4.48Å; L206-F234 HydrophobicContact CD2-CE2 3.59Å; L206-F234 HydrophobicContact CD2-CZ 3.64Å; L206-F234 HydrophobicContact CG-CE2 3.77Å; L206-F234 HydrophobicContact CG-CZ 3.92Å; L206-L237 HydrophobicContact CD1-CB 4.12Å; L206-L237 HydrophobicContact CD1-CD1 4.47Å; L206-L237 HydrophobicContact CD2-CB 3.8Å; L206-I238 HydrophobicContact CD2-CG1 4.15Å
207Q93.5Very high91.8Very high70 Ų7049.5 Ų49.533%0.32724%0.235SC..Hα-helixtrans-61.3-25.5178.1-71.1-172.137.800113.9F169 D203 L204 L205 F209 H210F169-Q207 HydrophobicContact CE1-CB 3.72Å; F169-Q207 HydrophobicContact CZ-CB 3.64Å; D203-Q207 WeakPolarHBondContact O-CG 3.47Å; D203-Q207 PolarHBondContact O-N 2.84Å; L204-Q207 WeakPolarHBondContact O-CB 2.93Å; L204-Q207 PolarHBondContact O-N 2.98Å; L205-Q207 VanDerWaalsContact C-N 3.26Å; L205-Q207 PolarHBondContact O-N 3.33Å; Q207-F209 PolarHBondContact O-N 3.02Å; Q207-H210 WeakPolarHBondContact CA-CD2 3.42Å; Q207-H210 WeakPolarHBondContact CA-NE2 3.33Å; Q207-H210 WeakPolarHBondContact CB-NE2 3.31Å; Q207-H210 WeakPolarHBondContact CG-NE2 3.41Å; Q207-H210 PolarHBondContact O-CD2 3.25Å; Q207-H210 PolarHBondContact O-CE1 2.86Å; Q207-H210 VanDerWaalsContact O-CE1 3.24Å; Q207-H210 PolarHBondContact O-N 3.4Å; Q207-H210 PolarHBondContact O-ND1 3.45Å; Q207-H210 PolarHBondContact O-NE2 2.85Å
208C95Very high92.4Very high0 Ų046.5 Ų46.50%023%0.225CC..Hα-helixtrans-61-30.9176.2-62.20000111.9L165 L204 L205 L206 H210 R211 L224L165-C208 VanDerWaalsContact CD1-SG 3.6Å; L204-C208 PolarHBondContact O-N 2.88Å; L204-C208 PolarHBondContact O-SG 3.22Å; L205-C208 VanDerWaalsContact O-CB 3.29Å; L205-C208 WeakPolarHBondContact O-CB 3.35Å; L205-C208 PolarHBondContact O-N 2.85Å; L206-C208 PolarHBondContact O-N 2.89Å; L206-C208 VanDerWaalsContact O-N 3.16Å; C208-H210 PolarHBondContact O-N 3.05Å; C208-R211 PolarHBondContact O-N 2.93Å; C208-L224 HydrophobicContact CB-CD2 3.62Å
209F93.5Very high92.8Very high0 Ų047.9 Ų47.90%023%0.232CC..THydrogen-bonded Turntrans-73.7-8.7-179.7-73-82.4000114.5L206 Q207 I215 L224 L227 F228 I238 T241 I242 Y249 I260L206-F209 WeakPolarHBondContact O-CB 3.48Å; L206-F209 PolarHBondContact O-N 3.05Å; Q207-F209 PolarHBondContact O-N 3.02Å; F209-I215 WeakPolarHBondContact O-CD1 3.29Å; F209-L224 HydrophobicContact CD1-CD1 4.36Å; F209-L224 HydrophobicContact CD1-CD2 3.94Å; F209-L224 HydrophobicContact CD2-CD2 3.97Å; F209-L224 HydrophobicContact CE1-CB 3.84Å; F209-L224 HydrophobicContact CE1-CD1 4.43Å; F209-L224 HydrophobicContact CE1-CD2 3.79Å; F209-L224 HydrophobicContact CE1-CG 4.22Å; F209-L224 HydrophobicContact CE2-CD2 3.81Å; F209-L224 HydrophobicContact CG-CD2 4.05Å; F209-L224 HydrophobicContact CZ-CB 4.05Å; F209-L224 HydrophobicContact CZ-CD2 3.73Å; F209-L224 HydrophobicContact CZ-CG 4.45Å; F209-L227 HydrophobicContact CE2-CB 4.37Å; F209-L227 HydrophobicContact CE2-CD1 3.68Å; F209-L227 HydrophobicContact CZ-CB 4.24Å; F209-L227 HydrophobicContact CZ-CD1 4.12Å; F209-F228 AromaticContact CE1-CE2 3.82Å; F209-F228 HydrophobicContact CE1-CE2 3.82Å; F209-F228 HydrophobicContact CE1-CZ 4.49Å; F209-F228 HydrophobicContact CZ-CD2 4.47Å; F209-F228 HydrophobicContact CZ-CE2 4.03Å; F209-I238 HydrophobicContact CD1-CG2 3.89Å; F209-I238 HydrophobicContact CD2-CG1 4.28Å; F209-I238 HydrophobicContact CD2-CG2 4.05Å; F209-I238 HydrophobicContact CE1-CG2 3.55Å; F209-I238 HydrophobicContact CE2-CB 4.28Å; F209-I238 HydrophobicContact CE2-CD1 3.9Å; F209-I238 HydrophobicContact CE2-CG1 3.64Å; F209-I238 HydrophobicContact CE2-CG2 3.73Å; F209-I238 HydrophobicContact CG-CG2 4.11Å; F209-I238 HydrophobicContact CZ-CB 4.36Å; F209-I238 HydrophobicContact CZ-CD1 3.84Å; F209-I238 HydrophobicContact CZ-CG1 3.96Å; F209-I238 HydrophobicContact CZ-CG2 3.46Å; F209-I238 VanDerWaalsContact CZ-CG2 3.46Å; F209-T241 HydrophobicContact CB-CG2 4.4Å; F209-I242 HydrophobicContact CB-CG1 4.07Å; F209-I242 HydrophobicContact CD1-CD1 3.71Å; F209-I242 HydrophobicContact CD1-CG1 4.12Å; F209-I242 HydrophobicContact CE1-CD1 4.25Å; F209-I242 HydrophobicContact CG-CD1 4.39Å; F209-I242 HydrophobicContact CG-CG1 4.38Å; F209-Y249 PolarHBondContact O-OH 2.8Å; F209-I260 HydrophobicContact CE1-CG2 4.46Å
210H86.6Confident93.1Very high48 Ų4842.6 Ų42.622%0.22221%0.209CC..THydrogen-bonded Turntrans-110.31.4174.568.464.4000113.7Q207 C208 P212 Q245Q207-H210 WeakPolarHBondContact CA-CD2 3.42Å; Q207-H210 WeakPolarHBondContact CA-NE2 3.33Å; Q207-H210 WeakPolarHBondContact CB-NE2 3.31Å; Q207-H210 WeakPolarHBondContact CG-NE2 3.41Å; Q207-H210 PolarHBondContact O-CD2 3.25Å; Q207-H210 PolarHBondContact O-CE1 2.86Å; Q207-H210 VanDerWaalsContact O-CE1 3.24Å; Q207-H210 PolarHBondContact O-N 3.4Å; Q207-H210 PolarHBondContact O-ND1 3.45Å; Q207-H210 PolarHBondContact O-NE2 2.85Å; C208-H210 PolarHBondContact O-N 3.05Å; H210-P212 WeakPolarHBondContact O-CD 3.38Å; H210-Q245 HydrophobicContact CB-CG 3.92Å
211R89.8Confident93.4Very high101 Ų10138 Ų3838%0.38119%0.187SC..  trans-96.5117.2179.1-67.6-60.7-179.1-179.60110.9F169 C208 T213 H214 I215F169-R211 HydrophobicContact CD1-CG 3.72Å; F169-R211 HydrophobicContact CE1-CG 3.47Å; F169-R211 VanDerWaalsContact CE1-CG 3.47Å; C208-R211 PolarHBondContact O-N 2.93Å; R211-T213 PolarHBondContact O-N 2.97Å; R211-T213 VanDerWaalsContact O-N 3.11Å; R211-H214 HydrophobicContact CB-CB 4.39Å; R211-H214 PolarHBondContact O-N 2.76Å; R211-H214 VanDerWaalsContact O-N 3.11Å; R211-I215 PolarHBondContact O-N 2.93Å; R211-I215 VanDerWaalsContact O-N 3.16Å
212P91.1Very high93.6Very high59 Ų5943.3 Ų43.338%0.38321%0.207SC..Hα-helixtrans-58-28.9178.4-26.435000113.9H210 R216 L253H210-P212 WeakPolarHBondContact O-CD 3.38Å; P212-R216 VanDerWaalsContact O-CB 3.27Å; P212-R216 WeakPolarHBondContact O-CB 3.48Å; P212-R216 VanDerWaalsContact O-CG 3.23Å; P212-R216 WeakPolarHBondContact O-CG 3.32Å; P212-R216 PolarHBondContact O-N 3.22Å; P212-L253 HydrophobicContact CB-CD1 4.25Å; P212-L253 HydrophobicContact CB-CD2 4.5Å; P212-L253 HydrophobicContact CG-CD2 4.23Å
213T91.6Very high93.8Very high65 Ų6542.6 Ų42.640%0.39920%0.204SC..Hα-helixtrans-63-43.6177.145.80000112.2P174 R211 N217P174-T213 HydrophobicContact CG-CG2 4.07Å; R211-T213 PolarHBondContact O-N 2.97Å; R211-T213 VanDerWaalsContact O-N 3.11Å; T213-N217 WeakPolarHBondContact O-CB 3.46Å; T213-N217 PolarHBondContact O-N 2.97Å
214H93.6Very high94Very high0 Ų038.9 Ų38.90%018%0.183CC..Hα-helixtrans-69.5-45.1175.7-80.1-89.6000111.8S168 R211 R216 G220 L224S168-H214 PolarHBondContact OG-CE1 3.43Å; S168-H214 PolarHBondContact OG-NE2 2.88Å; R211-H214 HydrophobicContact CB-CB 4.39Å; R211-H214 PolarHBondContact O-N 2.76Å; R211-H214 VanDerWaalsContact O-N 3.11Å; H214-R216 PolarHBondContact O-N 3.2Å; H214-G220 CarbonylContact O-C 3.26Å; H214-G220 WeakPolarHBondContact O-CA 3.34Å; H214-L224 HydrophobicContact CB-CD1 4.42Å
215I94.4Very high94.2Very high0 Ų038.1 Ų38.10%018%0.18CC..Hα-helixtrans-67.9-35.1-176.3-64.1160.5000112.6F209 R211 K221 L224 L253 H256 I257 I260F209-I215 WeakPolarHBondContact O-CD1 3.29Å; R211-I215 PolarHBondContact O-N 2.93Å; R211-I215 VanDerWaalsContact O-N 3.16Å; I215-K221 WeakPolarHBondContact O-CE 3.37Å; I215-K221 WeakPolarHBondContact O-CG 3.45Å; I215-L224 HydrophobicContact CG1-CD1 4.09Å; I215-L253 HydrophobicContact CB-CD1 3.83Å; I215-L253 HydrophobicContact CD1-CD1 4.03Å; I215-L253 HydrophobicContact CD1-CD2 4.19Å; I215-L253 HydrophobicContact CD1-CG 4.21Å; I215-L253 HydrophobicContact CG2-CD1 3.51Å; I215-L253 HydrophobicContact CG2-CG 4.25Å; I215-H256 HydrophobicContact CG2-CB 3.47Å; I215-H256 VanDerWaalsContact CG2-CB 3.47Å; I215-I257 HydrophobicContact CD1-CD1 3.87Å; I215-I257 HydrophobicContact CG1-CD1 4.06Å; I215-I257 HydrophobicContact CG2-CD1 4.03Å; I215-I257 HydrophobicContact CG2-CG1 4.42Å; I215-I260 HydrophobicContact CG2-CD1 4.07Å
216R93.3Very high94.2Very high120 Ų12039.4 Ų39.445%0.45319%0.185SC..Hα-helixtrans-83.3-32.8-177.3-69.7176.6-180-177.31.4113P212 H214 L253P212-R216 VanDerWaalsContact O-CB 3.27Å; P212-R216 WeakPolarHBondContact O-CB 3.48Å; P212-R216 VanDerWaalsContact O-CG 3.23Å; P212-R216 WeakPolarHBondContact O-CG 3.32Å; P212-R216 PolarHBondContact O-N 3.22Å; H214-R216 PolarHBondContact O-N 3.2Å; R216-L253 HydrophobicContact CG-CD1 4.21Å
217N93.9Very high94.3Very high50 Ų5038.2 Ų38.227%0.26718%0.179SC..SBendtrans-71.7139.3-178.5-178.9-75.1000111.3I178 T213 D219 G220 K221I178-N217 HydrophobicContact CD1-CB 4.48Å; T213-N217 WeakPolarHBondContact O-CB 3.46Å; T213-N217 PolarHBondContact O-N 2.97Å; N217-D219 PolarHBondContact OD1-N 3.4Å; N217-G220 PolarHBondContact O-N 2.97Å; N217-G220 PolarHBondContact OD1-N 2.86Å; N217-K221 WeakPolarHBondContact O-CG 3.3Å; N217-K221 PolarHBondContact O-N 3.22Å
218D94.7Very high94.4Very high94 Ų9435 Ų3550%0.50316%0.164SC..Hα-helixtrans-69.1-39-176.3-77.6-34.8000114.2G220 K221 R222D218-G220 VanDerWaalsContact C-N 3.34Å; D218-K221 PolarHBondContact O-N 3.33Å; D218-K221 IonicContact OD1-NZ 2.97Å; D218-R222 WeakPolarHBondContact O-CG 3.37Å; D218-R222 PolarHBondContact O-N 2.65Å
219D95.3Very high94.4Very high34 Ų3437.8 Ų37.818%0.18218%0.184CC..Hα-helixtrans-70-35.6172.9-72.9-30.6000110.9I178 W182 N217 R222 F223I178-D219 HydrophobicContact CG2-CB 4.42Å; W182-D219 HydrophobicContact CB-CB 4.13Å; W182-D219 HydrophobicContact CG-CB 4.37Å; N217-D219 PolarHBondContact OD1-N 3.4Å; D219-R222 WeakPolarHBondContact O-CB 3.36Å; D219-R222 PolarHBondContact O-N 3.27Å; D219-R222 IonicContact OD1-CZ 2.98Å; D219-R222 IonicContact OD1-NH1 3.05Å; D219-R222 PolarHBondContact OD1-NH1 2.99Å; D219-F223 WeakPolarHBondContact O-CB 3.39Å; D219-F223 PolarHBondContact O-N 3.42Å
220G96.2Very high94.4Very high0 Ų039.4 Ų39.40%019%0.19CC..Hα-helixtrans-58-47.7169.900000112.1I178 H214 N217 D218 R222 F223 L224I178-G220 VanDerWaalsContact CG2-CA 3.46Å; I178-G220 VanDerWaalsContact CG2-N 3.32Å; H214-G220 CarbonylContact O-C 3.26Å; H214-G220 WeakPolarHBondContact O-CA 3.34Å; N217-G220 PolarHBondContact O-N 2.97Å; N217-G220 PolarHBondContact OD1-N 2.86Å; D218-G220 VanDerWaalsContact C-N 3.34Å; G220-R222 PolarHBondContact O-N 3.45Å; G220-F223 WeakPolarHBondContact O-CB 3.44Å; G220-F223 PolarHBondContact O-N 3.47Å; G220-L224 VanDerWaalsContact O-CG 3.28Å; G220-L224 WeakPolarHBondContact O-CG 3.39Å; G220-L224 PolarHBondContact O-N 3.44Å
221K95.8Very high94.8Very high11 Ų1139 Ų395%0.04819%0.189CC..Hα-helixtrans-60.8-42.7173.9-70.5175.6-165.2169.60112.2I215 N217 D218 F223 L224 V225 H256 E259 I260I215-K221 WeakPolarHBondContact O-CE 3.37Å; I215-K221 WeakPolarHBondContact O-CG 3.45Å; N217-K221 WeakPolarHBondContact O-CG 3.3Å; N217-K221 PolarHBondContact O-N 3.22Å; D218-K221 PolarHBondContact O-N 3.33Å; D218-K221 IonicContact OD1-NZ 2.97Å; K221-F223 VanDerWaalsContact C-N 3.29Å; K221-F223 PolarHBondContact O-N 3Å; K221-L224 PolarHBondContact O-N 3.07Å; K221-V225 VanDerWaalsContact O-CB 3.29Å; K221-V225 WeakPolarHBondContact O-CB 3.47Å; K221-V225 WeakPolarHBondContact O-CG2 3.43Å; K221-V225 PolarHBondContact O-N 3.47Å; K221-H256 PolarHBondContact NZ-ND1 3.34Å; K221-E259 IonicContact NZ-OE2 3.68Å; K221-E259 PolarHBondContact NZ-OE2 3.04Å; K221-I260 HydrophobicContact CB-CG1 4.37Å; K221-I260 HydrophobicContact CG-CD1 4.3Å; K221-I260 HydrophobicContact CG-CG1 4.14Å
222R96.4Very high95Very high117 Ų11736.2 Ų36.244%0.44218%0.184SC..Hα-helixtrans-59.7-43.9176.9-73.7170.8177.8170.8-4.9110.9W182 D218 D219 G220 V225 F226W182-R222 HydrophobicContact CD2-CB 3.92Å; W182-R222 HydrophobicContact CE3-CB 3.8Å; W182-R222 HydrophobicContact CH2-CB 3.9Å; W182-R222 HydrophobicContact CZ2-CB 4Å; W182-R222 VanDerWaalsContact CZ3-C 3.47Å; W182-R222 HydrophobicContact CZ3-CB 3.79Å; W182-R222 WeakPolarHBondContact CZ3-O 3.47Å; D218-R222 WeakPolarHBondContact O-CG 3.37Å; D218-R222 PolarHBondContact O-N 2.65Å; D219-R222 WeakPolarHBondContact O-CB 3.36Å; D219-R222 PolarHBondContact O-N 3.27Å; D219-R222 IonicContact OD1-CZ 2.98Å; D219-R222 IonicContact OD1-NH1 3.05Å; D219-R222 PolarHBondContact OD1-NH1 2.99Å; G220-R222 PolarHBondContact O-N 3.45Å; R222-V225 PolarHBondContact O-N 3.06Å; R222-F226 PolarHBondContact O-N 2.95Å
223F97.1Very high95Very high1 Ų138.4 Ų38.40%0.00419%0.192CC..Hα-helixtrans-62.7-51.6176.1-180-110.5000111.9F161 W182 H185 L188 L205 D219 G220 K221 V225 F226 L227F161-F223 AromaticContact CE2-CE2 3.96Å; F161-F223 HydrophobicContact CE2-CE2 3.96Å; F161-F223 HydrophobicContact CE2-CZ 4.1Å; F161-F223 HydrophobicContact CZ-CE2 4.12Å; F161-F223 AromaticContact CZ-CZ 3.87Å; F161-F223 HydrophobicContact CZ-CZ 3.87Å; W182-F223 HydrophobicContact CE3-CB 4.05Å; H185-F223 HydrophobicContact CB-CD2 4.06Å; H185-F223 HydrophobicContact CB-CE2 4.22Å; L188-F223 HydrophobicContact CD1-CE2 4.21Å; L188-F223 HydrophobicContact CD1-CZ 4.41Å; L205-F223 HydrophobicContact CD2-CE1 4.07Å; L205-F223 HydrophobicContact CD2-CZ 3.62Å; D219-F223 WeakPolarHBondContact O-CB 3.39Å; D219-F223 PolarHBondContact O-N 3.42Å; G220-F223 WeakPolarHBondContact O-CB 3.44Å; G220-F223 PolarHBondContact O-N 3.47Å; K221-F223 VanDerWaalsContact C-N 3.29Å; K221-F223 PolarHBondContact O-N 3Å; F223-V225 VanDerWaalsContact C-N 3.29Å; F223-V225 PolarHBondContact O-N 3.13Å; F223-F226 WeakPolarHBondContact O-CA 3.39Å; F223-F226 WeakPolarHBondContact O-CB 3.45Å; F223-F226 PolarHBondContact O-N 3.07Å; F223-L227 HydrophobicContact CD1-CD1 4.44Å; F223-L227 HydrophobicContact CE1-CD1 4.01Å; F223-L227 HydrophobicContact CE1-CD2 4.5Å; F223-L227 HydrophobicContact CE1-CG 4.45Å; F223-L227 HydrophobicContact CE2-CD2 4.3Å; F223-L227 HydrophobicContact CZ-CD1 4.37Å; F223-L227 HydrophobicContact CZ-CD2 4.06Å; F223-L227 HydrophobicContact CZ-CG 4.46Å; F223-L227 WeakPolarHBondContact O-CG 3.37Å; F223-L227 PolarHBondContact O-N 2.67Å; F223-L227 VanDerWaalsContact O-N 3.11Å
224L97.4Very high95.2Very high0 Ų035.3 Ų35.30%017%0.173CC..Hα-helixtrans-59.4-38.3177.2-66.9177.7000112.5C208 F209 H214 I215 G220 K221 F226 L227 F228 I260C208-L224 HydrophobicContact CB-CD2 3.62Å; F209-L224 HydrophobicContact CD1-CD1 4.36Å; F209-L224 HydrophobicContact CD1-CD2 3.94Å; F209-L224 HydrophobicContact CD2-CD2 3.97Å; F209-L224 HydrophobicContact CE1-CB 3.84Å; F209-L224 HydrophobicContact CE1-CD1 4.43Å; F209-L224 HydrophobicContact CE1-CD2 3.79Å; F209-L224 HydrophobicContact CE1-CG 4.22Å; F209-L224 HydrophobicContact CE2-CD2 3.81Å; F209-L224 HydrophobicContact CG-CD2 4.05Å; F209-L224 HydrophobicContact CZ-CB 4.05Å; F209-L224 HydrophobicContact CZ-CD2 3.73Å; F209-L224 HydrophobicContact CZ-CG 4.45Å; H214-L224 HydrophobicContact CB-CD1 4.42Å; I215-L224 HydrophobicContact CG1-CD1 4.09Å; G220-L224 VanDerWaalsContact O-CG 3.28Å; G220-L224 WeakPolarHBondContact O-CG 3.39Å; G220-L224 PolarHBondContact O-N 3.44Å; K221-L224 PolarHBondContact O-N 3.07Å; L224-F226 VanDerWaalsContact C-N 3.34Å; L224-L227 HydrophobicContact CD2-CD1 4.2Å; L224-L227 PolarHBondContact O-N 2.91Å; L224-F228 WeakPolarHBondContact O-CD2 3.49Å; L224-I260 HydrophobicContact CB-CD1 4.4Å; L224-I260 HydrophobicContact CB-CG2 4.29Å; L224-I260 HydrophobicContact CD1-CD1 3.74Å
225V97.6Very high95.3Very high7 Ų735.3 Ų35.34%0.04217%0.173CC..Hα-helixtrans-64-39.1173.9165.60000111.5K221 R222 F223 L227 F228 I260 R263 A264 K267K221-V225 VanDerWaalsContact O-CB 3.29Å; K221-V225 WeakPolarHBondContact O-CB 3.47Å; K221-V225 WeakPolarHBondContact O-CG2 3.43Å; K221-V225 PolarHBondContact O-N 3.47Å; R222-V225 PolarHBondContact O-N 3.06Å; F223-V225 VanDerWaalsContact C-N 3.29Å; F223-V225 PolarHBondContact O-N 3.13Å; V225-L227 VanDerWaalsContact C-N 3.31Å; V225-L227 PolarHBondContact O-N 3.16Å; V225-F228 PolarHBondContact O-N 3.23Å; V225-I260 HydrophobicContact CG2-CB 4.44Å; V225-I260 HydrophobicContact CG2-CG2 4.05Å; V225-R263 HydrophobicContact CG1-CB 4.22Å; V225-R263 HydrophobicContact CG2-CB 3.66Å; V225-A264 HydrophobicContact CG1-CB 4.4Å; V225-K267 HydrophobicContact CG1-CD 3.96Å
226F96.9Very high95.3Very high26 Ų2643.6 Ų43.611%0.11420%0.204CC..Hα-helixtrans-64.2-35176.4169.4-98.1000112.3W182 H185 L188 K189 R222 F223 L224 F228 S229W182-F226 HydrophobicContact CZ3-CB 4.02Å; H185-F226 HydrophobicContact CB-CD1 4.04Å; H185-F226 HydrophobicContact CB-CE1 4.1Å; H185-F226 AromaticContact CD2-CD1 3.99Å; H185-F226 AromaticContact CD2-CD2 3.73Å; H185-F226 AromaticContact CD2-CE1 3.9Å; H185-F226 AromaticContact CD2-CE2 3.65Å; H185-F226 AromaticContact CD2-CG 3.9Å; H185-F226 AromaticContact CD2-CZ 3.74Å; H185-F226 WeakPolarHBondContact O-CE1 3.24Å; L188-F226 HydrophobicContact CB-CE1 4.26Å; L188-F226 HydrophobicContact CD1-CD1 4.45Å; L188-F226 HydrophobicContact CD1-CE1 4Å; K189-F226 HydrophobicContact CG-CZ 4.49Å; R222-F226 PolarHBondContact O-N 2.95Å; F223-F226 WeakPolarHBondContact O-CA 3.39Å; F223-F226 WeakPolarHBondContact O-CB 3.45Å; F223-F226 PolarHBondContact O-N 3.07Å; L224-F226 VanDerWaalsContact C-N 3.34Å; F226-F228 PolarHBondContact O-N 3.48Å; F226-S229 WeakPolarHBondContact O-CA 3.47Å; F226-S229 PolarHBondContact O-N 2.95Å; F226-S229 PolarHBondContact O-OG 3.16Å
227L96.3Very high95.4Very high0 Ų040.1 Ų40.10%020%0.195CC..Hα-helixtrans-60.7-28.4179.4-63.3-179.1000113.5L188 L205 F209 F223 L224 V225 S229 W230 F234 I238L188-L227 HydrophobicContact CD1-CD2 3.39Å; L205-L227 HydrophobicContact CB-CD1 4.38Å; L205-L227 HydrophobicContact CD1-CD2 4.31Å; L205-L227 HydrophobicContact CD2-CD1 4.26Å; L205-L227 HydrophobicContact CD2-CD2 4.04Å; F209-L227 HydrophobicContact CE2-CB 4.37Å; F209-L227 HydrophobicContact CE2-CD1 3.68Å; F209-L227 HydrophobicContact CZ-CB 4.24Å; F209-L227 HydrophobicContact CZ-CD1 4.12Å; F223-L227 HydrophobicContact CD1-CD1 4.44Å; F223-L227 HydrophobicContact CE1-CD1 4.01Å; F223-L227 HydrophobicContact CE1-CD2 4.5Å; F223-L227 HydrophobicContact CE1-CG 4.45Å; F223-L227 HydrophobicContact CE2-CD2 4.3Å; F223-L227 HydrophobicContact CZ-CD1 4.37Å; F223-L227 HydrophobicContact CZ-CD2 4.06Å; F223-L227 HydrophobicContact CZ-CG 4.46Å; F223-L227 WeakPolarHBondContact O-CG 3.37Å; F223-L227 PolarHBondContact O-N 2.67Å; F223-L227 VanDerWaalsContact O-N 3.11Å; L224-L227 HydrophobicContact CD2-CD1 4.2Å; L224-L227 PolarHBondContact O-N 2.91Å; V225-L227 VanDerWaalsContact C-N 3.31Å; V225-L227 PolarHBondContact O-N 3.16Å; L227-S229 PolarHBondContact O-N 3.49Å; L227-W230 PolarHBondContact O-N 3.34Å; L227-F234 HydrophobicContact CB-CE1 4.29Å; L227-I238 HydrophobicContact CB-CD1 4.1Å
228F96.8Very high95.5Very high3 Ų337.8 Ų37.81%0.01318%0.182CC..THydrogen-bonded Turntrans-66.9-15.1172.4-79.6-89.5000114F209 L224 V225 F226 I235 I238 I260 Y261 A264 F272 I276F209-F228 AromaticContact CE1-CE2 3.82Å; F209-F228 HydrophobicContact CE1-CE2 3.82Å; F209-F228 HydrophobicContact CE1-CZ 4.49Å; F209-F228 HydrophobicContact CZ-CD2 4.47Å; F209-F228 HydrophobicContact CZ-CE2 4.03Å; L224-F228 WeakPolarHBondContact O-CD2 3.49Å; V225-F228 PolarHBondContact O-N 3.23Å; F226-F228 PolarHBondContact O-N 3.48Å; F228-I235 HydrophobicContact CD1-CG1 4.26Å; F228-I235 HydrophobicContact CD1-CG2 4.01Å; F228-I235 HydrophobicContact CE1-CG2 4.17Å; F228-I235 WeakPolarHBondContact O-CD1 3.18Å; F228-I238 HydrophobicContact CD2-CD1 4.41Å; F228-I238 HydrophobicContact CE1-CG2 3.98Å; F228-I238 HydrophobicContact CE2-CG2 3.84Å; F228-I238 HydrophobicContact CG-CD1 4.4Å; F228-I238 HydrophobicContact CZ-CB 4.41Å; F228-I238 HydrophobicContact CZ-CG2 3.42Å; F228-I238 VanDerWaalsContact CZ-CG2 3.42Å; F228-I260 HydrophobicContact CE2-CG2 3.92Å; F228-Y261 HydrophobicContact CE1-CD1 4.08Å; F228-Y261 AromaticContact CE1-CE1 3.66Å; F228-Y261 HydrophobicContact CE1-CE1 3.66Å; F228-Y261 AromaticContact CZ-CD1 3.95Å; F228-Y261 HydrophobicContact CZ-CD1 3.95Å; F228-Y261 AromaticContact CZ-CE1 3.58Å; F228-Y261 HydrophobicContact CZ-CE1 3.58Å; F228-A264 HydrophobicContact CB-CB 3.75Å; F228-A264 HydrophobicContact CD1-CB 4.26Å; F228-A264 HydrophobicContact CD2-CB 3.66Å; F228-A264 HydrophobicContact CE2-CB 4.3Å; F228-A264 HydrophobicContact CG-CB 3.63Å; F228-F272 WeakPolarHBondContact O-CD1 3.43Å; F228-I276 HydrophobicContact CB-CD1 4.18Å; F228-I276 HydrophobicContact CD1-CD1 4.14Å; F228-I276 HydrophobicContact CD1-CG1 4.03Å
229S94.5Very high95.6Very high58 Ų5833.7 Ų33.741%0.40616%0.16SC..THydrogen-bonded Turntrans-106.36.3177.861.50000113.4F226 L227F226-S229 WeakPolarHBondContact O-CA 3.47Å; F226-S229 PolarHBondContact O-N 2.95Å; F226-S229 PolarHBondContact O-OG 3.16Å; L227-S229 PolarHBondContact O-N 3.49Å
230W94.1Very high95.7Very high33 Ų3333.3 Ų33.313%0.12516%0.164CC..THydrogen-bonded Turntrans-82.4-50.7-176.4177.744.1000112.6L188 L191 Y193 I202 L205 L227 F234L188-W230 HydrophobicContact CB-CG 4.41Å; L188-W230 PolarHBondContact O-NE1 3.31Å; L191-W230 HydrophobicContact CB-CZ2 4.21Å; Y193-W230 HydrophobicContact CD2-CH2 4.12Å; Y193-W230 HydrophobicContact CD2-CZ3 4.13Å; I202-W230 HydrophobicContact CD1-CH2 4.5Å; I202-W230 HydrophobicContact CG1-CH2 3.97Å; I202-W230 HydrophobicContact CG1-CZ3 4.36Å; L205-W230 HydrophobicContact CD1-CE3 4.33Å; L205-W230 HydrophobicContact CD1-CH2 4.32Å; L205-W230 HydrophobicContact CD1-CZ3 3.89Å; L227-W230 PolarHBondContact O-N 3.34Å; W230-F234 HydrophobicContact CE3-CB 4.42Å; W230-F234 AromaticContact CE3-CD1 3.64Å; W230-F234 HydrophobicContact CE3-CD1 3.64Å; W230-F234 AromaticContact CE3-CE1 3.96Å; W230-F234 HydrophobicContact CE3-CE1 3.96Å; W230-F234 AromaticContact CE3-CG 3.94Å; W230-F234 HydrophobicContact CE3-CG 3.94Å; W230-F234 HydrophobicContact CZ3-CD1 4.07Å; W230-F234 HydrophobicContact CZ3-CD2 4.17Å; W230-F234 HydrophobicContact CZ3-CE1 4.19Å; W230-F234 HydrophobicContact CZ3-CE2 4.32Å; W230-F234 HydrophobicContact CZ3-CG 4.06Å; W230-F234 HydrophobicContact CZ3-CZ 4.32Å
231N93.9Very high95.6Very high40 Ų4034.7 Ų34.721%0.21417%0.173CC..  trans-151.4140.9178.1176.1-80000109.7Y193 D233 F234Y193-N231 HydrophobicContact CG-CB 4.38Å; N231-D233 WeakPolarHBondContact OD1-CA 3.45Å; N231-D233 WeakPolarHBondContact OD1-CB 2.96Å; N231-D233 PolarHBondContact OD1-N 3.01Å; N231-F234 HydrophobicContact CB-CB 3.99Å; N231-F234 WeakPolarHBondContact O-CB 3.48Å; N231-F234 PolarHBondContact O-N 3.05Å; N231-F234 PolarHBondContact OD1-N 3.37Å; N231-F234 VanDerWaalsContact OD1-N 3.14Å
232V93.7Very high95.6Very high43 Ų4334.2 Ų34.226%0.26117%0.17SC..Hα-helixtrans-65.6-44.2-175.4176.50000111.7F234 I235 D271 F272 T275V232-F234 VanDerWaalsContact C-N 3.25Å; V232-F234 PolarHBondContact O-N 3.26Å; V232-I235 WeakPolarHBondContact O-CB 3.35Å; V232-I235 PolarHBondContact O-N 3.46Å; V232-D271 HydrophobicContact CG2-CB 4.33Å; V232-F272 HydrophobicContact CG2-CD1 3.89Å; V232-F272 HydrophobicContact CG2-CD2 4.41Å; V232-F272 HydrophobicContact CG2-CE1 3.77Å; V232-F272 HydrophobicContact CG2-CE2 4.31Å; V232-F272 HydrophobicContact CG2-CG 4.21Å; V232-F272 HydrophobicContact CG2-CZ 4Å; V232-T275 HydrophobicContact CG1-CG2 4.02Å; V232-T275 VanDerWaalsContact CG1-OG1 3.31Å; V232-T275 WeakPolarHBondContact CG1-OG1 3.25Å
233D92.3Very high95.5Very high105 Ų10532.1 Ų32.156%0.56117%0.165SC*.Hα-helixtrans-66.2-31.2178.8-58.2-43.5000111.6Y193 N231 I235 W236Y193-D233 HydrophobicContact CE1-CB 3.85Å; N231-D233 WeakPolarHBondContact OD1-CA 3.45Å; N231-D233 WeakPolarHBondContact OD1-CB 2.96Å; N231-D233 PolarHBondContact OD1-N 3.01Å; D233-I235 VanDerWaalsContact C-N 3.25Å; D233-I235 PolarHBondContact O-N 2.74Å; D233-W236 WeakPolarHBondContact O-CB 3.39Å; D233-W236 PolarHBondContact O-N 3Å
234F94.3Very high95.3Very high0 Ų037.9 Ų37.90%020%0.195CC..Hα-helixtrans-64.8-27.8177.1-166.7-118.4000113Y193 I202 L205 L206 L227 W230 N231 V232 W236 L237 I238Y193-F234 HydrophobicContact CD2-CD2 4.4Å; Y193-F234 HydrophobicContact CE2-CB 4.2Å; Y193-F234 AromaticContact CE2-CD2 3.8Å; Y193-F234 HydrophobicContact CE2-CD2 3.8Å; Y193-F234 HydrophobicContact CE2-CG 4.42Å; I202-F234 HydrophobicContact CG2-CD2 4.39Å; I202-F234 HydrophobicContact CG2-CE2 3.81Å; L205-F234 HydrophobicContact CB-CE1 4.49Å; L205-F234 HydrophobicContact CB-CZ 3.9Å; L205-F234 HydrophobicContact CD1-CZ 4.48Å; L206-F234 HydrophobicContact CD1-CE2 4.34Å; L206-F234 HydrophobicContact CD2-CD2 4.48Å; L206-F234 HydrophobicContact CD2-CE2 3.59Å; L206-F234 HydrophobicContact CD2-CZ 3.64Å; L206-F234 HydrophobicContact CG-CE2 3.77Å; L206-F234 HydrophobicContact CG-CZ 3.92Å; L227-F234 HydrophobicContact CB-CE1 4.29Å; W230-F234 HydrophobicContact CE3-CB 4.42Å; W230-F234 AromaticContact CE3-CD1 3.64Å; W230-F234 HydrophobicContact CE3-CD1 3.64Å; W230-F234 AromaticContact CE3-CE1 3.96Å; W230-F234 HydrophobicContact CE3-CE1 3.96Å; W230-F234 AromaticContact CE3-CG 3.94Å; W230-F234 HydrophobicContact CE3-CG 3.94Å; W230-F234 HydrophobicContact CZ3-CD1 4.07Å; W230-F234 HydrophobicContact CZ3-CD2 4.17Å; W230-F234 HydrophobicContact CZ3-CE1 4.19Å; W230-F234 HydrophobicContact CZ3-CE2 4.32Å; W230-F234 HydrophobicContact CZ3-CG 4.06Å; W230-F234 HydrophobicContact CZ3-CZ 4.32Å; N231-F234 HydrophobicContact CB-CB 3.99Å; N231-F234 WeakPolarHBondContact O-CB 3.48Å; N231-F234 PolarHBondContact O-N 3.05Å; N231-F234 PolarHBondContact OD1-N 3.37Å; N231-F234 VanDerWaalsContact OD1-N 3.14Å; V232-F234 VanDerWaalsContact C-N 3.25Å; V232-F234 PolarHBondContact O-N 3.26Å; F234-W236 PolarHBondContact O-N 2.93Å; F234-L237 HydrophobicContact CD2-CB 4.36Å; F234-L237 HydrophobicContact CD2-CD1 4.06Å; F234-L237 HydrophobicContact CE2-CD1 4.47Å; F234-L237 PolarHBondContact O-N 3.04Å; F234-I238 HydrophobicContact CD1-CD1 3.62Å; F234-I238 HydrophobicContact CD1-CG1 3.95Å; F234-I238 HydrophobicContact CE1-CD1 3.71Å; F234-I238 HydrophobicContact CE1-CG1 3.8Å; F234-I238 HydrophobicContact CZ-CG1 4.3Å; F234-I238 WeakPolarHBondContact O-CG1 3.32Å; F234-I238 PolarHBondContact O-N 3.39Å
235I96.6Very high95Very high0 Ų041 Ų410%021%0.21CC..Hα-helixtrans-57.3-40.1176-63.5166.8000110.8F228 V232 D233 L237 I238 H239 F272 T275 I276 C280F228-I235 HydrophobicContact CD1-CG1 4.26Å; F228-I235 HydrophobicContact CD1-CG2 4.01Å; F228-I235 HydrophobicContact CE1-CG2 4.17Å; F228-I235 WeakPolarHBondContact O-CD1 3.18Å; V232-I235 WeakPolarHBondContact O-CB 3.35Å; V232-I235 PolarHBondContact O-N 3.46Å; D233-I235 VanDerWaalsContact C-N 3.25Å; D233-I235 PolarHBondContact O-N 2.74Å; I235-L237 PolarHBondContact O-N 3.21Å; I235-I238 PolarHBondContact O-N 2.82Å; I235-H239 PolarHBondContact O-N 3.11Å; I235-F272 HydrophobicContact CD1-CD1 4.05Å; I235-T275 HydrophobicContact CB-CG2 4.14Å; I235-T275 HydrophobicContact CD1-CG2 3.88Å; I235-T275 HydrophobicContact CG2-CG2 4.1Å; I235-I276 HydrophobicContact CD1-CG1 4.09Å; I235-I276 HydrophobicContact CG2-CG1 4.22Å; I235-C280 VanDerWaalsContact CG2-SG 3.56Å
236W94.6Very high94.7Very high173 Ų17340.9 Ų40.966%0.65521%0.209SC*.Hα-helixtrans-64.1-42.1-179.9-173.382.5000111.6D233 F234 H239 G240D233-W236 WeakPolarHBondContact O-CB 3.39Å; D233-W236 PolarHBondContact O-N 3Å; F234-W236 PolarHBondContact O-N 2.93Å; W236-H239 PolarHBondContact O-N 2.86Å; W236-G240 PolarHBondContact O-N 3.42Å
237L95.1Very high94.5Very high48 Ų4844.8 Ų44.825%0.25123%0.228SC..Hα-helixtrans-65.3-40.5176-64.4177.4000112Y193 L206 F234 I235 H239 T241Y193-L237 HydrophobicContact CE2-CD1 4.36Å; Y193-L237 VanDerWaalsContact OH-CD1 3.23Å; Y193-L237 WeakPolarHBondContact OH-CD1 3.4Å; L206-L237 HydrophobicContact CD1-CB 4.12Å; L206-L237 HydrophobicContact CD1-CD1 4.47Å; L206-L237 HydrophobicContact CD2-CB 3.8Å; F234-L237 HydrophobicContact CD2-CB 4.36Å; F234-L237 HydrophobicContact CD2-CD1 4.06Å; F234-L237 HydrophobicContact CE2-CD1 4.47Å; F234-L237 PolarHBondContact O-N 3.04Å; I235-L237 PolarHBondContact O-N 3.21Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 2.72Å; L237-T241 WeakPolarHBondContact O-CB 3.49Å; L237-T241 PolarHBondContact O-N 3.48Å; L237-T241 PolarHBondContact O-OG1 2.94Å
238I96.4Very high94.2Very high0 Ų051.8 Ų51.80%026%0.258CS..Hα-helixtrans-58.7-49.1174-66.2168.8000110L206 F209 L227 F228 F234 I235 T241 I242L206-I238 HydrophobicContact CD2-CG1 4.15Å; F209-I238 HydrophobicContact CD1-CG2 3.89Å; F209-I238 HydrophobicContact CD2-CG1 4.28Å; F209-I238 HydrophobicContact CD2-CG2 4.05Å; F209-I238 HydrophobicContact CE1-CG2 3.55Å; F209-I238 HydrophobicContact CE2-CB 4.28Å; F209-I238 HydrophobicContact CE2-CD1 3.9Å; F209-I238 HydrophobicContact CE2-CG1 3.64Å; F209-I238 HydrophobicContact CE2-CG2 3.73Å; F209-I238 HydrophobicContact CG-CG2 4.11Å; F209-I238 HydrophobicContact CZ-CB 4.36Å; F209-I238 HydrophobicContact CZ-CD1 3.84Å; F209-I238 HydrophobicContact CZ-CG1 3.96Å; F209-I238 HydrophobicContact CZ-CG2 3.46Å; F209-I238 VanDerWaalsContact CZ-CG2 3.46Å; L227-I238 HydrophobicContact CB-CD1 4.1Å; F228-I238 HydrophobicContact CD2-CD1 4.41Å; F228-I238 HydrophobicContact CE1-CG2 3.98Å; F228-I238 HydrophobicContact CE2-CG2 3.84Å; F228-I238 HydrophobicContact CG-CD1 4.4Å; F228-I238 HydrophobicContact CZ-CB 4.41Å; F228-I238 HydrophobicContact CZ-CG2 3.42Å; F228-I238 VanDerWaalsContact CZ-CG2 3.42Å; F234-I238 HydrophobicContact CD1-CD1 3.62Å; F234-I238 HydrophobicContact CD1-CG1 3.95Å; F234-I238 HydrophobicContact CE1-CD1 3.71Å; F234-I238 HydrophobicContact CE1-CG1 3.8Å; F234-I238 HydrophobicContact CZ-CG1 4.3Å; F234-I238 WeakPolarHBondContact O-CG1 3.32Å; F234-I238 PolarHBondContact O-N 3.39Å; I235-I238 PolarHBondContact O-N 2.82Å; I238-T241 WeakPolarHBondContact O-CB 3.23Å; I238-T241 PolarHBondContact O-N 3.39Å; I238-I242 HydrophobicContact CG2-CD1 3.84Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.92Å
239H97.1Very high93.8Very high9 Ų952.2 Ų52.24%0.04226%0.26CS..Hα-helixtrans-64.8-44.8-178-176.356.2000112.7I235 W236 L237 T241 I242 K243 Y261 T279 C280 D283 F284I235-H239 PolarHBondContact O-N 3.11Å; W236-H239 PolarHBondContact O-N 2.86Å; L237-H239 VanDerWaalsContact C-N 3.34Å; L237-H239 PolarHBondContact O-N 2.72Å; H239-T241 VanDerWaalsContact C-N 3.32Å; H239-T241 PolarHBondContact O-N 3.27Å; H239-I242 PolarHBondContact O-N 3.04Å; H239-K243 VanDerWaalsContact NE2-CD 3.29Å; H239-K243 WeakPolarHBondContact NE2-CD 3.43Å; H239-K243 WeakPolarHBondContact O-CG 3.39Å; H239-K243 PolarHBondContact O-N 2.9Å; H239-Y261 WeakPolarHBondContact CA-OH 3.37Å; H239-Y261 AromaticContact ND1-CZ 3.83Å; H239-Y261 PolarHBondContact ND1-OH 3.36Å; H239-T279 PolarHBondContact CD2-O 3.25Å; H239-T279 VanDerWaalsContact CD2-O 3.28Å; H239-T279 PolarHBondContact NE2-O 2.98Å; H239-C280 VanDerWaalsContact CB-SG 3.59Å; H239-D283 IonicContact CE1-OD2 3.58Å; H239-D283 IonicContact NE2-OD2 2.6Å; H239-D283 PolarHBondContact NE2-OD2 2.91Å; H239-D283 VanDerWaalsContact NE2-OD2 3.12Å; H239-F284 AromaticContact CE1-CD2 3.86Å; H239-F284 AromaticContact CE1-CE1 4Å; H239-F284 AromaticContact CE1-CE2 3.45Å; H239-F284 VanDerWaalsContact CE1-CE2 3.45Å; H239-F284 WeakPolarHBondContact CE1-CE2 3.27Å; H239-F284 AromaticContact CE1-CZ 3.53Å; H239-F284 AromaticContact ND1-CE2 3.66Å; H239-F284 AromaticContact ND1-CZ 3.78Å
240G95.8Very high93.5Very high26 Ų2655.5 Ų55.527%0.26827%0.269SS..Hα-helixtrans-58-43.4173.300000112.4W236 I242 K243 N244W236-G240 PolarHBondContact O-N 3.42Å; G240-I242 PolarHBondContact O-N 2.85Å; G240-K243 PolarHBondContact O-N 2.83Å; G240-N244 VanDerWaalsContact O-CG 3.26Å; G240-N244 PolarHBondContact O-N 2.84Å; G240-N244 PolarHBondContact O-ND2 3.4Å
241T95.1Very high93Very high29 Ų2960.9 Ų60.918%0.17829%0.293CS..Hα-helixtrans-60.4-47.8176.8-59.30000111.5F209 L237 I238 H239 K243 N244 Q245F209-T241 HydrophobicContact CB-CG2 4.4Å; L237-T241 WeakPolarHBondContact O-CB 3.49Å; L237-T241 PolarHBondContact O-N 3.48Å; L237-T241 PolarHBondContact O-OG1 2.94Å; I238-T241 WeakPolarHBondContact O-CB 3.23Å; I238-T241 PolarHBondContact O-N 3.39Å; H239-T241 VanDerWaalsContact C-N 3.32Å; H239-T241 PolarHBondContact O-N 3.27Å; T241-K243 PolarHBondContact O-N 3.41Å; T241-N244 PolarHBondContact O-N 3.08Å; T241-Q245 VanDerWaalsContact O-CG 3.29Å; T241-Q245 WeakPolarHBondContact O-CG 3.44Å; T241-Q245 PolarHBondContact O-N 3.38Å
242I95.4Very high92.8Very high0 Ų062.8 Ų62.80%031%0.306CS..Hα-helixtrans-64.1-41.7179-69168.2000111.2F209 I238 H239 G240 Q245 L246 Y249 I257 Y261 F284F209-I242 HydrophobicContact CB-CG1 4.07Å; F209-I242 HydrophobicContact CD1-CD1 3.71Å; F209-I242 HydrophobicContact CD1-CG1 4.12Å; F209-I242 HydrophobicContact CE1-CD1 4.25Å; F209-I242 HydrophobicContact CG-CD1 4.39Å; F209-I242 HydrophobicContact CG-CG1 4.38Å; I238-I242 HydrophobicContact CG2-CD1 3.84Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.92Å; H239-I242 PolarHBondContact O-N 3.04Å; G240-I242 PolarHBondContact O-N 2.85Å; I242-Q245 PolarHBondContact O-N 3.33Å; I242-L246 PolarHBondContact O-N 2.88Å; I242-L246 VanDerWaalsContact O-N 3.09Å; I242-Y249 HydrophobicContact CG2-CE2 4.43Å; I242-I257 HydrophobicContact CG2-CG2 3.86Å; I242-Y261 HydrophobicContact CD1-CE2 3.66Å; I242-Y261 WeakPolarHBondContact CD1-OH 3.28Å; I242-Y261 HydrophobicContact CG2-CE2 4.25Å; I242-F284 HydrophobicContact CG2-CZ 4.41Å
243K94.4Very high92.6Very high74 Ų7461 Ų6132%0.32230%0.296SS..Hα-helixtrans-61.6-46.4178.7-79.7179.962.8169.20112.1H239 G240 T241 Q245 L246 D283 F284H239-K243 VanDerWaalsContact NE2-CD 3.29Å; H239-K243 WeakPolarHBondContact NE2-CD 3.43Å; H239-K243 WeakPolarHBondContact O-CG 3.39Å; H239-K243 PolarHBondContact O-N 2.9Å; G240-K243 PolarHBondContact O-N 2.83Å; T241-K243 PolarHBondContact O-N 3.41Å; K243-Q245 PolarHBondContact O-N 3.32Å; K243-L246 WeakPolarHBondContact O-CB 3.46Å; K243-L246 PolarHBondContact O-N 2.85Å; K243-D283 WeakPolarHBondContact CD-OD2 3.39Å; K243-D283 WeakPolarHBondContact CE-OD2 3.34Å; K243-D283 IonicContact NZ-OD1 3.8Å; K243-D283 PolarHBondContact NZ-OD1 3Å; K243-D283 IonicContact NZ-OD2 2.77Å; K243-D283 PolarHBondContact NZ-OD2 3.44Å; K243-F284 HydrophobicContact CG-CE1 4.06Å; K243-F284 HydrophobicContact CG-CZ 4.32Å
244N92.8Very high92.6Very high122 Ų12256 Ų5665%0.65227%0.269SS*.Hα-helixtrans-62.5-24.8179.3-70.2-15.8000112.9G240 T241G240-N244 VanDerWaalsContact O-CG 3.26Å; G240-N244 PolarHBondContact O-N 2.84Å; G240-N244 PolarHBondContact O-ND2 3.4Å; T241-N244 PolarHBondContact O-N 3.08Å
245Q91.4Very high92.5Very high65 Ų6558.5 Ų58.530%0.30428%0.284SS..Hα-helixtrans-97.5-9-178.9-62.7-60.6-42.600113.7H210 T241 I242 K243 E247 F248 Y249H210-Q245 HydrophobicContact CB-CG 3.92Å; T241-Q245 VanDerWaalsContact O-CG 3.29Å; T241-Q245 WeakPolarHBondContact O-CG 3.44Å; T241-Q245 PolarHBondContact O-N 3.38Å; I242-Q245 PolarHBondContact O-N 3.33Å; K243-Q245 PolarHBondContact O-N 3.32Å; Q245-E247 PolarHBondContact O-N 3.28Å; Q245-F248 PolarHBondContact O-N 2.93Å; Q245-Y249 HydrophobicContact CB-CD1 4.44Å; Q245-Y249 HydrophobicContact CB-CE1 3.61Å; Q245-Y249 HydrophobicContact CB-CE2 4.41Å; Q245-Y249 WeakPolarHBondContact CB-OH 3.49Å; Q245-Y249 VanDerWaalsContact O-CD1 3.32Å; Q245-Y249 WeakPolarHBondContact O-CD1 3.42Å; Q245-Y249 PolarHBondContact O-N 2.79Å
246L91.5Very high92.5Very high4 Ų460.9 Ų60.92%0.02130%0.295CS..G310 helixtrans-62-32.3-170.1-165.363.2000112.5I242 K243 F248 Y249 F284 V297 K300 V301 I304I242-L246 PolarHBondContact O-N 2.88Å; I242-L246 VanDerWaalsContact O-N 3.09Å; K243-L246 WeakPolarHBondContact O-CB 3.46Å; K243-L246 PolarHBondContact O-N 2.85Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 2.71Å; L246-Y249 HydrophobicContact CD1-CD2 3.97Å; L246-Y249 PolarHBondContact O-N 3.48Å; L246-F284 HydrophobicContact CD2-CE1 4.36Å; L246-V297 HydrophobicContact CB-CG1 4.01Å; L246-V297 HydrophobicContact CD2-CB 4.12Å; L246-V297 HydrophobicContact CD2-CG1 4.38Å; L246-V297 HydrophobicContact CG-CB 4.32Å; L246-V297 HydrophobicContact CG-CG1 4.13Å; L246-K300 HydrophobicContact CD1-CB 4.11Å; L246-K300 HydrophobicContact CD1-CD 4.47Å; L246-K300 HydrophobicContact CD2-CB 4.46Å; L246-K300 HydrophobicContact CG-CB 4.16Å; L246-K300 HydrophobicContact CG-CD 4.29Å; L246-K300 WeakPolarHBondContact O-CD 3.4Å; L246-K300 WeakPolarHBondContact O-CE 3.32Å; L246-K300 PolarHBondContact O-NZ 2.96Å; L246-V301 HydrophobicContact CD2-CG2 3.44Å; L246-V301 VanDerWaalsContact CD2-CG2 3.44Å; L246-I304 HydrophobicContact CD1-CD1 4.02Å
247E92.3Very high92.5Very high108 Ų10852.7 Ų52.751%0.50526%0.264SS..G310 helixtrans-61.5-35.5176.2-178.2167.7-170.900112.4Q245 P296 V297 K300Q245-E247 PolarHBondContact O-N 3.28Å; E247-P296 HydrophobicContact CG-CB 4.14Å; E247-P296 HydrophobicContact CG-CG 3.98Å; E247-P296 WeakPolarHBondContact OE1-CG 3.42Å; E247-V297 HydrophobicContact CB-CG1 3.84Å; E247-K300 VanDerWaalsContact C-NZ 3.28Å; E247-K300 PolarHBondContact O-NZ 3.03Å
248F90.6Very high92.5Very high147 Ų14750.4 Ų50.465%0.64525%0.252SS*.G310 helixtrans-86.8-11.4-177.6-51.9-69.4000113.1Q245 L246Q245-F248 PolarHBondContact O-N 2.93Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 2.71Å
249Y88.2Confident92.5Very high13 Ų1351.9 Ų51.95%0.05126%0.259CS..  trans-71.9138.2-179.9-69.8-5.3000113F209 I242 Q245 L246 L253 I257 K300F209-Y249 PolarHBondContact O-OH 2.8Å; I242-Y249 HydrophobicContact CG2-CE2 4.43Å; Q245-Y249 HydrophobicContact CB-CD1 4.44Å; Q245-Y249 HydrophobicContact CB-CE1 3.61Å; Q245-Y249 HydrophobicContact CB-CE2 4.41Å; Q245-Y249 WeakPolarHBondContact CB-OH 3.49Å; Q245-Y249 VanDerWaalsContact O-CD1 3.32Å; Q245-Y249 WeakPolarHBondContact O-CD1 3.42Å; Q245-Y249 PolarHBondContact O-N 2.79Å; L246-Y249 HydrophobicContact CD1-CD2 3.97Å; L246-Y249 PolarHBondContact O-N 3.48Å; Y249-L253 HydrophobicContact CD1-CD2 3.66Å; Y249-L253 HydrophobicContact CD2-CD2 4.44Å; Y249-L253 HydrophobicContact CE1-CD2 4.05Å; Y249-L253 HydrophobicContact CG-CD2 3.89Å; Y249-L253 HydrophobicContact CG-CG 4.48Å; Y249-I257 HydrophobicContact CD2-CG1 4.21Å; Y249-I257 HydrophobicContact CE2-CD1 4.22Å; Y249-I257 HydrophobicContact CE2-CG1 3.87Å; Y249-K300 WeakPolarHBondContact O-CE 3.21Å; Y249-K300 PolarHBondContact O-NZ 3.44Å
250Q87.6Confident92.6Very high127 Ų12751.5 Ų51.559%0.59326%0.257SS*.  trans-71.2153.2164.4-65.4177.8-12.100110.4T252 L253 A254Q250-T252 PolarHBondContact O-N 3.12Å; Q250-T252 VanDerWaalsContact O-N 3.17Å; Q250-L253 WeakPolarHBondContact O-CB 3.49Å; Q250-L253 PolarHBondContact O-N 3.35Å; Q250-A254 PolarHBondContact O-N 3.14Å
251K84.5Confident92.7Very high145 Ų14550.3 Ų50.363%0.6324%0.244SC*.Hα-helixtrans-57.2-32.4-178.8-165.3179.5-179.9-179.80113.8T255 Q303K251-T255 PolarHBondContact O-OG1 3.41Å; K251-Q303 PolarHBondContact O-NE2 3.1Å; K251-Q303 PolarHBondContact O-OE1 3.15Å
252T88.9Confident92.8Very high80 Ų8050 Ų5049%0.49124%0.241SC..Hα-helixtrans-68.6-40.7175.450.20000111.8Q250 A254 T255Q250-T252 PolarHBondContact O-N 3.12Å; Q250-T252 VanDerWaalsContact O-N 3.17Å; T252-A254 PolarHBondContact O-N 2.95Å; T252-T255 VanDerWaalsContact O-CB 3.32Å; T252-T255 WeakPolarHBondContact O-CB 3.21Å; T252-T255 PolarHBondContact O-N 3Å; T252-T255 VanDerWaalsContact O-N 3.14Å
253L90.9Very high92.9Very high7 Ų754.2 Ų54.24%0.03726%0.257CS..Hα-helixtrans-65.6-38.3178.9-165.166000111.9P212 I215 R216 Y249 Q250 T255 H256 I257P212-L253 HydrophobicContact CB-CD1 4.25Å; P212-L253 HydrophobicContact CB-CD2 4.5Å; P212-L253 HydrophobicContact CG-CD2 4.23Å; I215-L253 HydrophobicContact CB-CD1 3.83Å; I215-L253 HydrophobicContact CD1-CD1 4.03Å; I215-L253 HydrophobicContact CD1-CD2 4.19Å; I215-L253 HydrophobicContact CD1-CG 4.21Å; I215-L253 HydrophobicContact CG2-CD1 3.51Å; I215-L253 HydrophobicContact CG2-CG 4.25Å; R216-L253 HydrophobicContact CG-CD1 4.21Å; Y249-L253 HydrophobicContact CD1-CD2 3.66Å; Y249-L253 HydrophobicContact CD2-CD2 4.44Å; Y249-L253 HydrophobicContact CE1-CD2 4.05Å; Y249-L253 HydrophobicContact CG-CD2 3.89Å; Y249-L253 HydrophobicContact CG-CG 4.48Å; Q250-L253 WeakPolarHBondContact O-CB 3.49Å; Q250-L253 PolarHBondContact O-N 3.35Å; L253-T255 PolarHBondContact O-N 3.35Å; L253-H256 WeakPolarHBondContact O-CB 3.34Å; L253-H256 PolarHBondContact O-N 3.4Å; L253-I257 PolarHBondContact O-N 3Å
254A91.4Very high93Very high0 Ų050.8 Ų50.80%024%0.242CC..Hα-helixtrans-58.5-30174.100000113Q250 T252 I257 A258 K300Q250-A254 PolarHBondContact O-N 3.14Å; T252-A254 PolarHBondContact O-N 2.95Å; A254-I257 PolarHBondContact O-N 3.34Å; A254-A258 PolarHBondContact O-N 2.64Å; A254-K300 HydrophobicContact CB-CB 4.28Å
255T92.3Very high93.3Very high52 Ų5245.2 Ų45.232%0.31921%0.212SC..Hα-helixtrans-67.7-40.6175.2-49.40000111.5K251 T252 L253 A258 E259 Q303K251-T255 PolarHBondContact O-OG1 3.41Å; T252-T255 VanDerWaalsContact O-CB 3.32Å; T252-T255 WeakPolarHBondContact O-CB 3.21Å; T252-T255 PolarHBondContact O-N 3Å; T252-T255 VanDerWaalsContact O-N 3.14Å; L253-T255 PolarHBondContact O-N 3.35Å; T255-A258 WeakPolarHBondContact O-CB 3.08Å; T255-A258 PolarHBondContact O-N 3.4Å; T255-E259 PolarHBondContact O-N 3.16Å; T255-Q303 PolarHBondContact OG1-NE2 3.3Å
256H95.3Very high93.5Very high50 Ų5049.1 Ų49.123%0.23123%0.228CC..Hα-helixtrans-68.5-36.3175.6-65.4-54.8000112.1I215 K221 L253 E259 I260I215-H256 HydrophobicContact CG2-CB 3.47Å; I215-H256 VanDerWaalsContact CG2-CB 3.47Å; K221-H256 PolarHBondContact NZ-ND1 3.34Å; L253-H256 WeakPolarHBondContact O-CB 3.34Å; L253-H256 PolarHBondContact O-N 3.4Å; H256-E259 IonicContact ND1-OE2 3.93Å; H256-E259 WeakPolarHBondContact O-CB 3.44Å; H256-E259 PolarHBondContact O-N 3.45Å; H256-I260 WeakPolarHBondContact O-CG1 3.38Å; H256-I260 PolarHBondContact O-N 3.04Å
257I95.7Very high93.6Very high1 Ų156 Ų561%0.00526%0.258CS..Hα-helixtrans-61.2-45.8171.6-67.7-59000111I215 I242 Y249 L253 A254 E259 I260 Y261 I304I215-I257 HydrophobicContact CD1-CD1 3.87Å; I215-I257 HydrophobicContact CG1-CD1 4.06Å; I215-I257 HydrophobicContact CG2-CD1 4.03Å; I215-I257 HydrophobicContact CG2-CG1 4.42Å; I242-I257 HydrophobicContact CG2-CG2 3.86Å; Y249-I257 HydrophobicContact CD2-CG1 4.21Å; Y249-I257 HydrophobicContact CE2-CD1 4.22Å; Y249-I257 HydrophobicContact CE2-CG1 3.87Å; L253-I257 PolarHBondContact O-N 3Å; A254-I257 PolarHBondContact O-N 3.34Å; I257-E259 VanDerWaalsContact C-N 3.26Å; I257-E259 PolarHBondContact O-N 3.32Å; I257-I260 HydrophobicContact CD1-CD1 4.31Å; I257-I260 PolarHBondContact O-N 2.87Å; I257-I260 VanDerWaalsContact O-N 3.14Å; I257-Y261 HydrophobicContact CG2-CD2 3.82Å; I257-Y261 HydrophobicContact CG2-CE2 3.82Å; I257-Y261 WeakPolarHBondContact O-CD2 3.46Å; I257-Y261 PolarHBondContact O-N 2.82Å; I257-I304 HydrophobicContact CG2-CD1 4.14Å
258A95.9Very high93.8Very high0 Ų051.5 Ų51.50%024%0.239CC..Hα-helixtrans-58.8-40.317600000111.9A254 T255 F262 I304 Y307A254-A258 PolarHBondContact O-N 2.64Å; T255-A258 WeakPolarHBondContact O-CB 3.08Å; T255-A258 PolarHBondContact O-N 3.4Å; A258-F262 WeakPolarHBondContact O-CB 3.41Å; A258-F262 PolarHBondContact O-N 2.97Å; A258-I304 HydrophobicContact CB-CB 4.26Å; A258-I304 HydrophobicContact CB-CG1 4.13Å; A258-I304 HydrophobicContact CB-CG2 4.26Å; A258-Y307 HydrophobicContact CB-CD1 4.08Å; A258-Y307 HydrophobicContact CB-CD2 4.09Å; A258-Y307 HydrophobicContact CB-CG 3.69Å
259E96.3Very high94Very high30 Ų3048.7 Ų48.714%0.1424%0.238CC..Hα-helixtrans-61.5-44.3173.6177.4173.9-147.800112.9K221 T255 H256 I257 F262 R263 Y307K221-E259 IonicContact NZ-OE2 3.68Å; K221-E259 PolarHBondContact NZ-OE2 3.04Å; T255-E259 PolarHBondContact O-N 3.16Å; H256-E259 IonicContact ND1-OE2 3.93Å; H256-E259 WeakPolarHBondContact O-CB 3.44Å; H256-E259 PolarHBondContact O-N 3.45Å; I257-E259 VanDerWaalsContact C-N 3.26Å; I257-E259 PolarHBondContact O-N 3.32Å; E259-F262 PolarHBondContact O-N 3.23Å; E259-R263 HydrophobicContact CG-CG 4.37Å; E259-R263 WeakPolarHBondContact O-CB 3.37Å; E259-R263 VanDerWaalsContact O-CG 3.29Å; E259-R263 WeakPolarHBondContact O-CG 3.39Å; E259-R263 PolarHBondContact O-N 3.42Å; E259-R263 IonicContact OE1-CZ 2.89Å; E259-R263 IonicContact OE1-NE 3.05Å; E259-R263 PolarHBondContact OE1-NE 3.29Å; E259-R263 VanDerWaalsContact OE1-NE 3.13Å; E259-R263 IonicContact OE1-NH2 3.6Å; E259-R263 PolarHBondContact OE1-NH2 3.23Å; E259-Y307 HydrophobicContact CB-CE1 4.24Å; E259-Y307 HydrophobicContact CB-CE2 4.39Å; E259-Y307 VanDerWaalsContact CB-OH 3.32Å; E259-Y307 WeakPolarHBondContact CB-OH 3.5Å; E259-Y307 WeakPolarHBondContact CG-OH 3.28Å
260I97.6Very high94.3Very high1 Ų150.4 Ų50.41%0.00526%0.26CS..Hα-helixtrans-60.9-50177.4-70.5161.8000110.2F209 I215 K221 L224 V225 F228 H256 I257 F262 R263 A264F209-I260 HydrophobicContact CE1-CG2 4.46Å; I215-I260 HydrophobicContact CG2-CD1 4.07Å; K221-I260 HydrophobicContact CB-CG1 4.37Å; K221-I260 HydrophobicContact CG-CD1 4.3Å; K221-I260 HydrophobicContact CG-CG1 4.14Å; L224-I260 HydrophobicContact CB-CD1 4.4Å; L224-I260 HydrophobicContact CB-CG2 4.29Å; L224-I260 HydrophobicContact CD1-CD1 3.74Å; V225-I260 HydrophobicContact CG2-CB 4.44Å; V225-I260 HydrophobicContact CG2-CG2 4.05Å; F228-I260 HydrophobicContact CE2-CG2 3.92Å; H256-I260 WeakPolarHBondContact O-CG1 3.38Å; H256-I260 PolarHBondContact O-N 3.04Å; I257-I260 HydrophobicContact CD1-CD1 4.31Å; I257-I260 PolarHBondContact O-N 2.87Å; I257-I260 VanDerWaalsContact O-N 3.14Å; I260-F262 PolarHBondContact O-N 3.14Å; I260-R263 PolarHBondContact O-N 3.21Å; I260-A264 VanDerWaalsContact O-CB 3.31Å; I260-A264 WeakPolarHBondContact O-CB 3.33Å; I260-A264 PolarHBondContact O-N 3.31Å
261Y97.9Very high94.7Very high1 Ų149.8 Ų49.80%0.00426%0.261CS..Hα-helixtrans-57.8-46.3177.2-88.3-71.9000112.6F228 H239 I242 I257 A264 W265 C280 F284F228-Y261 HydrophobicContact CE1-CD1 4.08Å; F228-Y261 AromaticContact CE1-CE1 3.66Å; F228-Y261 HydrophobicContact CE1-CE1 3.66Å; F228-Y261 AromaticContact CZ-CD1 3.95Å; F228-Y261 HydrophobicContact CZ-CD1 3.95Å; F228-Y261 AromaticContact CZ-CE1 3.58Å; F228-Y261 HydrophobicContact CZ-CE1 3.58Å; H239-Y261 WeakPolarHBondContact CA-OH 3.37Å; H239-Y261 AromaticContact ND1-CZ 3.83Å; H239-Y261 PolarHBondContact ND1-OH 3.36Å; I242-Y261 HydrophobicContact CD1-CE2 3.66Å; I242-Y261 WeakPolarHBondContact CD1-OH 3.28Å; I242-Y261 HydrophobicContact CG2-CE2 4.25Å; I257-Y261 HydrophobicContact CG2-CD2 3.82Å; I257-Y261 HydrophobicContact CG2-CE2 3.82Å; I257-Y261 WeakPolarHBondContact O-CD2 3.46Å; I257-Y261 PolarHBondContact O-N 2.82Å; Y261-A264 PolarHBondContact O-N 3.49Å; Y261-W265 WeakPolarHBondContact O-CB 3.27Å; Y261-W265 PolarHBondContact O-N 3.19Å; Y261-C280 HydrophobicContact CD1-CB 4.22Å; Y261-C280 HydrophobicContact CE1-CB 3.62Å; Y261-F284 HydrophobicContact CD2-CE2 4.11Å; Y261-F284 HydrophobicContact CE1-CE2 4.32Å; Y261-F284 AromaticContact CE2-CE2 3.53Å; Y261-F284 HydrophobicContact CE2-CE2 3.53Å; Y261-F284 HydrophobicContact CE2-CZ 4.06Å; Y261-F284 AromaticContact CZ-CE2 3.66Å
262F97.4Very high95.3Very high22 Ų2245.7 Ų45.710%0.09624%0.243CC..Hα-helixtrans-63.4-43.9179-178.6-95.6000112.1A258 E259 I260 W265 K266 Y307 F308 R311 V317A258-F262 WeakPolarHBondContact O-CB 3.41Å; A258-F262 PolarHBondContact O-N 2.97Å; E259-F262 PolarHBondContact O-N 3.23Å; I260-F262 PolarHBondContact O-N 3.14Å; F262-W265 HydrophobicContact CD2-CE3 4.27Å; F262-W265 HydrophobicContact CD2-CZ3 4.45Å; F262-W265 HydrophobicContact CE2-CE3 4.17Å; F262-W265 AromaticContact CE2-CZ3 3.9Å; F262-W265 HydrophobicContact CE2-CZ3 3.9Å; F262-W265 HydrophobicContact CZ-CZ3 4.42Å; F262-K266 HydrophobicContact CE1-CD 4.08Å; F262-K266 HydrophobicContact CZ-CD 4.42Å; F262-K266 VanDerWaalsContact O-CB 3.25Å; F262-K266 WeakPolarHBondContact O-CB 3.46Å; F262-K266 PolarHBondContact O-N 3.33Å; F262-Y307 HydrophobicContact CB-CD1 3.9Å; F262-Y307 HydrophobicContact CB-CE1 3.62Å; F262-Y307 HydrophobicContact CD1-CE1 4.32Å; F262-Y307 HydrophobicContact CG-CD1 4.32Å; F262-Y307 AromaticContact CG-CE1 3.98Å; F262-Y307 HydrophobicContact CG-CE1 3.98Å; F262-F308 HydrophobicContact CB-CE1 4.15Å; F262-F308 HydrophobicContact CB-CZ 4.21Å; F262-F308 AromaticContact CD2-CD1 3.72Å; F262-F308 HydrophobicContact CD2-CD1 3.72Å; F262-F308 AromaticContact CD2-CE1 3.73Å; F262-F308 HydrophobicContact CD2-CE1 3.73Å; F262-F308 HydrophobicContact CE2-CD1 4.41Å; F262-F308 HydrophobicContact CG-CE1 4.44Å; F262-R311 HydrophobicContact CE2-CB 4.37Å; F262-R311 HydrophobicContact CZ-CB 4.46Å; F262-V317 HydrophobicContact CE2-CG2 4.02Å; F262-V317 HydrophobicContact CZ-CG2 4.37Å
263R97.4Very high95.7Very high89 Ų8944.8 Ų44.834%0.33623%0.233SC..Hα-helixtrans-66.1-37.8177.9-73.4178.3-178.4-149.91.8111.8V225 E259 I260 K267V225-R263 HydrophobicContact CG1-CB 4.22Å; V225-R263 HydrophobicContact CG2-CB 3.66Å; E259-R263 HydrophobicContact CG-CG 4.37Å; E259-R263 WeakPolarHBondContact O-CB 3.37Å; E259-R263 VanDerWaalsContact O-CG 3.29Å; E259-R263 WeakPolarHBondContact O-CG 3.39Å; E259-R263 PolarHBondContact O-N 3.42Å; E259-R263 IonicContact OE1-CZ 2.89Å; E259-R263 IonicContact OE1-NE 3.05Å; E259-R263 PolarHBondContact OE1-NE 3.29Å; E259-R263 VanDerWaalsContact OE1-NE 3.13Å; E259-R263 IonicContact OE1-NH2 3.6Å; E259-R263 PolarHBondContact OE1-NH2 3.23Å; I260-R263 PolarHBondContact O-N 3.21Å; R263-K267 WeakPolarHBondContact O-CG 3.47Å; R263-K267 PolarHBondContact O-N 3.17Å
264A97.6Very high95.9Very high3 Ų349.8 Ų49.83%0.02526%0.256CS..Hα-helixtrans-64-53.3175.100000111.4V225 F228 I260 Y261 K266 K267 A268 I276V225-A264 HydrophobicContact CG1-CB 4.4Å; F228-A264 HydrophobicContact CB-CB 3.75Å; F228-A264 HydrophobicContact CD1-CB 4.26Å; F228-A264 HydrophobicContact CD2-CB 3.66Å; F228-A264 HydrophobicContact CE2-CB 4.3Å; F228-A264 HydrophobicContact CG-CB 3.63Å; I260-A264 VanDerWaalsContact O-CB 3.31Å; I260-A264 WeakPolarHBondContact O-CB 3.33Å; I260-A264 PolarHBondContact O-N 3.31Å; Y261-A264 PolarHBondContact O-N 3.49Å; A264-K266 VanDerWaalsContact C-N 3.33Å; A264-K266 PolarHBondContact O-N 3Å; A264-K267 PolarHBondContact O-N 3.35Å; A264-A268 WeakPolarHBondContact O-CB 3.19Å; A264-A268 PolarHBondContact O-N 2.96Å; A264-I276 HydrophobicContact CB-CD1 4.34Å
265W97.6Very high96.2Very high5 Ų551 Ų512%0.01926%0.263CS..Hα-helixtrans-57-44.8176.4169.776.1000112.3Y261 F262 K267 A268 I276 E277 I281 V317 M320Y261-W265 WeakPolarHBondContact O-CB 3.27Å; Y261-W265 PolarHBondContact O-N 3.19Å; F262-W265 HydrophobicContact CD2-CE3 4.27Å; F262-W265 HydrophobicContact CD2-CZ3 4.45Å; F262-W265 HydrophobicContact CE2-CE3 4.17Å; F262-W265 AromaticContact CE2-CZ3 3.9Å; F262-W265 HydrophobicContact CE2-CZ3 3.9Å; F262-W265 HydrophobicContact CZ-CZ3 4.42Å; W265-K267 VanDerWaalsContact C-N 3.26Å; W265-K267 PolarHBondContact O-N 3.01Å; W265-A268 PolarHBondContact O-N 3.32Å; W265-I276 HydrophobicContact CB-CG2 3.87Å; W265-E277 PolarHBondContact NE1-OE1 3.28Å; W265-I281 HydrophobicContact CB-CD1 4.04Å; W265-I281 HydrophobicContact CG-CD1 3.93Å; W265-V317 HydrophobicContact CH2-CB 4.42Å; W265-V317 HydrophobicContact CH2-CG2 3.81Å; W265-V317 HydrophobicContact CZ3-CG2 3.81Å; W265-M320 HydrophobicContact CH2-CB 4.37Å; W265-M320 HydrophobicContact CH2-CE 4.31Å; W265-M320 HydrophobicContact CZ2-CB 3.59Å; W265-M320 HydrophobicContact CZ2-CE 4.16Å; W265-M320 HydrophobicContact CZ2-CG 3.82Å
266K95.7Very high96.5Very high146 Ų14648.5 Ų48.564%0.63525%0.248SC*.Hα-helixtrans-64.2-28.6-178.9-174.8174.7-179.3179.80113.3F262 A264F262-K266 HydrophobicContact CE1-CD 4.08Å; F262-K266 HydrophobicContact CZ-CD 4.42Å; F262-K266 VanDerWaalsContact O-CB 3.25Å; F262-K266 WeakPolarHBondContact O-CB 3.46Å; F262-K266 PolarHBondContact O-N 3.33Å; A264-K266 VanDerWaalsContact C-N 3.33Å; A264-K266 PolarHBondContact O-N 3Å
267K95.5Very high96.6Very high149 Ų14946.8 Ų46.865%0.64824%0.24SC*.Hα-helixtrans-91.5-21.1179.4-75.6-174.9175-1710113.4V225 R263 A264 W265V225-K267 HydrophobicContact CG1-CD 3.96Å; R263-K267 WeakPolarHBondContact O-CG 3.47Å; R263-K267 PolarHBondContact O-N 3.17Å; A264-K267 PolarHBondContact O-N 3.35Å; W265-K267 VanDerWaalsContact C-N 3.26Å; W265-K267 PolarHBondContact O-N 3.01Å
268A95.9Very high96.5Very high14 Ų1449.3 Ų49.312%0.11626%0.258CS..  trans-74.3155-178.200000111.8A264 W265 F272 Q273 I276A264-A268 WeakPolarHBondContact O-CB 3.19Å; A264-A268 PolarHBondContact O-N 2.96Å; W265-A268 PolarHBondContact O-N 3.32Å; A268-F272 HydrophobicContact CB-CB 4.08Å; A268-Q273 HydrophobicContact CB-CB 3.97Å; A268-I276 HydrophobicContact CB-CD1 3.78Å
269S93.9Very high96.5Very high87 Ų8751.5 Ų51.561%0.60827%0.271SS*.  trans-144.8155.2175.257.10000110.2
270G95.5Very high96.5Very high50 Ų5050 Ų5052%0.51526%0.264SS..THydrogen-bonded Turntrans60.5-139.2-179.900000112.5F272 Q273 E274G270-F272 PolarHBondContact O-N 2.95Å; G270-F272 VanDerWaalsContact O-N 3.16Å; G270-Q273 WeakPolarHBondContact O-CB 3.39Å; G270-Q273 PolarHBondContact O-N 3.45Å; G270-E274 PolarHBondContact O-N 2.75Å; G270-E274 VanDerWaalsContact O-N 3.1Å
271D95.9Very high96.5Very high114 Ų11450.2 Ų50.261%0.6127%0.265SS*.Hα-helixtrans-56.8-33.3-174.4-56.1-11.7000113.4V232 T275V232-D271 HydrophobicContact CG2-CB 4.33Å; D271-T275 VanDerWaalsContact O-CB 3.23Å; D271-T275 WeakPolarHBondContact O-CB 3.48Å; D271-T275 PolarHBondContact O-N 2.96Å; D271-T275 PolarHBondContact O-OG1 3.1Å
272F96.4Very high96.5Very high59 Ų5952.1 Ų52.126%0.25927%0.274SS..Hα-helixtrans-64.8-44.6175.7-67.2-86.1000111.6F228 V232 I235 A268 G270 T275 I276F228-F272 WeakPolarHBondContact O-CD1 3.43Å; V232-F272 HydrophobicContact CG2-CD1 3.89Å; V232-F272 HydrophobicContact CG2-CD2 4.41Å; V232-F272 HydrophobicContact CG2-CE1 3.77Å; V232-F272 HydrophobicContact CG2-CE2 4.31Å; V232-F272 HydrophobicContact CG2-CG 4.21Å; V232-F272 HydrophobicContact CG2-CZ 4Å; I235-F272 HydrophobicContact CD1-CD1 4.05Å; A268-F272 HydrophobicContact CB-CB 4.08Å; G270-F272 PolarHBondContact O-N 2.95Å; G270-F272 VanDerWaalsContact O-N 3.16Å; F272-T275 PolarHBondContact O-N 3.19Å; F272-I276 VanDerWaalsContact O-CG1 3.24Å; F272-I276 WeakPolarHBondContact O-CG1 3.24Å; F272-I276 PolarHBondContact O-N 2.93Å
273Q97.1Very high96.5Very high61 Ų6152.8 Ų52.829%0.28528%0.279SS..Hα-helixtrans-66.9-45.8-179.7-172.5-179.728.500110.5A268 G270 T275 I276 E277A268-Q273 HydrophobicContact CB-CB 3.97Å; G270-Q273 WeakPolarHBondContact O-CB 3.39Å; G270-Q273 PolarHBondContact O-N 3.45Å; Q273-T275 VanDerWaalsContact C-N 3.29Å; Q273-T275 PolarHBondContact O-N 3.38Å; Q273-I276 PolarHBondContact O-N 2.97Å; Q273-E277 WeakPolarHBondContact O-CB 3.45Å; Q273-E277 WeakPolarHBondContact O-CG 3.26Å; Q273-E277 PolarHBondContact O-N 3.45Å
274E95.9Very high96.5Very high112 Ų11248.8 Ų48.852%0.52326%0.264SS..Hα-helixtrans-60.2-41177.4-178.9167-161.900111.8G270 E277 S278G270-E274 PolarHBondContact O-N 2.75Å; G270-E274 VanDerWaalsContact O-N 3.1Å; E274-E277 PolarHBondContact O-N 3.27Å; E274-S278 WeakPolarHBondContact O-CB 3.41Å; E274-S278 PolarHBondContact O-N 2.84Å; E274-S278 PolarHBondContact O-OG 3.49Å
275T97.4Very high96.5Very high24 Ų2448.7 Ų48.715%0.14726%0.263CS..Hα-helixtrans-65-46.5176.5-59.80000111.4V232 I235 D271 F272 Q273 E277 S278 T279V232-T275 HydrophobicContact CG1-CG2 4.02Å; V232-T275 VanDerWaalsContact CG1-OG1 3.31Å; V232-T275 WeakPolarHBondContact CG1-OG1 3.25Å; I235-T275 HydrophobicContact CB-CG2 4.14Å; I235-T275 HydrophobicContact CD1-CG2 3.88Å; I235-T275 HydrophobicContact CG2-CG2 4.1Å; D271-T275 VanDerWaalsContact O-CB 3.23Å; D271-T275 WeakPolarHBondContact O-CB 3.48Å; D271-T275 PolarHBondContact O-N 2.96Å; D271-T275 PolarHBondContact O-OG1 3.1Å; F272-T275 PolarHBondContact O-N 3.19Å; Q273-T275 VanDerWaalsContact C-N 3.29Å; Q273-T275 PolarHBondContact O-N 3.38Å; T275-E277 VanDerWaalsContact C-N 3.3Å; T275-E277 PolarHBondContact O-N 3.35Å; T275-S278 PolarHBondContact O-N 2.86Å; T275-T279 HydrophobicContact CG2-CG2 3.95Å; T275-T279 WeakPolarHBondContact O-CB 3.39Å; T275-T279 PolarHBondContact O-N 3.24Å; T275-T279 PolarHBondContact O-OG1 3.46Å
276I97.9Very high96.5Very high0 Ų052.5 Ų52.50%028%0.281CS..Iπ-helixtrans-60.9-40.9176.3-65.7165000111F228 I235 A264 W265 A268 F272 Q273 C280 I281F228-I276 HydrophobicContact CB-CD1 4.18Å; F228-I276 HydrophobicContact CD1-CD1 4.14Å; F228-I276 HydrophobicContact CD1-CG1 4.03Å; I235-I276 HydrophobicContact CD1-CG1 4.09Å; I235-I276 HydrophobicContact CG2-CG1 4.22Å; A264-I276 HydrophobicContact CB-CD1 4.34Å; W265-I276 HydrophobicContact CB-CG2 3.87Å; A268-I276 HydrophobicContact CB-CD1 3.78Å; F272-I276 VanDerWaalsContact O-CG1 3.24Å; F272-I276 WeakPolarHBondContact O-CG1 3.24Å; F272-I276 PolarHBondContact O-N 2.93Å; Q273-I276 PolarHBondContact O-N 2.97Å; I276-C280 VanDerWaalsContact O-CB 3.27Å; I276-C280 WeakPolarHBondContact O-CB 3.41Å; I276-C280 PolarHBondContact O-N 3.07Å; I276-I281 HydrophobicContact CG2-CD1 3.97Å; I276-I281 HydrophobicContact CG2-CG1 4.22Å; I276-I281 PolarHBondContact O-N 3.2Å
277E97.6Very high96.6Very high15 Ų1547.4 Ų47.47%0.0726%0.261CS..Iπ-helixtrans-62.6-56.1177.4-80.2-176.5-178.300112.3W265 Q273 E274 T275 Q282 M320 K323 L324W265-E277 PolarHBondContact NE1-OE1 3.28Å; Q273-E277 WeakPolarHBondContact O-CB 3.45Å; Q273-E277 WeakPolarHBondContact O-CG 3.26Å; Q273-E277 PolarHBondContact O-N 3.45Å; E274-E277 PolarHBondContact O-N 3.27Å; T275-E277 VanDerWaalsContact C-N 3.3Å; T275-E277 PolarHBondContact O-N 3.35Å; E277-Q282 WeakPolarHBondContact O-CB 3.32Å; E277-Q282 PolarHBondContact O-N 3Å; E277-M320 HydrophobicContact CG-CG 3.98Å; E277-K323 IonicContact OE2-NZ 3.67Å; E277-K323 PolarHBondContact OE2-NZ 3.21Å; E277-L324 HydrophobicContact CB-CD1 4.21Å; E277-L324 HydrophobicContact CB-CD2 4.14Å; E277-L324 HydrophobicContact CG-CD1 4.46Å; E277-L324 WeakPolarHBondContact O-CD1 3.38Å
278S94.6Very high96.7Very high53 Ų5340.3 Ų40.337%0.37123%0.23SC..Iπ-helixtrans-76.7-42.7-172.2580000113.3E274 T275E274-S278 WeakPolarHBondContact O-CB 3.41Å; E274-S278 PolarHBondContact O-N 2.84Å; E274-S278 PolarHBondContact O-OG 3.49Å; T275-S278 PolarHBondContact O-N 2.86Å
279T94.4Very high96.7Very high46 Ų4639.8 Ų39.828%0.28223%0.225SC..Iπ-helixtrans-90.3-27.5-173.169.60000113.7H239 T275 D283H239-T279 PolarHBondContact CD2-O 3.25Å; H239-T279 VanDerWaalsContact CD2-O 3.28Å; H239-T279 PolarHBondContact NE2-O 2.98Å; T275-T279 HydrophobicContact CG2-CG2 3.95Å; T275-T279 WeakPolarHBondContact O-CB 3.39Å; T275-T279 PolarHBondContact O-N 3.24Å; T275-T279 PolarHBondContact O-OG1 3.46Å; T279-D283 WeakPolarHBondContact O-CB 3.34Å
280C97.6Very high96.9Very high0 Ų039.9 Ų39.90%022%0.218CC..Iπ-helixtrans-110.3-60.9-174.1-56.40000112.6I235 H239 Y261 I276 D283 F284I235-C280 VanDerWaalsContact CG2-SG 3.56Å; H239-C280 VanDerWaalsContact CB-SG 3.59Å; Y261-C280 HydrophobicContact CD1-CB 4.22Å; Y261-C280 HydrophobicContact CE1-CB 3.62Å; I276-C280 VanDerWaalsContact O-CB 3.27Å; I276-C280 WeakPolarHBondContact O-CB 3.41Å; I276-C280 PolarHBondContact O-N 3.07Å; C280-D283 PolarHBondContact O-N 2.95Å; C280-F284 VanDerWaalsContact O-CD2 3.29Å; C280-F284 WeakPolarHBondContact O-CD2 3.49Å; C280-F284 PolarHBondContact O-N 2.84Å
281I97.8Very high96.9Very high4 Ų439.3 Ų39.32%0.02120%0.203CC..Iπ-helixtrans-68.5-47.2-172.6-63.6172.8000110W265 I276 D283 F284 M285 F308 M320 L324W265-I281 HydrophobicContact CB-CD1 4.04Å; W265-I281 HydrophobicContact CG-CD1 3.93Å; I276-I281 HydrophobicContact CG2-CD1 3.97Å; I276-I281 HydrophobicContact CG2-CG1 4.22Å; I276-I281 PolarHBondContact O-N 3.2Å; I281-D283 VanDerWaalsContact C-N 3.33Å; I281-D283 PolarHBondContact O-N 2.9Å; I281-F284 PolarHBondContact O-N 3.41Å; I281-M285 HydrophobicContact CG2-CE 3.64Å; I281-M285 HydrophobicContact CG2-SD 4.32Å; I281-M285 WeakPolarHBondContact O-CG 3.23Å; I281-M285 PolarHBondContact O-N 3.17Å; I281-F308 HydrophobicContact CD1-CE1 3.64Å; I281-F308 HydrophobicContact CD1-CZ 3.77Å; I281-F308 HydrophobicContact CG1-CE1 4.3Å; I281-F308 HydrophobicContact CG1-CZ 3.95Å; I281-M320 HydrophobicContact CG2-SD 4.25Å; I281-L324 HydrophobicContact CB-CD1 3.91Å; I281-L324 HydrophobicContact CG2-CD1 3.62Å
282Q97.3Very high96.8Very high41 Ų4140 Ų4019%0.19220%0.203CC..Hα-helixtrans-65.3-35.4178.3-167.5171.862.300112.3E277 M285 Q286 L324 P327 I328E277-Q282 WeakPolarHBondContact O-CB 3.32Å; E277-Q282 PolarHBondContact O-N 3Å; Q282-M285 WeakPolarHBondContact O-CB 3.4Å; Q282-M285 PolarHBondContact O-N 3.05Å; Q282-Q286 WeakPolarHBondContact O-CB 3.37Å; Q282-Q286 PolarHBondContact O-N 3.18Å; Q282-L324 HydrophobicContact CB-CD1 4.34Å; Q282-L324 HydrophobicContact CB-CD2 4.14Å; Q282-L324 PolarHBondContact NE2-O 3.46Å; Q282-P327 VanDerWaalsContact NE2-CG 3.34Å; Q282-I328 HydrophobicContact CG-CD1 4.21Å
283D97.4Very high96.5Very high37 Ų3740.4 Ų40.420%0.19820%0.203CC..Hα-helixtrans-60.6-45.8172.4175.686000111.3H239 K243 T279 C280 I281 M285 Q286 N287H239-D283 IonicContact CE1-OD2 3.58Å; H239-D283 IonicContact NE2-OD2 2.6Å; H239-D283 PolarHBondContact NE2-OD2 2.91Å; H239-D283 VanDerWaalsContact NE2-OD2 3.12Å; K243-D283 WeakPolarHBondContact CD-OD2 3.39Å; K243-D283 WeakPolarHBondContact CE-OD2 3.34Å; K243-D283 IonicContact NZ-OD1 3.8Å; K243-D283 PolarHBondContact NZ-OD1 3Å; K243-D283 IonicContact NZ-OD2 2.77Å; K243-D283 PolarHBondContact NZ-OD2 3.44Å; T279-D283 WeakPolarHBondContact O-CB 3.34Å; C280-D283 PolarHBondContact O-N 2.95Å; I281-D283 VanDerWaalsContact C-N 3.33Å; I281-D283 PolarHBondContact O-N 2.9Å; D283-M285 PolarHBondContact O-N 2.81Å; D283-Q286 PolarHBondContact O-N 3.05Å; D283-N287 WeakPolarHBondContact O-CB 3.45Å; D283-N287 PolarHBondContact O-N 3.42Å; D283-N287 PolarHBondContact O-ND2 3.45Å; D283-N287 PolarHBondContact OD1-ND2 3.21Å; D283-N287 VanDerWaalsContact OD1-ND2 3.1Å; D283-N287 PolarHBondContact OD2-ND2 3.45Å
284F97.9Very high96.2Very high5 Ų543.1 Ų43.12%0.02222%0.223CC..Hα-helixtrans-64-38.7174.2-75.6-52.1000112.7H239 I242 K243 L246 Y261 C280 I281 N287 A288 V301 I304 V305H239-F284 AromaticContact CE1-CD2 3.86Å; H239-F284 AromaticContact CE1-CE1 4Å; H239-F284 AromaticContact CE1-CE2 3.45Å; H239-F284 VanDerWaalsContact CE1-CE2 3.45Å; H239-F284 WeakPolarHBondContact CE1-CE2 3.27Å; H239-F284 AromaticContact CE1-CZ 3.53Å; H239-F284 AromaticContact ND1-CE2 3.66Å; H239-F284 AromaticContact ND1-CZ 3.78Å; I242-F284 HydrophobicContact CG2-CZ 4.41Å; K243-F284 HydrophobicContact CG-CE1 4.06Å; K243-F284 HydrophobicContact CG-CZ 4.32Å; L246-F284 HydrophobicContact CD2-CE1 4.36Å; Y261-F284 HydrophobicContact CD2-CE2 4.11Å; Y261-F284 HydrophobicContact CE1-CE2 4.32Å; Y261-F284 AromaticContact CE2-CE2 3.53Å; Y261-F284 HydrophobicContact CE2-CE2 3.53Å; Y261-F284 HydrophobicContact CE2-CZ 4.06Å; Y261-F284 AromaticContact CZ-CE2 3.66Å; C280-F284 VanDerWaalsContact O-CD2 3.29Å; C280-F284 WeakPolarHBondContact O-CD2 3.49Å; C280-F284 PolarHBondContact O-N 2.84Å; I281-F284 PolarHBondContact O-N 3.41Å; F284-N287 PolarHBondContact O-N 2.97Å; F284-A288 VanDerWaalsContact O-CB 3.26Å; F284-A288 WeakPolarHBondContact O-CB 3.37Å; F284-A288 PolarHBondContact O-N 3.44Å; F284-V301 HydrophobicContact CB-CG1 4.32Å; F284-V301 HydrophobicContact CD1-CG1 4.07Å; F284-V301 HydrophobicContact CD1-CG2 4.39Å; F284-V301 VanDerWaalsContact O-CG1 3.23Å; F284-V301 WeakPolarHBondContact O-CG1 3.29Å; F284-I304 HydrophobicContact CD2-CG2 4.05Å; F284-I304 HydrophobicContact CE1-CD1 4.26Å; F284-I304 HydrophobicContact CE2-CG2 4.34Å; F284-I304 HydrophobicContact CG-CG2 4.36Å; F284-I304 HydrophobicContact CZ-CD1 4.22Å; F284-V305 HydrophobicContact CB-CG2 4.03Å
285M97.9Very high96.1Very high1 Ų139.1 Ų39.11%0.00521%0.208CC..Hα-helixtrans-62.3-43.8175-70.8177.7177.100111.6I281 Q282 D283 A288 I289 V305 M320 L321 L324 Y325 I328I281-M285 HydrophobicContact CG2-CE 3.64Å; I281-M285 HydrophobicContact CG2-SD 4.32Å; I281-M285 WeakPolarHBondContact O-CG 3.23Å; I281-M285 PolarHBondContact O-N 3.17Å; Q282-M285 WeakPolarHBondContact O-CB 3.4Å; Q282-M285 PolarHBondContact O-N 3.05Å; D283-M285 PolarHBondContact O-N 2.81Å; M285-A288 WeakPolarHBondContact O-CB 3.19Å; M285-A288 PolarHBondContact O-N 2.96Å; M285-I289 WeakPolarHBondContact O-CG1 3.34Å; M285-I289 PolarHBondContact O-N 3.23Å; M285-V305 HydrophobicContact CG-CG1 4.15Å; M285-V305 HydrophobicContact CG-CG2 4.33Å; M285-M320 HydrophobicContact CE-SD 4.33Å; M285-L321 HydrophobicContact CE-CD2 3.42Å; M285-L321 VanDerWaalsContact CE-CD2 3.42Å; M285-L324 HydrophobicContact CE-CB 4.38Å; M285-L324 HydrophobicContact CE-CD1 4.34Å; M285-L324 HydrophobicContact SD-CB 3.8Å; M285-L324 HydrophobicContact SD-CD1 4.33Å; M285-Y325 HydrophobicContact CB-CE1 4.01Å; M285-Y325 HydrophobicContact CE-CE2 4.04Å; M285-Y325 HydrophobicContact CG-CE1 3.95Å; M285-Y325 HydrophobicContact SD-CD1 4.1Å; M285-Y325 HydrophobicContact SD-CD2 4.47Å; M285-Y325 HydrophobicContact SD-CE1 3.73Å; M285-Y325 HydrophobicContact SD-CE2 4.14Å; M285-Y325 HydrophobicContact SD-CG 4.44Å; M285-I328 HydrophobicContact CB-CD1 3.87Å
286Q97.3Very high95.7Very high85 Ų8541.3 Ų41.340%0.39722%0.222SC..Hα-helixtrans-67.4-43.1178.4-175.2171.11.200111.3Q282 D283 A288 I289 L290 I328Q282-Q286 WeakPolarHBondContact O-CB 3.37Å; Q282-Q286 PolarHBondContact O-N 3.18Å; D283-Q286 PolarHBondContact O-N 3.05Å; Q286-A288 VanDerWaalsContact C-N 3.34Å; Q286-A288 PolarHBondContact O-N 2.9Å; Q286-I289 WeakPolarHBondContact O-CB 3.48Å; Q286-I289 PolarHBondContact O-N 3.05Å; Q286-I289 VanDerWaalsContact O-N 3.1Å; Q286-L290 HydrophobicContact CG-CD1 3.62Å; Q286-L290 HydrophobicContact CG-CG 4.24Å; Q286-L290 WeakPolarHBondContact O-CB 3.34Å; Q286-L290 WeakPolarHBondContact O-CG 3.5Å; Q286-L290 PolarHBondContact O-N 2.89Å; Q286-I328 HydrophobicContact CB-CD1 4.37Å
287N96.9Very high95.5Very high39 Ų3942.5 Ų42.521%0.20923%0.23CC..Hα-helixtrans-66.1-35.3175.1-76.5-56.5000112.2D283 F284 I289 L290 L291 V301D283-N287 WeakPolarHBondContact O-CB 3.45Å; D283-N287 PolarHBondContact O-N 3.42Å; D283-N287 PolarHBondContact O-ND2 3.45Å; D283-N287 PolarHBondContact OD1-ND2 3.21Å; D283-N287 VanDerWaalsContact OD1-ND2 3.1Å; D283-N287 PolarHBondContact OD2-ND2 3.45Å; F284-N287 PolarHBondContact O-N 2.97Å; N287-I289 PolarHBondContact O-N 2.88Å; N287-L290 PolarHBondContact O-N 3.48Å; N287-L291 HydrophobicContact CB-CD1 4.04Å; N287-L291 HydrophobicContact CB-CG 4.25Å; N287-L291 WeakPolarHBondContact O-CB 3.32Å; N287-L291 WeakPolarHBondContact O-CD1 3.5Å; N287-L291 WeakPolarHBondContact O-CG 3.45Å; N287-L291 PolarHBondContact O-N 2.9Å; N287-V301 HydrophobicContact CB-CG1 4.22Å
288A97Very high95.4Very high0 Ų042.1 Ų42.10%023%0.228CC..Hα-helixtrans-61.2-27172.800000112.7F284 M285 Q286 V301 R302 V305 L347F284-A288 VanDerWaalsContact O-CB 3.26Å; F284-A288 WeakPolarHBondContact O-CB 3.37Å; F284-A288 PolarHBondContact O-N 3.44Å; M285-A288 WeakPolarHBondContact O-CB 3.19Å; M285-A288 PolarHBondContact O-N 2.96Å; Q286-A288 VanDerWaalsContact C-N 3.34Å; Q286-A288 PolarHBondContact O-N 2.9Å; A288-V301 HydrophobicContact CB-CG1 3.93Å; A288-R302 HydrophobicContact CB-CG 4.27Å; A288-V305 HydrophobicContact CB-CG2 4.13Å; A288-L347 HydrophobicContact CB-CD1 3.57Å; A288-L347 HydrophobicContact CB-CD2 4.23Å; A288-L347 HydrophobicContact CB-CG 4.46Å
289I97.6Very high95.3Very high2 Ų242.7 Ų42.71%0.0123%0.232CC..Hα-helixtrans-83.5-48.7176-68.8172000111M285 Q286 N287 I328 L329 S332 V340 N343 A344 L347M285-I289 WeakPolarHBondContact O-CG1 3.34Å; M285-I289 PolarHBondContact O-N 3.23Å; Q286-I289 WeakPolarHBondContact O-CB 3.48Å; Q286-I289 PolarHBondContact O-N 3.05Å; Q286-I289 VanDerWaalsContact O-N 3.1Å; N287-I289 PolarHBondContact O-N 2.88Å; I289-I328 HydrophobicContact CD1-CD1 4.3Å; I289-I328 HydrophobicContact CD1-CG1 4.38Å; I289-L329 HydrophobicContact CD1-CD1 4.29Å; I289-S332 WeakPolarHBondContact CG2-OG 3.46Å; I289-V340 HydrophobicContact CG2-CG1 3.6Å; I289-N343 WeakPolarHBondContact O-CB 3.48Å; I289-N343 PolarHBondContact O-ND2 3.34Å; I289-A344 HydrophobicContact CG1-CB 4.42Å; I289-A344 HydrophobicContact CG2-CB 4.35Å; I289-L347 HydrophobicContact CD1-CD1 4.31Å; I289-L347 HydrophobicContact CG1-CD1 3.52Å
290L96.9Very high95.3Very high89 Ų8941.5 Ų41.547%0.46622%0.223SC..Hα-helixtrans-88.2-24.2-166.8-63.4179.8000114.8Q286 N287 Q292 V340Q286-L290 HydrophobicContact CG-CD1 3.62Å; Q286-L290 HydrophobicContact CG-CG 4.24Å; Q286-L290 WeakPolarHBondContact O-CB 3.34Å; Q286-L290 WeakPolarHBondContact O-CG 3.5Å; Q286-L290 PolarHBondContact O-N 2.89Å; N287-L290 PolarHBondContact O-N 3.48Å; L290-Q292 PolarHBondContact O-N 3.48Å; L290-V340 HydrophobicContact CD2-CG1 4.2Å; L290-V340 HydrophobicContact CD2-CG2 4.31Å
291L95.6Very high95.2Very high39 Ų3941.8 Ų41.820%0.20422%0.224CC..SBendtrans-64135.9-179.3-75.6169.6000111.2N287 V297 H298 V301 N343N287-L291 HydrophobicContact CB-CD1 4.04Å; N287-L291 HydrophobicContact CB-CG 4.25Å; N287-L291 WeakPolarHBondContact O-CB 3.32Å; N287-L291 WeakPolarHBondContact O-CD1 3.5Å; N287-L291 WeakPolarHBondContact O-CG 3.45Å; N287-L291 PolarHBondContact O-N 2.9Å; L291-V297 HydrophobicContact CD1-CG2 4.03Å; L291-V297 HydrophobicContact CD2-CG2 4.49Å; L291-H298 HydrophobicContact CB-CB 4.22Å; L291-V301 HydrophobicContact CD1-CB 4.35Å; L291-V301 HydrophobicContact CD1-CG2 3.93Å; L291-N343 PolarHBondContact O-ND2 3.06Å; L291-N343 VanDerWaalsContact O-ND2 3.07Å
292Q94.2Very high95Very high128 Ų12845.1 Ų45.160%0.59824%0.237SC*.  trans-59.6144.2169.5-68.8-179.1-7.200110.3L290 T294 S295 E339L290-Q292 PolarHBondContact O-N 3.48Å; Q292-T294 PolarHBondContact O-N 2.93Å; Q292-S295 WeakPolarHBondContact O-CB 3.39Å; Q292-S295 PolarHBondContact O-N 3.17Å; Q292-E339 WeakPolarHBondContact CA-OE2 3.49Å
293R89.3Confident94.8Very high67 Ų6745.3 Ų45.325%0.25324%0.238SC..THydrogen-bonded Turntrans-65.7-23.5-176.5-69.2-172.4154.2156.8-0.7114.4S295 E339 A342 N343 N389R293-S295 VanDerWaalsContact C-N 3.28Å; R293-E339 PolarHBondContact N-OE2 2.98Å; R293-A342 VanDerWaalsContact NH1-CB 3.33Å; R293-A342 PolarHBondContact NH2-O 2.98Å; R293-N343 VanDerWaalsContact CZ-OD1 3.27Å; R293-N343 PolarHBondContact NE-OD1 2.91Å; R293-N343 PolarHBondContact NH2-OD1 3.3Å; R293-N389 PolarHBondContact NH2-ND2 3.13Å
294T91.6Very high94.7Very high118 Ų11843.6 Ų43.672%0.72423%0.228SC*.THydrogen-bonded Turntrans-76-12.7175.449.90000113.2Q292Q292-T294 PolarHBondContact O-N 2.93Å
295S93.1Very high94.7Very high29 Ų2943.5 Ų43.520%0.20323%0.228CC..  trans-62.6134.3-179.1175.50000111.6Q292 R293 V297 H298Q292-S295 WeakPolarHBondContact O-CB 3.39Å; Q292-S295 PolarHBondContact O-N 3.17Å; R293-S295 VanDerWaalsContact C-N 3.28Å; S295-V297 PolarHBondContact O-N 2.87Å; S295-V297 VanDerWaalsContact O-N 3.11Å; S295-V297 WeakPolarHBondContact OG-CG2 3.35Å; S295-V297 PolarHBondContact OG-N 3.43Å; S295-H298 PolarHBondContact O-N 2.92Å
296P90.8Very high94.5Very high69 Ų6945.5 Ų45.545%0.44824%0.242SC..THydrogen-bonded Turntrans-64.5-18.8-17926.9-35.2000113E247E247-P296 HydrophobicContact CG-CB 4.14Å; E247-P296 HydrophobicContact CG-CG 3.98Å; E247-P296 WeakPolarHBondContact OE1-CG 3.42Å
297V93.7Very high94.4Very high25 Ų2543.1 Ų43.115%0.15223%0.23CC..THydrogen-bonded Turntrans-98-16.8179.5-660000114L246 E247 L291 S295 S299 K300 V301L246-V297 HydrophobicContact CB-CG1 4.01Å; L246-V297 HydrophobicContact CD2-CB 4.12Å; L246-V297 HydrophobicContact CD2-CG1 4.38Å; L246-V297 HydrophobicContact CG-CB 4.32Å; L246-V297 HydrophobicContact CG-CG1 4.13Å; E247-V297 HydrophobicContact CB-CG1 3.84Å; L291-V297 HydrophobicContact CD1-CG2 4.03Å; L291-V297 HydrophobicContact CD2-CG2 4.49Å; S295-V297 PolarHBondContact O-N 2.87Å; S295-V297 VanDerWaalsContact O-N 3.11Å; S295-V297 WeakPolarHBondContact OG-CG2 3.35Å; S295-V297 PolarHBondContact OG-N 3.43Å; V297-S299 VanDerWaalsContact C-N 3.33Å; V297-S299 PolarHBondContact O-N 3.28Å; V297-K300 WeakPolarHBondContact O-CB 3.45Å; V297-K300 PolarHBondContact O-N 3.08Å; V297-V301 WeakPolarHBondContact O-CG2 3.45Å; V297-V301 PolarHBondContact O-N 3.16Å
298H93.8Very high94.4Very high8 Ų841.5 Ų41.54%0.03722%0.221CC..Hα-helixtrans-55.4-45.1-173.5165.9-110.5000112.7L291 S295 K300 V301 R302 N343L291-H298 HydrophobicContact CB-CB 4.22Å; S295-H298 PolarHBondContact O-N 2.92Å; H298-K300 VanDerWaalsContact C-N 3.31Å; H298-K300 PolarHBondContact O-N 3.48Å; H298-V301 PolarHBondContact O-N 3.02Å; H298-R302 VanDerWaalsContact CE1-CZ 3.47Å; H298-R302 PolarHBondContact CE1-NH1 3.41Å; H298-R302 VanDerWaalsContact CE1-NH1 3.32Å; H298-R302 WeakPolarHBondContact O-CG 3.49Å; H298-R302 PolarHBondContact O-N 3.41Å; H298-N343 PolarHBondContact NE2-OD1 3.36Å
299S92.8Very high94.3Very high64 Ų6442 Ų4245%0.44822%0.223SC..Hα-helixtrans-63.9-33.5178.767.10000113.6V297 Q303V297-S299 VanDerWaalsContact C-N 3.33Å; V297-S299 PolarHBondContact O-N 3.28Å; S299-Q303 WeakPolarHBondContact O-CB 3.32Å; S299-Q303 PolarHBondContact O-N 3.13Å; S299-Q303 VanDerWaalsContact O-N 3.12Å
300K94.3Very high94.1Very high22 Ų2246 Ų4610%0.09625%0.252CS..Hα-helixtrans-76.3-42.3-179.7-59.6169.2-171.3171.40111.1L246 E247 Y249 A254 V297 H298 R302 Q303 I304L246-K300 HydrophobicContact CD1-CB 4.11Å; L246-K300 HydrophobicContact CD1-CD 4.47Å; L246-K300 HydrophobicContact CD2-CB 4.46Å; L246-K300 HydrophobicContact CG-CB 4.16Å; L246-K300 HydrophobicContact CG-CD 4.29Å; L246-K300 WeakPolarHBondContact O-CD 3.4Å; L246-K300 WeakPolarHBondContact O-CE 3.32Å; L246-K300 PolarHBondContact O-NZ 2.96Å; E247-K300 VanDerWaalsContact C-NZ 3.28Å; E247-K300 PolarHBondContact O-NZ 3.03Å; Y249-K300 WeakPolarHBondContact O-CE 3.21Å; Y249-K300 PolarHBondContact O-NZ 3.44Å; A254-K300 HydrophobicContact CB-CB 4.28Å; V297-K300 WeakPolarHBondContact O-CB 3.45Å; V297-K300 PolarHBondContact O-N 3.08Å; H298-K300 VanDerWaalsContact C-N 3.31Å; H298-K300 PolarHBondContact O-N 3.48Å; K300-R302 VanDerWaalsContact C-N 3.35Å; K300-R302 PolarHBondContact O-N 3.48Å; K300-Q303 WeakPolarHBondContact O-CB 3.37Å; K300-Q303 PolarHBondContact O-N 3.28Å; K300-I304 WeakPolarHBondContact O-CG1 3.37Å; K300-I304 PolarHBondContact O-N 3.01Å
301V95.8Very high93.9Very high5 Ų545.5 Ų45.53%0.0324%0.243CC..Hα-helixtrans-59.4-47.1173.8177.60000110.2L246 F284 N287 A288 L291 V297 H298 Q303 I304 V305L246-V301 HydrophobicContact CD2-CG2 3.44Å; L246-V301 VanDerWaalsContact CD2-CG2 3.44Å; F284-V301 HydrophobicContact CB-CG1 4.32Å; F284-V301 HydrophobicContact CD1-CG1 4.07Å; F284-V301 HydrophobicContact CD1-CG2 4.39Å; F284-V301 VanDerWaalsContact O-CG1 3.23Å; F284-V301 WeakPolarHBondContact O-CG1 3.29Å; N287-V301 HydrophobicContact CB-CG1 4.22Å; A288-V301 HydrophobicContact CB-CG1 3.93Å; L291-V301 HydrophobicContact CD1-CB 4.35Å; L291-V301 HydrophobicContact CD1-CG2 3.93Å; V297-V301 WeakPolarHBondContact O-CG2 3.45Å; V297-V301 PolarHBondContact O-N 3.16Å; H298-V301 PolarHBondContact O-N 3.02Å; V301-Q303 VanDerWaalsContact C-N 3.29Å; V301-Q303 PolarHBondContact O-N 3.36Å; V301-I304 PolarHBondContact O-N 3.17Å; V301-I304 VanDerWaalsContact O-N 3.16Å; V301-V305 WeakPolarHBondContact O-CG2 3.42Å; V301-V305 PolarHBondContact O-N 3.41Å
302R94.2Very high93.6Very high74 Ų7445.9 Ų45.928%0.27924%0.243SC..Hα-helixtrans-60.2-38.6175.6-70.2-155.4-52.2-1586.8112.8A288 H298 K300 V305 S306A288-R302 HydrophobicContact CB-CG 4.27Å; H298-R302 VanDerWaalsContact CE1-CZ 3.47Å; H298-R302 PolarHBondContact CE1-NH1 3.41Å; H298-R302 VanDerWaalsContact CE1-NH1 3.32Å; H298-R302 WeakPolarHBondContact O-CG 3.49Å; H298-R302 PolarHBondContact O-N 3.41Å; K300-R302 VanDerWaalsContact C-N 3.35Å; K300-R302 PolarHBondContact O-N 3.48Å; R302-V305 PolarHBondContact O-N 3.25Å; R302-S306 VanDerWaalsContact O-CB 3.26Å; R302-S306 WeakPolarHBondContact O-CB 3.48Å; R302-S306 PolarHBondContact O-N 3.45Å
303Q93.1Very high93.1Very high45 Ų4543.1 Ų43.121%0.2125%0.25CC..Hα-helixtrans-63.7-40.3176.4-175.7178.911.700112.3K251 T255 S299 K300 V301 S306 Y307K251-Q303 PolarHBondContact O-NE2 3.1Å; K251-Q303 PolarHBondContact O-OE1 3.15Å; T255-Q303 PolarHBondContact OG1-NE2 3.3Å; S299-Q303 WeakPolarHBondContact O-CB 3.32Å; S299-Q303 PolarHBondContact O-N 3.13Å; S299-Q303 VanDerWaalsContact O-N 3.12Å; K300-Q303 WeakPolarHBondContact O-CB 3.37Å; K300-Q303 PolarHBondContact O-N 3.28Å; V301-Q303 VanDerWaalsContact C-N 3.29Å; V301-Q303 PolarHBondContact O-N 3.36Å; Q303-S306 PolarHBondContact O-N 3.13Å; Q303-Y307 PolarHBondContact O-N 2.67Å
304I95.7Very high93.1Very high1 Ų142.5 Ų42.51%0.00526%0.255CS..Hα-helixtrans-61.4-47.5175.3-68.4167.3000110.3L246 I257 A258 F284 K300 V301 Y307 F308L246-I304 HydrophobicContact CD1-CD1 4.02Å; I257-I304 HydrophobicContact CG2-CD1 4.14Å; A258-I304 HydrophobicContact CB-CB 4.26Å; A258-I304 HydrophobicContact CB-CG1 4.13Å; A258-I304 HydrophobicContact CB-CG2 4.26Å; F284-I304 HydrophobicContact CD2-CG2 4.05Å; F284-I304 HydrophobicContact CE1-CD1 4.26Å; F284-I304 HydrophobicContact CE2-CG2 4.34Å; F284-I304 HydrophobicContact CG-CG2 4.36Å; F284-I304 HydrophobicContact CZ-CD1 4.22Å; K300-I304 WeakPolarHBondContact O-CG1 3.37Å; K300-I304 PolarHBondContact O-N 3.01Å; V301-I304 PolarHBondContact O-N 3.17Å; V301-I304 VanDerWaalsContact O-N 3.16Å; I304-Y307 VanDerWaalsContact O-CB 3.26Å; I304-Y307 WeakPolarHBondContact O-CB 3.35Å; I304-Y307 PolarHBondContact O-N 2.99Å; I304-F308 WeakPolarHBondContact O-CD2 3.45Å
305V96.6Very high93.1Very high3 Ų340.9 Ų40.92%0.01825%0.247CC..Hα-helixtrans-65.2-43.7179.5177.60000111.7F284 M285 A288 V301 R302 Y307 F308 H309 Y325 L347F284-V305 HydrophobicContact CB-CG2 4.03Å; M285-V305 HydrophobicContact CG-CG1 4.15Å; M285-V305 HydrophobicContact CG-CG2 4.33Å; A288-V305 HydrophobicContact CB-CG2 4.13Å; V301-V305 WeakPolarHBondContact O-CG2 3.42Å; V301-V305 PolarHBondContact O-N 3.41Å; R302-V305 PolarHBondContact O-N 3.25Å; V305-Y307 PolarHBondContact O-N 3.46Å; V305-Y307 VanDerWaalsContact O-N 3.14Å; V305-F308 WeakPolarHBondContact O-CB 3.36Å; V305-F308 PolarHBondContact O-N 3.25Å; V305-H309 PolarHBondContact O-N 3.25Å; V305-Y325 WeakPolarHBondContact CG1-OH 3.45Å; V305-L347 HydrophobicContact CG1-CD2 4.03Å
306S94.9Very high93.1Very high43 Ų4342.4 Ų42.430%0.30126%0.257SS..Hα-helixtrans-60.1-27179.4-164.40000112.7R302 Q303 F308 H309 S310 E350R302-S306 VanDerWaalsContact O-CB 3.26Å; R302-S306 WeakPolarHBondContact O-CB 3.48Å; R302-S306 PolarHBondContact O-N 3.45Å; Q303-S306 PolarHBondContact O-N 3.13Å; S306-F308 VanDerWaalsContact C-N 3.28Å; S306-F308 PolarHBondContact O-N 3Å; S306-H309 PolarHBondContact O-N 3.4Å; S306-S310 PolarHBondContact O-N 2.93Å; S306-E350 PolarHBondContact OG-OE2 3.4Å
307Y95.5Very high93.3Very high36 Ų3639.2 Ų39.214%0.14124%0.236CC..Hα-helixtrans-60.2-36.6173.5-165.7-97.1000112.4A258 E259 F262 Q303 I304 V305 S310 R311A258-Y307 HydrophobicContact CB-CD1 4.08Å; A258-Y307 HydrophobicContact CB-CD2 4.09Å; A258-Y307 HydrophobicContact CB-CG 3.69Å; E259-Y307 HydrophobicContact CB-CE1 4.24Å; E259-Y307 HydrophobicContact CB-CE2 4.39Å; E259-Y307 VanDerWaalsContact CB-OH 3.32Å; E259-Y307 WeakPolarHBondContact CB-OH 3.5Å; E259-Y307 WeakPolarHBondContact CG-OH 3.28Å; F262-Y307 HydrophobicContact CB-CD1 3.9Å; F262-Y307 HydrophobicContact CB-CE1 3.62Å; F262-Y307 HydrophobicContact CD1-CE1 4.32Å; F262-Y307 HydrophobicContact CG-CD1 4.32Å; F262-Y307 AromaticContact CG-CE1 3.98Å; F262-Y307 HydrophobicContact CG-CE1 3.98Å; Q303-Y307 PolarHBondContact O-N 2.67Å; I304-Y307 VanDerWaalsContact O-CB 3.26Å; I304-Y307 WeakPolarHBondContact O-CB 3.35Å; I304-Y307 PolarHBondContact O-N 2.99Å; V305-Y307 PolarHBondContact O-N 3.46Å; V305-Y307 VanDerWaalsContact O-N 3.14Å; Y307-S310 PolarHBondContact O-OG 3.24Å; Y307-R311 VanDerWaalsContact CE2-NH1 3.31Å; Y307-R311 PolarHBondContact O-NH1 2.98Å; Y307-R311 PolarHBondContact OH-NH2 3.16Å
308F95.9Very high93.3Very high4 Ų438.5 Ų38.52%0.01823%0.232CC..Hα-helixtrans-72.9-41.9174.3-67.2-95000111.3F262 I281 I304 V305 S306 S310 R311 M320 L321F262-F308 HydrophobicContact CB-CE1 4.15Å; F262-F308 HydrophobicContact CB-CZ 4.21Å; F262-F308 AromaticContact CD2-CD1 3.72Å; F262-F308 HydrophobicContact CD2-CD1 3.72Å; F262-F308 AromaticContact CD2-CE1 3.73Å; F262-F308 HydrophobicContact CD2-CE1 3.73Å; F262-F308 HydrophobicContact CE2-CD1 4.41Å; F262-F308 HydrophobicContact CG-CE1 4.44Å; I281-F308 HydrophobicContact CD1-CE1 3.64Å; I281-F308 HydrophobicContact CD1-CZ 3.77Å; I281-F308 HydrophobicContact CG1-CE1 4.3Å; I281-F308 HydrophobicContact CG1-CZ 3.95Å; I304-F308 WeakPolarHBondContact O-CD2 3.45Å; V305-F308 WeakPolarHBondContact O-CB 3.36Å; V305-F308 PolarHBondContact O-N 3.25Å; S306-F308 VanDerWaalsContact C-N 3.28Å; S306-F308 PolarHBondContact O-N 3Å; F308-S310 VanDerWaalsContact C-N 3.31Å; F308-S310 PolarHBondContact O-N 3.34Å; F308-R311 PolarHBondContact O-N 3.32Å; F308-R311 VanDerWaalsContact O-N 3.1Å; F308-M320 HydrophobicContact CD1-CE 3.7Å; F308-M320 HydrophobicContact CE1-CE 4.31Å; F308-L321 HydrophobicContact CB-CD2 4.32Å
309H94.9Very high93.4Very high11 Ų1142 Ų425%0.05125%0.247CC..Hα-helixtrans-61.1-38177.8-59.2161.4000113.2V305 S306 R311 K312 Y325V305-H309 PolarHBondContact O-N 3.25Å; S306-H309 PolarHBondContact O-N 3.4Å; H309-R311 PolarHBondContact O-N 3.45Å; H309-K312 WeakPolarHBondContact O-CB 3.46Å; H309-K312 VanDerWaalsContact O-CG 3.31Å; H309-K312 WeakPolarHBondContact O-CG 3.36Å; H309-K312 PolarHBondContact O-N 3.11Å; H309-Y325 PolarHBondContact CE1-OH 2.89Å; H309-Y325 AromaticContact NE2-CE2 3.54Å; H309-Y325 AromaticContact NE2-CZ 3.55Å; H309-Y325 PolarHBondContact NE2-OH 3.37Å
310S92.6Very high93.5Very high86 Ų8639.1 Ų39.160%0.60123%0.226SC*.THydrogen-bonded Turntrans-63.2-11.4177.670.10000114.4S306 Y307 F308S306-S310 PolarHBondContact O-N 2.93Å; Y307-S310 PolarHBondContact O-OG 3.24Å; F308-S310 VanDerWaalsContact C-N 3.31Å; F308-S310 PolarHBondContact O-N 3.34Å
311R92.6Very high93.7Very high78 Ų7838.1 Ų38.129%0.29422%0.222SC..THydrogen-bonded Turntrans-112.615.3-179.3-66.3179.817568.77.2113.6F262 Y307 F308 H309F262-R311 HydrophobicContact CE2-CB 4.37Å; F262-R311 HydrophobicContact CZ-CB 4.46Å; Y307-R311 VanDerWaalsContact CE2-NH1 3.31Å; Y307-R311 PolarHBondContact O-NH1 2.98Å; Y307-R311 PolarHBondContact OH-NH2 3.16Å; F308-R311 PolarHBondContact O-N 3.32Å; F308-R311 VanDerWaalsContact O-N 3.1Å; H309-R311 PolarHBondContact O-N 3.45Å
312K89.8Confident93.6Very high47 Ų4740.2 Ų40.220%0.20423%0.23CC..THydrogen-bonded Turntrans-57.5155.1167.3-75.2-178.361.6680111.3H309 D318 L321 A351 P353H309-K312 WeakPolarHBondContact O-CB 3.46Å; H309-K312 VanDerWaalsContact O-CG 3.31Å; H309-K312 WeakPolarHBondContact O-CG 3.36Å; H309-K312 PolarHBondContact O-N 3.11Å; K312-D318 IonicContact NZ-OD1 3.94Å; K312-D318 PolarHBondContact NZ-OD1 3.17Å; K312-L321 HydrophobicContact CD-CD1 3.93Å; K312-L321 HydrophobicContact CG-CD1 3.57Å; K312-A351 WeakPolarHBondContact CD-O 3.38Å; K312-A351 WeakPolarHBondContact CE-O 3.35Å; K312-A351 PolarHBondContact NZ-O 2.75Å; K312-A351 VanDerWaalsContact NZ-O 3.11Å; K312-P353 WeakPolarHBondContact CE-O 3.38Å; K312-P353 PolarHBondContact NZ-O 3.04Å
313G83.8Confident93.7Very high71 Ų7141.6 Ų41.673%0.73224%0.238SC*.THydrogen-bonded Turntrans97.4-5.1-17000000113.3D318G313-D318 WeakPolarHBondContact CA-OD2 3.45Å; G313-D318 PolarHBondContact N-OD2 3.25Å
314C89.4Confident93.9Very high54 Ų5439.7 Ų39.737%0.36523%0.229SC..SBendtrans-98.8122.8167.4-176.80000109S316 V317 D318C314-S316 VanDerWaalsContact C-N 3.27Å; C314-S316 PolarHBondContact O-N 3.14Å; C314-S316 VanDerWaalsContact O-N 3.12Å; C314-S316 PolarHBondContact SG-OG 3.11Å; C314-V317 HydrophobicContact CB-CB 4.25Å; C314-V317 HydrophobicContact CB-CG2 4Å; C314-V317 WeakPolarHBondContact O-CB 3.45Å; C314-V317 PolarHBondContact O-N 3.04Å; C314-D318 PolarHBondContact O-N 3.04Å
315P91.6Very high94Very high84 Ų8439.7 Ų39.755%0.54523%0.229SC..Hα-helixtrans-53.4-39-173.6-3035.1000114.5V317 D318 K319 P357P315-V317 PolarHBondContact O-N 3.27Å; P315-D318 PolarHBondContact O-N 3.36Å; P315-K319 WeakPolarHBondContact O-CB 3.27Å; P315-K319 PolarHBondContact O-N 3.47Å; P315-P357 HydrophobicContact CB-CB 4.32Å; P315-P357 HydrophobicContact CB-CG 4.1Å; P315-P357 WeakPolarHBondContact O-CG 3.4Å
316S92.7Very high93.8Very high61 Ų6145.7 Ų45.743%0.42726%0.255SS..Hα-helixtrans-67.2-35.5178.257.40000113.1C314 M320C314-S316 VanDerWaalsContact C-N 3.27Å; C314-S316 PolarHBondContact O-N 3.14Å; C314-S316 VanDerWaalsContact O-N 3.12Å; C314-S316 PolarHBondContact SG-OG 3.11Å; S316-M320 WeakPolarHBondContact O-CB 3.23Å; S316-M320 PolarHBondContact O-N 3.06Å; S316-M320 VanDerWaalsContact O-N 3.14Å
317V95.5Very high93.8Very high1 Ų146.7 Ų46.71%0.00626%0.26CS..Hα-helixtrans-70.8-45176.3177.70000109.8F262 W265 C314 P315 M320 L321F262-V317 HydrophobicContact CE2-CG2 4.02Å; F262-V317 HydrophobicContact CZ-CG2 4.37Å; W265-V317 HydrophobicContact CH2-CB 4.42Å; W265-V317 HydrophobicContact CH2-CG2 3.81Å; W265-V317 HydrophobicContact CZ3-CG2 3.81Å; C314-V317 HydrophobicContact CB-CB 4.25Å; C314-V317 HydrophobicContact CB-CG2 4Å; C314-V317 WeakPolarHBondContact O-CB 3.45Å; C314-V317 PolarHBondContact O-N 3.04Å; P315-V317 PolarHBondContact O-N 3.27Å; V317-M320 HydrophobicContact CG1-CE 4.45Å; V317-M320 PolarHBondContact O-N 3.22Å; V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.18Å; V317-L321 WeakPolarHBondContact O-CB 3.06Å; V317-L321 VanDerWaalsContact O-CG 3.3Å; V317-L321 WeakPolarHBondContact O-CG 3.41Å; V317-L321 PolarHBondContact O-N 3.24Å
318D94.4Very high93.8Very high10 Ų1046 Ų465%0.05326%0.259CS..Hα-helixtrans-63.2-43.9-179.6-71.1-50.5000111.7K312 G313 C314 P315 M320 L321 Y322K312-D318 IonicContact NZ-OD1 3.94Å; K312-D318 PolarHBondContact NZ-OD1 3.17Å; G313-D318 WeakPolarHBondContact CA-OD2 3.45Å; G313-D318 PolarHBondContact N-OD2 3.25Å; C314-D318 PolarHBondContact O-N 3.04Å; P315-D318 PolarHBondContact O-N 3.36Å; D318-M320 PolarHBondContact O-N 3.35Å; D318-L321 PolarHBondContact O-N 3.29Å; D318-Y322 WeakPolarHBondContact O-CB 3.35Å; D318-Y322 PolarHBondContact O-N 3.16Å
319K94.9Very high93.8Very high82 Ų8245.9 Ų45.936%0.35726%0.258SS..Hα-helixtrans-59.3-45.5173.6-173.8171.3179.2173.50112.5P315 Y322 K323 P357 E358P315-K319 WeakPolarHBondContact O-CB 3.27Å; P315-K319 PolarHBondContact O-N 3.47Å; K319-Y322 PolarHBondContact O-N 3.41Å; K319-K323 WeakPolarHBondContact O-CB 3.32Å; K319-K323 PolarHBondContact O-N 3.27Å; K319-P357 HydrophobicContact CB-CG 4.16Å; K319-E358 IonicContact NZ-OE1 2.93Å; K319-E358 PolarHBondContact NZ-OE1 2.8Å; K319-E358 IonicContact NZ-OE2 2.69Å; K319-E358 PolarHBondContact NZ-OE2 3.49Å
320M96.4Very high93.8Very high4 Ų449.2 Ų49.22%0.0227%0.27CS..Hα-helixtrans-64-47.4177.9174.4-81.9-66.300111.8W265 E277 I281 M285 F308 S316 V317 D318 Y322 K323 L324W265-M320 HydrophobicContact CH2-CB 4.37Å; W265-M320 HydrophobicContact CH2-CE 4.31Å; W265-M320 HydrophobicContact CZ2-CB 3.59Å; W265-M320 HydrophobicContact CZ2-CE 4.16Å; W265-M320 HydrophobicContact CZ2-CG 3.82Å; E277-M320 HydrophobicContact CG-CG 3.98Å; I281-M320 HydrophobicContact CG2-SD 4.25Å; M285-M320 HydrophobicContact CE-SD 4.33Å; F308-M320 HydrophobicContact CD1-CE 3.7Å; F308-M320 HydrophobicContact CE1-CE 4.31Å; S316-M320 WeakPolarHBondContact O-CB 3.23Å; S316-M320 PolarHBondContact O-N 3.06Å; S316-M320 VanDerWaalsContact O-N 3.14Å; V317-M320 HydrophobicContact CG1-CE 4.45Å; V317-M320 PolarHBondContact O-N 3.22Å; D318-M320 PolarHBondContact O-N 3.35Å; M320-Y322 VanDerWaalsContact C-N 3.31Å; M320-Y322 PolarHBondContact O-N 3.07Å; M320-K323 PolarHBondContact O-N 2.99Å; M320-L324 HydrophobicContact CG-CD1 4.04Å; M320-L324 HydrophobicContact CG-CG 4.31Å; M320-L324 WeakPolarHBondContact O-CB 3.49Å; M320-L324 WeakPolarHBondContact O-CG 3.27Å; M320-L324 PolarHBondContact O-N 2.85Å; M320-L324 HydrophobicContact SD-CD1 3.53Å; M320-L324 VanDerWaalsContact SD-CD1 3.53Å; M320-L324 HydrophobicContact SD-CG 4.12Å
321L96.7Very high93.9Very high0 Ų052.6 Ų52.60%027%0.274CS..Hα-helixtrans-60.4-42.4177.8-69.7178.9000111.2M285 F308 K312 V317 D318 Y325M285-L321 HydrophobicContact CE-CD2 3.42Å; M285-L321 VanDerWaalsContact CE-CD2 3.42Å; F308-L321 HydrophobicContact CB-CD2 4.32Å; K312-L321 HydrophobicContact CD-CD1 3.93Å; K312-L321 HydrophobicContact CG-CD1 3.57Å; V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.18Å; V317-L321 WeakPolarHBondContact O-CB 3.06Å; V317-L321 VanDerWaalsContact O-CG 3.3Å; V317-L321 WeakPolarHBondContact O-CG 3.41Å; V317-L321 PolarHBondContact O-N 3.24Å; D318-L321 PolarHBondContact O-N 3.29Å; L321-Y325 HydrophobicContact CB-CD2 4.37Å; L321-Y325 HydrophobicContact CD2-CE2 4.08Å; L321-Y325 WeakPolarHBondContact O-CB 3.34Å; L321-Y325 VanDerWaalsContact O-CD2 3.3Å; L321-Y325 WeakPolarHBondContact O-CD2 3.28Å; L321-Y325 PolarHBondContact O-N 3.3Å
322Y95.1Very high94.1Very high49 Ų4949.6 Ų49.619%0.19227%0.265CS..Hα-helixtrans-59.3-51.1175.6175.1-95.7000111.9D318 K319 M320 L324 K326 V354 H355 D356D318-Y322 WeakPolarHBondContact O-CB 3.35Å; D318-Y322 PolarHBondContact O-N 3.16Å; K319-Y322 PolarHBondContact O-N 3.41Å; M320-Y322 VanDerWaalsContact C-N 3.31Å; M320-Y322 PolarHBondContact O-N 3.07Å; Y322-L324 PolarHBondContact O-N 3.44Å; Y322-K326 HydrophobicContact CE1-CD 4.5Å; Y322-K326 WeakPolarHBondContact O-CB 3.29Å; Y322-K326 PolarHBondContact O-N 3.16Å; Y322-K326 VanDerWaalsContact O-N 3.14Å; Y322-V354 HydrophobicContact CD2-CG1 4.28Å; Y322-H355 WeakPolarHBondContact CB-O 3.23Å; Y322-D356 HydrophobicContact CD1-CB 3.66Å; Y322-D356 HydrophobicContact CD2-CB 4.35Å; Y322-D356 HydrophobicContact CE1-CB 3.82Å; Y322-D356 HydrophobicContact CE2-CB 4.49Å; Y322-D356 HydrophobicContact CG-CB 3.94Å
323K95.9Very high94.5Very high104 Ų10447.9 Ų47.945%0.45226%0.258SS..Hα-helixtrans-58.4-48.3178.5-179.8-174.1170.1-164.20111.7E277 K319 M320 P327E277-K323 IonicContact OE2-NZ 3.67Å; E277-K323 PolarHBondContact OE2-NZ 3.21Å; K319-K323 WeakPolarHBondContact O-CB 3.32Å; K319-K323 PolarHBondContact O-N 3.27Å; M320-K323 PolarHBondContact O-N 2.99Å; K323-P327 WeakPolarHBondContact O-CD 3.46Å
324L97.3Very high95Very high5 Ų549.4 Ų49.43%0.02626%0.258CS..Hα-helixtrans-75.3-32-173.6-66-168.4000113.8E277 I281 Q282 M285 M320 Y322 P327E277-L324 HydrophobicContact CB-CD1 4.21Å; E277-L324 HydrophobicContact CB-CD2 4.14Å; E277-L324 HydrophobicContact CG-CD1 4.46Å; E277-L324 WeakPolarHBondContact O-CD1 3.38Å; I281-L324 HydrophobicContact CB-CD1 3.91Å; I281-L324 HydrophobicContact CG2-CD1 3.62Å; Q282-L324 HydrophobicContact CB-CD1 4.34Å; Q282-L324 HydrophobicContact CB-CD2 4.14Å; Q282-L324 PolarHBondContact NE2-O 3.46Å; M285-L324 HydrophobicContact CE-CB 4.38Å; M285-L324 HydrophobicContact CE-CD1 4.34Å; M285-L324 HydrophobicContact SD-CB 3.8Å; M285-L324 HydrophobicContact SD-CD1 4.33Å; M320-L324 HydrophobicContact CG-CD1 4.04Å; M320-L324 HydrophobicContact CG-CG 4.31Å; M320-L324 WeakPolarHBondContact O-CB 3.49Å; M320-L324 WeakPolarHBondContact O-CG 3.27Å; M320-L324 PolarHBondContact O-N 2.85Å; M320-L324 HydrophobicContact SD-CD1 3.53Å; M320-L324 VanDerWaalsContact SD-CD1 3.53Å; M320-L324 HydrophobicContact SD-CG 4.12Å; Y322-L324 PolarHBondContact O-N 3.44Å; L324-P327 WeakPolarHBondContact O-CD 3.49Å
325Y96.8Very high95.4Very high0 Ų048.9 Ų48.90%025%0.253CS..Hα-helixtrans-80.3-28.2177.1-80.9-52.2000114.1M285 V305 H309 L321 P327 I328 L329 A351M285-Y325 HydrophobicContact CB-CE1 4.01Å; M285-Y325 HydrophobicContact CE-CE2 4.04Å; M285-Y325 HydrophobicContact CG-CE1 3.95Å; M285-Y325 HydrophobicContact SD-CD1 4.1Å; M285-Y325 HydrophobicContact SD-CD2 4.47Å; M285-Y325 HydrophobicContact SD-CE1 3.73Å; M285-Y325 HydrophobicContact SD-CE2 4.14Å; M285-Y325 HydrophobicContact SD-CG 4.44Å; V305-Y325 WeakPolarHBondContact CG1-OH 3.45Å; H309-Y325 PolarHBondContact CE1-OH 2.89Å; H309-Y325 AromaticContact NE2-CE2 3.54Å; H309-Y325 AromaticContact NE2-CZ 3.55Å; H309-Y325 PolarHBondContact NE2-OH 3.37Å; L321-Y325 HydrophobicContact CB-CD2 4.37Å; L321-Y325 HydrophobicContact CD2-CE2 4.08Å; L321-Y325 WeakPolarHBondContact O-CB 3.34Å; L321-Y325 VanDerWaalsContact O-CD2 3.3Å; L321-Y325 WeakPolarHBondContact O-CD2 3.28Å; L321-Y325 PolarHBondContact O-N 3.3Å; Y325-P327 VanDerWaalsContact C-CD 3.49Å; Y325-P327 VanDerWaalsContact C-N 3.35Å; Y325-I328 HydrophobicContact CD1-CD1 4.31Å; Y325-I328 HydrophobicContact CD1-CG1 4.27Å; Y325-I328 PolarHBondContact O-N 3.14Å; Y325-L329 HydrophobicContact CD1-CB 3.8Å; Y325-L329 HydrophobicContact CD1-CD1 4.38Å; Y325-L329 HydrophobicContact CD1-CD2 4.07Å; Y325-L329 HydrophobicContact CD1-CG 4.31Å; Y325-L329 HydrophobicContact CD2-CD2 4.49Å; Y325-L329 HydrophobicContact CG-CB 4.16Å; Y325-L329 HydrophobicContact CG-CD2 3.98Å; Y325-L329 WeakPolarHBondContact O-CB 3.39Å; Y325-L329 PolarHBondContact O-N 3.4Å; Y325-A351 HydrophobicContact CD2-CB 4.48Å; Y325-A351 HydrophobicContact CE2-CB 3.91Å
326K93.4Very high95.6Very high130 Ų13051.2 Ų51.257%0.56527%0.268SS*.THydrogen-bonded Turntrans-45.6-46.7-178.3-174.9174.2-177.9175.30114.5Y322Y322-K326 HydrophobicContact CE1-CD 4.5Å; Y322-K326 WeakPolarHBondContact O-CB 3.29Å; Y322-K326 PolarHBondContact O-N 3.16Å; Y322-K326 VanDerWaalsContact O-N 3.14Å
327P93.9Very high95.8Very high63 Ų6352.3 Ų52.341%0.40927%0.269SS..THydrogen-bonded Turntrans-78.8-20.3-178.729.1-35.5000115.3Q282 K323 L324 Y325Q282-P327 VanDerWaalsContact NE2-CG 3.34Å; K323-P327 WeakPolarHBondContact O-CD 3.46Å; L324-P327 WeakPolarHBondContact O-CD 3.49Å; Y325-P327 VanDerWaalsContact C-CD 3.49Å; Y325-P327 VanDerWaalsContact C-N 3.35Å
328I95.6Very high95.8Very high23 Ų2355.5 Ų55.512%0.11828%0.283CS..THydrogen-bonded Turntrans-115.2-47.3-167.759.7177.2000113.8Q282 M285 Q286 I289 Y325 S332Q282-I328 HydrophobicContact CG-CD1 4.21Å; M285-I328 HydrophobicContact CB-CD1 3.87Å; Q286-I328 HydrophobicContact CB-CD1 4.37Å; I289-I328 HydrophobicContact CD1-CD1 4.3Å; I289-I328 HydrophobicContact CD1-CG1 4.38Å; Y325-I328 HydrophobicContact CD1-CD1 4.31Å; Y325-I328 HydrophobicContact CD1-CG1 4.27Å; Y325-I328 PolarHBondContact O-N 3.14Å; I328-S332 WeakPolarHBondContact O-CB 3.42Å; I328-S332 PolarHBondContact O-N 3.21Å; I328-S332 PolarHBondContact O-OG 3.37Å
329L96.3Very high96Very high0 Ų057.4 Ų57.40%029%0.291CS..Hα-helixtrans-66.2-52.7-163.6-177.262.5000112.3I289 Y325 K331 S332 L333 A344 F348I289-L329 HydrophobicContact CD1-CD1 4.29Å; Y325-L329 HydrophobicContact CD1-CB 3.8Å; Y325-L329 HydrophobicContact CD1-CD1 4.38Å; Y325-L329 HydrophobicContact CD1-CD2 4.07Å; Y325-L329 HydrophobicContact CD1-CG 4.31Å; Y325-L329 HydrophobicContact CD2-CD2 4.49Å; Y325-L329 HydrophobicContact CG-CB 4.16Å; Y325-L329 HydrophobicContact CG-CD2 3.98Å; Y325-L329 WeakPolarHBondContact O-CB 3.39Å; Y325-L329 PolarHBondContact O-N 3.4Å; L329-K331 VanDerWaalsContact C-N 3.31Å; L329-K331 PolarHBondContact O-N 2.88Å; L329-S332 WeakPolarHBondContact O-CB 3.47Å; L329-S332 PolarHBondContact O-N 2.96Å; L329-S332 VanDerWaalsContact O-N 3.09Å; L329-L333 PolarHBondContact O-N 2.97Å; L329-L333 VanDerWaalsContact O-N 3.17Å; L329-A344 HydrophobicContact CD1-CB 4.21Å; L329-F348 HydrophobicContact CD1-CB 4.09Å; L329-F348 HydrophobicContact CD2-CB 4.04Å; L329-F348 HydrophobicContact CD2-CD2 4.36Å; L329-F348 HydrophobicContact CG-CB 4.37Å
330W94.5Very high96.1Very high81 Ų8154.2 Ų54.231%0.30728%0.279SS..Hα-helixtrans-65.1-35.8-172.5-51.7119.3000112.3L333 F348 V354 Q371W330-L333 HydrophobicContact CE3-CD1 3.77Å; W330-L333 HydrophobicContact CZ3-CD1 4.01Å; W330-L333 PolarHBondContact O-N 3.24Å; W330-F348 AromaticContact CH2-CD2 3.71Å; W330-F348 HydrophobicContact CH2-CD2 3.71Å; W330-F348 AromaticContact CH2-CE2 3.75Å; W330-F348 HydrophobicContact CH2-CE2 3.75Å; W330-F348 AromaticContact CZ3-CD2 3.68Å; W330-F348 HydrophobicContact CZ3-CD2 3.68Å; W330-F348 AromaticContact CZ3-CE2 3.77Å; W330-F348 HydrophobicContact CZ3-CE2 3.77Å; W330-F348 HydrophobicContact CZ3-CG 4.4Å; W330-V354 HydrophobicContact CZ2-CB 4.31Å; W330-Q371 HydrophobicContact CH2-CG 3.5Å; W330-Q371 HydrophobicContact CZ2-CG 4.18Å; W330-Q371 HydrophobicContact CZ3-CG 4.08Å
331K95.1Very high96.2Very high158 Ų15855.1 Ų55.169%0.68728%0.282SS*.Hα-helixtrans-65.9-43.2173.8-66.3-179.4-178.2175.90110.8L329 L333 S334 V335L329-K331 VanDerWaalsContact C-N 3.31Å; L329-K331 PolarHBondContact O-N 2.88Å; K331-L333 PolarHBondContact O-N 3.17Å; K331-S334 PolarHBondContact O-N 3.14Å; K331-S334 VanDerWaalsContact O-N 3.14Å; K331-V335 WeakPolarHBondContact O-CG1 3.3Å
332S97.4Very high96.2Very high14 Ų1455.1 Ų55.110%0.09828%0.282CS..Hα-helixtrans-66.7-19.7-179-630000114.6I289 I328 L329 S334 R341I289-S332 WeakPolarHBondContact CG2-OG 3.46Å; I328-S332 WeakPolarHBondContact O-CB 3.42Å; I328-S332 PolarHBondContact O-N 3.21Å; I328-S332 PolarHBondContact O-OG 3.37Å; L329-S332 WeakPolarHBondContact O-CB 3.47Å; L329-S332 PolarHBondContact O-N 2.96Å; L329-S332 VanDerWaalsContact O-N 3.09Å; S332-S334 PolarHBondContact O-N 2.8Å; S332-R341 WeakPolarHBondContact O-CA 3.41Å
333L97.3Very high96.4Very high11 Ų1152.9 Ų52.96%0.05827%0.273CS..THydrogen-bonded Turntrans-71.1-17.6173.3-67176.8000113.3L329 W330 K331 R341 A344 F348 L378L329-L333 PolarHBondContact O-N 2.97Å; L329-L333 VanDerWaalsContact O-N 3.17Å; W330-L333 HydrophobicContact CE3-CD1 3.77Å; W330-L333 HydrophobicContact CZ3-CD1 4.01Å; W330-L333 PolarHBondContact O-N 3.24Å; K331-L333 PolarHBondContact O-N 3.17Å; L333-R341 WeakPolarHBondContact O-CD 3.48Å; L333-R341 WeakPolarHBondContact O-CG 3.42Å; L333-A344 HydrophobicContact CD2-CB 3.71Å; L333-A344 HydrophobicContact CG-CB 4.37Å; L333-F348 HydrophobicContact CD1-CD1 4.4Å; L333-F348 HydrophobicContact CD1-CG 4.42Å; L333-F348 HydrophobicContact CD2-CB 4.44Å; L333-L378 HydrophobicContact CB-CD2 4.48Å; L333-L378 HydrophobicContact CD1-CD1 4.36Å; L333-L378 HydrophobicContact CD2-CD1 3.86Å; L333-L378 HydrophobicContact CD2-CD2 4.16Å
334S95.2Very high96.5Very high104 Ų10447.9 Ų47.973%0.72725%0.252SS*.THydrogen-bonded Turntrans-123.712.7-173.6-530000114.1K331 S332K331-S334 PolarHBondContact O-N 3.14Å; K331-S334 VanDerWaalsContact O-N 3.14Å; S332-S334 PolarHBondContact O-N 2.8Å
335V96.7Very high96.5Very high43 Ų4347.7 Ų47.726%0.26125%0.25SS..SBendtrans-74.3158.6178.5-63.40000112.4K331 N337 V340 R341K331-V335 WeakPolarHBondContact O-CG1 3.3Å; V335-N337 VanDerWaalsContact C-N 3.3Å; V335-N337 PolarHBondContact O-N 3.06Å; V335-V340 HydrophobicContact CG2-CB 3.67Å; V335-V340 HydrophobicContact CG2-CG1 3.5Å; V335-V340 VanDerWaalsContact CG2-CG1 3.5Å; V335-R341 HydrophobicContact CG2-CG 3.98Å; V335-R341 WeakPolarHBondContact O-CD 3.45Å; V335-R341 WeakPolarHBondContact O-CG 3.43Å; V335-R341 PolarHBondContact O-NH1 3.36Å
336P96.4Very high96.5Very high132 Ų13248.4 Ų48.486%0.85725%0.254SS*.SBendtrans-60.9-32.4179.2-26.635.8000114.9F338 R341P336-F338 PolarHBondContact O-N 2.97Å; P336-R341 VanDerWaalsContact C-NH1 3.27Å; P336-R341 PolarHBondContact O-NH1 3.11Å
337N96.6Very high96.6Very high85 Ų8542.2 Ų42.246%0.45523%0.227SC..  trans-76.5117.7-177.8-173.7-36.2000111.7V335 E339 V340 R341V335-N337 VanDerWaalsContact C-N 3.3Å; V335-N337 PolarHBondContact O-N 3.06Å; N337-E339 PolarHBondContact O-N 3.43Å; N337-E339 WeakPolarHBondContact OD1-CB 3.26Å; N337-E339 PolarHBondContact OD1-N 3.35Å; N337-V340 HydrophobicContact CB-CB 4.28Å; N337-V340 HydrophobicContact CB-CG2 3.96Å; N337-V340 PolarHBondContact O-N 3.39Å; N337-V340 PolarHBondContact OD1-N 2.96Å; N337-R341 PolarHBondContact O-N 3.5Å
338F97Very high96.7Very high68 Ų6839.2 Ų39.230%0.29821%0.208SC..Hα-helixtrans-67.6-29.6-177.680.5-90.8000113.8P336 V340 R341 A342 H383 V386P336-F338 PolarHBondContact O-N 2.97Å; F338-V340 VanDerWaalsContact C-N 3.34Å; F338-R341 PolarHBondContact O-N 3.04Å; F338-A342 WeakPolarHBondContact O-CB 3.42Å; F338-A342 PolarHBondContact O-N 3.43Å; F338-H383 HydrophobicContact CB-CB 3.66Å; F338-H383 AromaticContact CD1-CD2 3.71Å; F338-H383 AromaticContact CD1-NE2 3.73Å; F338-H383 AromaticContact CD2-CD2 3.81Å; F338-H383 AromaticContact CD2-CE1 3.32Å; F338-H383 WeakPolarHBondContact CD2-CE1 3.45Å; F338-H383 AromaticContact CD2-CG 3.62Å; F338-H383 AromaticContact CD2-ND1 3.31Å; F338-H383 VanDerWaalsContact CD2-ND1 3.31Å; F338-H383 WeakPolarHBondContact CD2-ND1 3.29Å; F338-H383 AromaticContact CD2-NE2 3.64Å; F338-H383 AromaticContact CE1-NE2 3.82Å; F338-H383 AromaticContact CE2-CE1 3.38Å; F338-H383 WeakPolarHBondContact CE2-CE1 3.47Å; F338-H383 AromaticContact CE2-ND1 3.85Å; F338-H383 AromaticContact CE2-NE2 3.74Å; F338-H383 HydrophobicContact CG-CB 4.23Å; F338-H383 AromaticContact CG-CD2 3.45Å; F338-H383 VanDerWaalsContact CG-CD2 3.45Å; F338-H383 WeakPolarHBondContact CG-CD2 3.23Å; F338-H383 AromaticContact CG-CE1 3.8Å; F338-H383 AromaticContact CG-CG 3.52Å; F338-H383 AromaticContact CG-ND1 3.73Å; F338-H383 AromaticContact CG-NE2 3.64Å; F338-H383 AromaticContact CZ-CE1 3.9Å; F338-H383 AromaticContact CZ-NE2 3.83Å; F338-V386 HydrophobicContact CB-CG2 4.35Å; F338-V386 WeakPolarHBondContact O-CG2 3.44Å
339E97.1Very high96.7Very high49 Ų4938.6 Ų38.623%0.22921%0.205CC..Hα-helixtrans-66.4-42.3177.9-72.6-163.8-152.700110.4Q292 R293 N337 A342 N343Q292-E339 WeakPolarHBondContact CA-OE2 3.49Å; R293-E339 PolarHBondContact N-OE2 2.98Å; N337-E339 PolarHBondContact O-N 3.43Å; N337-E339 WeakPolarHBondContact OD1-CB 3.26Å; N337-E339 PolarHBondContact OD1-N 3.35Å; E339-A342 PolarHBondContact O-N 2.85Å; E339-N343 WeakPolarHBondContact O-CB 3.32Å; E339-N343 VanDerWaalsContact O-CG 3.25Å; E339-N343 PolarHBondContact O-N 3.16Å; E339-N343 PolarHBondContact O-ND2 3.37Å
340V98.1Very high96.6Very high16 Ų1641.4 Ų41.410%0.09722%0.218CC..Hα-helixtrans-61.5-49.4176178.80000110.2I289 L290 V335 N337 F338 A342 N343 A344I289-V340 HydrophobicContact CG2-CG1 3.6Å; L290-V340 HydrophobicContact CD2-CG1 4.2Å; L290-V340 HydrophobicContact CD2-CG2 4.31Å; V335-V340 HydrophobicContact CG2-CB 3.67Å; V335-V340 HydrophobicContact CG2-CG1 3.5Å; V335-V340 VanDerWaalsContact CG2-CG1 3.5Å; N337-V340 HydrophobicContact CB-CB 4.28Å; N337-V340 HydrophobicContact CB-CG2 3.96Å; N337-V340 PolarHBondContact O-N 3.39Å; N337-V340 PolarHBondContact OD1-N 2.96Å; F338-V340 VanDerWaalsContact C-N 3.34Å; V340-A342 VanDerWaalsContact C-N 3.33Å; V340-A342 PolarHBondContact O-N 3.4Å; V340-N343 PolarHBondContact O-N 3.5Å; V340-A344 VanDerWaalsContact O-CB 3.29Å; V340-A344 WeakPolarHBondContact O-CB 3.46Å; V340-A344 PolarHBondContact O-N 2.9Å
341R98.2Very high96.6Very high23 Ų2337.6 Ų37.69%0.08720%0.204CC..Hα-helixtrans-59-43.8175.3-64-162.3-54.5-83.33.9111.9S332 L333 V335 P336 N337 F338 N343 A344 T345 D381 V386S332-R341 WeakPolarHBondContact O-CA 3.41Å; L333-R341 WeakPolarHBondContact O-CD 3.48Å; L333-R341 WeakPolarHBondContact O-CG 3.42Å; V335-R341 HydrophobicContact CG2-CG 3.98Å; V335-R341 WeakPolarHBondContact O-CD 3.45Å; V335-R341 WeakPolarHBondContact O-CG 3.43Å; V335-R341 PolarHBondContact O-NH1 3.36Å; P336-R341 VanDerWaalsContact C-NH1 3.27Å; P336-R341 PolarHBondContact O-NH1 3.11Å; N337-R341 PolarHBondContact O-N 3.5Å; F338-R341 PolarHBondContact O-N 3.04Å; R341-N343 PolarHBondContact O-N 3.12Å; R341-A344 PolarHBondContact O-N 2.93Å; R341-T345 WeakPolarHBondContact O-CB 3.33Å; R341-T345 PolarHBondContact O-N 2.94Å; R341-T345 PolarHBondContact O-OG1 3.3Å; R341-D381 IonicContact CZ-OD1 2.59Å; R341-D381 IonicContact CZ-OD2 3.15Å; R341-D381 IonicContact NE-OD1 3.11Å; R341-D381 IonicContact NE-OD2 2.72Å; R341-D381 PolarHBondContact NE-OD2 3.43Å; R341-D381 IonicContact NH2-OD1 3.52Å; R341-D381 PolarHBondContact NH2-OD1 3.14Å; R341-D381 IonicContact NH2-OD2 2.78Å; R341-D381 PolarHBondContact NH2-OD2 3.29Å; R341-V386 HydrophobicContact CB-CG1 4.47Å; R341-V386 HydrophobicContact CB-CG2 3.98Å
342A97.4Very high96.6Very high0 Ų031 Ų310%018%0.175CC..Hα-helixtrans-68.4-34.9-178.200000112.4R293 F338 E339 V340 L346 V386 N389R293-A342 VanDerWaalsContact NH1-CB 3.33Å; R293-A342 PolarHBondContact NH2-O 2.98Å; F338-A342 WeakPolarHBondContact O-CB 3.42Å; F338-A342 PolarHBondContact O-N 3.43Å; E339-A342 PolarHBondContact O-N 2.85Å; V340-A342 VanDerWaalsContact C-N 3.33Å; V340-A342 PolarHBondContact O-N 3.4Å; A342-L346 PolarHBondContact O-N 3.43Å; A342-V386 HydrophobicContact CB-CB 4.48Å; A342-V386 HydrophobicContact CB-CG2 3.79Å; A342-N389 PolarHBondContact O-ND2 3.26Å
343N97.6Very high96.4Very high1 Ų131.9 Ų31.91%0.00518%0.181CC..Hα-helixtrans-71.8-46.2174.5-73.8-14.8000111.1I289 L291 R293 H298 E339 V340 R341 T345 L346 L347I289-N343 WeakPolarHBondContact O-CB 3.48Å; I289-N343 PolarHBondContact O-ND2 3.34Å; L291-N343 PolarHBondContact O-ND2 3.06Å; L291-N343 VanDerWaalsContact O-ND2 3.07Å; R293-N343 VanDerWaalsContact CZ-OD1 3.27Å; R293-N343 PolarHBondContact NE-OD1 2.91Å; R293-N343 PolarHBondContact NH2-OD1 3.3Å; H298-N343 PolarHBondContact NE2-OD1 3.36Å; E339-N343 WeakPolarHBondContact O-CB 3.32Å; E339-N343 VanDerWaalsContact O-CG 3.25Å; E339-N343 PolarHBondContact O-N 3.16Å; E339-N343 PolarHBondContact O-ND2 3.37Å; V340-N343 PolarHBondContact O-N 3.5Å; R341-N343 PolarHBondContact O-N 3.12Å; N343-T345 VanDerWaalsContact C-N 3.28Å; N343-T345 PolarHBondContact O-N 3.18Å; N343-L346 PolarHBondContact O-N 3.5Å; N343-L346 VanDerWaalsContact O-N 3.15Å; N343-L347 PolarHBondContact O-N 2.97Å; N343-L347 VanDerWaalsContact O-N 3.15Å
344A97.9Very high96.2Very high0 Ų031.5 Ų31.50%018%0.179CC..Hα-helixtrans-58.1-40.3174.500000111.7I289 L329 L333 V340 R341 L346 L347 F348I289-A344 HydrophobicContact CG1-CB 4.42Å; I289-A344 HydrophobicContact CG2-CB 4.35Å; L329-A344 HydrophobicContact CD1-CB 4.21Å; L333-A344 HydrophobicContact CD2-CB 3.71Å; L333-A344 HydrophobicContact CG-CB 4.37Å; V340-A344 VanDerWaalsContact O-CB 3.29Å; V340-A344 WeakPolarHBondContact O-CB 3.46Å; V340-A344 PolarHBondContact O-N 2.9Å; R341-A344 PolarHBondContact O-N 2.93Å; A344-L346 VanDerWaalsContact C-N 3.34Å; A344-L346 PolarHBondContact O-N 3.31Å; A344-L347 PolarHBondContact O-N 3.3Å; A344-F348 WeakPolarHBondContact O-CB 3.27Å; A344-F348 PolarHBondContact O-N 2.93Å
345T98Very high96Very high0 Ų028.4 Ų28.40%015%0.153CC..Hα-helixtrans-57.6-43.1175.3-61.30000112.5R341 N343 T349 L378 N389 A390R341-T345 WeakPolarHBondContact O-CB 3.33Å; R341-T345 PolarHBondContact O-N 2.94Å; R341-T345 PolarHBondContact O-OG1 3.3Å; N343-T345 VanDerWaalsContact C-N 3.28Å; N343-T345 PolarHBondContact O-N 3.18Å; T345-T349 WeakPolarHBondContact O-CB 3.26Å; T345-T349 VanDerWaalsContact O-CG2 3.29Å; T345-T349 WeakPolarHBondContact O-CG2 3.38Å; T345-T349 PolarHBondContact O-N 3.14Å; T345-T349 PolarHBondContact O-OG1 3.23Å; T345-L378 HydrophobicContact CG2-CD1 4.05Å; T345-N389 HydrophobicContact CG2-CB 4.03Å; T345-A390 HydrophobicContact CG2-CB 4.01Å
346L95.9Very high95.8Very high15 Ų1527.6 Ų27.68%0.07915%0.147CC..Hα-helixtrans-66.2-46.8178.2-71.9171.1000111.3A342 N343 A344 T349 E350 N389 L392A342-L346 PolarHBondContact O-N 3.43Å; N343-L346 PolarHBondContact O-N 3.5Å; N343-L346 VanDerWaalsContact O-N 3.15Å; A344-L346 VanDerWaalsContact C-N 3.34Å; A344-L346 PolarHBondContact O-N 3.31Å; L346-T349 PolarHBondContact O-N 3.01Å; L346-T349 PolarHBondContact O-OG1 3.26Å; L346-E350 WeakPolarHBondContact O-CB 3.45Å; L346-E350 WeakPolarHBondContact O-CG 3.41Å; L346-E350 PolarHBondContact O-N 2.96Å; L346-N389 VanDerWaalsContact CD1-ND2 3.34Å; L346-N389 WeakPolarHBondContact CD1-ND2 3.11Å; L346-N389 HydrophobicContact CD2-CB 3.97Å; L346-N389 HydrophobicContact CG-CB 4.09Å; L346-N389 WeakPolarHBondContact CG-ND2 3.48Å; L346-L392 HydrophobicContact CD2-CD2 4.29Å
347L96.3Very high95.4Very high1 Ų123.6 Ų23.61%0.00512%0.121CC..Hα-helixtrans-65.9-41.4179.6-62.5177.5000111.9A288 I289 V305 N343 A344 E350 A351A288-L347 HydrophobicContact CB-CD1 3.57Å; A288-L347 HydrophobicContact CB-CD2 4.23Å; A288-L347 HydrophobicContact CB-CG 4.46Å; I289-L347 HydrophobicContact CD1-CD1 4.31Å; I289-L347 HydrophobicContact CG1-CD1 3.52Å; V305-L347 HydrophobicContact CG1-CD2 4.03Å; N343-L347 PolarHBondContact O-N 2.97Å; N343-L347 VanDerWaalsContact O-N 3.15Å; A344-L347 PolarHBondContact O-N 3.3Å; L347-E350 PolarHBondContact O-N 3.45Å; L347-A351 WeakPolarHBondContact O-CB 3.32Å; L347-A351 PolarHBondContact O-N 3.48Å
348F96.9Very high95.1Very high0 Ų026 Ų260%013%0.129CC..Hα-helixtrans-56.1-53.4175.2161.3-126.1000110.9L329 W330 L333 A344 E350 A351 F352 Q371 A375 L378L329-F348 HydrophobicContact CD1-CB 4.09Å; L329-F348 HydrophobicContact CD2-CB 4.04Å; L329-F348 HydrophobicContact CD2-CD2 4.36Å; L329-F348 HydrophobicContact CG-CB 4.37Å; W330-F348 AromaticContact CH2-CD2 3.71Å; W330-F348 HydrophobicContact CH2-CD2 3.71Å; W330-F348 AromaticContact CH2-CE2 3.75Å; W330-F348 HydrophobicContact CH2-CE2 3.75Å; W330-F348 AromaticContact CZ3-CD2 3.68Å; W330-F348 HydrophobicContact CZ3-CD2 3.68Å; W330-F348 AromaticContact CZ3-CE2 3.77Å; W330-F348 HydrophobicContact CZ3-CE2 3.77Å; W330-F348 HydrophobicContact CZ3-CG 4.4Å; L333-F348 HydrophobicContact CD1-CD1 4.4Å; L333-F348 HydrophobicContact CD1-CG 4.42Å; L333-F348 HydrophobicContact CD2-CB 4.44Å; A344-F348 WeakPolarHBondContact O-CB 3.27Å; A344-F348 PolarHBondContact O-N 2.93Å; F348-E350 VanDerWaalsContact C-N 3.34Å; F348-E350 PolarHBondContact O-N 2.83Å; F348-A351 CarbonylContact O-C 3.5Å; F348-A351 PolarHBondContact O-N 2.84Å; F348-F352 AromaticContact CE2-CD2 3.91Å; F348-F352 HydrophobicContact CE2-CD2 3.91Å; F348-F352 HydrophobicContact CZ-CD2 4.02Å; F348-F352 PolarHBondContact O-N 2.83Å; F348-Q371 HydrophobicContact CE2-CB 3.9Å; F348-Q371 HydrophobicContact CE2-CG 4Å; F348-Q371 HydrophobicContact CZ-CB 4.01Å; F348-Q371 WeakPolarHBondContact CZ-O 3.47Å; F348-A375 HydrophobicContact CE1-CB 3.93Å; F348-A375 HydrophobicContact CZ-CB 4.29Å; F348-L378 HydrophobicContact CD1-CD1 3.96Å; F348-L378 HydrophobicContact CE1-CD1 4.21Å
349T95.3Very high94.8Very high10 Ų1025.4 Ų25.46%0.06113%0.129CC..Hα-helixtrans-72.6-26.6-175.255.70000112.8T345 L346 G393 I397T345-T349 WeakPolarHBondContact O-CB 3.26Å; T345-T349 VanDerWaalsContact O-CG2 3.29Å; T345-T349 WeakPolarHBondContact O-CG2 3.38Å; T345-T349 PolarHBondContact O-N 3.14Å; T345-T349 PolarHBondContact O-OG1 3.23Å; L346-T349 PolarHBondContact O-N 3.01Å; L346-T349 PolarHBondContact O-OG1 3.26Å; T349-G393 VanDerWaalsContact CB-CA 3.41Å; T349-G393 WeakPolarHBondContact OG1-CA 3.34Å; T349-I397 HydrophobicContact CG2-CD1 4.15Å
350E93.9Very high94.4Very high59 Ų5925.9 Ų25.928%0.27614%0.138SC..Hα-helixtrans-73.9-33.4170-73.7-176179.300113S306 L346 L347 F348 K396S306-E350 PolarHBondContact OG-OE2 3.4Å; L346-E350 WeakPolarHBondContact O-CB 3.45Å; L346-E350 WeakPolarHBondContact O-CG 3.41Å; L346-E350 PolarHBondContact O-N 2.96Å; L347-E350 PolarHBondContact O-N 3.45Å; F348-E350 VanDerWaalsContact C-N 3.34Å; F348-E350 PolarHBondContact O-N 2.83Å; E350-K396 IonicContact OE1-NZ 3.59Å; E350-K396 PolarHBondContact OE1-NZ 2.69Å
351A94.8Very high93.9Very high0 Ų031.5 Ų31.50%017%0.167CC..Hα-helixtrans-86.5-2.8177.400000113.9K312 Y325 L347 F348 P353 V354K312-A351 WeakPolarHBondContact CD-O 3.38Å; K312-A351 WeakPolarHBondContact CE-O 3.35Å; K312-A351 PolarHBondContact NZ-O 2.75Å; K312-A351 VanDerWaalsContact NZ-O 3.11Å; Y325-A351 HydrophobicContact CD2-CB 4.48Å; Y325-A351 HydrophobicContact CE2-CB 3.91Å; L347-A351 WeakPolarHBondContact O-CB 3.32Å; L347-A351 PolarHBondContact O-N 3.48Å; F348-A351 CarbonylContact O-C 3.5Å; F348-A351 PolarHBondContact O-N 2.84Å; A351-P353 CarbonylContact O-C 3.49Å; A351-P353 VanDerWaalsContact O-C 3.31Å; A351-V354 HydrophobicContact CB-CG2 3.71Å; A351-V354 WeakPolarHBondContact O-CG2 3.47Å; A351-V354 PolarHBondContact O-N 3.12Å
352F94.5Very high93.5Very high21 Ų2138 Ų389%0.09220%0.199CC..  trans-67.7137.6-176.3-177.9-86.2000112F348 I368 Q371 L372 I397F348-F352 AromaticContact CE2-CD2 3.91Å; F348-F352 HydrophobicContact CE2-CD2 3.91Å; F348-F352 HydrophobicContact CZ-CD2 4.02Å; F348-F352 PolarHBondContact O-N 2.83Å; F352-I368 HydrophobicContact CZ-CG2 4.18Å; F352-Q371 HydrophobicContact CD2-CB 4.11Å; F352-Q371 HydrophobicContact CE2-CB 3.72Å; F352-L372 HydrophobicContact CE2-CD2 4.13Å; F352-L372 HydrophobicContact CE2-CG 4.4Å; F352-L372 HydrophobicContact CZ-CD2 3.7Å; F352-L372 HydrophobicContact CZ-CG 4.18Å; F352-I397 HydrophobicContact CB-CD1 3.99Å; F352-I397 HydrophobicContact CB-CG1 4.1Å; F352-I397 HydrophobicContact CD1-CB 4.36Å; F352-I397 HydrophobicContact CD1-CD1 3.92Å; F352-I397 HydrophobicContact CD1-CG1 3.68Å; F352-I397 HydrophobicContact CD1-CG2 3.85Å; F352-I397 HydrophobicContact CD2-CD1 4Å; F352-I397 HydrophobicContact CE1-CD1 4.43Å; F352-I397 HydrophobicContact CE1-CG1 4.3Å; F352-I397 HydrophobicContact CE1-CG2 3.59Å; F352-I397 HydrophobicContact CE2-CD1 4.5Å; F352-I397 HydrophobicContact CG-CD1 3.69Å; F352-I397 HydrophobicContact CG-CG1 3.9Å; F352-I397 HydrophobicContact CZ-CG2 4.21Å
353P93.1Very high93.1Very high32 Ų3241.1 Ų41.121%0.20822%0.215CC..SBendcis-81.7134.9-9.131.6-32.5000111.6K312 A351 H355 I368K312-P353 WeakPolarHBondContact CE-O 3.38Å; K312-P353 PolarHBondContact NZ-O 3.04Å; A351-P353 CarbonylContact O-C 3.49Å; A351-P353 VanDerWaalsContact O-C 3.31Å; P353-H355 PolarHBondContact O-N 3.22Å; P353-H355 PolarHBondContact O-ND1 3.21Å; P353-I368 HydrophobicContact CB-CD1 4.33Å; P353-I368 HydrophobicContact CB-CG1 4.06Å
354V93.4Very high92.6Very high2 Ų242.1 Ų42.11%0.01222%0.221CC..  trans-86.7107.6173.4-177.30000108.4Y322 W330 A351 Q371Y322-V354 HydrophobicContact CD2-CG1 4.28Å; W330-V354 HydrophobicContact CZ2-CB 4.31Å; A351-V354 HydrophobicContact CB-CG2 3.71Å; A351-V354 WeakPolarHBondContact O-CG2 3.47Å; A351-V354 PolarHBondContact O-N 3.12Å; V354-Q371 PolarHBondContact O-NE2 2.88Å
355H90.4Very high92.2Very high40 Ų4047.3 Ų47.319%0.18525%0.249CC..  trans-144.9159.5-17873-78.1000111.2Y322 P353 V364Y322-H355 WeakPolarHBondContact CB-O 3.23Å; P353-H355 PolarHBondContact O-N 3.22Å; P353-H355 PolarHBondContact O-ND1 3.21Å; H355-V364 HydrophobicContact CB-CG1 4.49Å
356D92Very high91.8Very high26 Ų2651.4 Ų51.414%0.13927%0.269CS..  trans-93.2119.5171.2-174.4-11.8000108.9Y322 E358 L359Y322-D356 HydrophobicContact CD1-CB 3.66Å; Y322-D356 HydrophobicContact CD2-CB 4.35Å; Y322-D356 HydrophobicContact CE1-CB 3.82Å; Y322-D356 HydrophobicContact CE2-CB 4.49Å; Y322-D356 HydrophobicContact CG-CB 3.94Å; D356-E358 PolarHBondContact O-N 3.45Å; D356-E358 PolarHBondContact OD1-N 3.02Å; D356-L359 HydrophobicContact CB-CD1 3.81Å; D356-L359 HydrophobicContact CB-CG 3.87Å; D356-L359 PolarHBondContact O-N 3.16Å
357P89.6Confident91.6Very high48 Ų4852.3 Ų52.331%0.31227%0.274SS..THydrogen-bonded Turntrans-68-10.2-179.229-36.4000114P315 K319P315-P357 HydrophobicContact CB-CB 4.32Å; P315-P357 HydrophobicContact CB-CG 4.1Å; P315-P357 WeakPolarHBondContact O-CG 3.4Å; K319-P357 HydrophobicContact CB-CG 4.16Å
358E90.6Very high91.4Very high134 Ų13454.1 Ų54.163%0.62628%0.283SS*.THydrogen-bonded Turntrans-87.9-6.5177.6-65.6176-178.100113.3K319 D356K319-E358 IonicContact NZ-OE1 2.93Å; K319-E358 PolarHBondContact NZ-OE1 2.8Å; K319-E358 IonicContact NZ-OE2 2.69Å; K319-E358 PolarHBondContact NZ-OE2 3.49Å; D356-E358 PolarHBondContact O-N 3.45Å; D356-E358 PolarHBondContact OD1-N 3.02Å
359L89.1Confident91.3Very high57 Ų5757.3 Ų57.330%0.29830%0.298SS..SBendtrans-78.4154.5177.4-67.4175.1000112.1D356 N363 V364D356-L359 HydrophobicContact CB-CD1 3.81Å; D356-L359 HydrophobicContact CB-CG 3.87Å; D356-L359 PolarHBondContact O-N 3.16Å; L359-N363 HydrophobicContact CB-CB 4.21Å; L359-V364 HydrophobicContact CB-CG2 4.02Å
360S89Confident91.3Very high59 Ų5962.2 Ų62.241%0.41332%0.319SS..  trans-63.9151.8171.263.30000111.7E362 N363 V364S360-E362 PolarHBondContact O-N 2.8Å; S360-N363 WeakPolarHBondContact O-CB 3.26Å; S360-N363 PolarHBondContact O-N 2.92Å; S360-N363 PolarHBondContact OG-ND2 3.46Å; S360-V364 WeakPolarHBondContact O-CG2 3.16Å; S360-V364 PolarHBondContact O-N 3.22Å
361N87.5Confident91.4Very high133 Ų13359.7 Ų59.771%0.71131%0.307SS*.Hα-helixtrans-52.7-41.6-179.8-66.6-15.9000112.6N363 V364 D365N361-N363 VanDerWaalsContact C-N 3.33Å; N361-N363 PolarHBondContact O-N 3.36Å; N361-V364 WeakPolarHBondContact O-CB 3.29Å; N361-V364 PolarHBondContact O-N 3.21Å; N361-D365 PolarHBondContact O-N 3.15Å
362E89.3Confident91.5Very high160 Ų16059.9 Ų59.975%0.74831%0.308SS*.Hα-helixtrans-59-41.7176.6-64.2175.8178.400112.9S360 M366S360-E362 PolarHBondContact O-N 2.8Å; E362-M366 WeakPolarHBondContact O-CB 3.42Å; E362-M366 PolarHBondContact O-N 3.39Å
363N89.1Confident91.6Very high65 Ų6563 Ų6335%0.34833%0.325SS..Hα-helixtrans-72.7-33.4178.2-77.5-48.2000111.9L359 S360 N361 N367L359-N363 HydrophobicContact CB-CB 4.21Å; S360-N363 WeakPolarHBondContact O-CB 3.26Å; S360-N363 PolarHBondContact O-N 2.92Å; S360-N363 PolarHBondContact OG-ND2 3.46Å; N361-N363 VanDerWaalsContact C-N 3.33Å; N361-N363 PolarHBondContact O-N 3.36Å; N363-N367 WeakPolarHBondContact O-CB 3.41Å; N363-N367 PolarHBondContact O-N 3.15Å; N363-N367 PolarHBondContact O-ND2 3.29Å; N363-N367 VanDerWaalsContact O-ND2 3.15Å
364V87.9Confident91.8Very high22 Ų2263.3 Ų63.313%0.13333%0.329CS..Hα-helixtrans-64-49.4173.4174.10000110H355 L359 S360 N361 M366 N367 I368H355-V364 HydrophobicContact CB-CG1 4.49Å; L359-V364 HydrophobicContact CB-CG2 4.02Å; S360-V364 WeakPolarHBondContact O-CG2 3.16Å; S360-V364 PolarHBondContact O-N 3.22Å; N361-V364 WeakPolarHBondContact O-CB 3.29Å; N361-V364 PolarHBondContact O-N 3.21Å; V364-M366 PolarHBondContact O-N 3.37Å; V364-N367 PolarHBondContact O-N 3.31Å; V364-N367 VanDerWaalsContact O-N 3.1Å; V364-I368 HydrophobicContact CG1-CD1 3.72Å; V364-I368 HydrophobicContact CG1-CG1 4.36Å; V364-I368 WeakPolarHBondContact O-CG1 3.35Å; V364-I368 PolarHBondContact O-N 3.28Å
365D88.8Confident92.1Very high109 Ų10963.3 Ų63.358%0.58333%0.329SS*.Hα-helixtrans-60.1-45179.1-70.8-19.7000111.7N361 N367 I368 Q369N361-D365 PolarHBondContact O-N 3.15Å; D365-N367 VanDerWaalsContact C-N 3.32Å; D365-N367 PolarHBondContact O-N 3.43Å; D365-I368 PolarHBondContact O-N 3.4Å; D365-Q369 PolarHBondContact O-N 3.46Å
366M91Very high92.4Very high87 Ų8763.8 Ų63.843%0.42933%0.332SS..Hα-helixtrans-60.1-40.3175-178.7-17851.200112.2E362 V364 K370E362-M366 WeakPolarHBondContact O-CB 3.42Å; E362-M366 PolarHBondContact O-N 3.39Å; V364-M366 PolarHBondContact O-N 3.37Å; M366-K370 WeakPolarHBondContact O-CG 3.42Å; M366-K370 PolarHBondContact O-N 2.83Å
367N90.9Very high92.7Very high34 Ų3465.5 Ų65.518%0.18235%0.35CS..Hα-helixtrans-71.6-34.4178.6-75.6-26.4000112.5N363 V364 D365 Q371N363-N367 WeakPolarHBondContact O-CB 3.41Å; N363-N367 PolarHBondContact O-N 3.15Å; N363-N367 PolarHBondContact O-ND2 3.29Å; N363-N367 VanDerWaalsContact O-ND2 3.15Å; V364-N367 PolarHBondContact O-N 3.31Å; V364-N367 VanDerWaalsContact O-N 3.1Å; D365-N367 VanDerWaalsContact C-N 3.32Å; D365-N367 PolarHBondContact O-N 3.43Å; N367-Q371 WeakPolarHBondContact O-CG 3.44Å; N367-Q371 PolarHBondContact O-N 2.82Å; N367-Q371 PolarHBondContact O-NE2 3.11Å; N367-Q371 VanDerWaalsContact O-NE2 3.17Å
368I93.1Very high93.1Very high38 Ų3863.6 Ų63.620%0.19534%0.337CS..Hα-helixtrans-68.3-42.7174.4-69.4171.6000109.7F352 P353 V364 D365 K370 Q371 L372F352-I368 HydrophobicContact CZ-CG2 4.18Å; P353-I368 HydrophobicContact CB-CD1 4.33Å; P353-I368 HydrophobicContact CB-CG1 4.06Å; V364-I368 HydrophobicContact CG1-CD1 3.72Å; V364-I368 HydrophobicContact CG1-CG1 4.36Å; V364-I368 WeakPolarHBondContact O-CG1 3.35Å; V364-I368 PolarHBondContact O-N 3.28Å; D365-I368 PolarHBondContact O-N 3.4Å; I368-K370 PolarHBondContact O-N 2.94Å; I368-Q371 WeakPolarHBondContact O-CA 3.48Å; I368-Q371 WeakPolarHBondContact O-CB 3.26Å; I368-Q371 PolarHBondContact O-N 3.02Å; I368-L372 HydrophobicContact CG2-CD1 3.95Å; I368-L372 HydrophobicContact CG2-CG 4.32Å; I368-L372 WeakPolarHBondContact O-CG 3.49Å; I368-L372 PolarHBondContact O-N 3.4Å
369Q94.7Very high93.5Very high68 Ų6857.2 Ų57.232%0.31831%0.307SS..Hα-helixtrans-57.6-46.8176.6-173.258.451.600111.8D365 Q371 L372 D373D365-Q369 PolarHBondContact O-N 3.46Å; Q369-Q371 PolarHBondContact O-N 3.01Å; Q369-L372 WeakPolarHBondContact O-CB 3.29Å; Q369-L372 PolarHBondContact O-N 2.97Å; Q369-D373 PolarHBondContact NE2-OD1 3.24Å; Q369-D373 PolarHBondContact O-N 3.17Å
370K94.9Very high93.9Very high113 Ų11358.9 Ų58.949%0.49132%0.316SS..Hα-helixtrans-57.9-35175.2-71.8173.8-177.4170.80113.3M366 I368 S374M366-K370 WeakPolarHBondContact O-CG 3.42Å; M366-K370 PolarHBondContact O-N 2.83Å; I368-K370 PolarHBondContact O-N 2.94Å; K370-S374 WeakPolarHBondContact O-CB 3.46Å; K370-S374 PolarHBondContact O-N 3.1Å; K370-S374 PolarHBondContact O-OG 2.87Å
371Q96.5Very high94.3Very high6 Ų656.6 Ų56.63%0.02830%0.299CS..Hα-helixtrans-71.4-39.8176.2-72.7176.573.400111.7W330 F348 F352 V354 N367 I368 Q369 S374 A375W330-Q371 HydrophobicContact CH2-CG 3.5Å; W330-Q371 HydrophobicContact CZ2-CG 4.18Å; W330-Q371 HydrophobicContact CZ3-CG 4.08Å; F348-Q371 HydrophobicContact CE2-CB 3.9Å; F348-Q371 HydrophobicContact CE2-CG 4Å; F348-Q371 HydrophobicContact CZ-CB 4.01Å; F348-Q371 WeakPolarHBondContact CZ-O 3.47Å; F352-Q371 HydrophobicContact CD2-CB 4.11Å; F352-Q371 HydrophobicContact CE2-CB 3.72Å; V354-Q371 PolarHBondContact O-NE2 2.88Å; N367-Q371 WeakPolarHBondContact O-CG 3.44Å; N367-Q371 PolarHBondContact O-N 2.82Å; N367-Q371 PolarHBondContact O-NE2 3.11Å; N367-Q371 VanDerWaalsContact O-NE2 3.17Å; I368-Q371 WeakPolarHBondContact O-CA 3.48Å; I368-Q371 WeakPolarHBondContact O-CB 3.26Å; I368-Q371 PolarHBondContact O-N 3.02Å; Q369-Q371 PolarHBondContact O-N 3.01Å; Q371-S374 WeakPolarHBondContact O-CB 3.39Å; Q371-S374 PolarHBondContact O-N 3.43Å; Q371-A375 PolarHBondContact O-N 2.71Å
372L96.9Very high94.7Very high4 Ų455.7 Ų55.72%0.02130%0.301CS..Hα-helixtrans-63.4-42.5174.6-65.7167.1000111.1F352 I368 Q369 S374 A375 M376 L405 I409 F413F352-L372 HydrophobicContact CE2-CD2 4.13Å; F352-L372 HydrophobicContact CE2-CG 4.4Å; F352-L372 HydrophobicContact CZ-CD2 3.7Å; F352-L372 HydrophobicContact CZ-CG 4.18Å; I368-L372 HydrophobicContact CG2-CD1 3.95Å; I368-L372 HydrophobicContact CG2-CG 4.32Å; I368-L372 WeakPolarHBondContact O-CG 3.49Å; I368-L372 PolarHBondContact O-N 3.4Å; Q369-L372 WeakPolarHBondContact O-CB 3.29Å; Q369-L372 PolarHBondContact O-N 2.97Å; L372-S374 VanDerWaalsContact C-N 3.31Å; L372-S374 PolarHBondContact O-N 2.86Å; L372-A375 WeakPolarHBondContact O-CB 3.39Å; L372-A375 PolarHBondContact O-N 2.84Å; L372-M376 PolarHBondContact O-N 2.99Å; L372-L405 HydrophobicContact CD1-CD2 3.9Å; L372-L405 HydrophobicContact CD2-CD2 3.64Å; L372-L405 HydrophobicContact CG-CD2 4.4Å; L372-I409 HydrophobicContact CD1-CG2 4.26Å; L372-I409 HydrophobicContact CD2-CG2 4.26Å; L372-F413 HydrophobicContact CD2-CE2 3.89Å; L372-F413 HydrophobicContact CD2-CZ 4.18Å
373D96.7Very high95.1Very high85 Ų8550.8 Ų50.846%0.45528%0.278SS..Hα-helixtrans-61.3-41.4174.5-59-23000111.1Q369 M376 A377Q369-D373 PolarHBondContact NE2-OD1 3.24Å; Q369-D373 PolarHBondContact O-N 3.17Å; D373-M376 PolarHBondContact O-N 2.78Å; D373-A377 PolarHBondContact O-N 3.23Å
374S97.2Very high95.5Very high39 Ų3949.1 Ų49.127%0.27327%0.27SS..Hα-helixtrans-63.7-41.6174.7-58.30000111.8K370 Q371 L372 M376 A377 L378K370-S374 WeakPolarHBondContact O-CB 3.46Å; K370-S374 PolarHBondContact O-N 3.1Å; K370-S374 PolarHBondContact O-OG 2.87Å; Q371-S374 WeakPolarHBondContact O-CB 3.39Å; Q371-S374 PolarHBondContact O-N 3.43Å; L372-S374 VanDerWaalsContact C-N 3.31Å; L372-S374 PolarHBondContact O-N 2.86Å; S374-M376 VanDerWaalsContact C-N 3.32Å; S374-M376 PolarHBondContact O-N 2.8Å; S374-A377 PolarHBondContact O-N 3.28Å; S374-L378 VanDerWaalsContact O-CG 3.23Å; S374-L378 WeakPolarHBondContact O-CG 3.49Å; S374-L378 PolarHBondContact O-N 3.38Å
375A97.9Very high96Very high2 Ų250.4 Ų50.42%0.01728%0.278CS..Hα-helixtrans-62.4-40175.700000111.7F348 Q371 L372 L378 L379 V394 F413F348-A375 HydrophobicContact CE1-CB 3.93Å; F348-A375 HydrophobicContact CZ-CB 4.29Å; Q371-A375 PolarHBondContact O-N 2.71Å; L372-A375 WeakPolarHBondContact O-CB 3.39Å; L372-A375 PolarHBondContact O-N 2.84Å; A375-L378 PolarHBondContact O-N 3.25Å; A375-L379 PolarHBondContact O-N 3.43Å; A375-V394 HydrophobicContact CB-CG2 4.16Å; A375-F413 HydrophobicContact CB-CE1 4.31Å; A375-F413 HydrophobicContact CB-CZ 4.1Å
376M97.8Very high96.4Very high50 Ų5045.2 Ų45.225%0.24625%0.25CS..Hα-helixtrans-63.6-47.5174.4-17163.780.300111.2L372 D373 S374 L378 L379 D412 F413 K416L372-M376 PolarHBondContact O-N 2.99Å; D373-M376 PolarHBondContact O-N 2.78Å; S374-M376 VanDerWaalsContact C-N 3.32Å; S374-M376 PolarHBondContact O-N 2.8Å; M376-L378 VanDerWaalsContact C-N 3.25Å; M376-L378 PolarHBondContact O-N 3.09Å; M376-L379 WeakPolarHBondContact O-CB 3.46Å; M376-L379 PolarHBondContact O-N 3.04Å; M376-L379 HydrophobicContact SD-CD1 4.1Å; M376-D412 HydrophobicContact CE-CB 3.93Å; M376-F413 HydrophobicContact CB-CE1 4.04Å; M376-F413 HydrophobicContact CE-CD1 3.47Å; M376-F413 VanDerWaalsContact CE-CD1 3.47Å; M376-F413 HydrophobicContact CE-CE1 3.7Å; M376-F413 HydrophobicContact CE-CG 4.24Å; M376-F413 HydrophobicContact SD-CD1 4.03Å; M376-F413 HydrophobicContact SD-CE1 4.13Å; M376-K416 HydrophobicContact SD-CB 4.23Å; M376-K416 HydrophobicContact SD-CG 4.05Å
377A97.8Very high96.8Very high63 Ų6342.7 Ų42.752%0.52124%0.236SC..Hα-helixtrans-59.5-34.3177.900000113.1D373 S374 L379 D380 D381D373-A377 PolarHBondContact O-N 3.23Å; S374-A377 PolarHBondContact O-N 3.28Å; A377-L379 VanDerWaalsContact C-N 3.31Å; A377-L379 PolarHBondContact O-N 3.44Å; A377-D380 CarbonylContact O-C 3.58Å; A377-D380 WeakPolarHBondContact O-CA 3.34Å; A377-D380 WeakPolarHBondContact O-CB 3.35Å; A377-D380 PolarHBondContact O-N 3.03Å; A377-D381 PolarHBondContact O-N 3.45Å
378L98.4Very high97.1Very high8 Ų842 Ų424%0.04223%0.234CC..Hα-helixtrans-70.5-24.2176.7-68.1165.5000113.3L333 T345 F348 S374 A375 M376 D380 D381 V386 A390L333-L378 HydrophobicContact CB-CD2 4.48Å; L333-L378 HydrophobicContact CD1-CD1 4.36Å; L333-L378 HydrophobicContact CD2-CD1 3.86Å; L333-L378 HydrophobicContact CD2-CD2 4.16Å; T345-L378 HydrophobicContact CG2-CD1 4.05Å; F348-L378 HydrophobicContact CD1-CD1 3.96Å; F348-L378 HydrophobicContact CE1-CD1 4.21Å; S374-L378 VanDerWaalsContact O-CG 3.23Å; S374-L378 WeakPolarHBondContact O-CG 3.49Å; S374-L378 PolarHBondContact O-N 3.38Å; A375-L378 PolarHBondContact O-N 3.25Å; M376-L378 VanDerWaalsContact C-N 3.25Å; M376-L378 PolarHBondContact O-N 3.09Å; L378-D380 PolarHBondContact O-N 3.05Å; L378-D381 WeakPolarHBondContact O-CB 3.14Å; L378-D381 PolarHBondContact O-N 3.33Å; L378-V386 HydrophobicContact CD2-CG1 4.04Å; L378-A390 HydrophobicContact CB-CB 3.75Å; L378-A390 WeakPolarHBondContact O-CB 3.42Å
379L98.3Very high97.3Very high0 Ų041.3 Ų41.30%023%0.231CC..Hα-helixtrans-69.1-18.7169.8-64.6171.9000111.7A375 M376 A377 R387 A390 V394 F413 K416 L417 L421A375-L379 PolarHBondContact O-N 3.43Å; M376-L379 WeakPolarHBondContact O-CB 3.46Å; M376-L379 PolarHBondContact O-N 3.04Å; M376-L379 HydrophobicContact SD-CD1 4.1Å; A377-L379 VanDerWaalsContact C-N 3.31Å; A377-L379 PolarHBondContact O-N 3.44Å; L379-R387 WeakPolarHBondContact O-CD 3.35Å; L379-R387 VanDerWaalsContact O-CG 3.25Å; L379-R387 WeakPolarHBondContact O-CG 3.45Å; L379-A390 HydrophobicContact CD2-CB 3.75Å; L379-A390 HydrophobicContact CG-CB 4.26Å; L379-V394 HydrophobicContact CD1-CG2 4.01Å; L379-V394 HydrophobicContact CD2-CG2 4.2Å; L379-V394 HydrophobicContact CG-CG2 4.21Å; L379-F413 HydrophobicContact CD1-CD1 3.93Å; L379-F413 HydrophobicContact CD1-CE1 4.34Å; L379-K416 HydrophobicContact CB-CG 4.16Å; L379-K416 HydrophobicContact CD1-CB 4.37Å; L379-K416 HydrophobicContact CD1-CG 3.84Å; L379-L417 HydrophobicContact CD2-CD2 4.03Å; L379-L421 HydrophobicContact CB-CD1 4.19Å; L379-L421 HydrophobicContact CD2-CD1 3.66Å; L379-L421 HydrophobicContact CG-CD1 4.46Å
380D97.4Very high97.5Very high92 Ų9238.2 Ų38.249%0.49222%0.217SC..THydrogen-bonded Turntrans-100.510.3176.4-76.7-47.3000113.9A377 L378 K416A377-D380 CarbonylContact O-C 3.58Å; A377-D380 WeakPolarHBondContact O-CA 3.34Å; A377-D380 WeakPolarHBondContact O-CB 3.35Å; A377-D380 PolarHBondContact O-N 3.03Å; L378-D380 PolarHBondContact O-N 3.05Å; D380-K416 WeakPolarHBondContact OD1-CE 3.29Å; D380-K416 IonicContact OD1-NZ 2.76Å; D380-K416 PolarHBondContact OD1-NZ 3.1Å; D380-K416 WeakPolarHBondContact OD2-CE 3.32Å; D380-K416 IonicContact OD2-NZ 2.9Å; D380-K416 PolarHBondContact OD2-NZ 3.37Å; D380-K416 VanDerWaalsContact OD2-NZ 3.09Å
381D98.3Very high97.7Very high11 Ų1132.8 Ų32.86%0.05919%0.193CC..  trans-60.6137.5-178.3-168.5-77.8000112.2R341 A377 L378 H383 V386 R387R341-D381 IonicContact CZ-OD1 2.59Å; R341-D381 IonicContact CZ-OD2 3.15Å; R341-D381 IonicContact NE-OD1 3.11Å; R341-D381 IonicContact NE-OD2 2.72Å; R341-D381 PolarHBondContact NE-OD2 3.43Å; R341-D381 IonicContact NH2-OD1 3.52Å; R341-D381 PolarHBondContact NH2-OD1 3.14Å; R341-D381 IonicContact NH2-OD2 2.78Å; R341-D381 PolarHBondContact NH2-OD2 3.29Å; A377-D381 PolarHBondContact O-N 3.45Å; L378-D381 WeakPolarHBondContact O-CB 3.14Å; L378-D381 PolarHBondContact O-N 3.33Å; D381-H383 PolarHBondContact O-N 3.49Å; D381-H383 WeakPolarHBondContact OD1-CB 3.45Å; D381-H383 PolarHBondContact OD1-N 3.17Å; D381-V386 HydrophobicContact CB-CB 3.66Å; D381-V386 HydrophobicContact CB-CG1 3.54Å; D381-V386 HydrophobicContact CB-CG2 4.48Å; D381-V386 VanDerWaalsContact CG-CB 3.42Å; D381-V386 VanDerWaalsContact CG-CG1 3.46Å; D381-V386 WeakPolarHBondContact OD1-CG2 3.39Å; D381-V386 WeakPolarHBondContact OD2-CG1 3.32Å; D381-R387 HydrophobicContact CB-CG 4Å; D381-R387 WeakPolarHBondContact O-CD 3.29Å; D381-R387 VanDerWaalsContact O-CG 3.25Å; D381-R387 WeakPolarHBondContact O-CG 3.47Å; D381-R387 PolarHBondContact O-NE 3.27Å
382P96.6Very high97.7Very high114 Ų11434.8 Ų34.874%0.7420%0.203SC*.SBendtrans-59.5-24.9-179.523.4-35.6000113.5
383H97.8Very high97.8Very high57 Ų5734.6 Ų34.626%0.26420%0.202SC..SBendtrans-95.9124.6-178.1-160.1-78.9000112.2F338 D381 T385 V386 R387F338-H383 HydrophobicContact CB-CB 3.66Å; F338-H383 AromaticContact CD1-CD2 3.71Å; F338-H383 AromaticContact CD1-NE2 3.73Å; F338-H383 AromaticContact CD2-CD2 3.81Å; F338-H383 AromaticContact CD2-CE1 3.32Å; F338-H383 WeakPolarHBondContact CD2-CE1 3.45Å; F338-H383 AromaticContact CD2-CG 3.62Å; F338-H383 AromaticContact CD2-ND1 3.31Å; F338-H383 VanDerWaalsContact CD2-ND1 3.31Å; F338-H383 WeakPolarHBondContact CD2-ND1 3.29Å; F338-H383 AromaticContact CD2-NE2 3.64Å; F338-H383 AromaticContact CE1-NE2 3.82Å; F338-H383 AromaticContact CE2-CE1 3.38Å; F338-H383 WeakPolarHBondContact CE2-CE1 3.47Å; F338-H383 AromaticContact CE2-ND1 3.85Å; F338-H383 AromaticContact CE2-NE2 3.74Å; F338-H383 HydrophobicContact CG-CB 4.23Å; F338-H383 AromaticContact CG-CD2 3.45Å; F338-H383 VanDerWaalsContact CG-CD2 3.45Å; F338-H383 WeakPolarHBondContact CG-CD2 3.23Å; F338-H383 AromaticContact CG-CE1 3.8Å; F338-H383 AromaticContact CG-CG 3.52Å; F338-H383 AromaticContact CG-ND1 3.73Å; F338-H383 AromaticContact CG-NE2 3.64Å; F338-H383 AromaticContact CZ-CE1 3.9Å; F338-H383 AromaticContact CZ-NE2 3.83Å; D381-H383 PolarHBondContact O-N 3.49Å; D381-H383 WeakPolarHBondContact OD1-CB 3.45Å; D381-H383 PolarHBondContact OD1-N 3.17Å; H383-T385 VanDerWaalsContact C-N 3.27Å; H383-T385 PolarHBondContact CE1-OG1 2.7Å; H383-T385 PolarHBondContact ND1-N 3.19Å; H383-T385 PolarHBondContact ND1-OG1 3.39Å; H383-T385 PolarHBondContact O-N 3.09Å; H383-T385 VanDerWaalsContact O-N 3.12Å; H383-V386 HydrophobicContact CB-CG2 4.2Å; H383-V386 PolarHBondContact O-N 2.63Å; H383-R387 PolarHBondContact O-N 2.96Å
384P97.8Very high97.8Very high29 Ų2930.6 Ų30.619%0.18818%0.181CC..Hα-helixtrans-54.6-36.3-177-27.433.8000115.1V386 R387 S388 V430P384-V386 VanDerWaalsContact C-N 3.32Å; P384-V386 PolarHBondContact O-N 3.09Å; P384-R387 PolarHBondContact O-N 3.15Å; P384-S388 WeakPolarHBondContact O-CB 3.47Å; P384-S388 PolarHBondContact O-N 3.33Å; P384-S388 PolarHBondContact O-OG 3.08Å; P384-V430 HydrophobicContact CB-CG2 3.71Å; P384-V430 VanDerWaalsContact O-CG2 3.28Å; P384-V430 WeakPolarHBondContact O-CG2 3.47Å
385T97Very high97.9Very high49 Ų4928.7 Ų28.730%0.30117%0.168SC..Hα-helixtrans-65.3-33.6179.4-43.80000113.1H383 N389H383-T385 VanDerWaalsContact C-N 3.27Å; H383-T385 PolarHBondContact CE1-OG1 2.7Å; H383-T385 PolarHBondContact ND1-N 3.19Å; H383-T385 PolarHBondContact ND1-OG1 3.39Å; H383-T385 PolarHBondContact O-N 3.09Å; H383-T385 VanDerWaalsContact O-N 3.12Å; T385-N389 PolarHBondContact O-N 3.1Å
386V98.2Very high97.8Very high0 Ų031.3 Ų31.30%018%0.179CC..Hα-helixtrans-69.7-47.5175.7-178.60000108.9F338 R341 A342 L378 D381 H383 P384 S388 N389 A390F338-V386 HydrophobicContact CB-CG2 4.35Å; F338-V386 WeakPolarHBondContact O-CG2 3.44Å; R341-V386 HydrophobicContact CB-CG1 4.47Å; R341-V386 HydrophobicContact CB-CG2 3.98Å; A342-V386 HydrophobicContact CB-CB 4.48Å; A342-V386 HydrophobicContact CB-CG2 3.79Å; L378-V386 HydrophobicContact CD2-CG1 4.04Å; D381-V386 HydrophobicContact CB-CB 3.66Å; D381-V386 HydrophobicContact CB-CG1 3.54Å; D381-V386 HydrophobicContact CB-CG2 4.48Å; D381-V386 VanDerWaalsContact CG-CB 3.42Å; D381-V386 VanDerWaalsContact CG-CG1 3.46Å; D381-V386 WeakPolarHBondContact OD1-CG2 3.39Å; D381-V386 WeakPolarHBondContact OD2-CG1 3.32Å; H383-V386 HydrophobicContact CB-CG2 4.2Å; H383-V386 PolarHBondContact O-N 2.63Å; P384-V386 VanDerWaalsContact C-N 3.32Å; P384-V386 PolarHBondContact O-N 3.09Å; V386-S388 VanDerWaalsContact C-N 3.3Å; V386-S388 PolarHBondContact O-N 3.32Å; V386-N389 WeakPolarHBondContact O-CB 3.44Å; V386-N389 PolarHBondContact O-N 3.27Å; V386-A390 WeakPolarHBondContact O-CB 3.21Å; V386-A390 PolarHBondContact O-N 3.01Å
387R98.3Very high97.7Very high35 Ų3529.1 Ų29.113%0.13217%0.168CC..Hα-helixtrans-59.3-38.1177-67.6-170.5-79.7149.211.8113.5L379 D381 H383 P384 A390 T391 D424 S426 V430L379-R387 WeakPolarHBondContact O-CD 3.35Å; L379-R387 VanDerWaalsContact O-CG 3.25Å; L379-R387 WeakPolarHBondContact O-CG 3.45Å; D381-R387 HydrophobicContact CB-CG 4Å; D381-R387 WeakPolarHBondContact O-CD 3.29Å; D381-R387 VanDerWaalsContact O-CG 3.25Å; D381-R387 WeakPolarHBondContact O-CG 3.47Å; D381-R387 PolarHBondContact O-NE 3.27Å; H383-R387 PolarHBondContact O-N 2.96Å; P384-R387 PolarHBondContact O-N 3.15Å; R387-A390 PolarHBondContact O-N 3.32Å; R387-T391 WeakPolarHBondContact O-CB 3.43Å; R387-T391 PolarHBondContact O-N 3.2Å; R387-T391 PolarHBondContact O-OG1 3.37Å; R387-D424 IonicContact CZ-OD2 3.08Å; R387-D424 IonicContact NE-OD2 3.26Å; R387-D424 IonicContact NH1-OD1 3.34Å; R387-D424 IonicContact NH1-OD2 2.7Å; R387-D424 PolarHBondContact NH1-OD2 2.91Å; R387-D424 IonicContact NH2-OD1 2.89Å; R387-D424 IonicContact NH2-OD2 2.64Å; R387-D424 PolarHBondContact NH2-OD2 2.86Å; R387-D424 VanDerWaalsContact NH2-OD2 3.1Å; R387-S426 PolarHBondContact NH2-OG 3.34Å; R387-V430 HydrophobicContact CB-CG1 4.37Å; R387-V430 HydrophobicContact CB-CG2 4.28Å
388S97.8Very high97.7Very high19 Ų1926.1 Ų26.113%0.13314%0.144CC..Hα-helixtrans-63.7-41.1174.6-58.40000112P384 V386 T391 L392 V430P384-S388 WeakPolarHBondContact O-CB 3.47Å; P384-S388 PolarHBondContact O-N 3.33Å; P384-S388 PolarHBondContact O-OG 3.08Å; V386-S388 VanDerWaalsContact C-N 3.3Å; V386-S388 PolarHBondContact O-N 3.32Å; S388-T391 WeakPolarHBondContact O-CB 3.49Å; S388-L392 PolarHBondContact O-N 3.14Å; S388-V430 WeakPolarHBondContact OG-CG2 3.34Å
389N97.4Very high97.5Very high24 Ų2427 Ų2713%0.12815%0.152CC..Hα-helixtrans-71.2-39.1176.1-76.20.4000112.3R293 A342 T345 L346 T385 V386 T391 L392 G393R293-N389 PolarHBondContact NH2-ND2 3.13Å; A342-N389 PolarHBondContact O-ND2 3.26Å; T345-N389 HydrophobicContact CG2-CB 4.03Å; L346-N389 VanDerWaalsContact CD1-ND2 3.34Å; L346-N389 WeakPolarHBondContact CD1-ND2 3.11Å; L346-N389 HydrophobicContact CD2-CB 3.97Å; L346-N389 HydrophobicContact CG-CB 4.09Å; L346-N389 WeakPolarHBondContact CG-ND2 3.48Å; T385-N389 PolarHBondContact O-N 3.1Å; V386-N389 WeakPolarHBondContact O-CB 3.44Å; V386-N389 PolarHBondContact O-N 3.27Å; N389-T391 VanDerWaalsContact C-N 3.32Å; N389-L392 PolarHBondContact O-N 3.06Å; N389-G393 PolarHBondContact O-N 2.89Å
390A98.4Very high97.1Very high2 Ų235.2 Ų35.22%0.01719%0.188CC..Hα-helixtrans-62.1-41.6174.800000110.8T345 L378 L379 V386 R387 L392 G393 V394T345-A390 HydrophobicContact CG2-CB 4.01Å; L378-A390 HydrophobicContact CB-CB 3.75Å; L378-A390 WeakPolarHBondContact O-CB 3.42Å; L379-A390 HydrophobicContact CD2-CB 3.75Å; L379-A390 HydrophobicContact CG-CB 4.26Å; V386-A390 WeakPolarHBondContact O-CB 3.21Å; V386-A390 PolarHBondContact O-N 3.01Å; R387-A390 PolarHBondContact O-N 3.32Å; A390-L392 PolarHBondContact O-N 2.85Å; A390-G393 PolarHBondContact O-N 2.92Å; A390-G393 VanDerWaalsContact O-N 3.16Å; A390-V394 WeakPolarHBondContact O-CB 3.49Å; A390-V394 VanDerWaalsContact O-CG2 3.32Å; A390-V394 WeakPolarHBondContact O-CG2 3.47Å; A390-V394 PolarHBondContact O-N 2.99Å
391T98.5Very high96.9Very high0 Ų031.7 Ų31.70%017%0.17CC..Hα-helixtrans-56.4-49.8174.2-64.70000111.8R387 S388 N389 G393 C395 L417 L421 V434 C437R387-T391 WeakPolarHBondContact O-CB 3.43Å; R387-T391 PolarHBondContact O-N 3.2Å; R387-T391 PolarHBondContact O-OG1 3.37Å; S388-T391 WeakPolarHBondContact O-CB 3.49Å; N389-T391 VanDerWaalsContact C-N 3.32Å; T391-G393 VanDerWaalsContact C-N 3.35Å; T391-G393 PolarHBondContact O-N 2.99Å; T391-C395 WeakPolarHBondContact O-CB 3.16Å; T391-C395 PolarHBondContact O-N 3.25Å; T391-C395 PolarHBondContact O-SG 2.69Å; T391-L417 HydrophobicContact CG2-CD2 3.82Å; T391-L421 VanDerWaalsContact OG1-CD1 3.27Å; T391-L421 WeakPolarHBondContact OG1-CD1 3.38Å; T391-V434 HydrophobicContact CG2-CB 4.49Å; T391-V434 HydrophobicContact CG2-CG2 4.04Å; T391-C437 HydrophobicContact CG2-CB 4.12Å
392L98.1Very high96.7Very high47 Ų4732.7 Ų32.725%0.24617%0.173CC..Hα-helixtrans-59.5-46.3174.8175.362.7000111.8L346 S388 N389 A390 C395 K396 C437 I440L346-L392 HydrophobicContact CD2-CD2 4.29Å; S388-L392 PolarHBondContact O-N 3.14Å; N389-L392 PolarHBondContact O-N 3.06Å; A390-L392 PolarHBondContact O-N 2.85Å; L392-C395 PolarHBondContact O-N 3.18Å; L392-K396 HydrophobicContact CD1-CD 4.45Å; L392-K396 HydrophobicContact CD1-CG 4.42Å; L392-K396 HydrophobicContact CG-CD 4.43Å; L392-K396 WeakPolarHBondContact O-CG 3.41Å; L392-K396 PolarHBondContact O-N 3.23Å; L392-C437 VanDerWaalsContact CA-SG 3.53Å; L392-I440 HydrophobicContact CD1-CD1 3.72Å
393G97.2Very high96.6Very high0 Ų034.6 Ų34.60%017%0.172CC..Hα-helixtrans-61.8-49.8-17900000113T349 N389 A390 T391 C395 K396 I397T349-G393 VanDerWaalsContact CB-CA 3.41Å; T349-G393 WeakPolarHBondContact OG1-CA 3.34Å; N389-G393 PolarHBondContact O-N 2.89Å; A390-G393 PolarHBondContact O-N 2.92Å; A390-G393 VanDerWaalsContact O-N 3.16Å; T391-G393 VanDerWaalsContact C-N 3.35Å; T391-G393 PolarHBondContact O-N 2.99Å; G393-C395 PolarHBondContact O-N 3.17Å; G393-K396 WeakPolarHBondContact O-CB 3.47Å; G393-K396 PolarHBondContact O-N 3.24Å; G393-K396 VanDerWaalsContact O-N 3.17Å; G393-I397 VanDerWaalsContact O-CG1 3.32Å; G393-I397 WeakPolarHBondContact O-CG1 3.23Å; G393-I397 PolarHBondContact O-N 3.21Å
394V98.2Very high96.2Very high1 Ų138.9 Ų38.91%0.00620%0.196CC..Hα-helixtrans-60.8-43.4177.2167.80000110.8A375 L379 A390 K396 I397 L398 F413 L417A375-V394 HydrophobicContact CB-CG2 4.16Å; L379-V394 HydrophobicContact CD1-CG2 4.01Å; L379-V394 HydrophobicContact CD2-CG2 4.2Å; L379-V394 HydrophobicContact CG-CG2 4.21Å; A390-V394 WeakPolarHBondContact O-CB 3.49Å; A390-V394 VanDerWaalsContact O-CG2 3.32Å; A390-V394 WeakPolarHBondContact O-CG2 3.47Å; A390-V394 PolarHBondContact O-N 2.99Å; V394-K396 VanDerWaalsContact C-N 3.33Å; V394-K396 PolarHBondContact O-N 3.19Å; V394-I397 PolarHBondContact O-N 2.87Å; V394-L398 HydrophobicContact CG1-CD1 4.12Å; V394-L398 HydrophobicContact CG1-CG 4.37Å; V394-L398 WeakPolarHBondContact O-CB 3.46Å; V394-L398 WeakPolarHBondContact O-CG 3.3Å; V394-L398 PolarHBondContact O-N 3.2Å; V394-F413 HydrophobicContact CG1-CB 3.77Å; V394-F413 HydrophobicContact CG1-CD1 3.65Å; V394-F413 HydrophobicContact CG1-CD2 4.08Å; V394-F413 HydrophobicContact CG1-CE1 4.24Å; V394-F413 HydrophobicContact CG1-CG 3.58Å; V394-F413 HydrophobicContact CG2-CD1 4.21Å; V394-F413 HydrophobicContact CG2-CE1 4.07Å; V394-L417 HydrophobicContact CG1-CD1 4.38Å
395C98.2Very high96Very high0 Ų038.1 Ų38.10%019%0.19CC..Hα-helixtrans-62.9-38.5176-70.80000112.5T391 L392 G393 A399 L417 C437 V441T391-C395 WeakPolarHBondContact O-CB 3.16Å; T391-C395 PolarHBondContact O-N 3.25Å; T391-C395 PolarHBondContact O-SG 2.69Å; L392-C395 PolarHBondContact O-N 3.18Å; G393-C395 PolarHBondContact O-N 3.17Å; C395-A399 VanDerWaalsContact O-CB 3.32Å; C395-A399 WeakPolarHBondContact O-CB 3.21Å; C395-A399 PolarHBondContact O-N 3.18Å; C395-L417 VanDerWaalsContact SG-CD1 3.56Å; C395-C437 HydrophobicContact CB-CB 3.73Å; C395-C437 WeakPolarHBondContact SG-CB 3.48Å; C395-V441 HydrophobicContact CB-CG2 3.74Å
396K96.1Very high95.9Very high56 Ų5638.3 Ų38.324%0.24319%0.193CC..Hα-helixtrans-65.4-40.9173.6-75.8177.2175.9-179.70111.9E350 L392 G393 V394 A399 K400E350-K396 IonicContact OE1-NZ 3.59Å; E350-K396 PolarHBondContact OE1-NZ 2.69Å; L392-K396 HydrophobicContact CD1-CD 4.45Å; L392-K396 HydrophobicContact CD1-CG 4.42Å; L392-K396 HydrophobicContact CG-CD 4.43Å; L392-K396 WeakPolarHBondContact O-CG 3.41Å; L392-K396 PolarHBondContact O-N 3.23Å; G393-K396 WeakPolarHBondContact O-CB 3.47Å; G393-K396 PolarHBondContact O-N 3.24Å; G393-K396 VanDerWaalsContact O-N 3.17Å; V394-K396 VanDerWaalsContact C-N 3.33Å; V394-K396 PolarHBondContact O-N 3.19Å; K396-A399 PolarHBondContact O-N 2.84Å; K396-K400 WeakPolarHBondContact O-CB 3.35Å; K396-K400 WeakPolarHBondContact O-CG 3.29Å; K396-K400 PolarHBondContact O-N 3.31Å
397I95.9Very high95.7Very high5 Ų543.1 Ų43.13%0.02622%0.224CC..Hα-helixtrans-63-49.4176.7-69.8167.6000109.9T349 F352 G393 V394 A399 K400 C401 L405T349-I397 HydrophobicContact CG2-CD1 4.15Å; F352-I397 HydrophobicContact CB-CD1 3.99Å; F352-I397 HydrophobicContact CB-CG1 4.1Å; F352-I397 HydrophobicContact CD1-CB 4.36Å; F352-I397 HydrophobicContact CD1-CD1 3.92Å; F352-I397 HydrophobicContact CD1-CG1 3.68Å; F352-I397 HydrophobicContact CD1-CG2 3.85Å; F352-I397 HydrophobicContact CD2-CD1 4Å; F352-I397 HydrophobicContact CE1-CD1 4.43Å; F352-I397 HydrophobicContact CE1-CG1 4.3Å; F352-I397 HydrophobicContact CE1-CG2 3.59Å; F352-I397 HydrophobicContact CE2-CD1 4.5Å; F352-I397 HydrophobicContact CG-CD1 3.69Å; F352-I397 HydrophobicContact CG-CG1 3.9Å; F352-I397 HydrophobicContact CZ-CG2 4.21Å; G393-I397 VanDerWaalsContact O-CG1 3.32Å; G393-I397 WeakPolarHBondContact O-CG1 3.23Å; G393-I397 PolarHBondContact O-N 3.21Å; V394-I397 PolarHBondContact O-N 2.87Å; I397-A399 VanDerWaalsContact C-N 3.34Å; I397-A399 PolarHBondContact O-N 2.7Å; I397-K400 PolarHBondContact O-N 3.46Å; I397-C401 WeakPolarHBondContact O-CA 3.01Å; I397-C401 VanDerWaalsContact O-CB 3.29Å; I397-C401 WeakPolarHBondContact O-CB 3.36Å; I397-C401 PolarHBondContact O-N 2.74Å; I397-L405 HydrophobicContact CG2-CD1 4.02Å
398L96.9Very high95.6Very high0 Ų045.9 Ų45.90%024%0.244CC..Hα-helixtrans-58.3-44.6176.2-70.9175.8000111.8V394 K400 W402 L405 I410 F413 L414 V441V394-L398 HydrophobicContact CG1-CD1 4.12Å; V394-L398 HydrophobicContact CG1-CG 4.37Å; V394-L398 WeakPolarHBondContact O-CB 3.46Å; V394-L398 WeakPolarHBondContact O-CG 3.3Å; V394-L398 PolarHBondContact O-N 3.2Å; L398-K400 PolarHBondContact O-N 3.48Å; L398-W402 HydrophobicContact CB-CE3 4.41Å; L398-W402 WeakPolarHBondContact O-CB 3.46Å; L398-W402 PolarHBondContact O-N 3.16Å; L398-L405 HydrophobicContact CD2-CD1 4.06Å; L398-I410 HydrophobicContact CD2-CB 4.27Å; L398-I410 HydrophobicContact CD2-CG1 4.07Å; L398-I410 HydrophobicContact CD2-CG2 4.14Å; L398-F413 HydrophobicContact CD1-CB 4.1Å; L398-F413 HydrophobicContact CD2-CB 4.47Å; L398-F413 HydrophobicContact CD2-CD2 4.12Å; L398-L414 HydrophobicContact CD1-CD2 3.73Å; L398-L414 HydrophobicContact CD1-CG 4.03Å; L398-V441 HydrophobicContact CB-CG2 4.31Å
399A94.5Very high95.5Very high26 Ų2646.1 Ų46.122%0.21524%0.244CC..Hα-helixtrans-64.9-39.1-179.700000112.9C395 K396 I397 I440C395-A399 VanDerWaalsContact O-CB 3.32Å; C395-A399 WeakPolarHBondContact O-CB 3.21Å; C395-A399 PolarHBondContact O-N 3.18Å; K396-A399 PolarHBondContact O-N 2.84Å; I397-A399 VanDerWaalsContact C-N 3.34Å; I397-A399 PolarHBondContact O-N 2.7Å; A399-I440 HydrophobicContact CB-CG2 3.86Å
400K90.9Very high95.5Very high172 Ų17245.4 Ų45.475%0.74824%0.24SC*.Hα-helixtrans-88-33.7-176.1-71.1-176.8176.6-173.70114.4K396 I397 L398K396-K400 WeakPolarHBondContact O-CB 3.35Å; K396-K400 WeakPolarHBondContact O-CG 3.29Å; K396-K400 PolarHBondContact O-N 3.31Å; I397-K400 PolarHBondContact O-N 3.46Å; L398-K400 PolarHBondContact O-N 3.48Å
401C92.4Very high95.4Very high18 Ų1847.1 Ų47.112%0.12225%0.25CS..Hα-helixtrans-114.818-168.4-56.70000112.7I397 E403 L404 L405I397-C401 WeakPolarHBondContact O-CA 3.01Å; I397-C401 VanDerWaalsContact O-CB 3.29Å; I397-C401 WeakPolarHBondContact O-CB 3.36Å; I397-C401 PolarHBondContact O-N 2.74Å; C401-E403 VanDerWaalsContact C-N 3.28Å; C401-E403 PolarHBondContact O-N 2.89Å; C401-L404 HydrophobicContact CB-CB 4.45Å; C401-L404 PolarHBondContact O-N 3.4Å; C401-L405 HydrophobicContact CB-CD1 4.22Å; C401-L405 HydrophobicContact CB-CG 4.18Å; C401-L405 VanDerWaalsContact O-CG 3.32Å; C401-L405 WeakPolarHBondContact O-CG 3.46Å; C401-L405 PolarHBondContact O-N 3.16Å
402W94.9Very high95.4Very high32 Ų3250.7 Ų50.712%0.12127%0.27CS..G310 helixtrans-49.1-46.2-173.9-169-85.9000113.6L398 L404 I410 L414 V441 N444 Q446 S447 L450L398-W402 HydrophobicContact CB-CE3 4.41Å; L398-W402 WeakPolarHBondContact O-CB 3.46Å; L398-W402 PolarHBondContact O-N 3.16Å; W402-L404 VanDerWaalsContact C-N 3.31Å; W402-L404 PolarHBondContact O-N 2.98Å; W402-I410 HydrophobicContact CD2-CD1 4.07Å; W402-I410 HydrophobicContact CD2-CG2 4.49Å; W402-I410 HydrophobicContact CE3-CG2 4.15Å; W402-I410 HydrophobicContact CG-CD1 4.31Å; W402-I410 HydrophobicContact CH2-CG2 3.33Å; W402-I410 HydrophobicContact CZ2-CD1 4.45Å; W402-I410 HydrophobicContact CZ2-CG2 3.72Å; W402-I410 HydrophobicContact CZ3-CG2 3.57Å; W402-I410 WeakPolarHBondContact O-CD1 3.41Å; W402-L414 HydrophobicContact CH2-CD1 3.99Å; W402-L414 HydrophobicContact CZ3-CD1 4.27Å; W402-V441 HydrophobicContact CZ3-CG1 4.06Å; W402-N444 WeakPolarHBondContact CB-ND2 3.25Å; W402-Q446 HydrophobicContact CG-CB 4.26Å; W402-Q446 WeakPolarHBondContact CZ2-O 3.47Å; W402-S447 VanDerWaalsContact CH2-CA 3.44Å; W402-L450 HydrophobicContact CH2-CD2 4.47Å
403E93.1Very high95.4Very high154 Ų15448.6 Ų48.672%0.7226%0.258SS*.G310 helixtrans-74.2-20.4-178.6-59-174.5163.600113.8C401 Q446C401-E403 VanDerWaalsContact C-N 3.28Å; C401-E403 PolarHBondContact O-N 2.89Å; E403-Q446 PolarHBondContact OE1-NE2 3.27Å
404L90.2Very high95.4Very high147 Ų14748.6 Ų48.677%0.7726%0.258SS*.G310 helixtrans-90.9-12.1-178.2-57.8178.1000112.5C401 W402C401-L404 HydrophobicContact CB-CB 4.45Å; C401-L404 PolarHBondContact O-N 3.4Å; W402-L404 VanDerWaalsContact C-N 3.31Å; W402-L404 PolarHBondContact O-N 2.98Å
405L93.9Very high95.3Very high13 Ų1353.3 Ų53.37%0.06828%0.279CS..SBendtrans-96.9142-175.5-67.4172000111.3L372 I397 L398 C401 I410L372-L405 HydrophobicContact CD1-CD2 3.9Å; L372-L405 HydrophobicContact CD2-CD2 3.64Å; L372-L405 HydrophobicContact CG-CD2 4.4Å; I397-L405 HydrophobicContact CG2-CD1 4.02Å; L398-L405 HydrophobicContact CD2-CD1 4.06Å; C401-L405 HydrophobicContact CB-CD1 4.22Å; C401-L405 HydrophobicContact CB-CG 4.18Å; C401-L405 VanDerWaalsContact O-CG 3.32Å; C401-L405 WeakPolarHBondContact O-CG 3.46Å; C401-L405 PolarHBondContact O-N 3.16Å; L405-I410 HydrophobicContact CB-CD1 4.07Å; L405-I410 HydrophobicContact CB-CG1 3.82Å; L405-I410 HydrophobicContact CD1-CG1 4.39Å
406P94.2Very high95.3Very high54 Ų5454.2 Ų54.235%0.35128%0.283SS..  trans-59137.3171-23.233.2000111.5T408 I409 I410P406-T408 PolarHBondContact O-N 3.42Å; P406-T408 VanDerWaalsContact O-N 3.11Å; P406-I409 HydrophobicContact CB-CG1 4.05Å; P406-I409 HydrophobicContact CG-CG1 4.13Å; P406-I409 WeakPolarHBondContact O-CB 3.45Å; P406-I409 PolarHBondContact O-N 3.35Å; P406-I410 PolarHBondContact O-N 3Å
407P94.8Very high95.4Very high101 Ų10151.5 Ų51.566%0.65627%0.271SS*.Hα-helixtrans-57-29.8-178.8-28.135000114.8T411P407-T411 WeakPolarHBondContact O-CB 3.42Å; P407-T411 PolarHBondContact O-N 3.18Å; P407-T411 VanDerWaalsContact O-N 3.09Å; P407-T411 PolarHBondContact O-OG1 3.25Å
408T95.4Very high95.4Very high92 Ų9251.5 Ų51.556%0.56427%0.271SS*.Hα-helixtrans-63.6-48.5175.149.10000111.2P406 I410 T411 D412P406-T408 PolarHBondContact O-N 3.42Å; P406-T408 VanDerWaalsContact O-N 3.11Å; T408-I410 PolarHBondContact O-N 3.24Å; T408-T411 WeakPolarHBondContact O-CB 3.46Å; T408-T411 PolarHBondContact O-N 3.19Å; T408-T411 VanDerWaalsContact O-N 3.13Å; T408-D412 VanDerWaalsContact O-CG 3.24Å; T408-D412 PolarHBondContact O-N 2.96Å
409I96.3Very high95.3Very high24 Ų2454.9 Ų54.912%0.12329%0.292CS..Hα-helixtrans-61.5-42.7178.7-60.6-61.7000111.6L372 P406 T411 D412 F413L372-I409 HydrophobicContact CD1-CG2 4.26Å; L372-I409 HydrophobicContact CD2-CG2 4.26Å; P406-I409 HydrophobicContact CB-CG1 4.05Å; P406-I409 HydrophobicContact CG-CG1 4.13Å; P406-I409 WeakPolarHBondContact O-CB 3.45Å; P406-I409 PolarHBondContact O-N 3.35Å; I409-T411 VanDerWaalsContact C-N 3.3Å; I409-T411 PolarHBondContact O-N 3.09Å; I409-D412 PolarHBondContact O-N 3.46Å; I409-F413 HydrophobicContact CG2-CD2 3.71Å; I409-F413 HydrophobicContact CG2-CE2 3.39Å; I409-F413 HydrophobicContact CG2-CZ 4.2Å; I409-F413 WeakPolarHBondContact O-CD2 3.14Å; I409-F413 PolarHBondContact O-N 3.49Å
410I97.4Very high95.3Very high9 Ų958.3 Ų58.35%0.04630%0.304CS..Hα-helixtrans-58-47.1175.3-64.3173.6000110.4L398 W402 L405 P406 T408 L414 L450L398-I410 HydrophobicContact CD2-CB 4.27Å; L398-I410 HydrophobicContact CD2-CG1 4.07Å; L398-I410 HydrophobicContact CD2-CG2 4.14Å; W402-I410 HydrophobicContact CD2-CD1 4.07Å; W402-I410 HydrophobicContact CD2-CG2 4.49Å; W402-I410 HydrophobicContact CE3-CG2 4.15Å; W402-I410 HydrophobicContact CG-CD1 4.31Å; W402-I410 HydrophobicContact CH2-CG2 3.33Å; W402-I410 HydrophobicContact CZ2-CD1 4.45Å; W402-I410 HydrophobicContact CZ2-CG2 3.72Å; W402-I410 HydrophobicContact CZ3-CG2 3.57Å; W402-I410 WeakPolarHBondContact O-CD1 3.41Å; L405-I410 HydrophobicContact CB-CD1 4.07Å; L405-I410 HydrophobicContact CB-CG1 3.82Å; L405-I410 HydrophobicContact CD1-CG1 4.39Å; P406-I410 PolarHBondContact O-N 3Å; T408-I410 PolarHBondContact O-N 3.24Å; I410-L414 HydrophobicContact CG2-CD1 4.21Å; I410-L414 WeakPolarHBondContact O-CG 3.14Å; I410-L414 PolarHBondContact O-N 3.4Å; I410-L450 HydrophobicContact CG2-CD2 4.13Å
411T96.5Very high95.7Very high38 Ų3850.4 Ų50.423%0.23327%0.269CS..Hα-helixtrans-63.5-43.2-179.8-58.50000111.3P407 T408 I409 L414 K415P407-T411 WeakPolarHBondContact O-CB 3.42Å; P407-T411 PolarHBondContact O-N 3.18Å; P407-T411 VanDerWaalsContact O-N 3.09Å; P407-T411 PolarHBondContact O-OG1 3.25Å; T408-T411 WeakPolarHBondContact O-CB 3.46Å; T408-T411 PolarHBondContact O-N 3.19Å; T408-T411 VanDerWaalsContact O-N 3.13Å; I409-T411 VanDerWaalsContact C-N 3.3Å; I409-T411 PolarHBondContact O-N 3.09Å; T411-L414 PolarHBondContact O-N 2.95Å; T411-K415 HydrophobicContact CG2-CD 4.06Å; T411-K415 HydrophobicContact CG2-CG 4.42Å; T411-K415 WeakPolarHBondContact O-CB 3.34Å; T411-K415 WeakPolarHBondContact O-CG 3.32Å; T411-K415 PolarHBondContact O-N 3.04Å
412D97.3Very high95.9Very high76 Ų7649.7 Ų49.741%0.40627%0.265SS..Hα-helixtrans-66.6-43.2-178.7-67.2-20.2000111.7M376 T408 I409 K415 K416M376-D412 HydrophobicContact CE-CB 3.93Å; T408-D412 VanDerWaalsContact O-CG 3.24Å; T408-D412 PolarHBondContact O-N 2.96Å; I409-D412 PolarHBondContact O-N 3.46Å; D412-K415 PolarHBondContact O-N 3.04Å; D412-K416 WeakPolarHBondContact O-CB 3.42Å; D412-K416 PolarHBondContact O-N 3.01Å
413F98.3Very high95.9Very high2 Ų251.6 Ų51.61%0.00929%0.288CS..Hα-helixtrans-60.9-49.5173.3-77.4-45.2000112L372 A375 M376 L379 V394 L398 I409 K415 K416 L417L372-F413 HydrophobicContact CD2-CE2 3.89Å; L372-F413 HydrophobicContact CD2-CZ 4.18Å; A375-F413 HydrophobicContact CB-CE1 4.31Å; A375-F413 HydrophobicContact CB-CZ 4.1Å; M376-F413 HydrophobicContact CB-CE1 4.04Å; M376-F413 HydrophobicContact CE-CD1 3.47Å; M376-F413 VanDerWaalsContact CE-CD1 3.47Å; M376-F413 HydrophobicContact CE-CE1 3.7Å; M376-F413 HydrophobicContact CE-CG 4.24Å; M376-F413 HydrophobicContact SD-CD1 4.03Å; M376-F413 HydrophobicContact SD-CE1 4.13Å; L379-F413 HydrophobicContact CD1-CD1 3.93Å; L379-F413 HydrophobicContact CD1-CE1 4.34Å; V394-F413 HydrophobicContact CG1-CB 3.77Å; V394-F413 HydrophobicContact CG1-CD1 3.65Å; V394-F413 HydrophobicContact CG1-CD2 4.08Å; V394-F413 HydrophobicContact CG1-CE1 4.24Å; V394-F413 HydrophobicContact CG1-CG 3.58Å; V394-F413 HydrophobicContact CG2-CD1 4.21Å; V394-F413 HydrophobicContact CG2-CE1 4.07Å; L398-F413 HydrophobicContact CD1-CB 4.1Å; L398-F413 HydrophobicContact CD2-CB 4.47Å; L398-F413 HydrophobicContact CD2-CD2 4.12Å; I409-F413 HydrophobicContact CG2-CD2 3.71Å; I409-F413 HydrophobicContact CG2-CE2 3.39Å; I409-F413 HydrophobicContact CG2-CZ 4.2Å; I409-F413 WeakPolarHBondContact O-CD2 3.14Å; I409-F413 PolarHBondContact O-N 3.49Å; F413-K415 VanDerWaalsContact C-N 3.33Å; F413-K415 PolarHBondContact O-N 3.33Å; F413-K416 WeakPolarHBondContact O-CB 3.21Å; F413-K416 PolarHBondContact O-N 3.5Å; F413-L417 VanDerWaalsContact O-CG 3.29Å; F413-L417 WeakPolarHBondContact O-CG 3.49Å; F413-L417 PolarHBondContact O-N 3.32Å
414L97.7Very high96.1Very high0 Ų044.6 Ų44.60%026%0.255CS..Hα-helixtrans-64-39.8-178.4-73.3-179.9000111.9L398 W402 I410 T411 L417 V418 L438 V441 L450 L451 L454L398-L414 HydrophobicContact CD1-CD2 3.73Å; L398-L414 HydrophobicContact CD1-CG 4.03Å; W402-L414 HydrophobicContact CH2-CD1 3.99Å; W402-L414 HydrophobicContact CZ3-CD1 4.27Å; I410-L414 HydrophobicContact CG2-CD1 4.21Å; I410-L414 WeakPolarHBondContact O-CG 3.14Å; I410-L414 PolarHBondContact O-N 3.4Å; T411-L414 PolarHBondContact O-N 2.95Å; L414-L417 HydrophobicContact CD2-CD1 4.48Å; L414-L417 PolarHBondContact O-N 3.25Å; L414-V418 WeakPolarHBondContact O-CG1 3.38Å; L414-V418 WeakPolarHBondContact O-CG2 3.48Å; L414-V418 PolarHBondContact O-N 3.47Å; L414-L438 HydrophobicContact CD2-CD2 4.08Å; L414-V441 HydrophobicContact CD2-CG1 4.49Å; L414-L450 HydrophobicContact CD1-CD2 3.64Å; L414-L450 HydrophobicContact CD1-CG 4.02Å; L414-L451 HydrophobicContact CD1-CD2 4.2Å; L414-L451 HydrophobicContact CD2-CD2 4.08Å; L414-L454 HydrophobicContact CB-CD1 3.69Å; L414-L454 HydrophobicContact CD1-CD1 4.42Å
415K96.7Very high96.2Very high100 Ų10043.6 Ų43.644%0.43526%0.26SS..Hα-helixtrans-58.4-53.3171.4-77.8177.9178.91750110.6T411 D412 F413 L417 V418 T419 L454T411-K415 HydrophobicContact CG2-CD 4.06Å; T411-K415 HydrophobicContact CG2-CG 4.42Å; T411-K415 WeakPolarHBondContact O-CB 3.34Å; T411-K415 WeakPolarHBondContact O-CG 3.32Å; T411-K415 PolarHBondContact O-N 3.04Å; D412-K415 PolarHBondContact O-N 3.04Å; F413-K415 VanDerWaalsContact C-N 3.33Å; F413-K415 PolarHBondContact O-N 3.33Å; K415-L417 PolarHBondContact O-N 3.06Å; K415-V418 PolarHBondContact O-N 2.93Å; K415-V418 VanDerWaalsContact O-N 3.11Å; K415-T419 WeakPolarHBondContact O-CB 3.47Å; K415-T419 PolarHBondContact O-N 3.21Å; K415-T419 PolarHBondContact O-OG1 3.5Å; K415-L454 HydrophobicContact CG-CD2 4.32Å
416K97.9Very high96.2Very high19 Ų1946.3 Ų46.38%0.08328%0.28CS..Iπ-helixtrans-51.3-44.7178.5-17362.5170.1-168.60112.4M376 L379 D380 D412 F413 E420 L421M376-K416 HydrophobicContact SD-CB 4.23Å; M376-K416 HydrophobicContact SD-CG 4.05Å; L379-K416 HydrophobicContact CB-CG 4.16Å; L379-K416 HydrophobicContact CD1-CB 4.37Å; L379-K416 HydrophobicContact CD1-CG 3.84Å; D380-K416 WeakPolarHBondContact OD1-CE 3.29Å; D380-K416 IonicContact OD1-NZ 2.76Å; D380-K416 PolarHBondContact OD1-NZ 3.1Å; D380-K416 WeakPolarHBondContact OD2-CE 3.32Å; D380-K416 IonicContact OD2-NZ 2.9Å; D380-K416 PolarHBondContact OD2-NZ 3.37Å; D380-K416 VanDerWaalsContact OD2-NZ 3.09Å; D412-K416 WeakPolarHBondContact O-CB 3.42Å; D412-K416 PolarHBondContact O-N 3.01Å; F413-K416 WeakPolarHBondContact O-CB 3.21Å; F413-K416 PolarHBondContact O-N 3.5Å; K416-E420 HydrophobicContact CD-CB 4.27Å; K416-E420 HydrophobicContact CD-CG 4.37Å; K416-E420 WeakPolarHBondContact CD-OE1 3.32Å; K416-E420 VanDerWaalsContact NZ-CD 3.33Å; K416-E420 IonicContact NZ-OE1 2.57Å; K416-E420 PolarHBondContact NZ-OE1 3.33Å; K416-E420 IonicContact NZ-OE2 3.53Å; K416-E420 PolarHBondContact NZ-OE2 3.38Å; K416-E420 WeakPolarHBondContact O-CB 3.36Å; K416-E420 PolarHBondContact O-N 3.2Å; K416-L421 PolarHBondContact O-N 2.87Å; K416-L421 VanDerWaalsContact O-N 3.09Å
417L98.1Very high96.4Very high0 Ų044.3 Ų44.30%027%0.268CS..Iπ-helixtrans-64.6-50.1178.3-66.6179.5000112.6L379 T391 V394 C395 F413 L414 K415 L421 A422 V434L379-L417 HydrophobicContact CD2-CD2 4.03Å; T391-L417 HydrophobicContact CG2-CD2 3.82Å; V394-L417 HydrophobicContact CG1-CD1 4.38Å; C395-L417 VanDerWaalsContact SG-CD1 3.56Å; F413-L417 VanDerWaalsContact O-CG 3.29Å; F413-L417 WeakPolarHBondContact O-CG 3.49Å; F413-L417 PolarHBondContact O-N 3.32Å; L414-L417 HydrophobicContact CD2-CD1 4.48Å; L414-L417 PolarHBondContact O-N 3.25Å; K415-L417 PolarHBondContact O-N 3.06Å; L417-L421 HydrophobicContact CD2-CD1 4.01Å; L417-A422 PolarHBondContact O-N 2.64Å; L417-V434 HydrophobicContact CB-CG1 4.3Å
418V96.4Very high96.5Very high4 Ų441.7 Ų41.72%0.02425%0.251CS..Iπ-helixtrans-87.4-25.3-170.5-57.40000114.5L414 K415 A422 L438 L454 I458L414-V418 WeakPolarHBondContact O-CG1 3.38Å; L414-V418 WeakPolarHBondContact O-CG2 3.48Å; L414-V418 PolarHBondContact O-N 3.47Å; K415-V418 PolarHBondContact O-N 2.93Å; K415-V418 VanDerWaalsContact O-N 3.11Å; V418-A422 WeakPolarHBondContact O-CB 3.34Å; V418-L438 HydrophobicContact CG1-CD1 4.04Å; V418-L454 HydrophobicContact CG2-CB 4.13Å; V418-L454 HydrophobicContact CG2-CD1 4.41Å; V418-L454 HydrophobicContact CG2-CD2 4.3Å; V418-I458 HydrophobicContact CB-CG2 3.99Å; V418-I458 WeakPolarHBondContact O-CG2 3.49Å
419T93.9Very high96.5Very high72 Ų7241 Ų4144%0.44224%0.244SC..Iπ-helixtrans-97.8-28.9-178.762.80000112.9K415K415-T419 WeakPolarHBondContact O-CB 3.47Å; K415-T419 PolarHBondContact O-N 3.21Å; K415-T419 PolarHBondContact O-OG1 3.5Å
420E95.8Very high96.6Very high98 Ų9839.9 Ų39.946%0.45824%0.238SC..Iπ-helixtrans-112.9-59.9-176.4-60.5179.5-120.100111.9K416 A422 A423 D424K416-E420 HydrophobicContact CD-CB 4.27Å; K416-E420 HydrophobicContact CD-CG 4.37Å; K416-E420 WeakPolarHBondContact CD-OE1 3.32Å; K416-E420 VanDerWaalsContact NZ-CD 3.33Å; K416-E420 IonicContact NZ-OE1 2.57Å; K416-E420 PolarHBondContact NZ-OE1 3.33Å; K416-E420 IonicContact NZ-OE2 3.53Å; K416-E420 PolarHBondContact NZ-OE2 3.38Å; K416-E420 WeakPolarHBondContact O-CB 3.36Å; K416-E420 PolarHBondContact O-N 3.2Å; E420-A422 VanDerWaalsContact C-N 3.35Å; E420-A422 PolarHBondContact O-N 3.21Å; E420-A423 CarbonylContact O-C 3.57Å; E420-A423 WeakPolarHBondContact O-CA 3.38Å; E420-A423 PolarHBondContact O-N 3.4Å; E420-D424 PolarHBondContact O-N 3.45Å
421L97.8Very high96.7Very high5 Ų541.5 Ų41.53%0.02624%0.243CC..G310 helixtrans-70.5-28.9-174.2-63.5-167000113.8L379 T391 K416 L417 A423 D424 V430 R431 V434L379-L421 HydrophobicContact CB-CD1 4.19Å; L379-L421 HydrophobicContact CD2-CD1 3.66Å; L379-L421 HydrophobicContact CG-CD1 4.46Å; T391-L421 VanDerWaalsContact OG1-CD1 3.27Å; T391-L421 WeakPolarHBondContact OG1-CD1 3.38Å; K416-L421 PolarHBondContact O-N 2.87Å; K416-L421 VanDerWaalsContact O-N 3.09Å; L417-L421 HydrophobicContact CD2-CD1 4.01Å; L421-A423 PolarHBondContact O-N 3.11Å; L421-D424 WeakPolarHBondContact O-CB 3.29Å; L421-D424 PolarHBondContact O-N 3.06Å; L421-V430 HydrophobicContact CB-CG1 4.07Å; L421-V430 HydrophobicContact CD1-CG1 4.44Å; L421-V430 HydrophobicContact CD2-CG1 4.11Å; L421-V430 HydrophobicContact CG-CG1 4.45Å; L421-R431 WeakPolarHBondContact O-CG 3.4Å; L421-V434 HydrophobicContact CB-CG2 3.57Å
422A97.3Very high96.7Very high3 Ų339.8 Ų39.83%0.02523%0.233CC..G310 helixtrans-64.5-19.6170.900000112.9L417 V418 E420 R431 V434 F435 I458L417-A422 PolarHBondContact O-N 2.64Å; V418-A422 WeakPolarHBondContact O-CB 3.34Å; E420-A422 VanDerWaalsContact C-N 3.35Å; E420-A422 PolarHBondContact O-N 3.21Å; A422-R431 WeakPolarHBondContact O-CD 3.48Å; A422-R431 VanDerWaalsContact O-CG 3.3Å; A422-R431 WeakPolarHBondContact O-CG 3.49Å; A422-V434 HydrophobicContact CB-CG1 4.26Å; A422-F435 HydrophobicContact CB-CE1 3.95Å; A422-F435 HydrophobicContact CB-CZ 3.93Å; A422-I458 HydrophobicContact CB-CG2 3.65Å
423A95.4Very high96.7Very high73 Ų7336.8 Ų36.860%0.60322%0.218SC*.G310 helixtrans-112.320.217800000112.8E420 L421 S425E420-A423 CarbonylContact O-C 3.57Å; E420-A423 WeakPolarHBondContact O-CA 3.38Å; E420-A423 PolarHBondContact O-N 3.4Å; L421-A423 PolarHBondContact O-N 3.11Å; A423-S425 PolarHBondContact O-N 3.05Å; A423-S425 VanDerWaalsContact O-N 3.14Å
424D96.8Very high96.7Very high7 Ų736.7 Ų36.74%0.03722%0.218CC..  trans-55.9117-179.4-172.3-51.5000112.5R387 E420 L421 S426 S427 V430 R431R387-D424 IonicContact CZ-OD2 3.08Å; R387-D424 IonicContact NE-OD2 3.26Å; R387-D424 IonicContact NH1-OD1 3.34Å; R387-D424 IonicContact NH1-OD2 2.7Å; R387-D424 PolarHBondContact NH1-OD2 2.91Å; R387-D424 IonicContact NH2-OD1 2.89Å; R387-D424 IonicContact NH2-OD2 2.64Å; R387-D424 PolarHBondContact NH2-OD2 2.86Å; R387-D424 VanDerWaalsContact NH2-OD2 3.1Å; E420-D424 PolarHBondContact O-N 3.45Å; L421-D424 WeakPolarHBondContact O-CB 3.29Å; L421-D424 PolarHBondContact O-N 3.06Å; D424-S426 WeakPolarHBondContact OD1-CA 3.46Å; D424-S426 WeakPolarHBondContact OD1-CB 3.42Å; D424-S426 PolarHBondContact OD1-N 2.85Å; D424-S426 PolarHBondContact OD1-OG 2.85Å; D424-S427 PolarHBondContact OD1-N 3.21Å; D424-V430 HydrophobicContact CB-CB 3.94Å; D424-V430 HydrophobicContact CB-CG1 3.9Å; D424-V430 WeakPolarHBondContact OD2-CB 3.19Å; D424-V430 VanDerWaalsContact OD2-CG1 3.28Å; D424-V430 WeakPolarHBondContact OD2-CG1 3.36Å; D424-R431 HydrophobicContact CB-CG 3.84Å; D424-R431 VanDerWaalsContact O-CD 3.3Å; D424-R431 WeakPolarHBondContact O-CD 3.48Å; D424-R431 PolarHBondContact O-NE 2.93Å
425S93.1Very high96.7Very high125 Ų12536.7 Ų36.787%0.87422%0.218SC*.SBendtrans-76.6-24.1-176.858.40000113.7A423A423-S425 PolarHBondContact O-N 3.05Å; A423-S425 VanDerWaalsContact O-N 3.14Å
426S94.3Very high96.8Very high70 Ų7037 Ų3749%0.4922%0.219SC..SBendtrans-84-30-17371.90000113.3R387 D424R387-S426 PolarHBondContact NH2-OG 3.34Å; D424-S426 WeakPolarHBondContact OD1-CA 3.46Å; D424-S426 WeakPolarHBondContact OD1-CB 3.42Å; D424-S426 PolarHBondContact OD1-N 2.85Å; D424-S426 PolarHBondContact OD1-OG 2.85Å
427S96.6Very high96.7Very high13 Ų1336.6 Ų36.69%0.09122%0.218CC..  trans-152.3129.7-175.2-177.30000114.1D424 D429 V430D424-S427 PolarHBondContact OD1-N 3.21Å; S427-D429 PolarHBondContact O-N 3.07Å; S427-D429 WeakPolarHBondContact OG-CB 3.43Å; S427-D429 PolarHBondContact OG-N 3.47Å; S427-D429 VanDerWaalsContact OG-N 3.08Å; S427-V430 PolarHBondContact O-N 3.28Å
428P97.3Very high96.7Very high46 Ų4636.6 Ų36.630%0.29922%0.218SC..Hα-helixtrans-65.5-20.2168.428.8-34000112.8C432 V469P428-C432 WeakPolarHBondContact O-CB 3.34Å; P428-C432 PolarHBondContact O-N 3.36Å; P428-V469 HydrophobicContact CB-CG2 3.75Å; P428-V469 VanDerWaalsContact O-CG2 3.29Å; P428-V469 WeakPolarHBondContact O-CG2 3.06Å
429D96.6Very high96.7Very high77 Ų7738.2 Ų38.241%0.41223%0.227SC..Hα-helixtrans-69.1-36.5179.3-68.3-35.8000112S427 S433 K468S427-D429 PolarHBondContact O-N 3.07Å; S427-D429 WeakPolarHBondContact OG-CB 3.43Å; S427-D429 PolarHBondContact OG-N 3.47Å; S427-D429 VanDerWaalsContact OG-N 3.08Å; D429-S433 WeakPolarHBondContact O-CB 3.49Å; D429-S433 PolarHBondContact O-N 3.23Å; D429-K468 WeakPolarHBondContact OD1-CE 2.96Å; D429-K468 IonicContact OD1-NZ 2.85Å; D429-K468 PolarHBondContact OD1-NZ 2.8Å
430V98.1Very high96.8Very high0 Ų037.3 Ų37.30%022%0.219CC..Hα-helixtrans-65.9-51.8175.4179.30000110P384 R387 S388 L421 D424 S427 C432 S433 V434P384-V430 HydrophobicContact CB-CG2 3.71Å; P384-V430 VanDerWaalsContact O-CG2 3.28Å; P384-V430 WeakPolarHBondContact O-CG2 3.47Å; R387-V430 HydrophobicContact CB-CG1 4.37Å; R387-V430 HydrophobicContact CB-CG2 4.28Å; S388-V430 WeakPolarHBondContact OG-CG2 3.34Å; L421-V430 HydrophobicContact CB-CG1 4.07Å; L421-V430 HydrophobicContact CD1-CG1 4.44Å; L421-V430 HydrophobicContact CD2-CG1 4.11Å; L421-V430 HydrophobicContact CG-CG1 4.45Å; D424-V430 HydrophobicContact CB-CB 3.94Å; D424-V430 HydrophobicContact CB-CG1 3.9Å; D424-V430 WeakPolarHBondContact OD2-CB 3.19Å; D424-V430 VanDerWaalsContact OD2-CG1 3.28Å; D424-V430 WeakPolarHBondContact OD2-CG1 3.36Å; S427-V430 PolarHBondContact O-N 3.28Å; V430-C432 VanDerWaalsContact C-N 3.3Å; V430-C432 PolarHBondContact O-N 2.89Å; V430-S433 WeakPolarHBondContact O-CA 3.36Å; V430-S433 WeakPolarHBondContact O-CB 3.14Å; V430-S433 PolarHBondContact O-N 3.1Å; V430-S433 PolarHBondContact O-OG 3.07Å; V430-V434 PolarHBondContact O-N 3.42Å; V430-V434 VanDerWaalsContact O-N 3.11Å
431R98.1Very high96.9Very high43 Ų4332.7 Ų32.716%0.16220%0.197CC..Hα-helixtrans-55.3-45.8176.3-63.7-178-86.7150.82.4111.9L421 A422 D424 S433 V434 F435 D464 V469L421-R431 WeakPolarHBondContact O-CG 3.4Å; A422-R431 WeakPolarHBondContact O-CD 3.48Å; A422-R431 VanDerWaalsContact O-CG 3.3Å; A422-R431 WeakPolarHBondContact O-CG 3.49Å; D424-R431 HydrophobicContact CB-CG 3.84Å; D424-R431 VanDerWaalsContact O-CD 3.3Å; D424-R431 WeakPolarHBondContact O-CD 3.48Å; D424-R431 PolarHBondContact O-NE 2.93Å; R431-S433 VanDerWaalsContact C-N 3.32Å; R431-S433 PolarHBondContact O-N 3.47Å; R431-V434 PolarHBondContact O-N 3.12Å; R431-F435 WeakPolarHBondContact O-CD2 3.2Å; R431-D464 IonicContact CZ-OD1 2.74Å; R431-D464 IonicContact CZ-OD2 3.45Å; R431-D464 IonicContact NH1-OD1 3.88Å; R431-D464 PolarHBondContact NH1-OD1 3.41Å; R431-D464 IonicContact NH1-OD2 3.87Å; R431-D464 PolarHBondContact NH1-OD2 2.99Å; R431-V469 HydrophobicContact CB-CG1 3.98Å; R431-V469 HydrophobicContact CB-CG2 4.05Å
432C97.4Very high96.8Very high2 Ų232.5 Ų32.51%0.01420%0.196CC..Hα-helixtrans-60.5-40.9175.2175.20000112.3P428 V430 V434 F435 K436 K468 V469 S472P428-C432 WeakPolarHBondContact O-CB 3.34Å; P428-C432 PolarHBondContact O-N 3.36Å; V430-C432 VanDerWaalsContact C-N 3.3Å; V430-C432 PolarHBondContact O-N 2.89Å; C432-V434 VanDerWaalsContact C-N 3.31Å; C432-V434 PolarHBondContact O-N 2.93Å; C432-F435 PolarHBondContact O-N 3.37Å; C432-K436 WeakPolarHBondContact O-CG 3.49Å; C432-K436 PolarHBondContact O-N 2.89Å; C432-K436 VanDerWaalsContact O-N 3.1Å; C432-K436 WeakPolarHBondContact SG-CE 3.39Å; C432-K436 PolarHBondContact SG-NZ 2.81Å; C432-K436 VanDerWaalsContact SG-NZ 3.43Å; C432-K468 HydrophobicContact CB-CG 4.23Å; C432-K468 WeakPolarHBondContact SG-CE 3.36Å; C432-V469 HydrophobicContact CB-CG2 4.22Å; C432-S472 PolarHBondContact SG-OG 2.73Å
433S97.8Very high96.7Very high14 Ų1437.2 Ų37.210%0.09822%0.221CC..Hα-helixtrans-62.7-37.8179.878.60000111.9D429 V430 R431 F435 K436 C437D429-S433 WeakPolarHBondContact O-CB 3.49Å; D429-S433 PolarHBondContact O-N 3.23Å; V430-S433 WeakPolarHBondContact O-CA 3.36Å; V430-S433 WeakPolarHBondContact O-CB 3.14Å; V430-S433 PolarHBondContact O-N 3.1Å; V430-S433 PolarHBondContact O-OG 3.07Å; R431-S433 VanDerWaalsContact C-N 3.32Å; R431-S433 PolarHBondContact O-N 3.47Å; S433-F435 PolarHBondContact O-N 2.81Å; S433-K436 PolarHBondContact O-N 3.32Å; S433-C437 VanDerWaalsContact O-CB 3.26Å; S433-C437 WeakPolarHBondContact O-CB 3.07Å; S433-C437 PolarHBondContact O-N 3.33Å; S433-C437 PolarHBondContact O-SG 3.49Å
434V98.3Very high96.7Very high0 Ų034.9 Ų34.90%020%0.199CC..Hα-helixtrans-56.7-54.9176175.40000110.5T391 L417 L421 A422 V430 R431 C432 K436 C437 L438T391-V434 HydrophobicContact CG2-CB 4.49Å; T391-V434 HydrophobicContact CG2-CG2 4.04Å; L417-V434 HydrophobicContact CB-CG1 4.3Å; L421-V434 HydrophobicContact CB-CG2 3.57Å; A422-V434 HydrophobicContact CB-CG1 4.26Å; V430-V434 PolarHBondContact O-N 3.42Å; V430-V434 VanDerWaalsContact O-N 3.11Å; R431-V434 PolarHBondContact O-N 3.12Å; C432-V434 VanDerWaalsContact C-N 3.31Å; C432-V434 PolarHBondContact O-N 2.93Å; V434-K436 VanDerWaalsContact C-N 3.33Å; V434-K436 PolarHBondContact O-N 3.4Å; V434-C437 PolarHBondContact O-N 3.36Å; V434-L438 HydrophobicContact CG1-CD1 3.84Å; V434-L438 HydrophobicContact CG1-CG 4.26Å; V434-L438 WeakPolarHBondContact O-CB 2.96Å; V434-L438 WeakPolarHBondContact O-CG 3.5Å; V434-L438 PolarHBondContact O-N 3.47Å
435F97.9Very high96.6Very high0 Ų038.9 Ų38.90%023%0.225CC..Hα-helixtrans-65.9-36.6-176.8-52.7-42000112.8A422 R431 C432 S433 I458 S461 V469 F473 L476A422-F435 HydrophobicContact CB-CE1 3.95Å; A422-F435 HydrophobicContact CB-CZ 3.93Å; R431-F435 WeakPolarHBondContact O-CD2 3.2Å; C432-F435 PolarHBondContact O-N 3.37Å; S433-F435 PolarHBondContact O-N 2.81Å; F435-I458 HydrophobicContact CD1-CD1 4.02Å; F435-I458 HydrophobicContact CE1-CB 4.2Å; F435-I458 HydrophobicContact CE1-CD1 3.64Å; F435-I458 HydrophobicContact CE1-CG1 4.5Å; F435-I458 HydrophobicContact CE1-CG2 4.29Å; F435-S461 VanDerWaalsContact CZ-CB 3.46Å; F435-S461 VanDerWaalsContact CZ-OG 3.23Å; F435-S461 WeakPolarHBondContact CZ-OG 3.36Å; F435-V469 HydrophobicContact CD2-CG1 4.03Å; F435-V469 HydrophobicContact CE2-CG1 3.55Å; F435-F473 HydrophobicContact CD1-CD2 4.02Å; F435-F473 HydrophobicContact CD2-CB 3.78Å; F435-F473 HydrophobicContact CD2-CD2 4.32Å; F435-F473 AromaticContact CE1-CD2 3.92Å; F435-F473 HydrophobicContact CE1-CD2 3.92Å; F435-F473 HydrophobicContact CE2-CB 4.04Å; F435-F473 HydrophobicContact CE2-CD2 4.19Å; F435-F473 HydrophobicContact CG-CB 4.21Å; F435-F473 HydrophobicContact CG-CD2 4.26Å; F435-F473 HydrophobicContact CZ-CD2 4.02Å; F435-L476 HydrophobicContact CB-CB 4.33Å; F435-L476 HydrophobicContact CB-CD2 4.32Å; F435-L476 HydrophobicContact CD1-CD2 3.82Å; F435-L476 HydrophobicContact CG-CD2 4.45Å
436K97.5Very high96.7Very high106 Ų10637 Ų3746%0.46120%0.202SC..Hα-helixtrans-65.9-40174.7-74.1178.3175.1173.90112.7C432 S433 V434 N439 S472C432-K436 WeakPolarHBondContact O-CG 3.49Å; C432-K436 PolarHBondContact O-N 2.89Å; C432-K436 VanDerWaalsContact O-N 3.1Å; C432-K436 WeakPolarHBondContact SG-CE 3.39Å; C432-K436 PolarHBondContact SG-NZ 2.81Å; C432-K436 VanDerWaalsContact SG-NZ 3.43Å; S433-K436 PolarHBondContact O-N 3.32Å; V434-K436 VanDerWaalsContact C-N 3.33Å; V434-K436 PolarHBondContact O-N 3.4Å; K436-N439 WeakPolarHBondContact O-CB 3.27Å; K436-S472 WeakPolarHBondContact CE-OG 3.4Å
437C97.4Very high96.8Very high10 Ų1033.7 Ų33.77%0.06818%0.179CC..Hα-helixtrans-83.9-28.3-174.4-60.60000112.6T391 L392 C395 S433 V434 N439 I440T391-C437 HydrophobicContact CG2-CB 4.12Å; L392-C437 VanDerWaalsContact CA-SG 3.53Å; C395-C437 HydrophobicContact CB-CB 3.73Å; C395-C437 WeakPolarHBondContact SG-CB 3.48Å; S433-C437 VanDerWaalsContact O-CB 3.26Å; S433-C437 WeakPolarHBondContact O-CB 3.07Å; S433-C437 PolarHBondContact O-N 3.33Å; S433-C437 PolarHBondContact O-SG 3.49Å; V434-C437 PolarHBondContact O-N 3.36Å; C437-N439 PolarHBondContact O-N 2.84Å; C437-I440 VanDerWaalsContact O-CB 3.26Å; C437-I440 WeakPolarHBondContact O-CB 3.37Å; C437-I440 PolarHBondContact O-N 2.83Å
438L97.4Very high96.8Very high1 Ų134.5 Ų34.51%0.00518%0.181CC..Hα-helixtrans-60.1-27.3171.4-78.3175.7000112.6L414 V418 V434 I440 V441 L442 L451 L476L414-L438 HydrophobicContact CD2-CD2 4.08Å; V418-L438 HydrophobicContact CG1-CD1 4.04Å; V434-L438 HydrophobicContact CG1-CD1 3.84Å; V434-L438 HydrophobicContact CG1-CG 4.26Å; V434-L438 WeakPolarHBondContact O-CB 2.96Å; V434-L438 WeakPolarHBondContact O-CG 3.5Å; V434-L438 PolarHBondContact O-N 3.47Å; L438-I440 PolarHBondContact O-N 3.32Å; L438-V441 PolarHBondContact O-N 3.41Å; L438-V441 VanDerWaalsContact O-N 3.1Å; L438-L442 WeakPolarHBondContact O-CG 3.17Å; L438-L442 PolarHBondContact O-N 3.29Å; L438-L451 HydrophobicContact CD2-CD2 4.1Å; L438-L476 HydrophobicContact CB-CD1 3.84Å; L438-L476 HydrophobicContact CB-CD2 4.49Å; L438-L476 HydrophobicContact CD1-CD2 4.08Å
439N95.9Very high96.7Very high37 Ų3736 Ų3620%0.19819%0.191CC..Hα-helixtrans-58-32.6171.7-70-31.2000112.9K436 C437 L476 K479K436-N439 WeakPolarHBondContact O-CB 3.27Å; C437-N439 PolarHBondContact O-N 2.84Å; N439-L476 WeakPolarHBondContact OD1-CA 3.21Å; N439-L476 WeakPolarHBondContact OD1-CD1 3.36Å; N439-K479 HydrophobicContact CB-CG 4.31Å; N439-K479 VanDerWaalsContact OD1-CB 3.23Å; N439-K479 WeakPolarHBondContact OD1-CB 3.26Å; N439-K479 WeakPolarHBondContact OD1-CG 3.36Å
440I96.3Very high96.7Very high54 Ų5434.3 Ų34.328%0.27718%0.182SC..Hα-helixtrans-70.9-40.4177.1-53.2171.7000109.9L392 A399 C437 L438 L442 D443L392-I440 HydrophobicContact CD1-CD1 3.72Å; A399-I440 HydrophobicContact CB-CG2 3.86Å; C437-I440 VanDerWaalsContact O-CB 3.26Å; C437-I440 WeakPolarHBondContact O-CB 3.37Å; C437-I440 PolarHBondContact O-N 2.83Å; L438-I440 PolarHBondContact O-N 3.32Å; I440-L442 VanDerWaalsContact C-N 3.35Å; I440-D443 WeakPolarHBondContact O-CB 3.45Å; I440-D443 PolarHBondContact O-N 3.18Å
441V97.1Very high96.5Very high0 Ų034.3 Ų34.30%018%0.182CC..Hα-helixtrans-66.7-39.9178.2-175.50000110.6C395 L398 W402 L414 L438 D443 N444 S447 L451C395-V441 HydrophobicContact CB-CG2 3.74Å; L398-V441 HydrophobicContact CB-CG2 4.31Å; W402-V441 HydrophobicContact CZ3-CG1 4.06Å; L414-V441 HydrophobicContact CD2-CG1 4.49Å; L438-V441 PolarHBondContact O-N 3.41Å; L438-V441 VanDerWaalsContact O-N 3.1Å; V441-D443 PolarHBondContact O-N 3.47Å; V441-D443 VanDerWaalsContact O-N 3.16Å; V441-N444 WeakPolarHBondContact O-CB 3.02Å; V441-N444 PolarHBondContact O-N 2.98Å; V441-S447 PolarHBondContact O-OG 2.99Å; V441-L451 HydrophobicContact CG1-CD1 4.13Å
442L96.6Very high96.4Very high2 Ų237 Ų371%0.0120%0.196CC..THydrogen-bonded Turntrans-62.7-17.5177.3-76.9169.8000114.3L438 I440 N444 H448 L451 L476 K479 V480 V483 A485L438-L442 WeakPolarHBondContact O-CG 3.17Å; L438-L442 PolarHBondContact O-N 3.29Å; I440-L442 VanDerWaalsContact C-N 3.35Å; L442-N444 PolarHBondContact O-N 3.43Å; L442-H448 PolarHBondContact O-NE2 2.88Å; L442-L451 HydrophobicContact CD2-CD1 3.51Å; L442-L451 HydrophobicContact CG-CD1 3.87Å; L442-L476 HydrophobicContact CD1-CD1 3.48Å; L442-L476 VanDerWaalsContact CD1-CD1 3.48Å; L442-K479 HydrophobicContact CB-CG 4.29Å; L442-K479 HydrophobicContact CD1-CB 4.43Å; L442-K479 HydrophobicContact CD1-CG 3.92Å; L442-V480 HydrophobicContact CD1-CG2 3.64Å; L442-V480 HydrophobicContact CD2-CG2 4.38Å; L442-V483 HydrophobicContact CB-CG2 4.43Å; L442-V483 HydrophobicContact CD2-CG2 4.41Å; L442-A485 HydrophobicContact CD2-CB 3.62Å
443D95.1Very high96.3Very high102 Ų10244.8 Ų44.855%0.54523%0.23SC..THydrogen-bonded Turntrans-68.5-19.8171.2-71.1-33000112.3I440 V441 P445 K479I440-D443 WeakPolarHBondContact O-CB 3.45Å; I440-D443 PolarHBondContact O-N 3.18Å; V441-D443 PolarHBondContact O-N 3.47Å; V441-D443 VanDerWaalsContact O-N 3.16Å; D443-P445 WeakPolarHBondContact O-CD 3.25Å; D443-K479 VanDerWaalsContact OD1-CE 3.24Å; D443-K479 WeakPolarHBondContact OD1-CE 3.44Å; D443-K479 IonicContact OD1-NZ 3.68Å; D443-K479 PolarHBondContact OD1-NZ 3.23Å
444N94.7Very high96.2Very high24 Ų2445.1 Ų45.113%0.12823%0.23CC..SBendtrans-91.5113.3170.5-176.4-11.1000110.6W402 V441 L442 Q446 S447W402-N444 WeakPolarHBondContact CB-ND2 3.25Å; V441-N444 WeakPolarHBondContact O-CB 3.02Å; V441-N444 PolarHBondContact O-N 2.98Å; L442-N444 PolarHBondContact O-N 3.43Å; N444-Q446 PolarHBondContact O-N 2.71Å; N444-Q446 WeakPolarHBondContact OD1-CB 3.48Å; N444-Q446 PolarHBondContact OD1-N 3.41Å; N444-S447 WeakPolarHBondContact O-CB 3.04Å; N444-S447 PolarHBondContact O-N 2.75Å; N444-S447 VanDerWaalsContact O-N 3.07Å; N444-S447 PolarHBondContact O-OG 3.41Å
445P95.6Very high96.1Very high91 Ų9145.1 Ų45.159%0.59123%0.231SC*.G310 helixtrans-59.4-27.1179.1-24.135.2000114.8D443 S447 H448D443-P445 WeakPolarHBondContact O-CD 3.25Å; P445-S447 PolarHBondContact O-N 3.37Å; P445-H448 WeakPolarHBondContact O-CB 3.19Å; P445-H448 PolarHBondContact O-N 3.3Å; P445-H448 VanDerWaalsContact O-N 3.15Å
446Q95.3Very high95.9Very high85 Ų8547.4 Ų47.440%0.39725%0.245SC..G310 helixtrans-65.3-19.4178.3-63172.9-39.400112.5W402 E403 N444W402-Q446 HydrophobicContact CG-CB 4.26Å; W402-Q446 WeakPolarHBondContact CZ2-O 3.47Å; E403-Q446 PolarHBondContact OE1-NE2 3.27Å; N444-Q446 PolarHBondContact O-N 2.71Å; N444-Q446 WeakPolarHBondContact OD1-CB 3.48Å; N444-Q446 PolarHBondContact OD1-N 3.41Å
447S96Very high95.8Very high0 Ų046 Ų460%025%0.246CC..G310 helixtrans-78.5-20.917773.10000114.1W402 V441 N444 P445 L450 L451W402-S447 VanDerWaalsContact CH2-CA 3.44Å; V441-S447 PolarHBondContact O-OG 2.99Å; N444-S447 WeakPolarHBondContact O-CB 3.04Å; N444-S447 PolarHBondContact O-N 2.75Å; N444-S447 VanDerWaalsContact O-N 3.07Å; N444-S447 PolarHBondContact O-OG 3.41Å; P445-S447 PolarHBondContact O-N 3.37Å; S447-L450 PolarHBondContact O-N 2.9Å; S447-L451 WeakPolarHBondContact O-CG 3.48Å; S447-L451 PolarHBondContact O-N 3.14Å
448H96.5Very high95.6Very high30 Ų3045.9 Ų45.914%0.13924%0.244CC..Hα-helixtrans-61-46.7-168.6-61.4179.3000113.3L442 P445 L450 L451 E452 A485L442-H448 PolarHBondContact O-NE2 2.88Å; P445-H448 WeakPolarHBondContact O-CB 3.19Å; P445-H448 PolarHBondContact O-N 3.3Å; P445-H448 VanDerWaalsContact O-N 3.15Å; H448-L450 PolarHBondContact O-N 3.26Å; H448-L451 PolarHBondContact O-N 3.42Å; H448-E452 WeakPolarHBondContact O-CB 3.33Å; H448-E452 PolarHBondContact O-N 3.38Å; H448-A485 HydrophobicContact CB-CB 3.98Å
449P95.6Very high95.5Very high79 Ų7951.3 Ų51.351%0.51327%0.268SS..Hα-helixtrans-62.8-29.4-178-23.535000114
450L95.2Very high95.4Very high40 Ų4055 Ų5521%0.20929%0.288CS..Hα-helixtrans-82.3-43.6177.9-177.254.5000110.8W402 I410 L414 S447 H448 E452 K453 L454W402-L450 HydrophobicContact CH2-CD2 4.47Å; I410-L450 HydrophobicContact CG2-CD2 4.13Å; L414-L450 HydrophobicContact CD1-CD2 3.64Å; L414-L450 HydrophobicContact CD1-CG 4.02Å; S447-L450 PolarHBondContact O-N 2.9Å; H448-L450 PolarHBondContact O-N 3.26Å; L450-E452 PolarHBondContact O-N 2.94Å; L450-K453 PolarHBondContact O-N 2.86Å; L450-L454 HydrophobicContact CD1-CD1 4.13Å; L450-L454 HydrophobicContact CD1-CG 4.4Å; L450-L454 HydrophobicContact CG-CD1 4.02Å; L450-L454 WeakPolarHBondContact O-CG 3.41Å; L450-L454 PolarHBondContact O-N 3.35Å
451L95.4Very high95.4Very high1 Ų153 Ų531%0.00528%0.278CS..Hα-helixtrans-65-36.9177-72.8174.2000112.3L414 L438 V441 L442 S447 H448 K453 L454 L455L414-L451 HydrophobicContact CD1-CD2 4.2Å; L414-L451 HydrophobicContact CD2-CD2 4.08Å; L438-L451 HydrophobicContact CD2-CD2 4.1Å; V441-L451 HydrophobicContact CG1-CD1 4.13Å; L442-L451 HydrophobicContact CD2-CD1 3.51Å; L442-L451 HydrophobicContact CG-CD1 3.87Å; S447-L451 WeakPolarHBondContact O-CG 3.48Å; S447-L451 PolarHBondContact O-N 3.14Å; H448-L451 PolarHBondContact O-N 3.42Å; L451-K453 PolarHBondContact O-N 3.07Å; L451-L454 PolarHBondContact O-N 3.26Å; L451-L455 HydrophobicContact CB-CD1 4.42Å; L451-L455 WeakPolarHBondContact O-CB 3.33Å; L451-L455 WeakPolarHBondContact O-CG 3.29Å; L451-L455 PolarHBondContact O-N 3.36Å
452E96.1Very high95.4Very high98 Ų9853 Ų5346%0.45828%0.279SS..Hα-helixtrans-54.2-38.5174.1-176.4173.5-152.100112H448 L450 P456 A486H448-E452 WeakPolarHBondContact O-CB 3.33Å; H448-E452 PolarHBondContact O-N 3.38Å; L450-E452 PolarHBondContact O-N 2.94Å; E452-P456 WeakPolarHBondContact O-CD 3.48Å; E452-A486 HydrophobicContact CB-CB 4.16Å; E452-A486 HydrophobicContact CG-CB 3.86Å
453K95.1Very high95.4Very high167 Ų16756 Ų5673%0.72629%0.292SS*.Hα-helixtrans-76.6-30.4177.3-63.8176.8-176.2178.90113.4L450 L451L450-K453 PolarHBondContact O-N 2.86Å; L451-K453 PolarHBondContact O-N 3.07Å
454L95.6Very high95.5Very high20 Ų2051.9 Ų51.911%0.10527%0.27CS..Hα-helixtrans-90.7-34.7-174.1-70.1176.8000113.4L414 K415 V418 L450 L451 P456 T457L414-L454 HydrophobicContact CB-CD1 3.69Å; L414-L454 HydrophobicContact CD1-CD1 4.42Å; K415-L454 HydrophobicContact CG-CD2 4.32Å; V418-L454 HydrophobicContact CG2-CB 4.13Å; V418-L454 HydrophobicContact CG2-CD1 4.41Å; V418-L454 HydrophobicContact CG2-CD2 4.3Å; L450-L454 HydrophobicContact CD1-CD1 4.13Å; L450-L454 HydrophobicContact CD1-CG 4.4Å; L450-L454 HydrophobicContact CG-CD1 4.02Å; L450-L454 WeakPolarHBondContact O-CG 3.41Å; L450-L454 PolarHBondContact O-N 3.35Å; L451-L454 PolarHBondContact O-N 3.26Å; L454-P456 VanDerWaalsContact C-N 3.32Å; L454-T457 WeakPolarHBondContact O-CB 3.37Å; L454-T457 WeakPolarHBondContact O-CG2 3.11Å; L454-T457 PolarHBondContact O-N 3.01Å; L454-T457 PolarHBondContact O-OG1 3.3Å
455L95.3Very high95.5Very high1 Ų158.5 Ų58.51%0.00531%0.306CS..G310 helixtrans-55.6-35.5-176.4-72.8167.8000114.4L451 T457 I458 L476 V480 A486 V491L451-L455 HydrophobicContact CB-CD1 4.42Å; L451-L455 WeakPolarHBondContact O-CB 3.33Å; L451-L455 WeakPolarHBondContact O-CG 3.29Å; L451-L455 PolarHBondContact O-N 3.36Å; L455-T457 PolarHBondContact O-N 3.24Å; L455-T457 VanDerWaalsContact O-N 3.07Å; L455-I458 HydrophobicContact CD2-CD1 3.79Å; L455-I458 WeakPolarHBondContact O-CG1 3.47Å; L455-I458 PolarHBondContact O-N 3.4Å; L455-I458 VanDerWaalsContact O-N 3.12Å; L455-L476 HydrophobicContact CD2-CD2 3.95Å; L455-V480 HydrophobicContact CD1-CG1 4.25Å; L455-V480 HydrophobicContact CD1-CG2 3.66Å; L455-A486 HydrophobicContact CD1-CB 4.43Å; L455-V491 HydrophobicContact CB-CG1 4.18Å; L455-V491 HydrophobicContact CB-CG2 3.68Å; L455-V491 HydrophobicContact CD1-CG2 4.43Å; L455-V491 WeakPolarHBondContact O-CG1 3.42Å
456P94.6Very high95.6Very high47 Ų4755.6 Ų55.631%0.30529%0.288SS..G310 helixtrans-58.8-20.7175.9-27.537000114.8E452 L454 I458 K459E452-P456 WeakPolarHBondContact O-CD 3.48Å; L454-P456 VanDerWaalsContact C-N 3.32Å; P456-I458 VanDerWaalsContact C-N 3.28Å; P456-I458 PolarHBondContact O-N 3.46Å; P456-K459 WeakPolarHBondContact O-CG 3.5Å; P456-K459 PolarHBondContact O-N 2.87Å
457T94.4Very high95.6Very high78 Ų7855.4 Ų55.448%0.47929%0.287SS..G310 helixtrans-70.5-23.9178.370.60000112.9L454 L455L454-T457 WeakPolarHBondContact O-CB 3.37Å; L454-T457 WeakPolarHBondContact O-CG2 3.11Å; L454-T457 PolarHBondContact O-N 3.01Å; L454-T457 PolarHBondContact O-OG1 3.3Å; L455-T457 PolarHBondContact O-N 3.24Å; L455-T457 VanDerWaalsContact O-N 3.07Å
458I94.7Very high95.6Very high6 Ų659.8 Ų59.83%0.03131%0.306CS..G310 helixtrans-9611.5-178.455.4166.5000113.4V418 A422 F435 L455 P456 N460 S461 F473 L476V418-I458 HydrophobicContact CB-CG2 3.99Å; V418-I458 WeakPolarHBondContact O-CG2 3.49Å; A422-I458 HydrophobicContact CB-CG2 3.65Å; F435-I458 HydrophobicContact CD1-CD1 4.02Å; F435-I458 HydrophobicContact CE1-CB 4.2Å; F435-I458 HydrophobicContact CE1-CD1 3.64Å; F435-I458 HydrophobicContact CE1-CG1 4.5Å; F435-I458 HydrophobicContact CE1-CG2 4.29Å; L455-I458 HydrophobicContact CD2-CD1 3.79Å; L455-I458 WeakPolarHBondContact O-CG1 3.47Å; L455-I458 PolarHBondContact O-N 3.4Å; L455-I458 VanDerWaalsContact O-N 3.12Å; P456-I458 VanDerWaalsContact C-N 3.28Å; P456-I458 PolarHBondContact O-N 3.46Å; I458-N460 PolarHBondContact O-N 3.38Å; I458-S461 VanDerWaalsContact O-CB 3.26Å; I458-S461 WeakPolarHBondContact O-CB 3.28Å; I458-S461 PolarHBondContact O-N 3.23Å; I458-S461 PolarHBondContact O-OG 3.4Å; I458-F473 HydrophobicContact CB-CE2 4.21Å; I458-F473 HydrophobicContact CD1-CD2 4.16Å; I458-F473 HydrophobicContact CD1-CE2 3.65Å; I458-F473 HydrophobicContact CG1-CE2 3.78Å; I458-F473 WeakPolarHBondContact O-CE2 3.37Å; I458-L476 HydrophobicContact CD1-CD2 3.83Å
459K94.4Very high95.7Very high115 Ų11558.4 Ų58.450%0.530%0.299SS..G310 helixtrans-53.7-31.4-177.868.9-176.2179.3-179.90114.5P456 S461 L462 V491P456-K459 WeakPolarHBondContact O-CG 3.5Å; P456-K459 PolarHBondContact O-N 2.87Å; K459-S461 PolarHBondContact O-N 2.83Å; K459-L462 WeakPolarHBondContact O-CB 3.31Å; K459-L462 PolarHBondContact O-N 3.24Å; K459-V491 WeakPolarHBondContact CB-O 3.28Å
460N93.8Very high95.8Very high115 Ų11555.8 Ų55.862%0.61528%0.279SS*.G310 helixtrans-72.3-17.1-178.5-67.9-20.4000112.8I458 L462 H463I458-N460 PolarHBondContact O-N 3.38Å; N460-L462 PolarHBondContact O-N 2.74Å; N460-H463 PolarHBondContact O-N 3.41Å
461S96.3Very high95.9Very high12 Ų1254.8 Ų54.88%0.08428%0.275CS..G310 helixtrans-66.4-14.7175.8-55.20000113.1F435 I458 K459 H463 D464F435-S461 VanDerWaalsContact CZ-CB 3.46Å; F435-S461 VanDerWaalsContact CZ-OG 3.23Å; F435-S461 WeakPolarHBondContact CZ-OG 3.36Å; I458-S461 VanDerWaalsContact O-CB 3.26Å; I458-S461 WeakPolarHBondContact O-CB 3.28Å; I458-S461 PolarHBondContact O-N 3.23Å; I458-S461 PolarHBondContact O-OG 3.4Å; K459-S461 PolarHBondContact O-N 2.83Å; S461-H463 PolarHBondContact O-N 3.28Å; S461-D464 WeakPolarHBondContact O-CB 3.47Å; S461-D464 PolarHBondContact O-N 3.35Å
462L96.8Very high96.1Very high1 Ų154.9 Ų54.91%0.00528%0.276CS..G310 helixtrans-60.1-32.4166.1-17957.2000112.5K459 N460 R470 F473 I474 C492 H496 L497 R500K459-L462 WeakPolarHBondContact O-CB 3.31Å; K459-L462 PolarHBondContact O-N 3.24Å; N460-L462 PolarHBondContact O-N 2.74Å; L462-R470 WeakPolarHBondContact O-CD 3.39Å; L462-F473 HydrophobicContact CB-CD1 4.12Å; L462-F473 HydrophobicContact CB-CE1 3.8Å; L462-I474 HydrophobicContact CD1-CD1 3.49Å; L462-I474 VanDerWaalsContact CD1-CD1 3.49Å; L462-I474 HydrophobicContact CD1-CG1 4.45Å; L462-C492 HydrophobicContact CD2-CB 4.11Å; L462-H496 HydrophobicContact CD2-CB 3.76Å; L462-L497 HydrophobicContact CD1-CD2 4.05Å; L462-L497 HydrophobicContact CD2-CD2 3.95Å; L462-L497 HydrophobicContact CD2-CG 4.29Å; L462-R500 HydrophobicContact CD1-CB 4.34Å; L462-R500 HydrophobicContact CD1-CG 3.78Å; L462-R500 HydrophobicContact CD2-CG 4.22Å; L462-R500 HydrophobicContact CG-CG 3.65Å
463H96.5Very high96.1Very high64 Ų6450.2 Ų50.230%0.29625%0.254SS..G310 helixtrans-10318.1-177.6-57.6-66.1000112.6N460 S461 H496 R500N460-H463 PolarHBondContact O-N 3.41Å; S461-H463 PolarHBondContact O-N 3.28Å; H463-H496 AromaticContact CE1-ND1 3.5Å; H463-H496 AromaticContact NE2-CE1 3.72Å; H463-H496 AromaticContact NE2-CG 3.43Å; H463-H496 AromaticContact NE2-ND1 3.05Å; H463-H496 PolarHBondContact NE2-ND1 3.31Å; H463-R500 WeakPolarHBondContact ND1-CD 3.29Å
464D97.5Very high96.3Very high16 Ų1642.3 Ų42.39%0.08622%0.219CC..  trans-56.8140.7179.5-159-69.9000111.6R431 S461 S466 V469 R470R431-D464 IonicContact CZ-OD1 2.74Å; R431-D464 IonicContact CZ-OD2 3.45Å; R431-D464 IonicContact NH1-OD1 3.88Å; R431-D464 PolarHBondContact NH1-OD1 3.41Å; R431-D464 IonicContact NH1-OD2 3.87Å; R431-D464 PolarHBondContact NH1-OD2 2.99Å; S461-D464 WeakPolarHBondContact O-CB 3.47Å; S461-D464 PolarHBondContact O-N 3.35Å; D464-S466 PolarHBondContact O-N 2.92Å; D464-S466 WeakPolarHBondContact OD1-CB 3.46Å; D464-S466 PolarHBondContact OD1-N 3.22Å; D464-V469 HydrophobicContact CB-CB 4Å; D464-V469 HydrophobicContact CB-CG1 3.92Å; D464-V469 VanDerWaalsContact OD2-CG1 3.25Å; D464-V469 WeakPolarHBondContact OD2-CG1 3.5Å; D464-R470 HydrophobicContact CB-CG 3.83Å; D464-R470 VanDerWaalsContact O-CD 3.25Å; D464-R470 WeakPolarHBondContact O-CD 3.48Å; D464-R470 WeakPolarHBondContact O-CG 3.31Å; D464-R470 PolarHBondContact O-NH1 3.39Å
465N95Very high96.4Very high163 Ų16343.9 Ų43.987%0.87223%0.228SC*.SBendtrans-62.3-31.4176.9-68.5-24000112.1R470N465-R470 PolarHBondContact O-NH1 3Å; N465-R470 VanDerWaalsContact O-NH1 3.13Å
466S96.6Very high96.5Very high30 Ų3043.9 Ų43.921%0.2123%0.228CC..  trans-83.9120.4178.9-1770000111.9D464 K468 V469 R470D464-S466 PolarHBondContact O-N 2.92Å; D464-S466 WeakPolarHBondContact OD1-CB 3.46Å; D464-S466 PolarHBondContact OD1-N 3.22Å; S466-K468 PolarHBondContact O-N 2.68Å; S466-V469 PolarHBondContact O-N 3.31Å; S466-V469 VanDerWaalsContact O-N 3.11Å; S466-R470 PolarHBondContact O-N 3.36Å; S466-R470 VanDerWaalsContact O-N 3.12Å
467E96.6Very high96.7Very high81 Ų8141.6 Ų41.638%0.37921%0.213SC..Hα-helixtrans-56.9-38174.9-175.9-177.7125.200112.6V469 R470 T471 S505 S507 V508E467-V469 VanDerWaalsContact C-N 3.28Å; E467-V469 PolarHBondContact O-N 3.16Å; E467-R470 PolarHBondContact O-N 2.79Å; E467-T471 WeakPolarHBondContact O-CB 3.21Å; E467-T471 PolarHBondContact O-N 3.17Å; E467-T471 PolarHBondContact O-OG1 3.44Å; E467-S505 PolarHBondContact OE1-OG 3.49Å; E467-S505 WeakPolarHBondContact OE2-CB 3.44Å; E467-S505 PolarHBondContact OE2-OG 3.37Å; E467-S507 WeakPolarHBondContact OE1-CB 3.45Å; E467-S507 PolarHBondContact OE1-OG 2.99Å; E467-V508 HydrophobicContact CG-CG2 3.73Å
468K96.7Very high96.8Very high92 Ų9239.7 Ų39.740%0.420%0.199SC..Hα-helixtrans-61.3-38.6178.3172177.9174.41790111.9D429 C432 S466 S472D429-K468 WeakPolarHBondContact OD1-CE 2.96Å; D429-K468 IonicContact OD1-NZ 2.85Å; D429-K468 PolarHBondContact OD1-NZ 2.8Å; C432-K468 HydrophobicContact CB-CG 4.23Å; C432-K468 WeakPolarHBondContact SG-CE 3.36Å; S466-K468 PolarHBondContact O-N 2.68Å; K468-S472 PolarHBondContact O-N 3.07Å; K468-S472 VanDerWaalsContact O-N 3.11Å; K468-S472 PolarHBondContact O-OG 3.46Å
469V97.8Very high97Very high0 Ų042 Ų420%021%0.209CC..Hα-helixtrans-69.8-49.9177.9-178.40000109.9P428 R431 C432 F435 D464 S466 E467 T471 S472 F473P428-V469 HydrophobicContact CB-CG2 3.75Å; P428-V469 VanDerWaalsContact O-CG2 3.29Å; P428-V469 WeakPolarHBondContact O-CG2 3.06Å; R431-V469 HydrophobicContact CB-CG1 3.98Å; R431-V469 HydrophobicContact CB-CG2 4.05Å; C432-V469 HydrophobicContact CB-CG2 4.22Å; F435-V469 HydrophobicContact CD2-CG1 4.03Å; F435-V469 HydrophobicContact CE2-CG1 3.55Å; D464-V469 HydrophobicContact CB-CB 4Å; D464-V469 HydrophobicContact CB-CG1 3.92Å; D464-V469 VanDerWaalsContact OD2-CG1 3.25Å; D464-V469 WeakPolarHBondContact OD2-CG1 3.5Å; S466-V469 PolarHBondContact O-N 3.31Å; S466-V469 VanDerWaalsContact O-N 3.11Å; E467-V469 VanDerWaalsContact C-N 3.28Å; E467-V469 PolarHBondContact O-N 3.16Å; V469-T471 VanDerWaalsContact C-N 3.28Å; V469-T471 PolarHBondContact O-N 2.92Å; V469-S472 PolarHBondContact O-N 3.35Å; V469-S472 VanDerWaalsContact O-N 3.08Å; V469-F473 WeakPolarHBondContact O-CB 3.43Å; V469-F473 PolarHBondContact O-N 3.5Å
470R97.8Very high97.1Very high25 Ų2536.5 Ų36.59%0.09419%0.185CC..Hα-helixtrans-54.2-45.4175.3-62.2-165.6-59.4-87.56.9111.9L462 D464 N465 S466 E467 S472 F473 I474 D504 V508L462-R470 WeakPolarHBondContact O-CD 3.39Å; D464-R470 HydrophobicContact CB-CG 3.83Å; D464-R470 VanDerWaalsContact O-CD 3.25Å; D464-R470 WeakPolarHBondContact O-CD 3.48Å; D464-R470 WeakPolarHBondContact O-CG 3.31Å; D464-R470 PolarHBondContact O-NH1 3.39Å; N465-R470 PolarHBondContact O-NH1 3Å; N465-R470 VanDerWaalsContact O-NH1 3.13Å; S466-R470 PolarHBondContact O-N 3.36Å; S466-R470 VanDerWaalsContact O-N 3.12Å; E467-R470 PolarHBondContact O-N 2.79Å; R470-S472 PolarHBondContact O-N 3.18Å; R470-F473 PolarHBondContact O-N 3.11Å; R470-I474 WeakPolarHBondContact O-CG1 3.43Å; R470-I474 PolarHBondContact O-N 3.49Å; R470-D504 IonicContact CZ-OD1 2.64Å; R470-D504 IonicContact NE-OD1 3.46Å; R470-D504 PolarHBondContact NE-OD1 3.39Å; R470-D504 VanDerWaalsContact NE-OD1 3.08Å; R470-D504 IonicContact NE-OD2 2.84Å; R470-D504 PolarHBondContact NE-OD2 2.77Å; R470-D504 IonicContact NH2-OD1 3.23Å; R470-D504 PolarHBondContact NH2-OD1 3.32Å; R470-V508 HydrophobicContact CB-CG2 4.37Å
471T97.8Very high97.2Very high19 Ų1934.2 Ų34.212%0.11717%0.17CC..Hα-helixtrans-56.6-49.5176.7-600000111.5E467 V469 F473 I474 D475 R511E467-T471 WeakPolarHBondContact O-CB 3.21Å; E467-T471 PolarHBondContact O-N 3.17Å; E467-T471 PolarHBondContact O-OG1 3.44Å; V469-T471 VanDerWaalsContact C-N 3.28Å; V469-T471 PolarHBondContact O-N 2.92Å; T471-F473 VanDerWaalsContact C-N 3.33Å; T471-F473 PolarHBondContact O-N 3.23Å; T471-I474 PolarHBondContact O-N 3.45Å; T471-D475 PolarHBondContact O-N 3.37Å; T471-R511 VanDerWaalsContact CG2-NE 3.32Å
472S97.8Very high97.2Very high3 Ų337.2 Ų37.22%0.02120%0.195CC..Hα-helixtrans-68.7-33.8-177.8-53.40000112.1C432 K436 K468 V469 R470 D475 L476C432-S472 PolarHBondContact SG-OG 2.73Å; K436-S472 WeakPolarHBondContact CE-OG 3.4Å; K468-S472 PolarHBondContact O-N 3.07Å; K468-S472 VanDerWaalsContact O-N 3.11Å; K468-S472 PolarHBondContact O-OG 3.46Å; V469-S472 PolarHBondContact O-N 3.35Å; V469-S472 VanDerWaalsContact O-N 3.08Å; R470-S472 PolarHBondContact O-N 3.18Å; S472-D475 PolarHBondContact O-N 3.47Å; S472-L476 PolarHBondContact O-N 3.11Å
473F98.1Very high97.2Very high0 Ų039.1 Ų39.10%021%0.207CC..Hα-helixtrans-67-43.7174.9179.6-103.8000112.1F435 I458 L462 V469 R470 T471 D475 L476 L477 V491 C492F435-F473 HydrophobicContact CD1-CD2 4.02Å; F435-F473 HydrophobicContact CD2-CB 3.78Å; F435-F473 HydrophobicContact CD2-CD2 4.32Å; F435-F473 AromaticContact CE1-CD2 3.92Å; F435-F473 HydrophobicContact CE1-CD2 3.92Å; F435-F473 HydrophobicContact CE2-CB 4.04Å; F435-F473 HydrophobicContact CE2-CD2 4.19Å; F435-F473 HydrophobicContact CG-CB 4.21Å; F435-F473 HydrophobicContact CG-CD2 4.26Å; F435-F473 HydrophobicContact CZ-CD2 4.02Å; I458-F473 HydrophobicContact CB-CE2 4.21Å; I458-F473 HydrophobicContact CD1-CD2 4.16Å; I458-F473 HydrophobicContact CD1-CE2 3.65Å; I458-F473 HydrophobicContact CG1-CE2 3.78Å; I458-F473 WeakPolarHBondContact O-CE2 3.37Å; L462-F473 HydrophobicContact CB-CD1 4.12Å; L462-F473 HydrophobicContact CB-CE1 3.8Å; V469-F473 WeakPolarHBondContact O-CB 3.43Å; V469-F473 PolarHBondContact O-N 3.5Å; R470-F473 PolarHBondContact O-N 3.11Å; T471-F473 VanDerWaalsContact C-N 3.33Å; T471-F473 PolarHBondContact O-N 3.23Å; F473-D475 VanDerWaalsContact C-N 3.33Å; F473-D475 PolarHBondContact O-N 2.88Å; F473-L476 WeakPolarHBondContact O-CB 3.17Å; F473-L476 PolarHBondContact O-N 3.08Å; F473-L477 HydrophobicContact CD1-CD1 4.35Å; F473-L477 HydrophobicContact CE1-CD1 3.78Å; F473-L477 HydrophobicContact CE1-CG 4.19Å; F473-L477 HydrophobicContact CZ-CD1 4.26Å; F473-L477 HydrophobicContact CZ-CD2 4.25Å; F473-L477 HydrophobicContact CZ-CG 4.33Å; F473-L477 PolarHBondContact O-N 3.44Å; F473-V491 HydrophobicContact CZ-CG1 4.31Å; F473-C492 VanDerWaalsContact CE1-SG 3.52Å; F473-C492 VanDerWaalsContact CZ-SG 3.57Å
474I98.1Very high97.1Very high0 Ų046.8 Ų46.80%023%0.233CC..Hα-helixtrans-65.1-38.7173.8-60-58000111.2L462 R470 T471 L476 L477 I478 L497 V508 R511 I512L462-I474 HydrophobicContact CD1-CD1 3.49Å; L462-I474 VanDerWaalsContact CD1-CD1 3.49Å; L462-I474 HydrophobicContact CD1-CG1 4.45Å; R470-I474 WeakPolarHBondContact O-CG1 3.43Å; R470-I474 PolarHBondContact O-N 3.49Å; T471-I474 PolarHBondContact O-N 3.45Å; I474-L476 PolarHBondContact O-N 3Å; I474-L477 HydrophobicContact CD1-CD1 4.07Å; I474-L477 PolarHBondContact O-N 2.96Å; I474-L477 VanDerWaalsContact O-N 3.07Å; I474-I478 HydrophobicContact CG2-CD1 4.05Å; I474-I478 HydrophobicContact CG2-CG1 4.34Å; I474-I478 WeakPolarHBondContact O-CG1 3.45Å; I474-I478 PolarHBondContact O-N 3.06Å; I474-L497 HydrophobicContact CD1-CD2 4.07Å; I474-V508 HydrophobicContact CG1-CG1 4.42Å; I474-R511 HydrophobicContact CB-CB 4.25Å; I474-R511 HydrophobicContact CG2-CB 3.52Å; I474-I512 HydrophobicContact CD1-CG1 4.05Å; I474-I512 HydrophobicContact CG1-CG1 4.1Å; I474-I512 HydrophobicContact CG2-CG1 4.41Å
475D98.1Very high97Very high54 Ų5446.2 Ų46.229%0.28923%0.231SC..Hα-helixtrans-58.9-38.3174.5-73.9-24.5000111.4T471 S472 F473 I478 K479 R511T471-D475 PolarHBondContact O-N 3.37Å; S472-D475 PolarHBondContact O-N 3.47Å; F473-D475 VanDerWaalsContact C-N 3.33Å; F473-D475 PolarHBondContact O-N 2.88Å; D475-I478 PolarHBondContact O-N 2.8Å; D475-K479 PolarHBondContact O-N 3.19Å; D475-R511 VanDerWaalsContact CG-NE 3.3Å; D475-R511 WeakPolarHBondContact OD1-CD 3.35Å; D475-R511 IonicContact OD1-CZ 2.79Å; D475-R511 IonicContact OD1-NE 3.13Å; D475-R511 PolarHBondContact OD1-NE 3.26Å; D475-R511 IonicContact OD1-NH2 3.95Å; D475-R511 IonicContact OD2-CZ 3.45Å; D475-R511 IonicContact OD2-NE 2.63Å; D475-R511 PolarHBondContact OD2-NE 3Å; D475-R511 IonicContact OD2-NH2 2.71Å; D475-R511 PolarHBondContact OD2-NH2 3.3Å
476L98Very high96.9Very high0 Ų039.1 Ų39.10%020%0.195CC..Hα-helixtrans-62-46.1171.1176.367.1000111.8F435 L438 N439 L442 L455 I458 S472 F473 I474 I478 K479 V480F435-L476 HydrophobicContact CB-CB 4.33Å; F435-L476 HydrophobicContact CB-CD2 4.32Å; F435-L476 HydrophobicContact CD1-CD2 3.82Å; F435-L476 HydrophobicContact CG-CD2 4.45Å; L438-L476 HydrophobicContact CB-CD1 3.84Å; L438-L476 HydrophobicContact CB-CD2 4.49Å; L438-L476 HydrophobicContact CD1-CD2 4.08Å; N439-L476 WeakPolarHBondContact OD1-CA 3.21Å; N439-L476 WeakPolarHBondContact OD1-CD1 3.36Å; L442-L476 HydrophobicContact CD1-CD1 3.48Å; L442-L476 VanDerWaalsContact CD1-CD1 3.48Å; L455-L476 HydrophobicContact CD2-CD2 3.95Å; I458-L476 HydrophobicContact CD1-CD2 3.83Å; S472-L476 PolarHBondContact O-N 3.11Å; F473-L476 WeakPolarHBondContact O-CB 3.17Å; F473-L476 PolarHBondContact O-N 3.08Å; I474-L476 PolarHBondContact O-N 3Å; L476-I478 VanDerWaalsContact C-N 3.31Å; L476-I478 PolarHBondContact O-N 3.43Å; L476-K479 WeakPolarHBondContact O-CB 3.23Å; L476-K479 PolarHBondContact O-N 3.12Å; L476-K479 VanDerWaalsContact O-N 3.16Å; L476-V480 HydrophobicContact CD1-CG2 4.37Å; L476-V480 HydrophobicContact CG-CG2 4.45Å; L476-V480 VanDerWaalsContact O-CG2 3.27Å; L476-V480 WeakPolarHBondContact O-CG2 3.11Å; L476-V480 PolarHBondContact O-N 3.48Å
477L97.8Very high96.8Very high0 Ų043 Ų430%021%0.208CC..Hα-helixtrans-61.9-38.1177.1-65-177.1000112.6F473 I474 V480 K481 F488 V491 C492 L497 L515F473-L477 HydrophobicContact CD1-CD1 4.35Å; F473-L477 HydrophobicContact CE1-CD1 3.78Å; F473-L477 HydrophobicContact CE1-CG 4.19Å; F473-L477 HydrophobicContact CZ-CD1 4.26Å; F473-L477 HydrophobicContact CZ-CD2 4.25Å; F473-L477 HydrophobicContact CZ-CG 4.33Å; F473-L477 PolarHBondContact O-N 3.44Å; I474-L477 HydrophobicContact CD1-CD1 4.07Å; I474-L477 PolarHBondContact O-N 2.96Å; I474-L477 VanDerWaalsContact O-N 3.07Å; L477-V480 PolarHBondContact O-N 3.25Å; L477-K481 WeakPolarHBondContact O-CB 3.48Å; L477-K481 PolarHBondContact O-N 3.37Å; L477-F488 HydrophobicContact CB-CB 4.48Å; L477-V491 HydrophobicContact CD2-CB 3.98Å; L477-V491 HydrophobicContact CD2-CG1 3.76Å; L477-V491 HydrophobicContact CD2-CG2 4.44Å; L477-C492 HydrophobicContact CD1-CB 4.43Å; L477-L497 HydrophobicContact CD1-CD2 4.46Å; L477-L515 HydrophobicContact CB-CD1 4.22Å; L477-L515 HydrophobicContact CB-CD2 4.04Å; L477-L515 HydrophobicContact CD1-CD2 4.1Å
478I97.6Very high96.7Very high37 Ų3739.4 Ų39.419%0.1919%0.191CC..Hα-helixtrans-63-45174.1-67.7167000109.9I474 D475 L476 K481 A482 R511 D514 L515I474-I478 HydrophobicContact CG2-CD1 4.05Å; I474-I478 HydrophobicContact CG2-CG1 4.34Å; I474-I478 WeakPolarHBondContact O-CG1 3.45Å; I474-I478 PolarHBondContact O-N 3.06Å; D475-I478 PolarHBondContact O-N 2.8Å; L476-I478 VanDerWaalsContact C-N 3.31Å; L476-I478 PolarHBondContact O-N 3.43Å; I478-K481 PolarHBondContact O-N 3.44Å; I478-A482 WeakPolarHBondContact O-CB 3.44Å; I478-A482 PolarHBondContact O-N 2.9Å; I478-R511 HydrophobicContact CD1-CB 4.05Å; I478-R511 HydrophobicContact CD1-CG 4.48Å; I478-D514 HydrophobicContact CD1-CB 4.3Å; I478-L515 HydrophobicContact CG1-CB 4.14Å; I478-L515 HydrophobicContact CG1-CD1 4.11Å
479K97.4Very high96.5Very high55 Ų5540.9 Ų40.924%0.23919%0.194CC..Hα-helixtrans-60.5-47.8175.8-178.464.4175.3-177.30111.5N439 L442 D443 D475 L476 K481 A482 V483N439-K479 HydrophobicContact CB-CG 4.31Å; N439-K479 VanDerWaalsContact OD1-CB 3.23Å; N439-K479 WeakPolarHBondContact OD1-CB 3.26Å; N439-K479 WeakPolarHBondContact OD1-CG 3.36Å; L442-K479 HydrophobicContact CB-CG 4.29Å; L442-K479 HydrophobicContact CD1-CB 4.43Å; L442-K479 HydrophobicContact CD1-CG 3.92Å; D443-K479 VanDerWaalsContact OD1-CE 3.24Å; D443-K479 WeakPolarHBondContact OD1-CE 3.44Å; D443-K479 IonicContact OD1-NZ 3.68Å; D443-K479 PolarHBondContact OD1-NZ 3.23Å; D475-K479 PolarHBondContact O-N 3.19Å; L476-K479 WeakPolarHBondContact O-CB 3.23Å; L476-K479 PolarHBondContact O-N 3.12Å; L476-K479 VanDerWaalsContact O-N 3.16Å; K479-K481 VanDerWaalsContact C-N 3.32Å; K479-K481 PolarHBondContact O-N 2.98Å; K479-A482 WeakPolarHBondContact O-CB 3.42Å; K479-A482 PolarHBondContact O-N 3.32Å; K479-V483 HydrophobicContact CD-CG1 4.09Å; K479-V483 WeakPolarHBondContact O-CG2 3.3Å; K479-V483 PolarHBondContact O-N 3.46Å
480V96.8Very high96.3Very high0 Ų045.3 Ų45.30%022%0.218CC..Hα-helixtrans-54.4-47.1176.6167.40000111.2L442 L455 L476 L477 A482 R484 A485 A486L442-V480 HydrophobicContact CD1-CG2 3.64Å; L442-V480 HydrophobicContact CD2-CG2 4.38Å; L455-V480 HydrophobicContact CD1-CG1 4.25Å; L455-V480 HydrophobicContact CD1-CG2 3.66Å; L476-V480 HydrophobicContact CD1-CG2 4.37Å; L476-V480 HydrophobicContact CG-CG2 4.45Å; L476-V480 VanDerWaalsContact O-CG2 3.27Å; L476-V480 WeakPolarHBondContact O-CG2 3.11Å; L476-V480 PolarHBondContact O-N 3.48Å; L477-V480 PolarHBondContact O-N 3.25Å; V480-A482 PolarHBondContact O-N 3Å; V480-R484 PolarHBondContact O-N 3.35Å; V480-A485 HydrophobicContact CG1-CB 4.44Å; V480-A485 PolarHBondContact O-N 3.18Å; V480-A485 VanDerWaalsContact O-N 3.11Å; V480-A486 HydrophobicContact CG1-CB 3.76Å; V480-A486 WeakPolarHBondContact CG1-O 3.3Å
481K95.8Very high96.1Very high66 Ų6644.4 Ų44.429%0.28722%0.215SC..Hα-helixtrans-61.2-42.3174.5177.6-175.8174-173.60112.1L477 I478 K479 R484 F488 L515L477-K481 WeakPolarHBondContact O-CB 3.48Å; L477-K481 PolarHBondContact O-N 3.37Å; I478-K481 PolarHBondContact O-N 3.44Å; K479-K481 VanDerWaalsContact C-N 3.32Å; K479-K481 PolarHBondContact O-N 2.98Å; K481-R484 PolarHBondContact O-N 3.18Å; K481-F488 HydrophobicContact CB-CD1 4.4Å; K481-F488 HydrophobicContact CD-CD1 4.12Å; K481-F488 HydrophobicContact CD-CE1 4.19Å; K481-F488 HydrophobicContact CG-CD1 4.38Å; K481-L515 HydrophobicContact CB-CD1 4.32Å; K481-L515 HydrophobicContact CD-CD1 3.92Å; K481-L515 PolarHBondContact NZ-O 2.86Å
482A96.4Very high95.8Very high75 Ų7543.7 Ų43.762%0.6221%0.211SC*.Hα-helixtrans-67.5-43.1-176.600000112.6I478 K479 V480 R484I478-A482 WeakPolarHBondContact O-CB 3.44Å; I478-A482 PolarHBondContact O-N 2.9Å; K479-A482 WeakPolarHBondContact O-CB 3.42Å; K479-A482 PolarHBondContact O-N 3.32Å; V480-A482 PolarHBondContact O-N 3Å; A482-R484 VanDerWaalsContact C-N 3.32Å
483V96.4Very high95.6Very high42 Ų4245.8 Ų45.826%0.25523%0.226SC..Hα-helixtrans-87-1.2178.8-55.90000113.5L442 K479 A485L442-V483 HydrophobicContact CB-CG2 4.43Å; L442-V483 HydrophobicContact CD2-CG2 4.41Å; K479-V483 HydrophobicContact CD-CG1 4.09Å; K479-V483 WeakPolarHBondContact O-CG2 3.3Å; K479-V483 PolarHBondContact O-N 3.46Å; V483-A485 HydrophobicContact CG2-CB 3.73Å; V483-A485 PolarHBondContact O-N 3.06Å
484R95.6Very high95.4Very high224 Ų22447.8 Ų47.885%0.84524%0.236SC*.THydrogen-bonded Turntrans5833-178-50.8178.3-1741791.1113.4V480 K481 A482V480-R484 PolarHBondContact O-N 3.35Å; K481-R484 PolarHBondContact O-N 3.18Å; A482-R484 VanDerWaalsContact C-N 3.32Å
485A94.1Very high95.3Very high5 Ų553.1 Ų53.14%0.04126%0.264CS..SBendtrans-72.6-31.7-178.900000113L442 H448 V480 V483L442-A485 HydrophobicContact CD2-CB 3.62Å; H448-A485 HydrophobicContact CB-CB 3.98Å; V480-A485 HydrophobicContact CG1-CB 4.44Å; V480-A485 PolarHBondContact O-N 3.18Å; V480-A485 VanDerWaalsContact O-N 3.11Å; V483-A485 HydrophobicContact CG2-CB 3.73Å; V483-A485 PolarHBondContact O-N 3.06Å
486A94.3Very high95.1Very high13 Ų1355 Ų5511%0.10727%0.271CS..SBendtrans-159.9164.6175.600000109.4E452 L455 V480E452-A486 HydrophobicContact CB-CB 4.16Å; E452-A486 HydrophobicContact CG-CB 3.86Å; L455-A486 HydrophobicContact CD1-CB 4.43Å; V480-A486 HydrophobicContact CG1-CB 3.76Å; V480-A486 WeakPolarHBondContact CG1-O 3.3Å
487K94.3Very high95.1Very high113 Ų11355 Ų5549%0.49127%0.271SS..  trans-78.3122.1167.9-69166.9174.9178.40109W489 D490K487-W489 HydrophobicContact CB-CD2 4.03Å; K487-W489 HydrophobicContact CB-CG 4.45Å; K487-W489 HydrophobicContact CB-CH2 4.35Å; K487-W489 HydrophobicContact CB-CZ2 3.79Å; K487-W489 HydrophobicContact CD-CZ2 3.54Å; K487-W489 HydrophobicContact CG-CH2 4.1Å; K487-W489 HydrophobicContact CG-CZ2 3.51Å; K487-W489 PolarHBondContact O-N 2.98Å; K487-W489 VanDerWaalsContact O-N 3.14Å; K487-D490 HydrophobicContact CB-CB 4.31Å; K487-D490 WeakPolarHBondContact CB-OD2 3.47Å; K487-D490 VanDerWaalsContact CD-OD2 3.32Å; K487-D490 WeakPolarHBondContact CD-OD2 3.42Å; K487-D490 WeakPolarHBondContact O-CB 3.36Å; K487-D490 PolarHBondContact O-N 3.25Å
488F94.3Very high95.1Very high4 Ų455.2 Ų55.22%0.01827%0.272CS..Hα-helixtrans-61.7-27.1-176.872.5-97.1000113.1L477 K481 D490 V491 C492 L497 L515 L516L477-F488 HydrophobicContact CB-CB 4.48Å; K481-F488 HydrophobicContact CB-CD1 4.4Å; K481-F488 HydrophobicContact CD-CD1 4.12Å; K481-F488 HydrophobicContact CD-CE1 4.19Å; K481-F488 HydrophobicContact CG-CD1 4.38Å; F488-D490 VanDerWaalsContact C-N 3.3Å; F488-V491 PolarHBondContact O-N 3.26Å; F488-C492 PolarHBondContact O-N 3.44Å; F488-L497 HydrophobicContact CD2-CD1 3.87Å; F488-L497 HydrophobicContact CE2-CD1 3.77Å; F488-L515 HydrophobicContact CB-CD1 4.14Å; F488-L515 HydrophobicContact CD1-CD1 3.9Å; F488-L515 HydrophobicContact CD1-CG 4.35Å; F488-L515 HydrophobicContact CD2-CD1 4.18Å; F488-L515 HydrophobicContact CD2-CD2 3.76Å; F488-L515 HydrophobicContact CD2-CG 3.95Å; F488-L515 HydrophobicContact CE1-CD1 4.33Å; F488-L515 HydrophobicContact CE1-CG 4.43Å; F488-L515 HydrophobicContact CE2-CD2 4.13Å; F488-L515 HydrophobicContact CE2-CG 4.06Å; F488-L515 HydrophobicContact CG-CD1 3.81Å; F488-L515 HydrophobicContact CG-CD2 4.19Å; F488-L515 HydrophobicContact CG-CG 4.11Å; F488-L515 HydrophobicContact CZ-CG 4.29Å; F488-L516 HydrophobicContact CE2-CD2 3.72Å; F488-L516 HydrophobicContact CZ-CD2 3.83Å
489W93Very high95Very high123 Ų12355.4 Ų55.447%0.46628%0.279SS..Hα-helixtrans-75.4-18.2177.95778.5000113.6K487 V491 C492K487-W489 HydrophobicContact CB-CD2 4.03Å; K487-W489 HydrophobicContact CB-CG 4.45Å; K487-W489 HydrophobicContact CB-CH2 4.35Å; K487-W489 HydrophobicContact CB-CZ2 3.79Å; K487-W489 HydrophobicContact CD-CZ2 3.54Å; K487-W489 HydrophobicContact CG-CH2 4.1Å; K487-W489 HydrophobicContact CG-CZ2 3.51Å; K487-W489 PolarHBondContact O-N 2.98Å; K487-W489 VanDerWaalsContact O-N 3.14Å; W489-V491 VanDerWaalsContact C-N 3.31Å; W489-C492 VanDerWaalsContact CA-O 3.29Å; W489-C492 WeakPolarHBondContact CA-O 3.28Å; W489-C492 CarbonylContact O-C 3.43Å
490D91.7Very high95Very high94 Ų9454.3 Ų54.350%0.50327%0.273SS..Hα-helixtrans-79.2-21171.3-62.6-18000110.9K487 F488K487-D490 HydrophobicContact CB-CB 4.31Å; K487-D490 WeakPolarHBondContact CB-OD2 3.47Å; K487-D490 VanDerWaalsContact CD-OD2 3.32Å; K487-D490 WeakPolarHBondContact CD-OD2 3.42Å; K487-D490 WeakPolarHBondContact O-CB 3.36Å; K487-D490 PolarHBondContact O-N 3.25Å; F488-D490 VanDerWaalsContact C-N 3.3Å
491V93.9Very high95Very high5 Ų554.3 Ų54.33%0.0327%0.273CS..Hα-helixtrans-83.9-52171.6-177.30000110.8L455 K459 F473 L477 F488 W489L455-V491 HydrophobicContact CB-CG1 4.18Å; L455-V491 HydrophobicContact CB-CG2 3.68Å; L455-V491 HydrophobicContact CD1-CG2 4.43Å; L455-V491 WeakPolarHBondContact O-CG1 3.42Å; K459-V491 WeakPolarHBondContact CB-O 3.28Å; F473-V491 HydrophobicContact CZ-CG1 4.31Å; L477-V491 HydrophobicContact CD2-CB 3.98Å; L477-V491 HydrophobicContact CD2-CG1 3.76Å; L477-V491 HydrophobicContact CD2-CG2 4.44Å; F488-V491 PolarHBondContact O-N 3.26Å; W489-V491 VanDerWaalsContact C-N 3.31Å
492C93.1Very high95.1Very high4 Ų451.9 Ų51.93%0.02727%0.265CS..SBendtrans-130.4120.6177.6-68.90000110.8L462 F473 L477 F488 W489 L497L462-C492 HydrophobicContact CD2-CB 4.11Å; F473-C492 VanDerWaalsContact CE1-SG 3.52Å; F473-C492 VanDerWaalsContact CZ-SG 3.57Å; L477-C492 HydrophobicContact CD1-CB 4.43Å; F488-C492 PolarHBondContact O-N 3.44Å; W489-C492 VanDerWaalsContact CA-O 3.29Å; W489-C492 WeakPolarHBondContact CA-O 3.28Å; W489-C492 CarbonylContact O-C 3.43Å; C492-L497 HydrophobicContact CB-CD2 4.45Å; C492-L497 HydrophobicContact CB-CG 4.29Å
493S93.1Very high95Very high47 Ų4754.1 Ų54.133%0.32927%0.266SS..  trans-54.9148.7176.864.10000112.3D495 H496 L497S493-D495 PolarHBondContact O-N 3.26Å; S493-H496 PolarHBondContact O-N 2.88Å; S493-H496 PolarHBondContact OG-CD2 3.17Å; S493-H496 PolarHBondContact OG-N 3.42Å; S493-L497 PolarHBondContact O-N 3.12Å
494M93.9Very high95Very high43 Ų4352.4 Ų52.421%0.21226%0.255CS..Hα-helixtrans-52.4-41.8175-169.861.868.800112.3H496 L497 L498 L516 F520 M540M494-H496 PolarHBondContact O-N 3.02Å; M494-L497 PolarHBondContact O-N 3.5Å; M494-L497 VanDerWaalsContact O-N 3.12Å; M494-L498 HydrophobicContact CG-CD1 3.99Å; M494-L498 HydrophobicContact CG-CG 4.16Å; M494-L498 WeakPolarHBondContact O-CG 3.49Å; M494-L498 PolarHBondContact O-N 3.14Å; M494-L498 HydrophobicContact SD-CD2 4.48Å; M494-L498 HydrophobicContact SD-CG 4.28Å; M494-L516 HydrophobicContact CE-CD2 3.86Å; M494-L516 HydrophobicContact SD-CD1 4.19Å; M494-L516 HydrophobicContact SD-CD2 3.63Å; M494-F520 HydrophobicContact CE-CE2 4.4Å; M494-F520 HydrophobicContact SD-CE2 3.89Å; M494-F520 HydrophobicContact SD-CZ 4.03Å; M494-M540 HydrophobicContact CB-CE 4.42Å; M494-M540 HydrophobicContact CG-CE 3.75Å
495D94.6Very high95Very high111 Ų11143.8 Ų43.859%0.59423%0.229SC*.Hα-helixtrans-59.5-45.7-177.5-61-25.2000112.7S493 L497 L498 A499S493-D495 PolarHBondContact O-N 3.26Å; D495-L497 PolarHBondContact O-N 3.36Å; D495-L498 PolarHBondContact O-N 2.79Å; D495-A499 VanDerWaalsContact O-CB 3.24Å; D495-A499 WeakPolarHBondContact O-CB 3.31Å; D495-A499 PolarHBondContact O-N 3.1Å
496H95.6Very high94.9Very high95 Ų9547.9 Ų47.944%0.4425%0.25SC..Hα-helixtrans-65.4-37.5175.8-75.7-57.5000112.9L462 H463 S493 M494 R500L462-H496 HydrophobicContact CD2-CB 3.76Å; H463-H496 AromaticContact CE1-ND1 3.5Å; H463-H496 AromaticContact NE2-CE1 3.72Å; H463-H496 AromaticContact NE2-CG 3.43Å; H463-H496 AromaticContact NE2-ND1 3.05Å; H463-H496 PolarHBondContact NE2-ND1 3.31Å; S493-H496 PolarHBondContact O-N 2.88Å; S493-H496 PolarHBondContact OG-CD2 3.17Å; S493-H496 PolarHBondContact OG-N 3.42Å; M494-H496 PolarHBondContact O-N 3.02Å; H496-R500 WeakPolarHBondContact O-CG 3.32Å; H496-R500 PolarHBondContact O-N 2.58Å
497L97.2Very high94.9Very high0 Ų048.9 Ų48.90%026%0.256CS..Hα-helixtrans-65.4-43.2176.4-71.7168.7000111.3L462 I474 L477 F488 C492 S493 M494 D495 R500 L501 L515 L516L462-L497 HydrophobicContact CD1-CD2 4.05Å; L462-L497 HydrophobicContact CD2-CD2 3.95Å; L462-L497 HydrophobicContact CD2-CG 4.29Å; I474-L497 HydrophobicContact CD1-CD2 4.07Å; L477-L497 HydrophobicContact CD1-CD2 4.46Å; F488-L497 HydrophobicContact CD2-CD1 3.87Å; F488-L497 HydrophobicContact CE2-CD1 3.77Å; C492-L497 HydrophobicContact CB-CD2 4.45Å; C492-L497 HydrophobicContact CB-CG 4.29Å; S493-L497 PolarHBondContact O-N 3.12Å; M494-L497 PolarHBondContact O-N 3.5Å; M494-L497 VanDerWaalsContact O-N 3.12Å; D495-L497 PolarHBondContact O-N 3.36Å; L497-R500 PolarHBondContact O-N 2.87Å; L497-L501 WeakPolarHBondContact O-CB 3.4Å; L497-L501 PolarHBondContact O-N 3.42Å; L497-L515 HydrophobicContact CD1-CD2 4.18Å; L497-L515 HydrophobicContact CD2-CD2 4.18Å; L497-L516 HydrophobicContact CB-CD1 4.44Å; L497-L516 HydrophobicContact CD1-CD2 4.25Å
498L97.4Very high95Very high3 Ų343.5 Ų43.52%0.01623%0.233CC..Hα-helixtrans-68-42.3176.6-65.7-177000111.8M494 D495 R500 L501 A502 L516 F520 L537 M540 N541 A544M494-L498 HydrophobicContact CG-CD1 3.99Å; M494-L498 HydrophobicContact CG-CG 4.16Å; M494-L498 WeakPolarHBondContact O-CG 3.49Å; M494-L498 PolarHBondContact O-N 3.14Å; M494-L498 HydrophobicContact SD-CD2 4.48Å; M494-L498 HydrophobicContact SD-CG 4.28Å; D495-L498 PolarHBondContact O-N 2.79Å; L498-R500 VanDerWaalsContact C-N 3.33Å; L498-R500 PolarHBondContact O-N 3.04Å; L498-L501 PolarHBondContact O-N 2.56Å; L498-A502 PolarHBondContact O-N 2.82Å; L498-L516 HydrophobicContact CD2-CD1 3.89Å; L498-F520 HydrophobicContact CD2-CE2 4.29Å; L498-L537 HydrophobicContact CD1-CD1 4.02Å; L498-L537 HydrophobicContact CD2-CD1 3.53Å; L498-L537 HydrophobicContact CG-CD1 4.44Å; L498-M540 HydrophobicContact CD1-CB 3.81Å; L498-M540 HydrophobicContact CD1-CE 3.76Å; L498-M540 HydrophobicContact CD1-SD 4.06Å; L498-N541 HydrophobicContact CB-CB 4.24Å; L498-A544 HydrophobicContact CB-CB 4.06Å; L498-A544 HydrophobicContact CD2-CB 4.09Å; L498-A544 WeakPolarHBondContact O-CB 3.37Å
499A96.6Very high95.1Very high41 Ų4143.4 Ų43.434%0.33923%0.232SC..Hα-helixtrans-59.4-43.7174.800000111.5D495D495-A499 VanDerWaalsContact O-CB 3.24Å; D495-A499 WeakPolarHBondContact O-CB 3.31Å; D495-A499 PolarHBondContact O-N 3.1Å
500R96.3Very high95.2Very high33 Ų3341 Ų4113%0.12523%0.225CC..Hα-helixtrans-63.3-48.5172.1-75.7-46.9-54.8-177.6-0.5111.5L462 H463 H496 L497 L498 A502 I503 D504 I512L462-R500 HydrophobicContact CD1-CB 4.34Å; L462-R500 HydrophobicContact CD1-CG 3.78Å; L462-R500 HydrophobicContact CD2-CG 4.22Å; L462-R500 HydrophobicContact CG-CG 3.65Å; H463-R500 WeakPolarHBondContact ND1-CD 3.29Å; H496-R500 WeakPolarHBondContact O-CG 3.32Å; H496-R500 PolarHBondContact O-N 2.58Å; L497-R500 PolarHBondContact O-N 2.87Å; L498-R500 VanDerWaalsContact C-N 3.33Å; L498-R500 PolarHBondContact O-N 3.04Å; R500-A502 PolarHBondContact O-N 3.06Å; R500-I503 PolarHBondContact O-N 2.85Å; R500-D504 IonicContact CZ-OD1 3.06Å; R500-D504 IonicContact CZ-OD2 3.32Å; R500-D504 IonicContact NE-OD2 2.73Å; R500-D504 PolarHBondContact NE-OD2 3.28Å; R500-D504 IonicContact NH2-OD1 2.86Å; R500-D504 PolarHBondContact NH2-OD1 2.71Å; R500-D504 IonicContact NH2-OD2 2.97Å; R500-D504 PolarHBondContact NH2-OD2 2.84Å; R500-D504 VanDerWaalsContact O-CB 3.29Å; R500-D504 WeakPolarHBondContact O-CB 3.45Å; R500-D504 PolarHBondContact O-N 2.86Å; R500-I512 HydrophobicContact CB-CD1 3.87Å
501L97.6Very high95.5Very high0 Ų040.2 Ų40.20%022%0.215CC..Hα-helixtrans-52.2-46.5179.2-179.155.9000110.8L497 L498 I503 I512 V513 A544 K547 F548L497-L501 WeakPolarHBondContact O-CB 3.4Å; L497-L501 PolarHBondContact O-N 3.42Å; L498-L501 PolarHBondContact O-N 2.56Å; L501-I503 VanDerWaalsContact C-N 3.28Å; L501-I503 PolarHBondContact O-N 2.73Å; L501-I512 HydrophobicContact CB-CD1 4.43Å; L501-I512 HydrophobicContact CB-CG2 4.03Å; L501-I512 HydrophobicContact CD1-CB 4.35Å; L501-I512 HydrophobicContact CD1-CG2 4.42Å; L501-I512 HydrophobicContact CD2-CG2 4.32Å; L501-I512 HydrophobicContact CG-CG2 4.49Å; L501-V513 HydrophobicContact CD1-CG2 3.98Å; L501-V513 HydrophobicContact CD2-CG2 4.28Å; L501-A544 HydrophobicContact CB-CB 4.21Å; L501-A544 HydrophobicContact CD2-CB 4.17Å; L501-A544 WeakPolarHBondContact CD2-O 3.41Å; L501-A544 HydrophobicContact CG-CB 4.24Å; L501-K547 HydrophobicContact CD1-CB 3.98Å; L501-K547 HydrophobicContact CG-CB 4.14Å; L501-K547 WeakPolarHBondContact O-CD 3.38Å; L501-K547 PolarHBondContact O-NZ 2.83Å; L501-F548 HydrophobicContact CD2-CB 4.03Å
502A96.9Very high95.7Very high14 Ų1440 Ų4012%0.11621%0.214CC..Hα-helixtrans-54.5-38179.100000113.8L498 R500 M543 A544 K547L498-A502 PolarHBondContact O-N 2.82Å; R500-A502 PolarHBondContact O-N 3.06Å; A502-M543 HydrophobicContact CB-CB 3.73Å; A502-A544 HydrophobicContact CB-CB 4.35Å; A502-K547 WeakPolarHBondContact O-CE 3.38Å; A502-K547 PolarHBondContact O-NZ 2.67Å
503I96.1Very high95.9Very high122 Ų12239.8 Ų39.863%0.62621%0.212SC*.Hα-helixtrans-109.8-20.7-172.167.7175.8000115R500 L501 K547R500-I503 PolarHBondContact O-N 2.85Å; L501-I503 VanDerWaalsContact C-N 3.28Å; L501-I503 PolarHBondContact O-N 2.73Å; I503-K547 VanDerWaalsContact C-NZ 3.28Å
504D96.3Very high96.1Very high7 Ų740.7 Ų40.74%0.03721%0.214CC..SBendtrans-69.9164.5-171.9-114-47.9000114.1R470 R500 V508 S509 K547R470-D504 IonicContact CZ-OD1 2.64Å; R470-D504 IonicContact NE-OD1 3.46Å; R470-D504 PolarHBondContact NE-OD1 3.39Å; R470-D504 VanDerWaalsContact NE-OD1 3.08Å; R470-D504 IonicContact NE-OD2 2.84Å; R470-D504 PolarHBondContact NE-OD2 2.77Å; R470-D504 IonicContact NH2-OD1 3.23Å; R470-D504 PolarHBondContact NH2-OD1 3.32Å; R500-D504 IonicContact CZ-OD1 3.06Å; R500-D504 IonicContact CZ-OD2 3.32Å; R500-D504 IonicContact NE-OD2 2.73Å; R500-D504 PolarHBondContact NE-OD2 3.28Å; R500-D504 IonicContact NH2-OD1 2.86Å; R500-D504 PolarHBondContact NH2-OD1 2.71Å; R500-D504 IonicContact NH2-OD2 2.97Å; R500-D504 PolarHBondContact NH2-OD2 2.84Å; R500-D504 VanDerWaalsContact O-CB 3.29Å; R500-D504 WeakPolarHBondContact O-CB 3.45Å; R500-D504 PolarHBondContact O-N 2.86Å; D504-V508 HydrophobicContact CB-CB 3.94Å; D504-V508 HydrophobicContact CB-CG1 4.07Å; D504-V508 WeakPolarHBondContact OD2-CG1 3.44Å; D504-S509 PolarHBondContact O-OG 3.47Å; D504-K547 PolarHBondContact O-NZ 2.96Å
505S94.2Very high96.3Very high42 Ų4238.7 Ų38.729%0.29420%0.204SC..  trans-69.8171.9174.366.90000112.4E467 S507 V508 S509E467-S505 PolarHBondContact OE1-OG 3.49Å; E467-S505 WeakPolarHBondContact OE2-CB 3.44Å; E467-S505 PolarHBondContact OE2-OG 3.37Å; S505-S507 VanDerWaalsContact C-N 3.28Å; S505-S507 PolarHBondContact O-N 2.98Å; S505-S507 PolarHBondContact OG-OG 3.4Å; S505-V508 PolarHBondContact O-N 3.04Å; S505-S509 VanDerWaalsContact O-CB 3.25Å; S505-S509 WeakPolarHBondContact O-CB 3.38Å; S505-S509 PolarHBondContact O-N 3.16Å; S505-S509 PolarHBondContact O-OG 3.43Å
506L92.7Very high96.4Very high92 Ų9233.4 Ų33.448%0.48218%0.176SC..Hα-helixtrans-58.7-36.7-178.4-179.763.7000113.4K510 F551L506-K510 HydrophobicContact CD1-CD 4.36Å; L506-K510 HydrophobicContact CD1-CG 4.34Å; L506-K510 HydrophobicContact CG-CD 4.42Å; L506-K510 VanDerWaalsContact CG-CE 3.48Å; L506-K510 VanDerWaalsContact O-CG 3.29Å; L506-K510 WeakPolarHBondContact O-CG 3.31Å; L506-K510 PolarHBondContact O-N 3.15Å; L506-F551 HydrophobicContact CD1-CD1 4.31Å; L506-F551 HydrophobicContact CD1-CE1 3.22Å; L506-F551 HydrophobicContact CD1-CE2 4.06Å; L506-F551 HydrophobicContact CD1-CZ 3.08Å
507S93.7Very high96.4Very high34 Ų3429.7 Ų29.724%0.23816%0.158CC..Hα-helixtrans-66.8-42.2-176.655.90000112.3E467 S505 R511E467-S507 WeakPolarHBondContact OE1-CB 3.45Å; E467-S507 PolarHBondContact OE1-OG 2.99Å; S505-S507 VanDerWaalsContact C-N 3.28Å; S505-S507 PolarHBondContact O-N 2.98Å; S505-S507 PolarHBondContact OG-OG 3.4Å; S507-R511 PolarHBondContact O-NH1 3.38Å
508V96.3Very high96.3Very high0 Ų037.1 Ų37.10%019%0.191CC..Hα-helixtrans-79.9-44.5178.6-176.70000110.3E467 R470 I474 D504 S505 K510 R511 I512E467-V508 HydrophobicContact CG-CG2 3.73Å; R470-V508 HydrophobicContact CB-CG2 4.37Å; I474-V508 HydrophobicContact CG1-CG1 4.42Å; D504-V508 HydrophobicContact CB-CB 3.94Å; D504-V508 HydrophobicContact CB-CG1 4.07Å; D504-V508 WeakPolarHBondContact OD2-CG1 3.44Å; S505-V508 PolarHBondContact O-N 3.04Å; V508-K510 VanDerWaalsContact C-N 3.34Å; V508-K510 PolarHBondContact O-N 2.93Å; V508-R511 WeakPolarHBondContact O-CB 3.41Å; V508-R511 PolarHBondContact O-N 3.14Å; V508-I512 HydrophobicContact CG1-CD1 3.86Å; V508-I512 HydrophobicContact CG1-CG1 4.26Å; V508-I512 PolarHBondContact O-N 3.04Å
509S96.6Very high96.1Very high1 Ų138.8 Ų38.81%0.00720%0.202CC..Hα-helixtrans-55.9-45-178.5-63.20000112.3D504 S505 R511 I512 V513D504-S509 PolarHBondContact O-OG 3.47Å; S505-S509 VanDerWaalsContact O-CB 3.25Å; S505-S509 WeakPolarHBondContact O-CB 3.38Å; S505-S509 PolarHBondContact O-N 3.16Å; S505-S509 PolarHBondContact O-OG 3.43Å; S509-R511 VanDerWaalsContact C-N 3.26Å; S509-R511 PolarHBondContact O-N 3.2Å; S509-I512 PolarHBondContact O-N 2.99Å; S509-V513 WeakPolarHBondContact O-CG2 3.38Å; S509-V513 PolarHBondContact O-N 3.04Å
510K96.1Very high96.1Very high72 Ų7237.3 Ų37.331%0.31319%0.188SC..Hα-helixtrans-56.9-38.6177.3-74.6172.6-169.91700112.9L506 V508 V513 D514 F551 K554L506-K510 HydrophobicContact CD1-CD 4.36Å; L506-K510 HydrophobicContact CD1-CG 4.34Å; L506-K510 HydrophobicContact CG-CD 4.42Å; L506-K510 VanDerWaalsContact CG-CE 3.48Å; L506-K510 VanDerWaalsContact O-CG 3.29Å; L506-K510 WeakPolarHBondContact O-CG 3.31Å; L506-K510 PolarHBondContact O-N 3.15Å; V508-K510 VanDerWaalsContact C-N 3.34Å; V508-K510 PolarHBondContact O-N 2.93Å; K510-V513 PolarHBondContact O-N 3.23Å; K510-D514 PolarHBondContact O-N 2.97Å; K510-F551 HydrophobicContact CG-CD1 4.13Å; K510-F551 HydrophobicContact CG-CD2 4.43Å; K510-F551 HydrophobicContact CG-CE1 4.46Å; K510-F551 HydrophobicContact CG-CG 4.15Å; K510-K554 VanDerWaalsContact CE-NZ 3.34Å
511R97.2Very high96.1Very high78 Ų7835.8 Ų35.829%0.29418%0.182SC..Hα-helixtrans-75.3-39.1-179.4-68.1172.4162.977-0.2112T471 I474 D475 I478 S507 V508 S509 V513 D514 L515T471-R511 VanDerWaalsContact CG2-NE 3.32Å; I474-R511 HydrophobicContact CB-CB 4.25Å; I474-R511 HydrophobicContact CG2-CB 3.52Å; D475-R511 VanDerWaalsContact CG-NE 3.3Å; D475-R511 WeakPolarHBondContact OD1-CD 3.35Å; D475-R511 IonicContact OD1-CZ 2.79Å; D475-R511 IonicContact OD1-NE 3.13Å; D475-R511 PolarHBondContact OD1-NE 3.26Å; D475-R511 IonicContact OD1-NH2 3.95Å; D475-R511 IonicContact OD2-CZ 3.45Å; D475-R511 IonicContact OD2-NE 2.63Å; D475-R511 PolarHBondContact OD2-NE 3Å; D475-R511 IonicContact OD2-NH2 2.71Å; D475-R511 PolarHBondContact OD2-NH2 3.3Å; I478-R511 HydrophobicContact CD1-CB 4.05Å; I478-R511 HydrophobicContact CD1-CG 4.48Å; S507-R511 PolarHBondContact O-NH1 3.38Å; V508-R511 WeakPolarHBondContact O-CB 3.41Å; V508-R511 PolarHBondContact O-N 3.14Å; S509-R511 VanDerWaalsContact C-N 3.26Å; S509-R511 PolarHBondContact O-N 3.2Å; R511-V513 VanDerWaalsContact C-N 3.26Å; R511-V513 PolarHBondContact O-N 3.01Å; R511-D514 WeakPolarHBondContact O-CB 3.44Å; R511-D514 PolarHBondContact O-N 2.99Å; R511-L515 PolarHBondContact O-N 3.08Å
512I97.8Very high95.9Very high0 Ų036.9 Ų36.90%019%0.19CC..Hα-helixtrans-61.7-40.6172.4-62.3173000109.7I474 R500 L501 V508 S509 L515 L516I474-I512 HydrophobicContact CD1-CG1 4.05Å; I474-I512 HydrophobicContact CG1-CG1 4.1Å; I474-I512 HydrophobicContact CG2-CG1 4.41Å; R500-I512 HydrophobicContact CB-CD1 3.87Å; L501-I512 HydrophobicContact CB-CD1 4.43Å; L501-I512 HydrophobicContact CB-CG2 4.03Å; L501-I512 HydrophobicContact CD1-CB 4.35Å; L501-I512 HydrophobicContact CD1-CG2 4.42Å; L501-I512 HydrophobicContact CD2-CG2 4.32Å; L501-I512 HydrophobicContact CG-CG2 4.49Å; V508-I512 HydrophobicContact CG1-CD1 3.86Å; V508-I512 HydrophobicContact CG1-CG1 4.26Å; V508-I512 PolarHBondContact O-N 3.04Å; S509-I512 PolarHBondContact O-N 2.99Å; I512-L515 WeakPolarHBondContact O-CB 3.22Å; I512-L515 PolarHBondContact O-N 3.46Å; I512-L516 HydrophobicContact CG2-CD1 3.69Å; I512-L516 HydrophobicContact CG2-CG 4.18Å; I512-L516 WeakPolarHBondContact O-CB 3.37Å; I512-L516 VanDerWaalsContact O-CG 3.31Å; I512-L516 WeakPolarHBondContact O-CG 3.49Å; I512-L516 PolarHBondContact O-N 3.17Å
513V97.8Very high95.7Very high0 Ų038.4 Ų38.40%020%0.197CC..Hα-helixtrans-61.7-44.2173.9174.80000111.6L501 S509 K510 R511 L515 L516 F517 F548 F551L501-V513 HydrophobicContact CD1-CG2 3.98Å; L501-V513 HydrophobicContact CD2-CG2 4.28Å; S509-V513 WeakPolarHBondContact O-CG2 3.38Å; S509-V513 PolarHBondContact O-N 3.04Å; K510-V513 PolarHBondContact O-N 3.23Å; R511-V513 VanDerWaalsContact C-N 3.26Å; R511-V513 PolarHBondContact O-N 3.01Å; V513-L515 VanDerWaalsContact C-N 3.32Å; V513-L515 PolarHBondContact O-N 2.91Å; V513-L516 CarbonylContact O-C 3.54Å; V513-L516 PolarHBondContact O-N 3.15Å; V513-L516 VanDerWaalsContact O-N 3.16Å; V513-F517 VanDerWaalsContact O-CA 3.31Å; V513-F517 WeakPolarHBondContact O-CA 3.41Å; V513-F517 VanDerWaalsContact O-CB 3.29Å; V513-F517 WeakPolarHBondContact O-CB 3.32Å; V513-F517 PolarHBondContact O-N 3.03Å; V513-F548 HydrophobicContact CB-CD2 4.4Å; V513-F548 HydrophobicContact CG1-CD2 4.05Å; V513-F548 HydrophobicContact CG1-CE2 4.08Å; V513-F548 HydrophobicContact CG2-CB 4.43Å; V513-F548 HydrophobicContact CG2-CD2 4.02Å; V513-F551 HydrophobicContact CB-CB 4.36Å; V513-F551 HydrophobicContact CG1-CB 4.14Å; V513-F551 HydrophobicContact CG2-CB 4.25Å; V513-F551 HydrophobicContact CG2-CD2 4.22Å
514D97.4Very high95.5Very high67 Ų6740.4 Ų40.436%0.35821%0.209SC..Hα-helixtrans-58.4-43.7174.8-169.924000112.3I478 K510 R511 L516 H555I478-D514 HydrophobicContact CD1-CB 4.3Å; K510-D514 PolarHBondContact O-N 2.97Å; R511-D514 WeakPolarHBondContact O-CB 3.44Å; R511-D514 PolarHBondContact O-N 2.99Å; D514-L516 VanDerWaalsContact C-N 3.33Å; D514-L516 PolarHBondContact O-N 3.06Å; D514-H555 IonicContact OD1-CE1 3.16Å; D514-H555 PolarHBondContact OD1-CE1 3.28Å; D514-H555 IonicContact OD1-ND1 3.81Å
515L97.4Very high95.4Very high1 Ų145 Ų451%0.00523%0.231CC..Hα-helixtrans-61.1-40.9175.7-173.466.8000111.9L477 I478 K481 F488 L497 R511 I512 V513L477-L515 HydrophobicContact CB-CD1 4.22Å; L477-L515 HydrophobicContact CB-CD2 4.04Å; L477-L515 HydrophobicContact CD1-CD2 4.1Å; I478-L515 HydrophobicContact CG1-CB 4.14Å; I478-L515 HydrophobicContact CG1-CD1 4.11Å; K481-L515 HydrophobicContact CB-CD1 4.32Å; K481-L515 HydrophobicContact CD-CD1 3.92Å; K481-L515 PolarHBondContact NZ-O 2.86Å; F488-L515 HydrophobicContact CB-CD1 4.14Å; F488-L515 HydrophobicContact CD1-CD1 3.9Å; F488-L515 HydrophobicContact CD1-CG 4.35Å; F488-L515 HydrophobicContact CD2-CD1 4.18Å; F488-L515 HydrophobicContact CD2-CD2 3.76Å; F488-L515 HydrophobicContact CD2-CG 3.95Å; F488-L515 HydrophobicContact CE1-CD1 4.33Å; F488-L515 HydrophobicContact CE1-CG 4.43Å; F488-L515 HydrophobicContact CE2-CD2 4.13Å; F488-L515 HydrophobicContact CE2-CG 4.06Å; F488-L515 HydrophobicContact CG-CD1 3.81Å; F488-L515 HydrophobicContact CG-CD2 4.19Å; F488-L515 HydrophobicContact CG-CG 4.11Å; F488-L515 HydrophobicContact CZ-CG 4.29Å; L497-L515 HydrophobicContact CD1-CD2 4.18Å; L497-L515 HydrophobicContact CD2-CD2 4.18Å; R511-L515 PolarHBondContact O-N 3.08Å; I512-L515 WeakPolarHBondContact O-CB 3.22Å; I512-L515 PolarHBondContact O-N 3.46Å; V513-L515 VanDerWaalsContact C-N 3.32Å; V513-L515 PolarHBondContact O-N 2.91Å
516L96.8Very high95.3Very high0 Ų046.9 Ų46.90%024%0.242CC..Hα-helixtrans-96.2-6.3-173.8-62.4-177.9000114.8F488 M494 L497 L498 I512 V513 D514 K518 S519 F520 F548F488-L516 HydrophobicContact CE2-CD2 3.72Å; F488-L516 HydrophobicContact CZ-CD2 3.83Å; M494-L516 HydrophobicContact CE-CD2 3.86Å; M494-L516 HydrophobicContact SD-CD1 4.19Å; M494-L516 HydrophobicContact SD-CD2 3.63Å; L497-L516 HydrophobicContact CB-CD1 4.44Å; L497-L516 HydrophobicContact CD1-CD2 4.25Å; L498-L516 HydrophobicContact CD2-CD1 3.89Å; I512-L516 HydrophobicContact CG2-CD1 3.69Å; I512-L516 HydrophobicContact CG2-CG 4.18Å; I512-L516 WeakPolarHBondContact O-CB 3.37Å; I512-L516 VanDerWaalsContact O-CG 3.31Å; I512-L516 WeakPolarHBondContact O-CG 3.49Å; I512-L516 PolarHBondContact O-N 3.17Å; V513-L516 CarbonylContact O-C 3.54Å; V513-L516 PolarHBondContact O-N 3.15Å; V513-L516 VanDerWaalsContact O-N 3.16Å; D514-L516 VanDerWaalsContact C-N 3.33Å; D514-L516 PolarHBondContact O-N 3.06Å; L516-K518 PolarHBondContact O-N 3.33Å; L516-S519 WeakPolarHBondContact O-CA 3.07Å; L516-S519 VanDerWaalsContact O-CB 3.28Å; L516-S519 WeakPolarHBondContact O-CB 3.41Å; L516-S519 PolarHBondContact O-N 3.39Å; L516-F520 HydrophobicContact CB-CD2 4.19Å; L516-F520 HydrophobicContact CB-CE2 4.39Å; L516-F520 HydrophobicContact CD1-CE2 4.31Å; L516-F520 PolarHBondContact O-N 2.91Å; L516-F548 HydrophobicContact CB-CE2 4.15Å
517F96.8Very high95.1Very high16 Ų1645.1 Ų45.17%0.0723%0.231CC..Hα-helixtrans-54.6-50.5-165.9-177.4-104.7000112.7V513 S519 F520 F521 V523 F548 A552 H555 T556V513-F517 VanDerWaalsContact O-CA 3.31Å; V513-F517 WeakPolarHBondContact O-CA 3.41Å; V513-F517 VanDerWaalsContact O-CB 3.29Å; V513-F517 WeakPolarHBondContact O-CB 3.32Å; V513-F517 PolarHBondContact O-N 3.03Å; F517-S519 PolarHBondContact O-N 3.49Å; F517-F520 PolarHBondContact O-N 3.06Å; F517-F521 HydrophobicContact CD2-CB 4.42Å; F517-F521 HydrophobicContact CE2-CB 3.92Å; F517-F521 HydrophobicContact CE2-CD1 4.21Å; F517-F521 HydrophobicContact CE2-CG 4.27Å; F517-F521 HydrophobicContact CZ-CB 4.06Å; F517-F521 HydrophobicContact CZ-CD1 4.36Å; F517-F521 HydrophobicContact CZ-CG 4.18Å; F517-F521 CarbonylContact O-C 3.5Å; F517-F521 WeakPolarHBondContact O-CA 3.31Å; F517-F521 PolarHBondContact O-N 2.9Å; F517-V523 HydrophobicContact CE1-CG2 3.91Å; F517-V523 HydrophobicContact CZ-CG2 4.07Å; F517-F548 HydrophobicContact CD2-CZ 4.14Å; F517-A552 HydrophobicContact CE2-CB 4.12Å; F517-H555 HydrophobicContact CD1-CB 3.66Å; F517-H555 HydrophobicContact CD2-CB 3.58Å; F517-H555 HydrophobicContact CE1-CB 3.65Å; F517-H555 HydrophobicContact CE2-CB 3.59Å; F517-H555 HydrophobicContact CG-CB 3.63Å; F517-H555 HydrophobicContact CZ-CB 3.63Å; F517-T556 HydrophobicContact CE2-CG2 4.42Å; F517-T556 HydrophobicContact CZ-CG2 3.88Å
518K94.2Very high94.8Very high157 Ų15750.2 Ų50.268%0.68325%0.249SC*.Hα-helixtrans-67-17.5179.5-62.5-174.1-180-177.40113.8L516 P522L516-K518 PolarHBondContact O-N 3.33Å; K518-P522 WeakPolarHBondContact O-CB 3.33Å
519S94.3Very high94.5Very high37 Ų3753 Ų5326%0.25926%0.262SS..Hα-helixtrans-80-34.4179.1-52.80000112.4L516 F517 R533L516-S519 WeakPolarHBondContact O-CA 3.07Å; L516-S519 VanDerWaalsContact O-CB 3.28Å; L516-S519 WeakPolarHBondContact O-CB 3.41Å; L516-S519 PolarHBondContact O-N 3.39Å; F517-S519 PolarHBondContact O-N 3.49Å; S519-R533 WeakPolarHBondContact O-CD 3.24Å
520F95.7Very high94.4Very high10 Ų1053.3 Ų53.34%0.04426%0.263CS..Hα-helixtrans-116.6-9.5-175.3-61.9-73.5000114.4M494 L498 L516 F517 L537 M540 F548 Y549M494-F520 HydrophobicContact CE-CE2 4.4Å; M494-F520 HydrophobicContact SD-CE2 3.89Å; M494-F520 HydrophobicContact SD-CZ 4.03Å; L498-F520 HydrophobicContact CD2-CE2 4.29Å; L516-F520 HydrophobicContact CB-CD2 4.19Å; L516-F520 HydrophobicContact CB-CE2 4.39Å; L516-F520 HydrophobicContact CD1-CE2 4.31Å; L516-F520 PolarHBondContact O-N 2.91Å; F517-F520 PolarHBondContact O-N 3.06Å; F520-L537 HydrophobicContact CB-CD2 4.06Å; F520-L537 HydrophobicContact CD1-CB 3.67Å; F520-L537 HydrophobicContact CD1-CD1 4.1Å; F520-L537 HydrophobicContact CD1-CD2 4.18Å; F520-L537 HydrophobicContact CD1-CG 4.18Å; F520-L537 HydrophobicContact CD2-CD1 4.22Å; F520-L537 HydrophobicContact CD2-CD2 4.26Å; F520-L537 HydrophobicContact CE1-CB 3.9Å; F520-L537 HydrophobicContact CE1-CD1 3.83Å; F520-L537 HydrophobicContact CE1-CG 4.33Å; F520-L537 HydrophobicContact CE2-CD1 3.98Å; F520-L537 HydrophobicContact CG-CB 4.28Å; F520-L537 HydrophobicContact CG-CD1 4.28Å; F520-L537 HydrophobicContact CG-CD2 3.92Å; F520-L537 HydrophobicContact CG-CG 4.38Å; F520-L537 HydrophobicContact CZ-CD1 3.77Å; F520-M540 HydrophobicContact CE1-SD 4.3Å; F520-M540 HydrophobicContact CZ-SD 4.3Å; F520-F548 HydrophobicContact CB-CD1 4.42Å; F520-F548 HydrophobicContact CB-CE1 3.8Å; F520-F548 HydrophobicContact CB-CE2 4.12Å; F520-F548 HydrophobicContact CB-CZ 3.64Å; F520-F548 HydrophobicContact CD2-CE2 4.31Å; F520-Y549 PolarHBondContact O-OH 3.47Å
521F96.4Very high94.2Very high1 Ų150.1 Ų50.10%0.00425%0.25CC..  trans-142.169.8169.4-157.7157000111.1F517 V523 W530 F548 Y549 A552 T556 N560 I561 L564F517-F521 HydrophobicContact CD2-CB 4.42Å; F517-F521 HydrophobicContact CE2-CB 3.92Å; F517-F521 HydrophobicContact CE2-CD1 4.21Å; F517-F521 HydrophobicContact CE2-CG 4.27Å; F517-F521 HydrophobicContact CZ-CB 4.06Å; F517-F521 HydrophobicContact CZ-CD1 4.36Å; F517-F521 HydrophobicContact CZ-CG 4.18Å; F517-F521 CarbonylContact O-C 3.5Å; F517-F521 WeakPolarHBondContact O-CA 3.31Å; F517-F521 PolarHBondContact O-N 2.9Å; F521-V523 HydrophobicContact CD2-CG2 4.17Å; F521-V523 HydrophobicContact CE2-CG2 4.39Å; F521-V523 PolarHBondContact O-N 3.43Å; F521-W530 HydrophobicContact CD2-CD2 4.09Å; F521-W530 HydrophobicContact CD2-CE3 4.5Å; F521-W530 HydrophobicContact CD2-CG 4.09Å; F521-W530 HydrophobicContact CE2-CB 4.42Å; F521-W530 AromaticContact CE2-CD2 3.49Å; F521-W530 HydrophobicContact CE2-CD2 3.49Å; F521-W530 VanDerWaalsContact CE2-CD2 3.49Å; F521-W530 AromaticContact CE2-CE2 3.92Å; F521-W530 AromaticContact CE2-CE3 3.5Å; F521-W530 HydrophobicContact CE2-CE3 3.5Å; F521-W530 VanDerWaalsContact CE2-CE3 3.5Å; F521-W530 AromaticContact CE2-CG 3.92Å; F521-W530 HydrophobicContact CE2-CG 3.92Å; F521-W530 HydrophobicContact CE2-CH2 4.32Å; F521-W530 HydrophobicContact CE2-CZ2 4.33Å; F521-W530 AromaticContact CE2-CZ3 3.91Å; F521-W530 HydrophobicContact CE2-CZ3 3.91Å; F521-W530 HydrophobicContact CZ-CD2 4.41Å; F521-W530 HydrophobicContact CZ-CE3 4.01Å; F521-W530 HydrophobicContact CZ-CZ3 4.3Å; F521-F548 HydrophobicContact CB-CE1 4.28Å; F521-F548 HydrophobicContact CB-CZ 4.37Å; F521-Y549 HydrophobicContact CD1-CE1 4.35Å; F521-A552 HydrophobicContact CD1-CB 4.33Å; F521-T556 HydrophobicContact CE1-CG2 4.33Å; F521-N560 HydrophobicContact CZ-CB 4.22Å; F521-I561 HydrophobicContact CE1-CD1 3.83Å; F521-L564 HydrophobicContact CD1-CD2 3.94Å; F521-L564 HydrophobicContact CE1-CB 4.23Å; F521-L564 HydrophobicContact CE1-CD2 3.44Å; F521-L564 VanDerWaalsContact CE1-CD2 3.44Å; F521-L564 HydrophobicContact CE1-CG 4.46Å; F521-L564 HydrophobicContact CZ-CB 3.88Å; F521-L564 HydrophobicContact CZ-CD2 3.85Å; F521-L564 HydrophobicContact CZ-CG 4.46Å
522P93.7Very high93.9Very high24 Ų2448.7 Ų48.716%0.15625%0.251CS..  trans-74.590.617731.2-34.3000110.8K518 N524 E525 E529 W530K518-P522 WeakPolarHBondContact O-CB 3.33Å; P522-N524 PolarHBondContact O-N 3.39Å; P522-E525 HydrophobicContact CB-CB 4.23Å; P522-E525 HydrophobicContact CB-CG 3.71Å; P522-E525 HydrophobicContact CG-CB 3.98Å; P522-E525 HydrophobicContact CG-CG 3.77Å; P522-E525 WeakPolarHBondContact O-CB 3.34Å; P522-E525 PolarHBondContact O-N 3.38Å; P522-E529 HydrophobicContact CG-CG 4.49Å; P522-W530 PolarHBondContact O-NE1 3.41Å
523V93.1Very high93.8Very high45 Ų4553.4 Ų53.427%0.27327%0.269SS..THydrogen-bonded Turntrans-56.2-18.9-174.1-174.80000114.6F517 F521 W530 N560F517-V523 HydrophobicContact CE1-CG2 3.91Å; F517-V523 HydrophobicContact CZ-CG2 4.07Å; F521-V523 HydrophobicContact CD2-CG2 4.17Å; F521-V523 HydrophobicContact CE2-CG2 4.39Å; F521-V523 PolarHBondContact O-N 3.43Å; V523-W530 WeakPolarHBondContact O-CZ2 3.26Å; V523-N560 WeakPolarHBondContact CG1-ND2 3.4Å
524N91.8Very high93.6Very high164 Ų16453.4 Ų53.488%0.87727%0.269SS*.THydrogen-bonded Turntrans-86.4-10.8178-61.6-17.7000113.7P522P522-N524 PolarHBondContact O-N 3.39Å
525E93.3Very high93.4Very high105 Ų10550.4 Ų50.449%0.49125%0.253SS..SBendtrans-89.7164.7178.1-63.8-63.9159.400111.6P522 E529 W530P522-E525 HydrophobicContact CB-CB 4.23Å; P522-E525 HydrophobicContact CB-CG 3.71Å; P522-E525 HydrophobicContact CG-CB 3.98Å; P522-E525 HydrophobicContact CG-CG 3.77Å; P522-E525 WeakPolarHBondContact O-CB 3.34Å; P522-E525 PolarHBondContact O-N 3.38Å; E525-E529 HydrophobicContact CB-CB 4.11Å; E525-E529 HydrophobicContact CB-CG 4.09Å; E525-E529 HydrophobicContact CG-CG 4.44Å; E525-W530 VanDerWaalsContact O-CE2 3.29Å; E525-W530 WeakPolarHBondContact O-CZ2 3.5Å; E525-W530 PolarHBondContact O-NE1 3.24Å
526P92Very high93.3Very high81 Ų8152.8 Ų52.853%0.52627%0.267SS..  trans-62.1153.2176.5-23.234.3000114.2K528 E529 W530P526-K528 PolarHBondContact O-N 3.25Å; P526-E529 WeakPolarHBondContact O-CB 3.4Å; P526-E529 PolarHBondContact O-N 3.43Å; P526-W530 PolarHBondContact O-N 2.9Å
527E89.4Confident93.2Very high54 Ų5452.8 Ų52.825%0.25227%0.267SS..Hα-helixtrans-54.5-31.2178.8-65179.9-176.700113.4W530 C531 K563 A567 R570E527-W530 HydrophobicContact CB-CE3 4.49Å; E527-W530 HydrophobicContact CG-CE3 4.27Å; E527-W530 HydrophobicContact CG-CH2 4.47Å; E527-W530 HydrophobicContact CG-CZ3 4.11Å; E527-W530 PolarHBondContact O-N 3.19Å; E527-C531 PolarHBondContact O-N 2.91Å; E527-K563 HydrophobicContact CG-CB 4.49Å; E527-K563 WeakPolarHBondContact OE1-CD 3.47Å; E527-K563 WeakPolarHBondContact OE1-CG 3.49Å; E527-A567 HydrophobicContact CB-CB 4.43Å; E527-R570 IonicContact OE2-CZ 2.86Å; E527-R570 IonicContact OE2-NH1 2.8Å; E527-R570 PolarHBondContact OE2-NH1 3.22Å; E527-R570 IonicContact OE2-NH2 3.11Å
528K86.3Confident93.1Very high142 Ų14252.3 Ų52.362%0.61727%0.266SS*.Hα-helixtrans-60.4-45175.9-175.1178.6178.4-1790111P526 W530 C531 C532P526-K528 PolarHBondContact O-N 3.25Å; K528-W530 VanDerWaalsContact C-N 3.33Å; K528-W530 PolarHBondContact O-N 3.03Å; K528-C531 PolarHBondContact O-N 3.27Å; K528-C532 PolarHBondContact O-N 3.03Å; K528-C532 PolarHBondContact O-SG 3.28Å; K528-C532 VanDerWaalsContact O-SG 3.35Å
529E91.2Very high93.1Very high57 Ų5750 Ų5027%0.26626%0.257SS..Hα-helixtrans-66-37.4179.9-176.660.9-168.400111.2P522 E525 P526 C531 C532 R533P522-E529 HydrophobicContact CG-CG 4.49Å; E525-E529 HydrophobicContact CB-CB 4.11Å; E525-E529 HydrophobicContact CB-CG 4.09Å; E525-E529 HydrophobicContact CG-CG 4.44Å; P526-E529 WeakPolarHBondContact O-CB 3.4Å; P526-E529 PolarHBondContact O-N 3.43Å; E529-C531 VanDerWaalsContact C-N 3.32Å; E529-C531 PolarHBondContact O-N 3.29Å; E529-C532 PolarHBondContact O-N 3.26Å; E529-R533 HydrophobicContact CG-CG 4.36Å; E529-R533 WeakPolarHBondContact O-CB 3.38Å; E529-R533 VanDerWaalsContact O-CG 3.29Å; E529-R533 WeakPolarHBondContact O-CG 3.44Å; E529-R533 PolarHBondContact O-N 3Å; E529-R533 IonicContact OE1-CZ 2.78Å; E529-R533 IonicContact OE1-NE 3.65Å; E529-R533 PolarHBondContact OE1-NE 2.84Å; E529-R533 IonicContact OE1-NH2 2.91Å; E529-R533 PolarHBondContact OE1-NH2 2.76Å
530W93.7Very high93.1Very high9 Ų952.2 Ų52.23%0.03426%0.264CS..Hα-helixtrans-60.9-42.9177-52.5-11.2000111.7F521 P522 V523 E525 P526 E527 K528 C534 N560 K563 L564F521-W530 HydrophobicContact CD2-CD2 4.09Å; F521-W530 HydrophobicContact CD2-CE3 4.5Å; F521-W530 HydrophobicContact CD2-CG 4.09Å; F521-W530 HydrophobicContact CE2-CB 4.42Å; F521-W530 AromaticContact CE2-CD2 3.49Å; F521-W530 HydrophobicContact CE2-CD2 3.49Å; F521-W530 VanDerWaalsContact CE2-CD2 3.49Å; F521-W530 AromaticContact CE2-CE2 3.92Å; F521-W530 AromaticContact CE2-CE3 3.5Å; F521-W530 HydrophobicContact CE2-CE3 3.5Å; F521-W530 VanDerWaalsContact CE2-CE3 3.5Å; F521-W530 AromaticContact CE2-CG 3.92Å; F521-W530 HydrophobicContact CE2-CG 3.92Å; F521-W530 HydrophobicContact CE2-CH2 4.32Å; F521-W530 HydrophobicContact CE2-CZ2 4.33Å; F521-W530 AromaticContact CE2-CZ3 3.91Å; F521-W530 HydrophobicContact CE2-CZ3 3.91Å; F521-W530 HydrophobicContact CZ-CD2 4.41Å; F521-W530 HydrophobicContact CZ-CE3 4.01Å; F521-W530 HydrophobicContact CZ-CZ3 4.3Å; P522-W530 PolarHBondContact O-NE1 3.41Å; V523-W530 WeakPolarHBondContact O-CZ2 3.26Å; E525-W530 VanDerWaalsContact O-CE2 3.29Å; E525-W530 WeakPolarHBondContact O-CZ2 3.5Å; E525-W530 PolarHBondContact O-NE1 3.24Å; P526-W530 PolarHBondContact O-N 2.9Å; E527-W530 HydrophobicContact CB-CE3 4.49Å; E527-W530 HydrophobicContact CG-CE3 4.27Å; E527-W530 HydrophobicContact CG-CH2 4.47Å; E527-W530 HydrophobicContact CG-CZ3 4.11Å; E527-W530 PolarHBondContact O-N 3.19Å; K528-W530 VanDerWaalsContact C-N 3.33Å; K528-W530 PolarHBondContact O-N 3.03Å; W530-C534 WeakPolarHBondContact O-CB 3.17Å; W530-C534 PolarHBondContact O-N 2.9Å; W530-N560 HydrophobicContact CH2-CB 4.27Å; W530-N560 HydrophobicContact CZ3-CB 4.33Å; W530-K563 HydrophobicContact CH2-CD 4.41Å; W530-K563 HydrophobicContact CZ3-CB 3.81Å; W530-K563 HydrophobicContact CZ3-CD 4.34Å; W530-L564 HydrophobicContact CB-CD1 3.87Å; W530-L564 HydrophobicContact CE3-CB 4.38Å
531C91.9Very high93.1Very high5 Ų553.5 Ų53.53%0.03427%0.272CS..Hα-helixtrans-67.8-41.4176.7-167.90000111.6E527 K528 E529 C534 I535 A567 T571E527-C531 PolarHBondContact O-N 2.91Å; K528-C531 PolarHBondContact O-N 3.27Å; E529-C531 VanDerWaalsContact C-N 3.32Å; E529-C531 PolarHBondContact O-N 3.29Å; C531-C534 WeakPolarHBondContact O-CB 3.25Å; C531-C534 PolarHBondContact O-N 2.86Å; C531-I535 WeakPolarHBondContact O-CD1 3.49Å; C531-I535 WeakPolarHBondContact O-CG1 3.34Å; C531-I535 PolarHBondContact O-N 3.47Å; C531-A567 HydrophobicContact CB-CB 4.24Å; C531-T571 PolarHBondContact SG-OG1 3.12Å
532C91.2Very high93Very high47 Ų4756.6 Ų56.632%0.31829%0.292SS..Hα-helixtrans-58.8-47.7174.9-710000111.3K528 E529 C534 I535 T536K528-C532 PolarHBondContact O-N 3.03Å; K528-C532 PolarHBondContact O-SG 3.28Å; K528-C532 VanDerWaalsContact O-SG 3.35Å; E529-C532 PolarHBondContact O-N 3.26Å; C532-C534 VanDerWaalsContact C-N 3.31Å; C532-C534 PolarHBondContact O-N 2.85Å; C532-I535 PolarHBondContact O-N 3.39Å; C532-T536 PolarHBondContact O-N 3Å; C532-T536 PolarHBondContact O-OG1 3.5Å; C532-T536 VanDerWaalsContact O-OG1 3.06Å
533R94.6Very high93.1Very high99 Ų9960.2 Ų60.237%0.37431%0.308SS..Hα-helixtrans-62.5-35.8176.4-67-66.1173.5177-5.5113.2S519 E529 T536 L537S519-R533 WeakPolarHBondContact O-CD 3.24Å; E529-R533 HydrophobicContact CG-CG 4.36Å; E529-R533 WeakPolarHBondContact O-CB 3.38Å; E529-R533 VanDerWaalsContact O-CG 3.29Å; E529-R533 WeakPolarHBondContact O-CG 3.44Å; E529-R533 PolarHBondContact O-N 3Å; E529-R533 IonicContact OE1-CZ 2.78Å; E529-R533 IonicContact OE1-NE 3.65Å; E529-R533 PolarHBondContact OE1-NE 2.84Å; E529-R533 IonicContact OE1-NH2 2.91Å; E529-R533 PolarHBondContact OE1-NH2 2.76Å; R533-T536 PolarHBondContact O-N 3.05Å; R533-L537 WeakPolarHBondContact O-CB 3.47Å; R533-L537 PolarHBondContact O-N 3.39Å
534C95.4Very high93.3Very high0 Ų058.1 Ų58.10%030%0.295CS..Hα-helixtrans-61.2-47172.9-177.30000111.9W530 C531 C532 L537 I538 Y549W530-C534 WeakPolarHBondContact O-CB 3.17Å; W530-C534 PolarHBondContact O-N 2.9Å; C531-C534 WeakPolarHBondContact O-CB 3.25Å; C531-C534 PolarHBondContact O-N 2.86Å; C532-C534 VanDerWaalsContact C-N 3.31Å; C532-C534 PolarHBondContact O-N 2.85Å; C534-L537 PolarHBondContact O-N 3.27Å; C534-I538 VanDerWaalsContact O-CG1 3.32Å; C534-I538 WeakPolarHBondContact O-CG1 3.37Å; C534-I538 PolarHBondContact O-N 3.35Å; C534-Y549 WeakPolarHBondContact CA-OH 3.24Å; C534-Y549 HydrophobicContact CB-CE2 4.03Å; C534-Y549 WeakPolarHBondContact CB-OH 3.35Å; C534-Y549 PolarHBondContact N-OH 3.3Å; C534-Y549 WeakPolarHBondContact SG-CE2 3.25Å
535I92.8Very high93.5Very high5 Ų550.3 Ų50.33%0.02625%0.253CS..Hα-helixtrans-64.5-44.6177.9-64.3157.1000110.5C531 C532 L537 I538 Q539 T571 L599 L601 V607 L611C531-I535 WeakPolarHBondContact O-CD1 3.49Å; C531-I535 WeakPolarHBondContact O-CG1 3.34Å; C531-I535 PolarHBondContact O-N 3.47Å; C532-I535 PolarHBondContact O-N 3.39Å; I535-L537 VanDerWaalsContact C-N 3.31Å; I535-L537 PolarHBondContact O-N 3.37Å; I535-I538 WeakPolarHBondContact O-CB 3.38Å; I535-I538 PolarHBondContact O-N 2.6Å; I535-Q539 HydrophobicContact CG2-CG 4.3Å; I535-Q539 WeakPolarHBondContact O-CG 3.29Å; I535-Q539 PolarHBondContact O-N 3.19Å; I535-T571 HydrophobicContact CD1-CG2 4.15Å; I535-L599 HydrophobicContact CB-CD2 4.3Å; I535-L599 HydrophobicContact CD1-CD2 4.38Å; I535-L599 HydrophobicContact CG2-CD2 3.4Å; I535-L601 HydrophobicContact CD1-CD1 3.66Å; I535-L601 HydrophobicContact CD1-CD2 4.39Å; I535-V607 HydrophobicContact CG2-CG1 3.99Å; I535-L611 HydrophobicContact CG1-CD1 4.19Å; I535-L611 HydrophobicContact CG1-CD2 4Å
536T94.1Very high93.7Very high51 Ų5149.4 Ų49.431%0.31325%0.245SC..Hα-helixtrans-57-45.4175.4-56.20000111.3C532 R533 I538 Q539 M540C532-T536 PolarHBondContact O-N 3Å; C532-T536 PolarHBondContact O-OG1 3.5Å; C532-T536 VanDerWaalsContact O-OG1 3.06Å; R533-T536 PolarHBondContact O-N 3.05Å; T536-I538 VanDerWaalsContact C-N 3.34Å; T536-I538 PolarHBondContact O-N 3.4Å; T536-Q539 PolarHBondContact O-N 2.92Å; T536-M540 HydrophobicContact CG2-CG 4.38Å; T536-M540 HydrophobicContact CG2-SD 4.11Å; T536-M540 VanDerWaalsContact O-CG 3.26Å; T536-M540 WeakPolarHBondContact O-CG 3.43Å; T536-M540 PolarHBondContact O-N 2.57Å
537L96.2Very high93.9Very high0 Ų047.3 Ų47.30%023%0.228CC..Hα-helixtrans-63.4-40.1178.9-176.556000112.2L498 F520 R533 C534 I535 M540 N541 A545 F548 Y549L498-L537 HydrophobicContact CD1-CD1 4.02Å; L498-L537 HydrophobicContact CD2-CD1 3.53Å; L498-L537 HydrophobicContact CG-CD1 4.44Å; F520-L537 HydrophobicContact CB-CD2 4.06Å; F520-L537 HydrophobicContact CD1-CB 3.67Å; F520-L537 HydrophobicContact CD1-CD1 4.1Å; F520-L537 HydrophobicContact CD1-CD2 4.18Å; F520-L537 HydrophobicContact CD1-CG 4.18Å; F520-L537 HydrophobicContact CD2-CD1 4.22Å; F520-L537 HydrophobicContact CD2-CD2 4.26Å; F520-L537 HydrophobicContact CE1-CB 3.9Å; F520-L537 HydrophobicContact CE1-CD1 3.83Å; F520-L537 HydrophobicContact CE1-CG 4.33Å; F520-L537 HydrophobicContact CE2-CD1 3.98Å; F520-L537 HydrophobicContact CG-CB 4.28Å; F520-L537 HydrophobicContact CG-CD1 4.28Å; F520-L537 HydrophobicContact CG-CD2 3.92Å; F520-L537 HydrophobicContact CG-CG 4.38Å; F520-L537 HydrophobicContact CZ-CD1 3.77Å; R533-L537 WeakPolarHBondContact O-CB 3.47Å; R533-L537 PolarHBondContact O-N 3.39Å; C534-L537 PolarHBondContact O-N 3.27Å; I535-L537 VanDerWaalsContact C-N 3.31Å; I535-L537 PolarHBondContact O-N 3.37Å; L537-M540 PolarHBondContact O-N 2.72Å; L537-N541 CarbonylContact O-C 3.58Å; L537-N541 PolarHBondContact O-N 3.12Å; L537-A545 HydrophobicContact CB-CB 4.42Å; L537-A545 HydrophobicContact CD2-CB 4.14Å; L537-A545 HydrophobicContact CG-CB 3.77Å; L537-F548 HydrophobicContact CD2-CB 3.73Å; L537-F548 HydrophobicContact CD2-CD1 3.78Å; L537-F548 HydrophobicContact CD2-CD2 4.36Å; L537-F548 HydrophobicContact CD2-CG 3.7Å; L537-Y549 HydrophobicContact CD2-CE2 4.02Å
538I94.8Very high94.3Very high6 Ų644.7 Ų44.73%0.03122%0.216CC..Hα-helixtrans-60.6-47.5174.3-71.8166.2000110.5C534 I535 T536 M540 N541 P542 A545 V607 S610 L611 V614C534-I538 VanDerWaalsContact O-CG1 3.32Å; C534-I538 WeakPolarHBondContact O-CG1 3.37Å; C534-I538 PolarHBondContact O-N 3.35Å; I535-I538 WeakPolarHBondContact O-CB 3.38Å; I535-I538 PolarHBondContact O-N 2.6Å; T536-I538 VanDerWaalsContact C-N 3.34Å; T536-I538 PolarHBondContact O-N 3.4Å; I538-M540 VanDerWaalsContact C-N 3.31Å; I538-M540 PolarHBondContact O-N 2.94Å; I538-N541 CarbonylContact O-C 3.31Å; I538-N541 PolarHBondContact O-N 3.11Å; I538-P542 WeakPolarHBondContact O-CD 3.28Å; I538-A545 HydrophobicContact CB-CB 4.5Å; I538-A545 HydrophobicContact CG1-CB 3.73Å; I538-V607 HydrophobicContact CG2-CG1 4.38Å; I538-V607 HydrophobicContact CG2-CG2 4.38Å; I538-S610 VanDerWaalsContact CG2-CB 3.47Å; I538-L611 HydrophobicContact CD1-CD2 3.56Å; I538-L611 HydrophobicContact CD1-CG 3.86Å; I538-V614 HydrophobicContact CD1-CG2 4.22Å
539Q93.2Very high94.8Very high108 Ų10838 Ų3851%0.50519%0.186SC..Hα-helixtrans-63.8-36.1179.3-71.9173.7-32.400112.3I535 T536 V607I535-Q539 HydrophobicContact CG2-CG 4.3Å; I535-Q539 WeakPolarHBondContact O-CG 3.29Å; I535-Q539 PolarHBondContact O-N 3.19Å; T536-Q539 PolarHBondContact O-N 2.92Å; Q539-V607 HydrophobicContact CG-CG2 4.11Å
540M94.2Very high95Very high83 Ų8339.5 Ų39.541%0.40919%0.194SC..Hα-helixtrans-70.9-49.1176-69.2-179.781.400111.9M494 L498 F520 T536 L537 I538M494-M540 HydrophobicContact CB-CE 4.42Å; M494-M540 HydrophobicContact CG-CE 3.75Å; L498-M540 HydrophobicContact CD1-CB 3.81Å; L498-M540 HydrophobicContact CD1-CE 3.76Å; L498-M540 HydrophobicContact CD1-SD 4.06Å; F520-M540 HydrophobicContact CE1-SD 4.3Å; F520-M540 HydrophobicContact CZ-SD 4.3Å; T536-M540 HydrophobicContact CG2-CG 4.38Å; T536-M540 HydrophobicContact CG2-SD 4.11Å; T536-M540 VanDerWaalsContact O-CG 3.26Å; T536-M540 WeakPolarHBondContact O-CG 3.43Å; T536-M540 PolarHBondContact O-N 2.57Å; L537-M540 PolarHBondContact O-N 2.72Å; I538-M540 VanDerWaalsContact C-N 3.31Å; I538-M540 PolarHBondContact O-N 2.94Å
541N95.8Very high95.1Very high38 Ų3839.8 Ų39.820%0.20320%0.195CC..  trans-162.1107.3177.7-170.2-52000111.3L498 L537 I538 M543 A544 A545L498-N541 HydrophobicContact CB-CB 4.24Å; L537-N541 CarbonylContact O-C 3.58Å; L537-N541 PolarHBondContact O-N 3.12Å; I538-N541 CarbonylContact O-C 3.31Å; I538-N541 PolarHBondContact O-N 3.11Å; N541-M543 PolarHBondContact O-N 3.32Å; N541-M543 PolarHBondContact OD1-N 2.88Å; N541-A544 HydrophobicContact CB-CB 3.74Å; N541-A544 PolarHBondContact O-N 3.08Å; N541-A544 PolarHBondContact OD1-N 3.39Å; N541-A545 PolarHBondContact O-N 3.42Å
542P94.3Very high95.3Very high65 Ų6539.5 Ų39.542%0.42219%0.194SC..Hα-helixtrans-66.4-35.3-174.124.5-33.5000113I538 A545 R546I538-P542 WeakPolarHBondContact O-CD 3.28Å; P542-A545 WeakPolarHBondContact O-CB 3.45Å; P542-A545 PolarHBondContact O-N 3.05Å; P542-R546 PolarHBondContact O-N 3.3Å
543M95.4Very high95.5Very high101 Ų10140.3 Ų40.350%0.49819%0.192SC..Hα-helixtrans-69.8-36.5177.6-70.3-56.4-6000112.1A502 N541 K547A502-M543 HydrophobicContact CB-CB 3.73Å; N541-M543 PolarHBondContact O-N 3.32Å; N541-M543 PolarHBondContact OD1-N 2.88Å; M543-K547 PolarHBondContact O-N 2.98Å
544A97Very high95.5Very high0 Ų040.8 Ų40.80%020%0.197CC..Hα-helixtrans-66.3-41.1172.200000111L498 L501 A502 N541 R546 K547 F548L498-A544 HydrophobicContact CB-CB 4.06Å; L498-A544 HydrophobicContact CD2-CB 4.09Å; L498-A544 WeakPolarHBondContact O-CB 3.37Å; L501-A544 HydrophobicContact CB-CB 4.21Å; L501-A544 HydrophobicContact CD2-CB 4.17Å; L501-A544 WeakPolarHBondContact CD2-O 3.41Å; L501-A544 HydrophobicContact CG-CB 4.24Å; A502-A544 HydrophobicContact CB-CB 4.35Å; N541-A544 HydrophobicContact CB-CB 3.74Å; N541-A544 PolarHBondContact O-N 3.08Å; N541-A544 PolarHBondContact OD1-N 3.39Å; A544-R546 PolarHBondContact O-N 3.31Å; A544-K547 PolarHBondContact O-N 3.23Å; A544-F548 VanDerWaalsContact O-CB 3.31Å; A544-F548 WeakPolarHBondContact O-CB 3.45Å; A544-F548 PolarHBondContact O-N 3.34Å
545A97.4Very high95.4Very high0 Ų044 Ų440%021%0.212CC..Hα-helixtrans-58-48.1175.100000111.8L537 I538 N541 P542 K547 F548 Y549L537-A545 HydrophobicContact CB-CB 4.42Å; L537-A545 HydrophobicContact CD2-CB 4.14Å; L537-A545 HydrophobicContact CG-CB 3.77Å; I538-A545 HydrophobicContact CB-CB 4.5Å; I538-A545 HydrophobicContact CG1-CB 3.73Å; N541-A545 PolarHBondContact O-N 3.42Å; P542-A545 WeakPolarHBondContact O-CB 3.45Å; P542-A545 PolarHBondContact O-N 3.05Å; A545-K547 PolarHBondContact O-N 2.97Å; A545-F548 PolarHBondContact O-N 2.81Å; A545-Y549 VanDerWaalsContact O-CD2 3.28Å; A545-Y549 WeakPolarHBondContact O-CD2 3.33Å; A545-Y549 PolarHBondContact O-N 3.33Å
546R96Very high95.5Very high86 Ų8644.9 Ų44.933%0.32522%0.218SC..Hα-helixtrans-53.1-50.8175.2164.4158.1-174.1104.7-1.5111.8P542 A544 Q550 E613 I617P542-R546 PolarHBondContact O-N 3.3Å; A544-R546 PolarHBondContact O-N 3.31Å; R546-Q550 WeakPolarHBondContact O-CB 3.21Å; R546-Q550 PolarHBondContact O-N 3.06Å; R546-Q550 VanDerWaalsContact O-N 3.08Å; R546-E613 VanDerWaalsContact CD-OE1 3.26Å; R546-E613 WeakPolarHBondContact CD-OE1 3.33Å; R546-E613 IonicContact CZ-OE1 2.86Å; R546-E613 VanDerWaalsContact CZ-OE1 3.26Å; R546-E613 IonicContact NE-OE1 3.81Å; R546-E613 VanDerWaalsContact NH1-CD 3.34Å; R546-E613 VanDerWaalsContact NH1-CG 3.31Å; R546-E613 IonicContact NH1-OE1 3.81Å; R546-E613 PolarHBondContact NH1-OE1 2.93Å; R546-I617 HydrophobicContact CB-CD1 3.94Å; R546-I617 HydrophobicContact CG-CD1 3.57Å
547K96.2Very high95.5Very high37 Ų3745 Ų4516%0.16122%0.224CC..Hα-helixtrans-70.3-35.1178.8-82.1178.4167.1178.10113.6L501 A502 I503 D504 M543 A544 A545 Q550 F551L501-K547 HydrophobicContact CD1-CB 3.98Å; L501-K547 HydrophobicContact CG-CB 4.14Å; L501-K547 WeakPolarHBondContact O-CD 3.38Å; L501-K547 PolarHBondContact O-NZ 2.83Å; A502-K547 WeakPolarHBondContact O-CE 3.38Å; A502-K547 PolarHBondContact O-NZ 2.67Å; I503-K547 VanDerWaalsContact C-NZ 3.28Å; D504-K547 PolarHBondContact O-NZ 2.96Å; M543-K547 PolarHBondContact O-N 2.98Å; A544-K547 PolarHBondContact O-N 3.23Å; A545-K547 PolarHBondContact O-N 2.97Å; K547-Q550 WeakPolarHBondContact O-CB 3.35Å; K547-Q550 PolarHBondContact O-N 3.33Å; K547-F551 WeakPolarHBondContact O-CD2 3.47Å; K547-F551 PolarHBondContact O-N 3.25Å
548F98.2Very high95.4Very high0 Ų046.5 Ų46.50%024%0.236CC..Hα-helixtrans-59.1-54.9176.3179.7-89.9000110.8L501 V513 L516 F517 F520 F521 L537 A544 A545 Q550 F551 A552L501-F548 HydrophobicContact CD2-CB 4.03Å; V513-F548 HydrophobicContact CB-CD2 4.4Å; V513-F548 HydrophobicContact CG1-CD2 4.05Å; V513-F548 HydrophobicContact CG1-CE2 4.08Å; V513-F548 HydrophobicContact CG2-CB 4.43Å; V513-F548 HydrophobicContact CG2-CD2 4.02Å; L516-F548 HydrophobicContact CB-CE2 4.15Å; F517-F548 HydrophobicContact CD2-CZ 4.14Å; F520-F548 HydrophobicContact CB-CD1 4.42Å; F520-F548 HydrophobicContact CB-CE1 3.8Å; F520-F548 HydrophobicContact CB-CE2 4.12Å; F520-F548 HydrophobicContact CB-CZ 3.64Å; F520-F548 HydrophobicContact CD2-CE2 4.31Å; F521-F548 HydrophobicContact CB-CE1 4.28Å; F521-F548 HydrophobicContact CB-CZ 4.37Å; L537-F548 HydrophobicContact CD2-CB 3.73Å; L537-F548 HydrophobicContact CD2-CD1 3.78Å; L537-F548 HydrophobicContact CD2-CD2 4.36Å; L537-F548 HydrophobicContact CD2-CG 3.7Å; A544-F548 VanDerWaalsContact O-CB 3.31Å; A544-F548 WeakPolarHBondContact O-CB 3.45Å; A544-F548 PolarHBondContact O-N 3.34Å; A545-F548 PolarHBondContact O-N 2.81Å; F548-Q550 VanDerWaalsContact C-N 3.28Å; F548-Q550 PolarHBondContact O-N 2.96Å; F548-F551 PolarHBondContact O-N 3.45Å; F548-F551 VanDerWaalsContact O-N 3.09Å; F548-A552 PolarHBondContact O-N 3Å
549Y97.5Very high95.3Very high0 Ų049.9 Ų49.90%026%0.257CS..Hα-helixtrans-71.4-22.7-178-71.3-61.7000113.2F520 F521 C534 L537 A545 F551 A552 L564 V614 L618F520-Y549 PolarHBondContact O-OH 3.47Å; F521-Y549 HydrophobicContact CD1-CE1 4.35Å; C534-Y549 WeakPolarHBondContact CA-OH 3.24Å; C534-Y549 HydrophobicContact CB-CE2 4.03Å; C534-Y549 WeakPolarHBondContact CB-OH 3.35Å; C534-Y549 PolarHBondContact N-OH 3.3Å; C534-Y549 WeakPolarHBondContact SG-CE2 3.25Å; L537-Y549 HydrophobicContact CD2-CE2 4.02Å; A545-Y549 VanDerWaalsContact O-CD2 3.28Å; A545-Y549 WeakPolarHBondContact O-CD2 3.33Å; A545-Y549 PolarHBondContact O-N 3.33Å; Y549-F551 VanDerWaalsContact C-N 3.25Å; Y549-F551 PolarHBondContact O-N 3.32Å; Y549-A552 HydrophobicContact CD1-CB 4.21Å; Y549-L564 HydrophobicContact CD1-CD2 4.1Å; Y549-L564 HydrophobicContact CE1-CD2 3.68Å; Y549-V614 HydrophobicContact CD2-CB 4.48Å; Y549-V614 HydrophobicContact CD2-CG1 3.64Å; Y549-V614 HydrophobicContact CD2-CG2 3.91Å; Y549-V614 HydrophobicContact CE2-CG1 4.27Å; Y549-V614 HydrophobicContact CG-CG1 3.8Å; Y549-L618 HydrophobicContact CD1-CD1 4.45Å; Y549-L618 HydrophobicContact CD1-CD2 3.91Å; Y549-L618 HydrophobicContact CG-CD2 4.26Å
550Q95.6Very high95.4Very high90 Ų9046 Ų4642%0.42124%0.24SC..Hα-helixtrans-59.2-35.9168.8-172-178.115.900112.5R546 K547 F548 H553 I617R546-Q550 WeakPolarHBondContact O-CB 3.21Å; R546-Q550 PolarHBondContact O-N 3.06Å; R546-Q550 VanDerWaalsContact O-N 3.08Å; K547-Q550 WeakPolarHBondContact O-CB 3.35Å; K547-Q550 PolarHBondContact O-N 3.33Å; F548-Q550 VanDerWaalsContact C-N 3.28Å; F548-Q550 PolarHBondContact O-N 2.96Å; Q550-H553 PolarHBondContact O-CE1 3.18Å; Q550-H553 PolarHBondContact O-ND1 3.23Å; Q550-I617 VanDerWaalsContact CA-CG2 3.42Å; Q550-I617 HydrophobicContact CB-CG2 3.86Å; Q550-I617 HydrophobicContact CG-CG2 4.47Å
551F95.9Very high95.5Very high14 Ų1442 Ų426%0.06122%0.22CC..Hα-helixtrans-105-7.9-178-56-55.3000114.7L506 K510 V513 K547 F548 Y549 H553 K554L506-F551 HydrophobicContact CD1-CD1 4.31Å; L506-F551 HydrophobicContact CD1-CE1 3.22Å; L506-F551 HydrophobicContact CD1-CE2 4.06Å; L506-F551 HydrophobicContact CD1-CZ 3.08Å; K510-F551 HydrophobicContact CG-CD1 4.13Å; K510-F551 HydrophobicContact CG-CD2 4.43Å; K510-F551 HydrophobicContact CG-CE1 4.46Å; K510-F551 HydrophobicContact CG-CG 4.15Å; V513-F551 HydrophobicContact CB-CB 4.36Å; V513-F551 HydrophobicContact CG1-CB 4.14Å; V513-F551 HydrophobicContact CG2-CB 4.25Å; V513-F551 HydrophobicContact CG2-CD2 4.22Å; K547-F551 WeakPolarHBondContact O-CD2 3.47Å; K547-F551 PolarHBondContact O-N 3.25Å; F548-F551 PolarHBondContact O-N 3.45Å; F548-F551 VanDerWaalsContact O-N 3.09Å; Y549-F551 VanDerWaalsContact C-N 3.25Å; Y549-F551 PolarHBondContact O-N 3.32Å; F551-H553 PolarHBondContact O-N 3.48Å; F551-H553 VanDerWaalsContact O-N 3.15Å; F551-K554 WeakPolarHBondContact O-CB 3.46Å; F551-K554 PolarHBondContact O-N 3.06Å
552A96.1Very high95.4Very high0 Ų041.3 Ų41.30%022%0.216CC..Hα-helixtrans-53.4-36.6-178.900000113.8F517 F521 F548 Y549 K554 H555 I561F517-A552 HydrophobicContact CE2-CB 4.12Å; F521-A552 HydrophobicContact CD1-CB 4.33Å; F548-A552 PolarHBondContact O-N 3Å; Y549-A552 HydrophobicContact CD1-CB 4.21Å; A552-K554 PolarHBondContact O-N 3.48Å; A552-H555 PolarHBondContact O-N 3.26Å; A552-I561 HydrophobicContact CB-CD1 4.37Å
553H94.6Very high95.4Very high63 Ų6342.5 Ų42.529%0.29222%0.215SC..THydrogen-bonded Turntrans-57.7-16.7178.473.1-83.2000114.5Q550 F551 H555 T556 I561 V622Q550-H553 PolarHBondContact O-CE1 3.18Å; Q550-H553 PolarHBondContact O-ND1 3.23Å; F551-H553 PolarHBondContact O-N 3.48Å; F551-H553 VanDerWaalsContact O-N 3.15Å; H553-H555 VanDerWaalsContact C-N 3.32Å; H553-T556 VanDerWaalsContact O-O 3.13Å; H553-I561 HydrophobicContact CB-CD1 4.35Å; H553-I561 HydrophobicContact CB-CG1 4.31Å; H553-V622 HydrophobicContact CB-CG1 4.26Å
554K94.2Very high95.4Very high110 Ų11037.8 Ų37.848%0.47819%0.192SC..THydrogen-bonded Turntrans-79.2-15.7178.2-63.4-171.6173.5-171.80113.9K510 F551 A552K510-K554 VanDerWaalsContact CE-NZ 3.34Å; F551-K554 WeakPolarHBondContact O-CB 3.46Å; F551-K554 PolarHBondContact O-N 3.06Å; A552-K554 PolarHBondContact O-N 3.48Å
555H94.3Very high95.3Very high67 Ų6737.8 Ų37.831%0.3119%0.192SC..SBendtrans-115.21.2-172.9-58.9-86.6000112.7D514 F517 A552 H553D514-H555 IonicContact OD1-CE1 3.16Å; D514-H555 PolarHBondContact OD1-CE1 3.28Å; D514-H555 IonicContact OD1-ND1 3.81Å; F517-H555 HydrophobicContact CD1-CB 3.66Å; F517-H555 HydrophobicContact CD2-CB 3.58Å; F517-H555 HydrophobicContact CE1-CB 3.65Å; F517-H555 HydrophobicContact CE2-CB 3.59Å; F517-H555 HydrophobicContact CG-CB 3.63Å; F517-H555 HydrophobicContact CZ-CB 3.63Å; A552-H555 PolarHBondContact O-N 3.26Å; H553-H555 VanDerWaalsContact C-N 3.32Å
556T95.3Very high95.2Very high23 Ų2338.6 Ų38.614%0.14120%0.196CC..SBendtrans-151.3161.2-179.9-177.20000111.7F517 F521 H553 N560 I561F517-T556 HydrophobicContact CE2-CG2 4.42Å; F517-T556 HydrophobicContact CZ-CG2 3.88Å; F521-T556 HydrophobicContact CE1-CG2 4.33Å; H553-T556 VanDerWaalsContact O-O 3.13Å; T556-N560 HydrophobicContact CG2-CB 4.45Å; T556-N560 WeakPolarHBondContact OG1-CB 3.45Å; T556-N560 PolarHBondContact OG1-ND2 3.4Å; T556-I561 HydrophobicContact CG2-CD1 3.66Å; T556-I561 HydrophobicContact CG2-CG1 4.11Å
557A94.4Very high95Very high53 Ų5334.7 Ų34.744%0.43818%0.182SC..  trans-64.814917400000112.2T559 N560 I561A557-T559 PolarHBondContact O-N 3.49Å; A557-T559 VanDerWaalsContact O-N 3.16Å; A557-N560 PolarHBondContact O-N 3.18Å; A557-I561 PolarHBondContact O-N 3.36Å
558A93.2Very high95Very high32 Ų3233 Ų3326%0.26418%0.175SC..Hα-helixtrans-57.4-30.1177.400000112.9N560 I561 I562 V622 A625A558-N560 VanDerWaalsContact C-N 3.32Å; A558-N560 PolarHBondContact O-N 3.17Å; A558-I561 WeakPolarHBondContact O-CB 3.47Å; A558-I561 PolarHBondContact O-N 2.88Å; A558-I562 VanDerWaalsContact O-CG1 3.31Å; A558-I562 WeakPolarHBondContact O-CG1 3.49Å; A558-I562 PolarHBondContact O-N 3.12Å; A558-V622 HydrophobicContact CB-CB 4.23Å; A558-V622 HydrophobicContact CB-CG1 3.94Å; A558-A625 HydrophobicContact CB-CB 3.76Å
559T92.9Very high94.7Very high78 Ų7834.6 Ų34.648%0.47918%0.181SC..Hα-helixtrans-59.4-39.6175.249.50000112.8A557 I562 K563A557-T559 PolarHBondContact O-N 3.49Å; A557-T559 VanDerWaalsContact O-N 3.16Å; T559-I562 PolarHBondContact O-N 3.47Å; T559-K563 WeakPolarHBondContact O-CG 3.35Å; T559-K563 PolarHBondContact O-N 3.38Å
560N95.1Very high94.4Very high25 Ų2540.3 Ų40.313%0.13420%0.202CC..Hα-helixtrans-71.1-35.1177.4-64.8-27.7000111.5F521 V523 W530 T556 A557 A558 K563 L564F521-N560 HydrophobicContact CZ-CB 4.22Å; V523-N560 WeakPolarHBondContact CG1-ND2 3.4Å; W530-N560 HydrophobicContact CH2-CB 4.27Å; W530-N560 HydrophobicContact CZ3-CB 4.33Å; T556-N560 HydrophobicContact CG2-CB 4.45Å; T556-N560 WeakPolarHBondContact OG1-CB 3.45Å; T556-N560 PolarHBondContact OG1-ND2 3.4Å; A557-N560 PolarHBondContact O-N 3.18Å; A558-N560 VanDerWaalsContact C-N 3.32Å; A558-N560 PolarHBondContact O-N 3.17Å; N560-K563 PolarHBondContact O-N 3Å; N560-L564 PolarHBondContact O-N 3.49Å
561I95.8Very high94.1Very high0 Ų037.3 Ų37.30%019%0.19CC..Hα-helixtrans-61.1-45.8172.6-57.3-62.8000110.6F521 A552 H553 T556 A557 A558 K563 L564 I565 L618 V622F521-I561 HydrophobicContact CE1-CD1 3.83Å; A552-I561 HydrophobicContact CB-CD1 4.37Å; H553-I561 HydrophobicContact CB-CD1 4.35Å; H553-I561 HydrophobicContact CB-CG1 4.31Å; T556-I561 HydrophobicContact CG2-CD1 3.66Å; T556-I561 HydrophobicContact CG2-CG1 4.11Å; A557-I561 PolarHBondContact O-N 3.36Å; A558-I561 WeakPolarHBondContact O-CB 3.47Å; A558-I561 PolarHBondContact O-N 2.88Å; I561-K563 PolarHBondContact O-N 2.89Å; I561-L564 PolarHBondContact O-N 3.17Å; I561-I565 HydrophobicContact CG2-CD1 4.05Å; I561-I565 WeakPolarHBondContact O-CG1 3.36Å; I561-I565 PolarHBondContact O-N 3.3Å; I561-L618 HydrophobicContact CD1-CD2 4.18Å; I561-L618 HydrophobicContact CG2-CB 3.89Å; I561-L618 HydrophobicContact CG2-CD2 3.96Å; I561-L618 HydrophobicContact CG2-CG 4.44Å; I561-V622 HydrophobicContact CB-CG1 3.78Å; I561-V622 HydrophobicContact CB-CG2 4.5Å; I561-V622 HydrophobicContact CG1-CG1 3.83Å; I561-V622 HydrophobicContact CG2-CB 4.48Å; I561-V622 HydrophobicContact CG2-CG1 3.7Å; I561-V622 HydrophobicContact CG2-CG2 3.92Å
562I93.8Very high93.8Very high23 Ų2336.7 Ų36.712%0.11819%0.187CC..Hα-helixtrans-62.3-43.8177.5-63.8162.2000110.9A558 T559 L564 I565 L566 V622 L626 A632A558-I562 VanDerWaalsContact O-CG1 3.31Å; A558-I562 WeakPolarHBondContact O-CG1 3.49Å; A558-I562 PolarHBondContact O-N 3.12Å; T559-I562 PolarHBondContact O-N 3.47Å; I562-L564 VanDerWaalsContact C-N 3.34Å; I562-L564 PolarHBondContact O-N 2.93Å; I562-I565 WeakPolarHBondContact O-CB 3.44Å; I562-I565 PolarHBondContact O-N 3.28Å; I562-L566 HydrophobicContact CG2-CD1 4.12Å; I562-L566 WeakPolarHBondContact O-CG 3.32Å; I562-L566 PolarHBondContact O-N 3.25Å; I562-V622 HydrophobicContact CG1-CG2 4.47Å; I562-L626 HydrophobicContact CD1-CD2 3.46Å; I562-L626 VanDerWaalsContact CD1-CD2 3.46Å; I562-L626 HydrophobicContact CD1-CG 4.19Å; I562-L626 HydrophobicContact CG1-CD2 3.9Å; I562-L626 HydrophobicContact CG1-CG 4.44Å; I562-A632 HydrophobicContact CD1-CB 4.33Å
563K94.1Very high93.5Very high91 Ų9137.9 Ų37.940%0.39619%0.194SC..Hα-helixtrans-58.9-43.1174.3-75.7175.8174.9-171.40112.2E527 W530 T559 N560 I561 L566 A567E527-K563 HydrophobicContact CG-CB 4.49Å; E527-K563 WeakPolarHBondContact OE1-CD 3.47Å; E527-K563 WeakPolarHBondContact OE1-CG 3.49Å; W530-K563 HydrophobicContact CH2-CD 4.41Å; W530-K563 HydrophobicContact CZ3-CB 3.81Å; W530-K563 HydrophobicContact CZ3-CD 4.34Å; T559-K563 WeakPolarHBondContact O-CG 3.35Å; T559-K563 PolarHBondContact O-N 3.38Å; N560-K563 PolarHBondContact O-N 3Å; I561-K563 PolarHBondContact O-N 2.89Å; K563-L566 PolarHBondContact O-N 2.92Å; K563-A567 WeakPolarHBondContact O-CB 3.36Å; K563-A567 PolarHBondContact O-N 2.64Å
564L95.9Very high92.9Very high1 Ų139.7 Ų39.71%0.00521%0.206CC..Hα-helixtrans-63.4-44.3174.8178.258.6000112F521 W530 Y549 N560 I561 I562 L566 A567 I568 L618F521-L564 HydrophobicContact CD1-CD2 3.94Å; F521-L564 HydrophobicContact CE1-CB 4.23Å; F521-L564 HydrophobicContact CE1-CD2 3.44Å; F521-L564 VanDerWaalsContact CE1-CD2 3.44Å; F521-L564 HydrophobicContact CE1-CG 4.46Å; F521-L564 HydrophobicContact CZ-CB 3.88Å; F521-L564 HydrophobicContact CZ-CD2 3.85Å; F521-L564 HydrophobicContact CZ-CG 4.46Å; W530-L564 HydrophobicContact CB-CD1 3.87Å; W530-L564 HydrophobicContact CE3-CB 4.38Å; Y549-L564 HydrophobicContact CD1-CD2 4.1Å; Y549-L564 HydrophobicContact CE1-CD2 3.68Å; N560-L564 PolarHBondContact O-N 3.49Å; I561-L564 PolarHBondContact O-N 3.17Å; I562-L564 VanDerWaalsContact C-N 3.34Å; I562-L564 PolarHBondContact O-N 2.93Å; L564-L566 VanDerWaalsContact C-N 3.26Å; L564-L566 PolarHBondContact O-N 3.17Å; L564-A567 PolarHBondContact O-N 3.08Å; L564-A567 VanDerWaalsContact O-N 3.15Å; L564-I568 HydrophobicContact CD1-CD1 4.07Å; L564-I568 HydrophobicContact CD1-CG1 4.12Å; L564-I568 HydrophobicContact CG-CD1 4Å; L564-I568 HydrophobicContact CG-CG1 4.49Å; L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.36Å; L564-L618 HydrophobicContact CD2-CD1 3.71Å; L564-L618 HydrophobicContact CG-CD1 3.94Å
565I95.6Very high92.3Very high0 Ų036 Ų360%019%0.194CC..Hα-helixtrans-55.2-44.2174.4-71164.8000110.6I561 I562 R569 V615 L618 W619 T636 F640I561-I565 HydrophobicContact CG2-CD1 4.05Å; I561-I565 WeakPolarHBondContact O-CG1 3.36Å; I561-I565 PolarHBondContact O-N 3.3Å; I562-I565 WeakPolarHBondContact O-CB 3.44Å; I562-I565 PolarHBondContact O-N 3.28Å; I565-R569 PolarHBondContact O-N 3.21Å; I565-V615 HydrophobicContact CG2-CG1 3.96Å; I565-L618 HydrophobicContact CD1-CB 3.8Å; I565-L618 HydrophobicContact CG1-CB 3.62Å; I565-L618 HydrophobicContact CG1-CD1 4.1Å; I565-W619 HydrophobicContact CD1-CB 4.26Å; I565-W619 HydrophobicContact CG2-CE3 4.16Å; I565-W619 HydrophobicContact CG2-CZ3 4.47Å; I565-T636 HydrophobicContact CG2-CG2 4.46Å; I565-F640 HydrophobicContact CG2-CE2 3.49Å; I565-F640 VanDerWaalsContact CG2-CE2 3.49Å; I565-F640 HydrophobicContact CG2-CZ 3.71Å
566L93.9Very high91.6Very high17 Ų1735 Ų359%0.08919%0.19CC..Hα-helixtrans-70.7-35.3178.1-66.9170.1000113I562 K563 L564 R569 R570 Y635 T636 K639I562-L566 HydrophobicContact CG2-CD1 4.12Å; I562-L566 WeakPolarHBondContact O-CG 3.32Å; I562-L566 PolarHBondContact O-N 3.25Å; K563-L566 PolarHBondContact O-N 2.92Å; L564-L566 VanDerWaalsContact C-N 3.26Å; L564-L566 PolarHBondContact O-N 3.17Å; L566-R569 WeakPolarHBondContact O-CB 3.39Å; L566-R569 PolarHBondContact O-N 3.26Å; L566-R570 WeakPolarHBondContact O-CG 3.28Å; L566-R570 PolarHBondContact O-N 3.34Å; L566-Y635 HydrophobicContact CD1-CD1 4.35Å; L566-Y635 HydrophobicContact CD1-CE1 3.75Å; L566-Y635 HydrophobicContact CD2-CE1 4.35Å; L566-T636 HydrophobicContact CD2-CG2 4.44Å; L566-K639 HydrophobicContact CD2-CB 4.24Å; L566-K639 HydrophobicContact CD2-CG 4.36Å
567A93.4Very high90.3Very high5 Ų538.6 Ų38.64%0.04121%0.205CC..Hα-helixtrans-64.1-46174.200000111E527 C531 K563 L564 R569 R570 T571E527-A567 HydrophobicContact CB-CB 4.43Å; C531-A567 HydrophobicContact CB-CB 4.24Å; K563-A567 WeakPolarHBondContact O-CB 3.36Å; K563-A567 PolarHBondContact O-N 2.64Å; L564-A567 PolarHBondContact O-N 3.08Å; L564-A567 VanDerWaalsContact O-N 3.15Å; A567-R569 VanDerWaalsContact C-N 3.29Å; A567-R569 PolarHBondContact O-N 3.36Å; A567-R570 WeakPolarHBondContact O-CB 3.47Å; A567-R570 PolarHBondContact O-N 3.09Å; A567-R570 VanDerWaalsContact O-N 3.12Å; A567-T571 PolarHBondContact O-N 2.79Å; A567-T571 PolarHBondContact O-OG1 3.43Å
568I94.4Very high88.2Confident0 Ų042.8 Ų42.80%023%0.225CC..Hα-helixtrans-60.1-40.4173.6-63.8165.7000110.5L564 R570 T571 L572 L611 V614 V615 L618L564-I568 HydrophobicContact CD1-CD1 4.07Å; L564-I568 HydrophobicContact CD1-CG1 4.12Å; L564-I568 HydrophobicContact CG-CD1 4Å; L564-I568 HydrophobicContact CG-CG1 4.49Å; L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.36Å; I568-R570 VanDerWaalsContact C-N 3.34Å; I568-R570 PolarHBondContact O-N 3.43Å; I568-T571 WeakPolarHBondContact O-CB 3.41Å; I568-T571 PolarHBondContact O-N 3.4Å; I568-L572 HydrophobicContact CG2-CD1 3.97Å; I568-L572 HydrophobicContact CG2-CG 4.22Å; I568-L572 WeakPolarHBondContact O-CG 3.25Å; I568-L572 PolarHBondContact O-N 2.97Å; I568-L611 HydrophobicContact CG1-CD2 4.39Å; I568-L611 HydrophobicContact CG2-CB 3.97Å; I568-L611 HydrophobicContact CG2-CD2 3.93Å; I568-L611 HydrophobicContact CG2-CG 4.42Å; I568-V614 HydrophobicContact CD1-CG1 3.95Å; I568-V615 HydrophobicContact CB-CG2 3.91Å; I568-V615 HydrophobicContact CD1-CG2 4.23Å; I568-V615 HydrophobicContact CG2-CG2 3.5Å; I568-V615 VanDerWaalsContact CG2-CG2 3.5Å; I568-L618 HydrophobicContact CD1-CD1 4.13Å
569R93.2Very high85.7Confident35 Ų3548.3 Ų48.313%0.13225%0.25CS..Hα-helixtrans-57.6-43.2174.3-165.2-169.972.1114.79.5112.7I565 L566 A567 T571 L572 N573 K639 F640 Y647I565-R569 PolarHBondContact O-N 3.21Å; L566-R569 WeakPolarHBondContact O-CB 3.39Å; L566-R569 PolarHBondContact O-N 3.26Å; A567-R569 VanDerWaalsContact C-N 3.29Å; A567-R569 PolarHBondContact O-N 3.36Å; R569-T571 VanDerWaalsContact C-N 3.31Å; R569-T571 PolarHBondContact O-N 3.3Å; R569-L572 PolarHBondContact O-N 3.43Å; R569-N573 VanDerWaalsContact O-CG 3.28Å; R569-N573 PolarHBondContact O-N 3.03Å; R569-N573 PolarHBondContact O-ND2 3.23Å; R569-K639 PolarHBondContact NH1-O 3.26Å; R569-F640 HydrophobicContact CB-CE1 4.05Å; R569-F640 HydrophobicContact CB-CE2 4Å; R569-F640 HydrophobicContact CB-CZ 3.54Å; R569-F640 HydrophobicContact CG-CD1 4.22Å; R569-F640 HydrophobicContact CG-CD2 4.49Å; R569-F640 HydrophobicContact CG-CE1 3.75Å; R569-F640 HydrophobicContact CG-CE2 4.03Å; R569-F640 HydrophobicContact CG-CZ 3.67Å; R569-Y647 PolarHBondContact O-OH 3.43Å
570R90.9Very high83.1Confident120 Ų12051.9 Ų51.945%0.45326%0.259SS..Hα-helixtrans-60.3-44.8177.3-66.8173.7-168.6132.2-1.6110E527 L566 A567 I568 N573 N574E527-R570 IonicContact OE2-CZ 2.86Å; E527-R570 IonicContact OE2-NH1 2.8Å; E527-R570 PolarHBondContact OE2-NH1 3.22Å; E527-R570 IonicContact OE2-NH2 3.11Å; L566-R570 WeakPolarHBondContact O-CG 3.28Å; L566-R570 PolarHBondContact O-N 3.34Å; A567-R570 WeakPolarHBondContact O-CB 3.47Å; A567-R570 PolarHBondContact O-N 3.09Å; A567-R570 VanDerWaalsContact O-N 3.12Å; I568-R570 VanDerWaalsContact C-N 3.34Å; I568-R570 PolarHBondContact O-N 3.43Å; R570-N573 WeakPolarHBondContact O-CB 3.33Å; R570-N573 PolarHBondContact O-N 3Å; R570-N574 VanDerWaalsContact O-CG 3.29Å; R570-N574 PolarHBondContact O-N 2.93Å; R570-N574 PolarHBondContact O-OD1 2.96Å
571T89.1Confident80.1Confident27 Ų2756.6 Ų56.617%0.16629%0.285CS..Hα-helixtrans-62.6-43.6176.7-52.90000112.9C531 I535 A567 I568 R569 N573 N574 C575 L601C531-T571 PolarHBondContact SG-OG1 3.12Å; I535-T571 HydrophobicContact CD1-CG2 4.15Å; A567-T571 PolarHBondContact O-N 2.79Å; A567-T571 PolarHBondContact O-OG1 3.43Å; I568-T571 WeakPolarHBondContact O-CB 3.41Å; I568-T571 PolarHBondContact O-N 3.4Å; R569-T571 VanDerWaalsContact C-N 3.31Å; R569-T571 PolarHBondContact O-N 3.3Å; T571-N573 VanDerWaalsContact C-N 3.34Å; T571-N573 PolarHBondContact O-N 3.3Å; T571-N574 WeakPolarHBondContact O-CB 3.14Å; T571-N574 PolarHBondContact O-N 3.27Å; T571-C575 PolarHBondContact O-N 3.21Å; T571-C575 PolarHBondContact O-SG 3.5Å; T571-L601 HydrophobicContact CG2-CD1 3.9Å; T571-L601 HydrophobicContact CG2-CD2 4.32Å
572L89.6Confident77.4Confident0 Ų061.9 Ų61.90%032%0.317CS..Hα-helixtrans-63-39.3175.5-71.9170000112I568 R569 N574 C575 V608 L611 L612 Y647 F651I568-L572 HydrophobicContact CG2-CD1 3.97Å; I568-L572 HydrophobicContact CG2-CG 4.22Å; I568-L572 WeakPolarHBondContact O-CG 3.25Å; I568-L572 PolarHBondContact O-N 2.97Å; R569-L572 PolarHBondContact O-N 3.43Å; L572-N574 VanDerWaalsContact C-N 3.33Å; L572-N574 PolarHBondContact O-N 2.78Å; L572-C575 WeakPolarHBondContact O-CB 3.41Å; L572-C575 PolarHBondContact O-N 2.96Å; L572-C575 VanDerWaalsContact O-N 3.15Å; L572-V608 HydrophobicContact CD2-CG1 3.86Å; L572-L611 HydrophobicContact CD2-CB 4.11Å; L572-L611 HydrophobicContact CD2-CD1 4.4Å; L572-L612 HydrophobicContact CD1-CD2 3.7Å; L572-L612 HydrophobicContact CD1-CG 4.27Å; L572-L612 HydrophobicContact CD2-CD2 4.43Å; L572-L612 HydrophobicContact CD2-CG 4.3Å; L572-Y647 HydrophobicContact CB-CE2 4.43Å; L572-Y647 VanDerWaalsContact CB-OH 3.27Å; L572-Y647 WeakPolarHBondContact CB-OH 3.49Å; L572-Y647 HydrophobicContact CD1-CE2 4.22Å; L572-F651 HydrophobicContact CD2-CZ 4.48Å
573N89Confident74.7Confident25 Ų2565.9 Ų65.913%0.13434%0.342CS..Hα-helixtrans-63.5-38.9175.3-74.3-23.2000112.3R569 R570 T571 C575 I576 Q577 Y647R569-N573 VanDerWaalsContact O-CG 3.28Å; R569-N573 PolarHBondContact O-N 3.03Å; R569-N573 PolarHBondContact O-ND2 3.23Å; R570-N573 WeakPolarHBondContact O-CB 3.33Å; R570-N573 PolarHBondContact O-N 3Å; T571-N573 VanDerWaalsContact C-N 3.34Å; T571-N573 PolarHBondContact O-N 3.3Å; N573-C575 PolarHBondContact O-N 3.36Å; N573-I576 PolarHBondContact O-N 3.22Å; N573-Q577 PolarHBondContact O-N 3.44Å; N573-Q577 VanDerWaalsContact O-N 3.12Å; N573-Y647 WeakPolarHBondContact OD1-CE1 3.38Å; N573-Y647 PolarHBondContact OD1-OH 2.91Å; N573-Y647 VanDerWaalsContact OD1-OH 3.1Å
574N83Confident71.8Confident101 Ų10170.3 Ų70.354%0.5436%0.364SS..Hα-helixtrans-62.6-24.8176.1-65.7-3.2000112.1R570 T571 L572 I576R570-N574 VanDerWaalsContact O-CG 3.29Å; R570-N574 PolarHBondContact O-N 2.93Å; R570-N574 PolarHBondContact O-OD1 2.96Å; T571-N574 WeakPolarHBondContact O-CB 3.14Å; T571-N574 PolarHBondContact O-N 3.27Å; L572-N574 VanDerWaalsContact C-N 3.33Å; L572-N574 PolarHBondContact O-N 2.78Å; N574-I576 PolarHBondContact O-N 2.94Å
575C81.4Confident69.1Low34 Ų3475.6 Ų75.623%0.2339%0.391CS..THydrogen-bonded Turntrans-74.2-14175.4-57.20000113.1T571 L572 N573 F651T571-C575 PolarHBondContact O-N 3.21Å; T571-C575 PolarHBondContact O-SG 3.5Å; L572-C575 WeakPolarHBondContact O-CB 3.41Å; L572-C575 PolarHBondContact O-N 2.96Å; L572-C575 VanDerWaalsContact O-N 3.15Å; N573-C575 PolarHBondContact O-N 3.36Å; C575-F651 HydrophobicContact CB-CE1 4.35Å; C575-F651 HydrophobicContact CB-CZ 4.38Å
576I80.6Confident66.2Low46 Ų4682.7 Ų82.724%0.23643%0.429CS..THydrogen-bonded Turntrans-110.7-20.1-175.9-51.8172.6000111.5N573 N574 Y647 A650 F651N573-I576 PolarHBondContact O-N 3.22Å; N574-I576 PolarHBondContact O-N 2.94Å; I576-Y647 HydrophobicContact CD1-CD1 3.2Å; I576-Y647 HydrophobicContact CD1-CE1 3.38Å; I576-Y647 HydrophobicContact CD1-CG 4.31Å; I576-A650 HydrophobicContact CB-CB 4.34Å; I576-A650 HydrophobicContact CD1-CB 3.95Å; I576-A650 HydrophobicContact CG1-CB 3.81Å; I576-A650 HydrophobicContact CG2-CB 3.68Å; I576-F651 HydrophobicContact CD1-CE1 4.29Å; I576-F651 HydrophobicContact CD1-CE2 3.68Å; I576-F651 HydrophobicContact CD1-CZ 3.54Å; I576-F651 HydrophobicContact CG1-CE1 3.93Å; I576-F651 HydrophobicContact CG1-CE2 4.22Å; I576-F651 HydrophobicContact CG1-CZ 3.55Å
577Q67.4Low63.2Low98 Ų9889.4 Ų89.446%0.45847%0.465SS..  trans-89117.3176.6-67-175.85.800109.9N573 D579N573-Q577 PolarHBondContact O-N 3.44Å; N573-Q577 VanDerWaalsContact O-N 3.12Å; Q577-D579 VanDerWaalsContact C-N 3.33Å
578V49Very low60.3Low140 Ų14094.1 Ų94.185%0.84850%0.498SS*.SBendtrans-78.1-14.8-179.2-179.90000112.8
579D40.8Very low57.4Low149 Ų149101.8 Ų101.880%0.79754%0.539SS*.  trans-131.8103.5178.1-70.9-46.2000111Q577Q577-D579 VanDerWaalsContact C-N 3.33Å
580F38.2Very low55Low152 Ų152109.2 Ų109.267%0.66757%0.572SS**  trans-138.4129160.3-141.6-89.6000109.6V582F580-V582 PolarHBondContact O-N 3.32Å
581D33.8Very low52.2Low125 Ų125112.2 Ų112.267%0.66859%0.591SS**  trans-65.5124.2-171.9-150.9-21000110.9T583D581-T583 PolarHBondContact O-N 3Å; D581-T583 VanDerWaalsContact O-N 3.14Å; D581-T583 PolarHBondContact OD1-OG1 2.92Å
582V39.2Very low49.6Very low111 Ų111118.7 Ų118.767%0.67363%0.625SS**G310 helixtrans-77.56.3-171.9177.20000112F580 E584 I585F580-V582 PolarHBondContact O-N 3.32Å; V582-E584 PolarHBondContact O-N 2.53Å; V582-I585 HydrophobicContact CG1-CD1 4.35Å
583T35.1Very low46.7Very low107 Ų107123.4 Ų123.466%0.65666%0.658SS**G310 helixtrans-81.2-9.3-169.444.70000115.3D581D581-T583 PolarHBondContact O-N 3Å; D581-T583 VanDerWaalsContact O-N 3.14Å; D581-T583 PolarHBondContact OD1-OG1 2.92Å
584E34.3Very low44Very low183 Ų183129 Ų12986%0.85569%0.693SS**G310 helixtrans-95.313.2175.3-69.3-169.6166.200114.6V582V582-E584 PolarHBondContact O-N 2.53Å
585I38.1Very low41.8Very low112 Ų112133.8 Ų133.857%0.57471%0.712SS**SBendtrans-94.3-14.6-178.5-61.3-177.6000113.2V582V582-I585 HydrophobicContact CG1-CD1 4.35Å
586N35.1Very low39.3Very low149 Ų149135.5 Ų135.580%0.79774%0.736SS**  trans-103.283179.6-103.6-2.8000111
587D32Very low36.9Very low159 Ų159136.1 Ų136.185%0.8575%0.754SS**  trans-165.2140.2134.7-103.7-25.2000113.6
588S32.2Very low35.3Very low103 Ų103137.5 Ų137.572%0.7277%0.771SS**SBendtrans92.7102.416673.80000120.1
589N32.5Very low35.2Very low162 Ų162134.8 Ų134.887%0.86675%0.752SS**  trans84.586.1131.8-64-6.9000119.7E591N589-E591 PolarHBondContact O-N 3.23Å
590K43.3Very low35.6Very low191 Ų191133.2 Ų133.283%0.8375%0.747SS**  trans-61.3109.2153.5-72.5173.4175.5173.50110.5
591E32.3Very low36.3Very low182 Ų182127.2 Ų127.285%0.8572%0.722SS**SBendtrans-168.9104.4140.9-105.5169.7-15700107.3N589N589-E591 PolarHBondContact O-N 3.23Å
592N35.2Very low37.2Very low164 Ų164124 Ų12488%0.87772%0.719SS**SBendtrans112.216.2179.2-57.9-31.8000118.6
593S29.3Very low38.1Very low98 Ų98127.1 Ų127.169%0.68573%0.726SS**  trans-97.891.716664.30000111.5Q595S593-Q595 PolarHBondContact O-N 3.2Å; S593-Q595 VanDerWaalsContact O-N 3.16Å
594T32.3Very low40.1Very low143 Ų143125.3 Ų125.388%0.87771%0.712SS**  trans-66.6108.2157.528.60000108.8
595Q35.7Very low42.3Very low201 Ų201120.1 Ų120.194%0.93969%0.69SS**SBendtrans33.892.7160.6-70.8-179.7-1400117.6S593S593-Q595 PolarHBondContact O-N 3.2Å; S593-Q595 VanDerWaalsContact O-N 3.16Å
596G29.3Very low44.5Very low71 Ų71117 Ų11773%0.73268%0.678SS**  trans-144.9111.4154.200000108.2
597G29.6Very low47.1Very low59 Ų59110.1 Ų110.161%0.60864%0.641SS**  trans-64.4176177.100000112.8L599G597-L599 PolarHBondContact O-N 2.79Å; G597-L599 VanDerWaalsContact O-N 3.08Å
598P35.2Very low49.9Very low126 Ų126102.7 Ų102.782%0.81860%0.602SS**  trans-57117.2-179.7-1628.3000109.9V600P598-V600 PolarHBondContact O-N 3.44Å
599L46.6Very low52.7Low84 Ų8498.4 Ų98.444%0.4457%0.572SS.*  trans-67.399.9-178.4-103.699.2000110.4I535 G597 L601I535-L599 HydrophobicContact CB-CD2 4.3Å; I535-L599 HydrophobicContact CD1-CD2 4.38Å; I535-L599 HydrophobicContact CG2-CD2 3.4Å; G597-L599 PolarHBondContact O-N 2.79Å; G597-L599 VanDerWaalsContact O-N 3.08Å; L599-L601 VanDerWaalsContact C-N 3.31Å; L599-L601 HydrophobicContact CB-CD1 4.13Å; L599-L601 HydrophobicContact CD2-CD1 3.81Å; L599-L601 HydrophobicContact CD2-CG 4.36Å; L599-L601 PolarHBondContact O-N 3.05Å
600V47.5Very low55.6Low115 Ų11591.6 Ų91.670%0.69754%0.537SS*.  trans-77.382.9167.1-176.70000108.1P598 G602P598-V600 PolarHBondContact O-N 3.44Å; V600-G602 VanDerWaalsContact C-N 3.26Å; V600-G602 PolarHBondContact O-N 2.66Å
601L54.5Low58Low26 Ų2682.5 Ų82.514%0.13650%0.497CS..G310 helixtrans-70.2-18.7178.8-99.6121.8000114I535 T571 L599 Q603 D604 V607 L611I535-L601 HydrophobicContact CD1-CD1 3.66Å; I535-L601 HydrophobicContact CD1-CD2 4.39Å; T571-L601 HydrophobicContact CG2-CD1 3.9Å; T571-L601 HydrophobicContact CG2-CD2 4.32Å; L599-L601 VanDerWaalsContact C-N 3.31Å; L599-L601 HydrophobicContact CB-CD1 4.13Å; L599-L601 HydrophobicContact CD2-CD1 3.81Å; L599-L601 HydrophobicContact CD2-CG 4.36Å; L599-L601 PolarHBondContact O-N 3.05Å; L601-Q603 PolarHBondContact O-N 3.36Å; L601-D604 PolarHBondContact O-N 2.94Å; L601-V607 HydrophobicContact CD2-CG1 3.81Å; L601-L611 HydrophobicContact CD2-CD1 3.9Å
602G52.8Low60.9Low59 Ų5973.9 Ų73.961%0.60846%0.457SS*.G310 helixtrans-63.9-3.1-169.900000116.4V600V600-G602 VanDerWaalsContact C-N 3.26Å; V600-G602 PolarHBondContact O-N 2.66Å
603Q57.5Low63.8Low176 Ų17668.4 Ų68.482%0.82243%0.426SS*.G310 helixtrans-121-11.3-176.8-66.4-178-13.200114.8L601L601-Q603 PolarHBondContact O-N 3.36Å
604D76.2Confident67Low69 Ų6963.9 Ų63.937%0.36939%0.394SS..  trans-104.885.1-178-166.2-12.9000112.2L601 S606 V607 V608L601-D604 PolarHBondContact O-N 2.94Å; D604-S606 PolarHBondContact O-N 2.78Å; D604-S606 VanDerWaalsContact O-N 3.12Å; D604-S606 VanDerWaalsContact OD1-CB 3.29Å; D604-S606 WeakPolarHBondContact OD1-CB 3.29Å; D604-S606 PolarHBondContact OD1-N 2.71Å; D604-S606 PolarHBondContact OD1-OG 2.89Å; D604-V607 HydrophobicContact CB-CB 4.42Å; D604-V607 HydrophobicContact CB-CG2 4.26Å; D604-V607 PolarHBondContact O-N 3.45Å; D604-V607 VanDerWaalsContact O-N 3.15Å; D604-V607 PolarHBondContact OD1-N 3.08Å; D604-V607 WeakPolarHBondContact OD2-CG2 3.36Å; D604-V608 PolarHBondContact O-N 2.68Å
605L81.6Confident70.1Confident73 Ų7357.1 Ų57.138%0.38235%0.353SS..Hα-helixtrans-59.8-19.6177.3-69169.3000113.2S609 F651 D653L605-S609 WeakPolarHBondContact O-CB 3.45Å; L605-S609 PolarHBondContact O-N 2.87Å; L605-F651 HydrophobicContact CD2-CD1 4.44Å; L605-D653 HydrophobicContact CD1-CB 4.31Å
606S84.9Confident72.9Confident46 Ų4647.6 Ų47.632%0.32231%0.308SS..Hα-helixtrans-72.1-42.1176.379.10000111.7D604 S609 S610D604-S606 PolarHBondContact O-N 2.78Å; D604-S606 VanDerWaalsContact O-N 3.12Å; D604-S606 VanDerWaalsContact OD1-CB 3.29Å; D604-S606 WeakPolarHBondContact OD1-CB 3.29Å; D604-S606 PolarHBondContact OD1-N 2.71Å; D604-S606 PolarHBondContact OD1-OG 2.89Å; S606-S609 PolarHBondContact O-N 2.64Å; S606-S610 PolarHBondContact O-N 3.36Å; S606-S610 PolarHBondContact O-OG 2.79Å
607V88.3Confident76.1Confident5 Ų545.1 Ų45.13%0.0328%0.278CS..Hα-helixtrans-66.3-39.9174.5174.30000110.6I535 I538 Q539 L601 D604 S610 L611I535-V607 HydrophobicContact CG2-CG1 3.99Å; I538-V607 HydrophobicContact CG2-CG1 4.38Å; I538-V607 HydrophobicContact CG2-CG2 4.38Å; Q539-V607 HydrophobicContact CG-CG2 4.11Å; L601-V607 HydrophobicContact CD2-CG1 3.81Å; D604-V607 HydrophobicContact CB-CB 4.42Å; D604-V607 HydrophobicContact CB-CG2 4.26Å; D604-V607 PolarHBondContact O-N 3.45Å; D604-V607 VanDerWaalsContact O-N 3.15Å; D604-V607 PolarHBondContact OD1-N 3.08Å; D604-V607 WeakPolarHBondContact OD2-CG2 3.36Å; V607-S610 PolarHBondContact O-N 2.92Å; V607-L611 HydrophobicContact CG1-CD1 4.09Å; V607-L611 HydrophobicContact CG1-CG 4.33Å; V607-L611 WeakPolarHBondContact O-CB 3.37Å; V607-L611 VanDerWaalsContact O-CG 3.32Å; V607-L611 WeakPolarHBondContact O-CG 2.84Å; V607-L611 PolarHBondContact O-N 2.89Å
608V90.3Very high79.3Confident4 Ų442.3 Ų42.32%0.02425%0.249CC..Hα-helixtrans-60-47.6175.7174.20000111.3L572 D604 S610 L611 L612 F651L572-V608 HydrophobicContact CD2-CG1 3.86Å; D604-V608 PolarHBondContact O-N 2.68Å; V608-S610 PolarHBondContact O-N 3.13Å; V608-L611 PolarHBondContact O-N 3.29Å; V608-L612 HydrophobicContact CG1-CD1 4.32Å; V608-L612 WeakPolarHBondContact O-CG 3.41Å; V608-L612 PolarHBondContact O-N 3.39Å; V608-F651 HydrophobicContact CG1-CD1 3.8Å; V608-F651 HydrophobicContact CG1-CD2 4.25Å; V608-F651 HydrophobicContact CG1-CE1 3.6Å; V608-F651 HydrophobicContact CG1-CE2 4.06Å; V608-F651 HydrophobicContact CG1-CG 4.12Å; V608-F651 HydrophobicContact CG1-CZ 3.72Å
609S91.4Very high82.2Confident13 Ų1336.5 Ų36.59%0.09121%0.211CC..Hα-helixtrans-57.1-48.1175.3171.30000111.7L605 S606 L611 L612 E613 R655L605-S609 WeakPolarHBondContact O-CB 3.45Å; L605-S609 PolarHBondContact O-N 2.87Å; S606-S609 PolarHBondContact O-N 2.64Å; S609-L611 PolarHBondContact O-N 3.47Å; S609-L612 WeakPolarHBondContact O-CB 3.25Å; S609-L612 PolarHBondContact O-N 3.48Å; S609-E613 PolarHBondContact O-N 3.27Å; S609-R655 PolarHBondContact OG-O 2.8Å
610S93.1Very high84.4Confident19 Ų1937.9 Ų37.913%0.13321%0.21CC..Hα-helixtrans-64.9-34.8177.2-67.20000113.3I538 S606 V607 V608 E613 V614I538-S610 VanDerWaalsContact CG2-CB 3.47Å; S606-S610 PolarHBondContact O-N 3.36Å; S606-S610 PolarHBondContact O-OG 2.79Å; V607-S610 PolarHBondContact O-N 2.92Å; V608-S610 PolarHBondContact O-N 3.13Å; S610-E613 PolarHBondContact O-N 3.4Å; S610-V614 WeakPolarHBondContact O-CG2 3.27Å; S610-V614 PolarHBondContact O-N 3.26Å
611L94.3Very high86.6Confident0 Ų033.9 Ų33.90%019%0.187CC..Hα-helixtrans-65.5-43.1174.5-76.9172000111.6I535 I538 I568 L572 L601 V607 V608 S609 E613 V614 V615I535-L611 HydrophobicContact CG1-CD1 4.19Å; I535-L611 HydrophobicContact CG1-CD2 4Å; I538-L611 HydrophobicContact CD1-CD2 3.56Å; I538-L611 HydrophobicContact CD1-CG 3.86Å; I568-L611 HydrophobicContact CG1-CD2 4.39Å; I568-L611 HydrophobicContact CG2-CB 3.97Å; I568-L611 HydrophobicContact CG2-CD2 3.93Å; I568-L611 HydrophobicContact CG2-CG 4.42Å; L572-L611 HydrophobicContact CD2-CB 4.11Å; L572-L611 HydrophobicContact CD2-CD1 4.4Å; L601-L611 HydrophobicContact CD2-CD1 3.9Å; V607-L611 HydrophobicContact CG1-CD1 4.09Å; V607-L611 HydrophobicContact CG1-CG 4.33Å; V607-L611 WeakPolarHBondContact O-CB 3.37Å; V607-L611 VanDerWaalsContact O-CG 3.32Å; V607-L611 WeakPolarHBondContact O-CG 2.84Å; V607-L611 PolarHBondContact O-N 2.89Å; V608-L611 PolarHBondContact O-N 3.29Å; S609-L611 PolarHBondContact O-N 3.47Å; L611-E613 VanDerWaalsContact C-N 3.29Å; L611-E613 PolarHBondContact O-N 3.44Å; L611-V614 PolarHBondContact O-N 3.34Å; L611-V615 WeakPolarHBondContact O-CG2 3.26Å; L611-V615 PolarHBondContact O-N 3.03Å
612L94.5Very high88.4Confident0 Ų033 Ų330%018%0.183CC..Hα-helixtrans-59.7-43.2173.8-70.9166.8000111L572 V608 S609 V615 V616 Y647 F651 C656 P659 L660 L663L572-L612 HydrophobicContact CD1-CD2 3.7Å; L572-L612 HydrophobicContact CD1-CG 4.27Å; L572-L612 HydrophobicContact CD2-CD2 4.43Å; L572-L612 HydrophobicContact CD2-CG 4.3Å; V608-L612 HydrophobicContact CG1-CD1 4.32Å; V608-L612 WeakPolarHBondContact O-CG 3.41Å; V608-L612 PolarHBondContact O-N 3.39Å; S609-L612 WeakPolarHBondContact O-CB 3.25Å; S609-L612 PolarHBondContact O-N 3.48Å; L612-V615 WeakPolarHBondContact O-CB 3.33Å; L612-V615 PolarHBondContact O-N 3.48Å; L612-V616 WeakPolarHBondContact O-CG2 3.49Å; L612-V616 PolarHBondContact O-N 3.34Å; L612-V616 VanDerWaalsContact O-N 3.08Å; L612-Y647 HydrophobicContact CD2-CD2 4.11Å; L612-Y647 HydrophobicContact CD2-CE2 4.17Å; L612-F651 HydrophobicContact CD1-CD2 4.2Å; L612-C656 HydrophobicContact CD1-CB 4.16Å; L612-P659 HydrophobicContact CB-CB 3.64Å; L612-L660 HydrophobicContact CD1-CD2 3.95Å; L612-L660 HydrophobicContact CD1-CG 4.04Å; L612-L660 HydrophobicContact CD2-CD2 3.86Å; L612-L663 HydrophobicContact CD2-CD2 4.3Å
613E94.8Very high90.2Very high50 Ų5034.1 Ų34.123%0.23417%0.172CC..Hα-helixtrans-63.1-44.4176.8-169.4179.3-168.600112.1R546 S609 S610 L611 V615 V616 I617 P659R546-E613 VanDerWaalsContact CD-OE1 3.26Å; R546-E613 WeakPolarHBondContact CD-OE1 3.33Å; R546-E613 IonicContact CZ-OE1 2.86Å; R546-E613 VanDerWaalsContact CZ-OE1 3.26Å; R546-E613 IonicContact NE-OE1 3.81Å; R546-E613 VanDerWaalsContact NH1-CD 3.34Å; R546-E613 VanDerWaalsContact NH1-CG 3.31Å; R546-E613 IonicContact NH1-OE1 3.81Å; R546-E613 PolarHBondContact NH1-OE1 2.93Å; S609-E613 PolarHBondContact O-N 3.27Å; S610-E613 PolarHBondContact O-N 3.4Å; L611-E613 VanDerWaalsContact C-N 3.29Å; L611-E613 PolarHBondContact O-N 3.44Å; E613-V615 VanDerWaalsContact C-N 3.31Å; E613-V615 PolarHBondContact O-N 2.89Å; E613-V616 WeakPolarHBondContact O-CB 3.29Å; E613-V616 PolarHBondContact O-N 3.01Å; E613-I617 HydrophobicContact CG-CD1 4.09Å; E613-I617 WeakPolarHBondContact O-CD1 3.05Å; E613-I617 VanDerWaalsContact O-CG1 3.27Å; E613-I617 WeakPolarHBondContact O-CG1 3.44Å; E613-I617 PolarHBondContact O-N 3.11Å; E613-P659 HydrophobicContact CB-CG 4.27Å
614V96.8Very high91.7Very high3 Ų333.6 Ų33.62%0.01817%0.167CC..Hα-helixtrans-60.2-40.4174.3167.80000111.3I538 Y549 I568 S610 L611 V616 I617 L618I538-V614 HydrophobicContact CD1-CG2 4.22Å; Y549-V614 HydrophobicContact CD2-CB 4.48Å; Y549-V614 HydrophobicContact CD2-CG1 3.64Å; Y549-V614 HydrophobicContact CD2-CG2 3.91Å; Y549-V614 HydrophobicContact CE2-CG1 4.27Å; Y549-V614 HydrophobicContact CG-CG1 3.8Å; I568-V614 HydrophobicContact CD1-CG1 3.95Å; S610-V614 WeakPolarHBondContact O-CG2 3.27Å; S610-V614 PolarHBondContact O-N 3.26Å; L611-V614 PolarHBondContact O-N 3.34Å; V614-V616 PolarHBondContact O-N 3.12Å; V614-I617 PolarHBondContact O-N 3.22Å; V614-L618 HydrophobicContact CG1-CD1 3.69Å; V614-L618 HydrophobicContact CG1-CG 4.08Å; V614-L618 WeakPolarHBondContact O-CB 3.47Å; V614-L618 VanDerWaalsContact O-CG 3.25Å; V614-L618 WeakPolarHBondContact O-CG 3.41Å; V614-L618 PolarHBondContact O-N 3.26Å
615V96.8Very high92.3Very high0 Ų032.1 Ų32.10%016%0.164CC..Hα-helixtrans-59.3-46.7174.5169.50000111I565 I568 L611 L612 E613 I617 L618 W619 F640 L663I565-V615 HydrophobicContact CG2-CG1 3.96Å; I568-V615 HydrophobicContact CB-CG2 3.91Å; I568-V615 HydrophobicContact CD1-CG2 4.23Å; I568-V615 HydrophobicContact CG2-CG2 3.5Å; I568-V615 VanDerWaalsContact CG2-CG2 3.5Å; L611-V615 WeakPolarHBondContact O-CG2 3.26Å; L611-V615 PolarHBondContact O-N 3.03Å; L612-V615 WeakPolarHBondContact O-CB 3.33Å; L612-V615 PolarHBondContact O-N 3.48Å; E613-V615 VanDerWaalsContact C-N 3.31Å; E613-V615 PolarHBondContact O-N 2.89Å; V615-I617 PolarHBondContact O-N 2.69Å; V615-L618 PolarHBondContact O-N 3.1Å; V615-W619 VanDerWaalsContact O-CB 3.3Å; V615-W619 WeakPolarHBondContact O-CB 3.39Å; V615-W619 PolarHBondContact O-N 3.43Å; V615-F640 HydrophobicContact CG1-CE1 3.96Å; V615-F640 HydrophobicContact CG1-CZ 3.77Å; V615-L663 HydrophobicContact CG1-CD1 3.77Å
616V95.6Very high92.6Very high2 Ų228.7 Ų28.71%0.01215%0.147CC..Hα-helixtrans-60.4-45.5177.3173.20000111.1L612 E613 V614 W619 R620 Q662 L663L612-V616 WeakPolarHBondContact O-CG2 3.49Å; L612-V616 PolarHBondContact O-N 3.34Å; L612-V616 VanDerWaalsContact O-N 3.08Å; E613-V616 WeakPolarHBondContact O-CB 3.29Å; E613-V616 PolarHBondContact O-N 3.01Å; V614-V616 PolarHBondContact O-N 3.12Å; V616-W619 PolarHBondContact O-N 3.48Å; V616-R620 WeakPolarHBondContact O-CB 3.36Å; V616-R620 WeakPolarHBondContact O-CG 3.43Å; V616-R620 PolarHBondContact O-N 3.48Å; V616-Q662 HydrophobicContact CG1-CB 3.86Å; V616-Q662 HydrophobicContact CG2-CB 4.02Å; V616-L663 HydrophobicContact CG2-CB 3.86Å; V616-L663 HydrophobicContact CG2-CD1 4.4Å
617I96.3Very high92.6Very high18 Ų1833 Ų339%0.09216%0.16CC..Hα-helixtrans-60.7-50.1178.8-68158.6000110.7R546 Q550 E613 V614 V615 W619 R620 S621R546-I617 HydrophobicContact CB-CD1 3.94Å; R546-I617 HydrophobicContact CG-CD1 3.57Å; Q550-I617 VanDerWaalsContact CA-CG2 3.42Å; Q550-I617 HydrophobicContact CB-CG2 3.86Å; Q550-I617 HydrophobicContact CG-CG2 4.47Å; E613-I617 HydrophobicContact CG-CD1 4.09Å; E613-I617 WeakPolarHBondContact O-CD1 3.05Å; E613-I617 VanDerWaalsContact O-CG1 3.27Å; E613-I617 WeakPolarHBondContact O-CG1 3.44Å; E613-I617 PolarHBondContact O-N 3.11Å; V614-I617 PolarHBondContact O-N 3.22Å; V615-I617 PolarHBondContact O-N 2.69Å; I617-W619 PolarHBondContact O-N 3.15Å; I617-R620 PolarHBondContact O-N 2.87Å; I617-S621 WeakPolarHBondContact O-CB 3.27Å; I617-S621 PolarHBondContact O-N 2.98Å
618L96.4Very high92.6Very high0 Ų039.9 Ų39.90%019%0.192CC..Hα-helixtrans-61.3-45.4179.5-72.2173.9000110.7Y549 I561 L564 I565 I568 V614 V615 R620 S621 V622Y549-L618 HydrophobicContact CD1-CD1 4.45Å; Y549-L618 HydrophobicContact CD1-CD2 3.91Å; Y549-L618 HydrophobicContact CG-CD2 4.26Å; I561-L618 HydrophobicContact CD1-CD2 4.18Å; I561-L618 HydrophobicContact CG2-CB 3.89Å; I561-L618 HydrophobicContact CG2-CD2 3.96Å; I561-L618 HydrophobicContact CG2-CG 4.44Å; L564-L618 HydrophobicContact CD2-CD1 3.71Å; L564-L618 HydrophobicContact CG-CD1 3.94Å; I565-L618 HydrophobicContact CD1-CB 3.8Å; I565-L618 HydrophobicContact CG1-CB 3.62Å; I565-L618 HydrophobicContact CG1-CD1 4.1Å; I568-L618 HydrophobicContact CD1-CD1 4.13Å; V614-L618 HydrophobicContact CG1-CD1 3.69Å; V614-L618 HydrophobicContact CG1-CG 4.08Å; V614-L618 WeakPolarHBondContact O-CB 3.47Å; V614-L618 VanDerWaalsContact O-CG 3.25Å; V614-L618 WeakPolarHBondContact O-CG 3.41Å; V614-L618 PolarHBondContact O-N 3.26Å; V615-L618 PolarHBondContact O-N 3.1Å; L618-R620 PolarHBondContact O-N 3.01Å; L618-S621 WeakPolarHBondContact O-CB 3.41Å; L618-S621 PolarHBondContact O-N 3.41Å; L618-S621 PolarHBondContact O-OG 3.44Å; L618-V622 WeakPolarHBondContact O-CG2 3.37Å; L618-V622 PolarHBondContact O-N 3.25Å
619W95.4Very high92.6Very high4 Ų443.3 Ų43.32%0.01521%0.21CC..Hα-helixtrans-58.8-50.7178.7-165.6-64.7000111.7I565 V615 V616 I617 S621 V622 E623 L626 T636 V637 F640 C666 M667I565-W619 HydrophobicContact CD1-CB 4.26Å; I565-W619 HydrophobicContact CG2-CE3 4.16Å; I565-W619 HydrophobicContact CG2-CZ3 4.47Å; V615-W619 VanDerWaalsContact O-CB 3.3Å; V615-W619 WeakPolarHBondContact O-CB 3.39Å; V615-W619 PolarHBondContact O-N 3.43Å; V616-W619 PolarHBondContact O-N 3.48Å; I617-W619 PolarHBondContact O-N 3.15Å; W619-S621 VanDerWaalsContact C-N 3.26Å; W619-S621 PolarHBondContact O-N 3.41Å; W619-V622 CarbonylContact O-C 3.6Å; W619-V622 PolarHBondContact O-N 3.34Å; W619-E623 PolarHBondContact O-N 2.94Å; W619-L626 HydrophobicContact CD2-CD1 4.38Å; W619-L626 HydrophobicContact CG-CD1 4.42Å; W619-T636 HydrophobicContact CE3-CG2 4Å; W619-T636 HydrophobicContact CH2-CG2 3.32Å; W619-T636 HydrophobicContact CZ2-CG2 4.24Å; W619-T636 HydrophobicContact CZ3-CG2 3.18Å; W619-V637 HydrophobicContact CH2-CG2 4.25Å; W619-V637 HydrophobicContact CZ2-CG2 3.97Å; W619-F640 HydrophobicContact CH2-CD2 4.48Å; W619-F640 AromaticContact CZ3-CD2 3.73Å; W619-F640 HydrophobicContact CZ3-CD2 3.73Å; W619-F640 HydrophobicContact CZ3-CE2 4.1Å; W619-F640 HydrophobicContact CZ3-CG 4.3Å; W619-C666 HydrophobicContact CD2-CB 4.27Å; W619-C666 HydrophobicContact CG-CB 4.09Å; W619-M667 HydrophobicContact CH2-CG 4.34Å; W619-M667 HydrophobicContact CZ2-CG 4.36Å
620R92.9Very high92.4Very high114 Ų11448.6 Ų48.643%0.4323%0.233SC..Hα-helixtrans-60.6-36.7177.2-71.6179.9-179.5-174.80.2111.7V616 I617 L618 V622 E623V616-R620 WeakPolarHBondContact O-CB 3.36Å; V616-R620 WeakPolarHBondContact O-CG 3.43Å; V616-R620 PolarHBondContact O-N 3.48Å; I617-R620 PolarHBondContact O-N 2.87Å; L618-R620 PolarHBondContact O-N 3.01Å; R620-V622 PolarHBondContact O-N 3.41Å; R620-E623 PolarHBondContact O-N 2.99Å
621S93.6Very high92.2Very high31 Ų3155.5 Ų55.522%0.21726%0.263CS..Hα-helixtrans-64.1-24.9179.381.70000114I617 L618 W619I617-S621 WeakPolarHBondContact O-CB 3.27Å; I617-S621 PolarHBondContact O-N 2.98Å; L618-S621 WeakPolarHBondContact O-CB 3.41Å; L618-S621 PolarHBondContact O-N 3.41Å; L618-S621 PolarHBondContact O-OG 3.44Å; W619-S621 VanDerWaalsContact C-N 3.26Å; W619-S621 PolarHBondContact O-N 3.41Å
622V93.2Very high91.9Very high7 Ų756.5 Ų56.54%0.04227%0.272CS..THydrogen-bonded Turntrans-116.412.2178.8-62.10000113.5H553 A558 I561 I562 L618 W619 R620 K624 A625 L626H553-V622 HydrophobicContact CB-CG1 4.26Å; A558-V622 HydrophobicContact CB-CB 4.23Å; A558-V622 HydrophobicContact CB-CG1 3.94Å; I561-V622 HydrophobicContact CB-CG1 3.78Å; I561-V622 HydrophobicContact CB-CG2 4.5Å; I561-V622 HydrophobicContact CG1-CG1 3.83Å; I561-V622 HydrophobicContact CG2-CB 4.48Å; I561-V622 HydrophobicContact CG2-CG1 3.7Å; I561-V622 HydrophobicContact CG2-CG2 3.92Å; I562-V622 HydrophobicContact CG1-CG2 4.47Å; L618-V622 WeakPolarHBondContact O-CG2 3.37Å; L618-V622 PolarHBondContact O-N 3.25Å; W619-V622 CarbonylContact O-C 3.6Å; W619-V622 PolarHBondContact O-N 3.34Å; R620-V622 PolarHBondContact O-N 3.41Å; V622-K624 VanDerWaalsContact C-N 3.29Å; V622-K624 PolarHBondContact O-N 3.49Å; V622-A625 CarbonylContact O-C 3.54Å; V622-A625 PolarHBondContact O-N 3.29Å; V622-L626 HydrophobicContact CG2-CD1 3.84Å; V622-L626 HydrophobicContact CG2-CG 4.12Å; V622-L626 PolarHBondContact O-N 3.46Å
623E89.8Confident91.7Very high83 Ų8358.8 Ų58.839%0.38828%0.282SS..Hα-helixtrans-55.8-42.9-175.1-172.4-173.817000112.3W619 R620 A625 L626 K627W619-E623 PolarHBondContact O-N 2.94Å; R620-E623 PolarHBondContact O-N 2.99Å; E623-A625 PolarHBondContact O-N 2.95Å; E623-L626 PolarHBondContact O-N 3.23Å; E623-K627 HydrophobicContact CG-CD 4.47Å; E623-K627 WeakPolarHBondContact O-CG 3.3Å; E623-K627 PolarHBondContact O-N 3.47Å; E623-K627 WeakPolarHBondContact OE1-CE 3.47Å; E623-K627 IonicContact OE1-NZ 2.76Å; E623-K627 PolarHBondContact OE1-NZ 3.08Å
624K89.4Confident91.5Very high165 Ų16562.5 Ų62.572%0.71730%0.297SS*.Hα-helixtrans-62.6-42.3176.7-173.1177.6180178.70112.1V622 K627 Q628V622-K624 VanDerWaalsContact C-N 3.29Å; V622-K624 PolarHBondContact O-N 3.49Å; K624-K627 PolarHBondContact O-N 3.19Å; K624-Q628 WeakPolarHBondContact O-CG 3.47Å; K624-Q628 PolarHBondContact O-N 3.42Å
625A89.1Confident91.2Very high37 Ų3768.1 Ų68.131%0.30632%0.319SS..Hα-helixtrans-70.5-35.8178.200000111.8A558 V622 E623 Q628 N629A558-A625 HydrophobicContact CB-CB 3.76Å; V622-A625 CarbonylContact O-C 3.54Å; V622-A625 PolarHBondContact O-N 3.29Å; E623-A625 PolarHBondContact O-N 2.95Å; A625-Q628 PolarHBondContact O-N 3.32Å; A625-N629 PolarHBondContact O-N 3.28Å
626L87.1Confident91Very high2 Ų268.1 Ų68.11%0.0132%0.319CS..Hα-helixtrans-63.7-45.5172.6-82.5170.9000111.4I562 W619 V622 E623 Q628 N629 A632 H633I562-L626 HydrophobicContact CD1-CD2 3.46Å; I562-L626 VanDerWaalsContact CD1-CD2 3.46Å; I562-L626 HydrophobicContact CD1-CG 4.19Å; I562-L626 HydrophobicContact CG1-CD2 3.9Å; I562-L626 HydrophobicContact CG1-CG 4.44Å; W619-L626 HydrophobicContact CD2-CD1 4.38Å; W619-L626 HydrophobicContact CG-CD1 4.42Å; V622-L626 HydrophobicContact CG2-CD1 3.84Å; V622-L626 HydrophobicContact CG2-CG 4.12Å; V622-L626 PolarHBondContact O-N 3.46Å; E623-L626 PolarHBondContact O-N 3.23Å; L626-Q628 PolarHBondContact O-N 3.47Å; L626-N629 CarbonylContact O-C 3.58Å; L626-N629 VanDerWaalsContact O-C 3.26Å; L626-N629 PolarHBondContact O-N 2.86Å; L626-A632 HydrophobicContact CD2-CB 4.42Å; L626-H633 WeakPolarHBondContact O-CB 3.49Å
627K85.2Confident90.8Very high137 Ų13768.9 Ų68.960%0.59632%0.324SS*.Hα-helixtrans-61.2-27.8176.5-74.5178-176.21700113.1E623 K624E623-K627 HydrophobicContact CG-CD 4.47Å; E623-K627 WeakPolarHBondContact O-CG 3.3Å; E623-K627 PolarHBondContact O-N 3.47Å; E623-K627 WeakPolarHBondContact OE1-CE 3.47Å; E623-K627 IonicContact OE1-NZ 2.76Å; E623-K627 PolarHBondContact OE1-NZ 3.08Å; K624-K627 PolarHBondContact O-N 3.19Å
628Q89.2Confident90.6Very high149 Ų14970.5 Ų70.570%0.69634%0.34SS*.Hα-helixtrans-79.7-18.5174.6-70.2174-17.200113.4K624 A625 L626K624-Q628 WeakPolarHBondContact O-CG 3.47Å; K624-Q628 PolarHBondContact O-N 3.42Å; A625-Q628 PolarHBondContact O-N 3.32Å; L626-Q628 PolarHBondContact O-N 3.47Å
629N89.8Confident90.4Very high76 Ų7673.8 Ų73.841%0.40635%0.354SS..  trans-117.387.5178.1-172.9-31.5000110.2A625 L626 E631 A632 H633A625-N629 PolarHBondContact O-N 3.28Å; L626-N629 CarbonylContact O-C 3.58Å; L626-N629 VanDerWaalsContact O-C 3.26Å; L626-N629 PolarHBondContact O-N 2.86Å; N629-E631 VanDerWaalsContact C-N 3.31Å; N629-E631 PolarHBondContact O-N 2.94Å; N629-A632 HydrophobicContact CB-CB 4.18Å; N629-A632 PolarHBondContact O-N 3.38Å; N629-A632 WeakPolarHBondContact OD1-CB 3.46Å; N629-A632 PolarHBondContact OD1-N 3.01Å; N629-H633 WeakPolarHBondContact O-CB 3.36Å; N629-H633 PolarHBondContact O-N 3.29Å
630E87.8Confident90.3Very high123 Ų12373.6 Ų73.658%0.57535%0.353SS*.Hα-helixtrans-60.4-37.7-172.3-164.6-177.7170.800113.1H633 K634E630-H633 PolarHBondContact O-N 2.86Å; E630-K634 HydrophobicContact CG-CD 4.26Å; E630-K634 WeakPolarHBondContact O-CB 3.45Å; E630-K634 WeakPolarHBondContact O-CG 3.26Å; E630-K634 PolarHBondContact O-N 3.25Å; E630-K634 WeakPolarHBondContact OE1-CE 3.29Å; E630-K634 IonicContact OE1-NZ 2.97Å; E630-K634 PolarHBondContact OE1-NZ 3.12Å
631E88.9Confident90.2Very high164 Ų16468.8 Ų68.877%0.76634%0.34SS*.Hα-helixtrans-65.3-49.3178.2-66.3-175.3168.700111.8N629 H633 K634 Y635N629-E631 VanDerWaalsContact C-N 3.31Å; N629-E631 PolarHBondContact O-N 2.94Å; E631-H633 VanDerWaalsContact C-N 3.3Å; E631-H633 PolarHBondContact O-N 3Å; E631-K634 PolarHBondContact O-N 3.36Å; E631-Y635 VanDerWaalsContact O-CB 3.28Å; E631-Y635 WeakPolarHBondContact O-CB 3.37Å; E631-Y635 PolarHBondContact O-N 2.91Å
632A87.9Confident89.9Confident22 Ų2273.6 Ų73.618%0.18236%0.363CS..Hα-helixtrans-63.7-38178.200000111.5I562 L626 N629 T636I562-A632 HydrophobicContact CD1-CB 4.33Å; L626-A632 HydrophobicContact CD2-CB 4.42Å; N629-A632 HydrophobicContact CB-CB 4.18Å; N629-A632 PolarHBondContact O-N 3.38Å; N629-A632 WeakPolarHBondContact OD1-CB 3.46Å; N629-A632 PolarHBondContact OD1-N 3.01Å; A632-T636 WeakPolarHBondContact O-CB 3.44Å; A632-T636 PolarHBondContact O-N 3.41Å; A632-T636 PolarHBondContact O-OG1 3.07Å
633H89.8Confident89.8Confident48 Ų4874 Ų7422%0.22237%0.365CS..Hα-helixtrans-63.7-52.8174.9-179-128.4000111.8L626 N629 E630 E631 Y635 T636 V637L626-H633 WeakPolarHBondContact O-CB 3.49Å; N629-H633 WeakPolarHBondContact O-CB 3.36Å; N629-H633 PolarHBondContact O-N 3.29Å; E630-H633 PolarHBondContact O-N 2.86Å; E631-H633 VanDerWaalsContact C-N 3.3Å; E631-H633 PolarHBondContact O-N 3Å; H633-Y635 VanDerWaalsContact C-N 3.31Å; H633-Y635 PolarHBondContact O-N 2.85Å; H633-T636 PolarHBondContact O-N 3.44Å; H633-V637 WeakPolarHBondContact O-CB 3.42Å; H633-V637 VanDerWaalsContact O-CG2 3.26Å; H633-V637 WeakPolarHBondContact O-CG2 3.27Å; H633-V637 PolarHBondContact O-N 3.38Å
634K90.6Very high89.8Confident127 Ų12770.1 Ų70.155%0.55235%0.347SS*.Hα-helixtrans-57.1-44.5176.8-76.6176.6-178.2167.50111.6E630 E631 A638E630-K634 HydrophobicContact CG-CD 4.26Å; E630-K634 WeakPolarHBondContact O-CB 3.45Å; E630-K634 WeakPolarHBondContact O-CG 3.26Å; E630-K634 PolarHBondContact O-N 3.25Å; E630-K634 WeakPolarHBondContact OE1-CE 3.29Å; E630-K634 IonicContact OE1-NZ 2.97Å; E630-K634 PolarHBondContact OE1-NZ 3.12Å; E631-K634 PolarHBondContact O-N 3.36Å; K634-A638 VanDerWaalsContact O-CB 3.27Å; K634-A638 WeakPolarHBondContact O-CB 3.33Å; K634-A638 PolarHBondContact O-N 3.15Å
635Y91.6Very high89.6Confident121 Ų12164.2 Ų64.248%0.47533%0.329SS..Hα-helixtrans-61.3-48.4178.2180-99.1000112L566 E631 H633 A638 K639L566-Y635 HydrophobicContact CD1-CD1 4.35Å; L566-Y635 HydrophobicContact CD1-CE1 3.75Å; L566-Y635 HydrophobicContact CD2-CE1 4.35Å; E631-Y635 VanDerWaalsContact O-CB 3.28Å; E631-Y635 WeakPolarHBondContact O-CB 3.37Å; E631-Y635 PolarHBondContact O-N 2.91Å; H633-Y635 VanDerWaalsContact C-N 3.31Å; H633-Y635 PolarHBondContact O-N 2.85Å; Y635-A638 PolarHBondContact O-N 2.55Å; Y635-K639 HydrophobicContact CD1-CG 4.42Å; Y635-K639 HydrophobicContact CE1-CG 4.07Å; Y635-K639 HydrophobicContact CE2-CG 4.32Å; Y635-K639 WeakPolarHBondContact O-CG 3.26Å; Y635-K639 PolarHBondContact O-N 2.8Å; Y635-K639 WeakPolarHBondContact OH-CE 3.19Å
636T91.6Very high89.6Confident1 Ų168.4 Ų68.41%0.00634%0.34CS..Hα-helixtrans-67.2-42.8-177.5-46.50000111I565 L566 W619 A632 H633 K639 F640I565-T636 HydrophobicContact CG2-CG2 4.46Å; L566-T636 HydrophobicContact CD2-CG2 4.44Å; W619-T636 HydrophobicContact CE3-CG2 4Å; W619-T636 HydrophobicContact CH2-CG2 3.32Å; W619-T636 HydrophobicContact CZ2-CG2 4.24Å; W619-T636 HydrophobicContact CZ3-CG2 3.18Å; A632-T636 WeakPolarHBondContact O-CB 3.44Å; A632-T636 PolarHBondContact O-N 3.41Å; A632-T636 PolarHBondContact O-OG1 3.07Å; H633-T636 PolarHBondContact O-N 3.44Å; T636-K639 PolarHBondContact O-N 2.69Å; T636-F640 HydrophobicContact CG2-CD2 4.26Å; T636-F640 HydrophobicContact CG2-CE2 4.41Å; T636-F640 PolarHBondContact O-N 3.32Å; T636-F640 VanDerWaalsContact O-N 3.11Å
637V92.1Very high89.7Confident17 Ų1768.3 Ų68.310%0.10334%0.34CS..Hα-helixtrans-59.9-47.4174.6170.80000111.1W619 H633 K639 F640 G641 M667 A671W619-V637 HydrophobicContact CH2-CG2 4.25Å; W619-V637 HydrophobicContact CZ2-CG2 3.97Å; H633-V637 WeakPolarHBondContact O-CB 3.42Å; H633-V637 VanDerWaalsContact O-CG2 3.26Å; H633-V637 WeakPolarHBondContact O-CG2 3.27Å; H633-V637 PolarHBondContact O-N 3.38Å; V637-K639 VanDerWaalsContact C-N 3.32Å; V637-K639 PolarHBondContact O-N 3.44Å; V637-F640 PolarHBondContact O-N 3.47Å; V637-G641 PolarHBondContact O-N 3.4Å; V637-M667 HydrophobicContact CG1-CB 4.3Å; V637-M667 HydrophobicContact CG1-CG 4.3Å; V637-M667 HydrophobicContact CG1-SD 4.43Å; V637-M667 HydrophobicContact CG2-CG 4.2Å; V637-A671 HydrophobicContact CG1-CB 4.06Å
638A91.8Very high89.8Confident52 Ų5264.4 Ų64.443%0.4332%0.323SS..Hα-helixtrans-61.5-40.7179.400000112.1K634 Y635 N642K634-A638 VanDerWaalsContact O-CB 3.27Å; K634-A638 WeakPolarHBondContact O-CB 3.33Å; K634-A638 PolarHBondContact O-N 3.15Å; Y635-A638 PolarHBondContact O-N 2.55Å; A638-N642 PolarHBondContact O-N 3.03Å; A638-N642 PolarHBondContact O-ND2 3.09Å; A638-N642 PolarHBondContact O-OD1 3.21Å
639K92.6Very high89.7Confident69 Ų6964 Ų6430%0.332%0.321SS..Hα-helixtrans-64.6-43178.1-72.8-56.9-175.3-174.60112.4L566 R569 Y635 T636 V637L566-K639 HydrophobicContact CD2-CB 4.24Å; L566-K639 HydrophobicContact CD2-CG 4.36Å; R569-K639 PolarHBondContact NH1-O 3.26Å; Y635-K639 HydrophobicContact CD1-CG 4.42Å; Y635-K639 HydrophobicContact CE1-CG 4.07Å; Y635-K639 HydrophobicContact CE2-CG 4.32Å; Y635-K639 WeakPolarHBondContact O-CG 3.26Å; Y635-K639 PolarHBondContact O-N 2.8Å; Y635-K639 WeakPolarHBondContact OH-CE 3.19Å; T636-K639 PolarHBondContact O-N 2.69Å; V637-K639 VanDerWaalsContact C-N 3.32Å; V637-K639 PolarHBondContact O-N 3.44Å
640F93.3Very high89.5Confident0 Ų062.6 Ų62.60%032%0.32CS..Hα-helixtrans-78.1-38.3178.4-84.7-89.2000112.8I565 R569 V615 W619 T636 V637 N642 V643 M644 L663 M667I565-F640 HydrophobicContact CG2-CE2 3.49Å; I565-F640 VanDerWaalsContact CG2-CE2 3.49Å; I565-F640 HydrophobicContact CG2-CZ 3.71Å; R569-F640 HydrophobicContact CB-CE1 4.05Å; R569-F640 HydrophobicContact CB-CE2 4Å; R569-F640 HydrophobicContact CB-CZ 3.54Å; R569-F640 HydrophobicContact CG-CD1 4.22Å; R569-F640 HydrophobicContact CG-CD2 4.49Å; R569-F640 HydrophobicContact CG-CE1 3.75Å; R569-F640 HydrophobicContact CG-CE2 4.03Å; R569-F640 HydrophobicContact CG-CZ 3.67Å; V615-F640 HydrophobicContact CG1-CE1 3.96Å; V615-F640 HydrophobicContact CG1-CZ 3.77Å; W619-F640 HydrophobicContact CH2-CD2 4.48Å; W619-F640 AromaticContact CZ3-CD2 3.73Å; W619-F640 HydrophobicContact CZ3-CD2 3.73Å; W619-F640 HydrophobicContact CZ3-CE2 4.1Å; W619-F640 HydrophobicContact CZ3-CG 4.3Å; T636-F640 HydrophobicContact CG2-CD2 4.26Å; T636-F640 HydrophobicContact CG2-CE2 4.41Å; T636-F640 PolarHBondContact O-N 3.32Å; T636-F640 VanDerWaalsContact O-N 3.11Å; V637-F640 PolarHBondContact O-N 3.47Å; F640-N642 VanDerWaalsContact C-N 3.29Å; F640-N642 PolarHBondContact O-N 3.34Å; F640-V643 WeakPolarHBondContact O-CG2 3.42Å; F640-V643 PolarHBondContact O-N 3.28Å; F640-M644 WeakPolarHBondContact O-CG 3.36Å; F640-M644 PolarHBondContact O-N 3.15Å; F640-M644 VanDerWaalsContact O-N 3.09Å; F640-L663 HydrophobicContact CD1-CD1 4.32Å; F640-L663 HydrophobicContact CD1-CD2 3.82Å; F640-L663 HydrophobicContact CD1-CG 4.42Å; F640-L663 HydrophobicContact CE1-CD1 4.49Å; F640-L663 HydrophobicContact CE1-CD2 4.01Å; F640-M667 HydrophobicContact CB-CE 4.07Å; F640-M667 HydrophobicContact CB-SD 3.61Å
641G89.4Confident89.4Confident14 Ų1457.1 Ų57.114%0.14430%0.295CS..Hα-helixtrans-54.6-42.2176.500000113.3V637 V643 M644 A671V637-G641 PolarHBondContact O-N 3.4Å; G641-V643 PolarHBondContact O-N 3.1Å; G641-V643 VanDerWaalsContact O-N 3.1Å; G641-M644 PolarHBondContact O-N 2.82Å; G641-A671 VanDerWaalsContact CA-O 3.26Å; G641-A671 WeakPolarHBondContact CA-O 3.46Å
642N88.1Confident88.9Confident131 Ų13157.1 Ų57.170%0.70129%0.294SS*.Hα-helixtrans-63.5-16.7178.8-71.3-7.5000114.8A638 F640A638-N642 PolarHBondContact O-N 3.03Å; A638-N642 PolarHBondContact O-ND2 3.09Å; A638-N642 PolarHBondContact O-OD1 3.21Å; F640-N642 VanDerWaalsContact C-N 3.29Å; F640-N642 PolarHBondContact O-N 3.34Å
643V90.1Very high88.5Confident16 Ų1657.7 Ų57.710%0.09730%0.295CS..Hα-helixtrans-115-12.3-177.4-60.20000113.5F640 G641 A645 K646 Y647F640-V643 WeakPolarHBondContact O-CG2 3.42Å; F640-V643 PolarHBondContact O-N 3.28Å; G641-V643 PolarHBondContact O-N 3.1Å; G641-V643 VanDerWaalsContact O-N 3.1Å; V643-A645 PolarHBondContact O-N 2.91Å; V643-K646 WeakPolarHBondContact O-CB 3.38Å; V643-K646 PolarHBondContact O-N 3.03Å; V643-Y647 HydrophobicContact CB-CD1 4.12Å; V643-Y647 HydrophobicContact CB-CE1 3.82Å; V643-Y647 HydrophobicContact CG2-CD1 4.32Å; V643-Y647 HydrophobicContact CG2-CD2 4.47Å; V643-Y647 HydrophobicContact CG2-CE1 3.85Å; V643-Y647 HydrophobicContact CG2-CE2 4.01Å; V643-Y647 WeakPolarHBondContact O-CD1 3.18Å; V643-Y647 PolarHBondContact O-N 3.02Å
644M89.9Confident88.1Confident1 Ų163.4 Ų63.41%0.00532%0.321CS..Hα-helixtrans-55-46-176-76.7-50.6-62.400113.6F640 G641 K646 Y647 F648 L660 L663 A664 M667 A672F640-M644 WeakPolarHBondContact O-CG 3.36Å; F640-M644 PolarHBondContact O-N 3.15Å; F640-M644 VanDerWaalsContact O-N 3.09Å; G641-M644 PolarHBondContact O-N 2.82Å; M644-K646 VanDerWaalsContact C-N 3.29Å; M644-K646 PolarHBondContact O-N 3.1Å; M644-Y647 PolarHBondContact O-N 3.37Å; M644-F648 HydrophobicContact CE-CD2 4.15Å; M644-F648 HydrophobicContact CE-CE2 3.51Å; M644-F648 HydrophobicContact CE-CZ 4.15Å; M644-F648 VanDerWaalsContact O-CD2 3.27Å; M644-F648 WeakPolarHBondContact O-CD2 3.43Å; M644-F648 PolarHBondContact O-N 2.83Å; M644-L660 HydrophobicContact CE-CD2 4.44Å; M644-L663 HydrophobicContact SD-CD2 3.98Å; M644-L663 HydrophobicContact SD-CG 4.12Å; M644-A664 HydrophobicContact CE-CB 4.03Å; M644-M667 HydrophobicContact CG-CE 3.59Å; M644-M667 HydrophobicContact SD-CE 3.67Å; M644-A672 HydrophobicContact CB-CB 4.25Å; M644-A672 HydrophobicContact CG-CB 4.41Å
645A86.6Confident87.9Confident41 Ų4163.8 Ų63.834%0.33932%0.319SS..Hα-helixtrans-62-38.4179.200000111.9V643 Q649V643-A645 PolarHBondContact O-N 2.91Å; A645-Q649 VanDerWaalsContact O-CG 3.3Å; A645-Q649 WeakPolarHBondContact O-CG 3.45Å; A645-Q649 PolarHBondContact O-N 3.23Å
646K87.3Confident87.7Confident125 Ų12558 Ų5854%0.54330%0.297SS..Hα-helixtrans-69.1-37.2175.9-63.4-174.4178.3-173.50111.6V643 M644 Q649 A650V643-K646 WeakPolarHBondContact O-CB 3.38Å; V643-K646 PolarHBondContact O-N 3.03Å; M644-K646 VanDerWaalsContact C-N 3.29Å; M644-K646 PolarHBondContact O-N 3.1Å; K646-Q649 PolarHBondContact O-N 3.27Å; K646-A650 VanDerWaalsContact O-CB 3.25Å; K646-A650 WeakPolarHBondContact O-CB 3.25Å; K646-A650 PolarHBondContact O-N 3.38Å
647Y90.6Very high87.5Confident0 Ų060.3 Ų60.30%031%0.311CS..Hα-helixtrans-65.6-43.8177.9-75.612.1000111.7R569 L572 N573 I576 L612 V643 M644 Q649 A650 F651 L660R569-Y647 PolarHBondContact O-OH 3.43Å; L572-Y647 HydrophobicContact CB-CE2 4.43Å; L572-Y647 VanDerWaalsContact CB-OH 3.27Å; L572-Y647 WeakPolarHBondContact CB-OH 3.49Å; L572-Y647 HydrophobicContact CD1-CE2 4.22Å; N573-Y647 WeakPolarHBondContact OD1-CE1 3.38Å; N573-Y647 PolarHBondContact OD1-OH 2.91Å; N573-Y647 VanDerWaalsContact OD1-OH 3.1Å; I576-Y647 HydrophobicContact CD1-CD1 3.2Å; I576-Y647 HydrophobicContact CD1-CE1 3.38Å; I576-Y647 HydrophobicContact CD1-CG 4.31Å; L612-Y647 HydrophobicContact CD2-CD2 4.11Å; L612-Y647 HydrophobicContact CD2-CE2 4.17Å; V643-Y647 HydrophobicContact CB-CD1 4.12Å; V643-Y647 HydrophobicContact CB-CE1 3.82Å; V643-Y647 HydrophobicContact CG2-CD1 4.32Å; V643-Y647 HydrophobicContact CG2-CD2 4.47Å; V643-Y647 HydrophobicContact CG2-CE1 3.85Å; V643-Y647 HydrophobicContact CG2-CE2 4.01Å; V643-Y647 WeakPolarHBondContact O-CD1 3.18Å; V643-Y647 PolarHBondContact O-N 3.02Å; M644-Y647 PolarHBondContact O-N 3.37Å; Y647-Q649 PolarHBondContact O-N 3.19Å; Y647-A650 PolarHBondContact O-N 2.81Å; Y647-F651 AromaticContact CD1-CE2 3.97Å; Y647-F651 HydrophobicContact CD1-CE2 3.97Å; Y647-F651 HydrophobicContact CD2-CE2 4.34Å; Y647-F651 HydrophobicContact CE1-CE2 4.32Å; Y647-F651 HydrophobicContact CG-CD2 4.2Å; Y647-F651 AromaticContact CG-CE2 3.96Å; Y647-F651 HydrophobicContact CG-CE2 3.96Å; Y647-F651 WeakPolarHBondContact O-CB 3.26Å; Y647-F651 PolarHBondContact O-N 2.7Å; Y647-L660 HydrophobicContact CD2-CD2 3.93Å; Y647-L660 HydrophobicContact CG-CD2 4.31Å
648F87.8Confident87.4Confident55 Ų5562.5 Ų62.524%0.24132%0.324CS..Hα-helixtrans-63.8-25.5174.4-80.5-67.3000113.4M644 L660 I661 F675M644-F648 HydrophobicContact CE-CD2 4.15Å; M644-F648 HydrophobicContact CE-CE2 3.51Å; M644-F648 HydrophobicContact CE-CZ 4.15Å; M644-F648 VanDerWaalsContact O-CD2 3.27Å; M644-F648 WeakPolarHBondContact O-CD2 3.43Å; M644-F648 PolarHBondContact O-N 2.83Å; F648-L660 HydrophobicContact CD1-CB 4.15Å; F648-L660 HydrophobicContact CD1-CD1 4.01Å; F648-L660 HydrophobicContact CE1-CB 3.58Å; F648-L660 HydrophobicContact CE1-CD1 4.3Å; F648-L660 HydrophobicContact CZ-CB 3.83Å; F648-I661 HydrophobicContact CE1-CG1 4.33Å; F648-I661 HydrophobicContact CZ-CG1 4.48Å; F648-F675 HydrophobicContact CE1-CD2 4.43Å; F648-F675 HydrophobicContact CE2-CB 4.12Å; F648-F675 HydrophobicContact CE2-CD1 4.43Å; F648-F675 HydrophobicContact CE2-CD2 4.41Å; F648-F675 HydrophobicContact CE2-CG 4.07Å; F648-F675 HydrophobicContact CZ-CD1 4.31Å; F648-F675 HydrophobicContact CZ-CD2 4.06Å; F648-F675 HydrophobicContact CZ-CE2 4.34Å; F648-F675 HydrophobicContact CZ-CG 4.06Å
649Q86.3Confident87.4Confident141 Ų14160.4 Ų60.466%0.65931%0.306SS*.Hα-helixtrans-84.9-37.9175.7-72.5171.6-10.500113A645 K646 Y647A645-Q649 VanDerWaalsContact O-CG 3.3Å; A645-Q649 WeakPolarHBondContact O-CG 3.45Å; A645-Q649 PolarHBondContact O-N 3.23Å; K646-Q649 PolarHBondContact O-N 3.27Å; Y647-Q649 PolarHBondContact O-N 3.19Å
650A84.7Confident87.4Confident46 Ų4657.2 Ų57.238%0.3829%0.292SS..Hα-helixtrans-87.7-28.1-173.400000113.4I576 K646 Y647I576-A650 HydrophobicContact CB-CB 4.34Å; I576-A650 HydrophobicContact CD1-CB 3.95Å; I576-A650 HydrophobicContact CG1-CB 3.81Å; I576-A650 HydrophobicContact CG2-CB 3.68Å; K646-A650 VanDerWaalsContact O-CB 3.25Å; K646-A650 WeakPolarHBondContact O-CB 3.25Å; K646-A650 PolarHBondContact O-N 3.38Å; Y647-A650 PolarHBondContact O-N 2.81Å
651F87.2Confident87.3Confident9 Ų957.7 Ų57.74%0.03930%0.295CS..  trans-110.668.6-176.9-54.4-44.6000111L572 C575 I576 L605 V608 L612 Y647 D653 C656 L660L572-F651 HydrophobicContact CD2-CZ 4.48Å; C575-F651 HydrophobicContact CB-CE1 4.35Å; C575-F651 HydrophobicContact CB-CZ 4.38Å; I576-F651 HydrophobicContact CD1-CE1 4.29Å; I576-F651 HydrophobicContact CD1-CE2 3.68Å; I576-F651 HydrophobicContact CD1-CZ 3.54Å; I576-F651 HydrophobicContact CG1-CE1 3.93Å; I576-F651 HydrophobicContact CG1-CE2 4.22Å; I576-F651 HydrophobicContact CG1-CZ 3.55Å; L605-F651 HydrophobicContact CD2-CD1 4.44Å; V608-F651 HydrophobicContact CG1-CD1 3.8Å; V608-F651 HydrophobicContact CG1-CD2 4.25Å; V608-F651 HydrophobicContact CG1-CE1 3.6Å; V608-F651 HydrophobicContact CG1-CE2 4.06Å; V608-F651 HydrophobicContact CG1-CG 4.12Å; V608-F651 HydrophobicContact CG1-CZ 3.72Å; L612-F651 HydrophobicContact CD1-CD2 4.2Å; Y647-F651 AromaticContact CD1-CE2 3.97Å; Y647-F651 HydrophobicContact CD1-CE2 3.97Å; Y647-F651 HydrophobicContact CD2-CE2 4.34Å; Y647-F651 HydrophobicContact CE1-CE2 4.32Å; Y647-F651 HydrophobicContact CG-CD2 4.2Å; Y647-F651 AromaticContact CG-CE2 3.96Å; Y647-F651 HydrophobicContact CG-CE2 3.96Å; Y647-F651 WeakPolarHBondContact O-CB 3.26Å; Y647-F651 PolarHBondContact O-N 2.7Å; F651-D653 PolarHBondContact O-N 3.36Å; F651-C656 HydrophobicContact CB-CB 3.82Å; F651-L660 HydrophobicContact CB-CD1 4.29Å
652E77.6Confident87.4Confident163 Ų16358.4 Ų58.476%0.76229%0.294SS*.  trans-74.5-7.5-178-60.3-172.8161.600114E654E652-E654 PolarHBondContact O-N 3.18Å
653D80.5Confident87.6Confident35 Ų3552.1 Ų52.119%0.18726%0.261CS..SBendtrans-58.1132.7175.9-168.1-61.1000110.8L605 F651 R655 C656 T657L605-D653 HydrophobicContact CD1-CB 4.31Å; F651-D653 PolarHBondContact O-N 3.36Å; D653-R655 PolarHBondContact O-N 3.39Å; D653-R655 VanDerWaalsContact O-N 3.12Å; D653-R655 WeakPolarHBondContact OD1-CB 3.2Å; D653-R655 VanDerWaalsContact OD1-CG 3.29Å; D653-R655 WeakPolarHBondContact OD1-CG 3.42Å; D653-R655 IonicContact OD1-CZ 3.22Å; D653-R655 PolarHBondContact OD1-N 2.75Å; D653-R655 IonicContact OD1-NE 3.46Å; D653-R655 PolarHBondContact OD1-NE 2.59Å; D653-R655 IonicContact OD1-NH2 3.62Å; D653-R655 IonicContact OD2-CZ 2.93Å; D653-R655 IonicContact OD2-NE 4Å; D653-R655 PolarHBondContact OD2-NE 3.08Å; D653-R655 IonicContact OD2-NH2 2.65Å; D653-R655 PolarHBondContact OD2-NH2 2.74Å; D653-C656 WeakPolarHBondContact O-CB 3.36Å; D653-C656 PolarHBondContact O-N 2.84Å; D653-T657 PolarHBondContact O-N 2.97Å
654E81.3Confident87.7Confident168 Ų16851.4 Ų51.479%0.78526%0.257SS*.Hα-helixtrans-54.8-34.2180-169.3177.8-176.200111.9E652 C656 T657E652-E654 PolarHBondContact O-N 3.18Å; E654-C656 VanDerWaalsContact C-N 3.27Å; E654-C656 PolarHBondContact O-N 3.32Å; E654-T657 WeakPolarHBondContact O-CB 3.44Å; E654-T657 PolarHBondContact O-N 3.37Å
655R84.9Confident87.7Confident134 Ų13452 Ų5251%0.50626%0.261SS..Hα-helixtrans-68.2-23.2177.2-58172.9-72.3-179-2.2113S609 D653 P659S609-R655 PolarHBondContact OG-O 2.8Å; D653-R655 PolarHBondContact O-N 3.39Å; D653-R655 VanDerWaalsContact O-N 3.12Å; D653-R655 WeakPolarHBondContact OD1-CB 3.2Å; D653-R655 VanDerWaalsContact OD1-CG 3.29Å; D653-R655 WeakPolarHBondContact OD1-CG 3.42Å; D653-R655 IonicContact OD1-CZ 3.22Å; D653-R655 PolarHBondContact OD1-N 2.75Å; D653-R655 IonicContact OD1-NE 3.46Å; D653-R655 PolarHBondContact OD1-NE 2.59Å; D653-R655 IonicContact OD1-NH2 3.62Å; D653-R655 IonicContact OD2-CZ 2.93Å; D653-R655 IonicContact OD2-NE 4Å; D653-R655 PolarHBondContact OD2-NE 3.08Å; D653-R655 IonicContact OD2-NH2 2.65Å; D653-R655 PolarHBondContact OD2-NH2 2.74Å; R655-P659 WeakPolarHBondContact O-CD 3.38Å
656C87.8Confident87.8Confident0 Ų051.1 Ų51.10%025%0.252CS..Hα-helixtrans-84.9-25.6175.5-66.70000112.2L612 F651 D653 E654 V658 P659 L660L612-C656 HydrophobicContact CD1-CB 4.16Å; F651-C656 HydrophobicContact CB-CB 3.82Å; D653-C656 WeakPolarHBondContact O-CB 3.36Å; D653-C656 PolarHBondContact O-N 2.84Å; E654-C656 VanDerWaalsContact C-N 3.27Å; E654-C656 PolarHBondContact O-N 3.32Å; C656-V658 PolarHBondContact O-N 2.76Å; C656-P659 WeakPolarHBondContact O-CD 3.47Å; C656-L660 HydrophobicContact CB-CD1 4.37Å; C656-L660 WeakPolarHBondContact O-CB 3.3Å; C656-L660 WeakPolarHBondContact O-CG 3.42Å; C656-L660 PolarHBondContact O-N 3.28Å
657T88.5Confident88Confident50 Ų5045.5 Ų45.531%0.30723%0.227SC..Hα-helixtrans-59.3-47.2-175.1-63.90000112.2D653 E654 L660 I661D653-T657 PolarHBondContact O-N 2.97Å; E654-T657 WeakPolarHBondContact O-CB 3.44Å; E654-T657 PolarHBondContact O-N 3.37Å; T657-L660 PolarHBondContact O-N 3.28Å; T657-I661 HydrophobicContact CG2-CD1 3.87Å; T657-I661 VanDerWaalsContact O-CG1 3.31Å; T657-I661 WeakPolarHBondContact O-CG1 3.32Å; T657-I661 PolarHBondContact O-N 3.12Å
658V88.9Confident87.9Confident63 Ų6348.4 Ų48.438%0.38225%0.247SC..Hα-helixtrans-64.5-53.1-178.71710000112.1C656 L660 I661 Q662 Q697C656-V658 PolarHBondContact O-N 2.76Å; V658-L660 VanDerWaalsContact C-N 3.25Å; V658-L660 PolarHBondContact O-N 3.15Å; V658-I661 PolarHBondContact O-N 3.44Å; V658-Q662 HydrophobicContact CG1-CG 4.48Å; V658-Q662 WeakPolarHBondContact O-CG 3.46Å; V658-Q662 PolarHBondContact O-N 3.14Å; V658-Q697 HydrophobicContact CG1-CG 4.02Å; V658-Q697 HydrophobicContact CG2-CG 4.32Å
659P91.5Very high88Confident8 Ų847.6 Ų47.65%0.05225%0.247CC..Hα-helixtrans-55.2-36.5173.5-28.134.9000113.9L612 E613 R655 C656 Q662 L663L612-P659 HydrophobicContact CB-CB 3.64Å; E613-P659 HydrophobicContact CB-CG 4.27Å; R655-P659 WeakPolarHBondContact O-CD 3.38Å; C656-P659 WeakPolarHBondContact O-CD 3.47Å; P659-Q662 PolarHBondContact O-N 3.41Å; P659-L663 VanDerWaalsContact O-CB 3.26Å; P659-L663 WeakPolarHBondContact O-CB 3.4Å; P659-L663 PolarHBondContact O-N 3.16Å
660L92.4Very high88Confident1 Ų145 Ų451%0.00525%0.249CC..Hα-helixtrans-67.4-41.5177.5-72172.5000112.8L612 M644 Y647 F648 F651 C656 T657 V658 Q662 L663 A664L612-L660 HydrophobicContact CD1-CD2 3.95Å; L612-L660 HydrophobicContact CD1-CG 4.04Å; L612-L660 HydrophobicContact CD2-CD2 3.86Å; M644-L660 HydrophobicContact CE-CD2 4.44Å; Y647-L660 HydrophobicContact CD2-CD2 3.93Å; Y647-L660 HydrophobicContact CG-CD2 4.31Å; F648-L660 HydrophobicContact CD1-CB 4.15Å; F648-L660 HydrophobicContact CD1-CD1 4.01Å; F648-L660 HydrophobicContact CE1-CB 3.58Å; F648-L660 HydrophobicContact CE1-CD1 4.3Å; F648-L660 HydrophobicContact CZ-CB 3.83Å; F651-L660 HydrophobicContact CB-CD1 4.29Å; C656-L660 HydrophobicContact CB-CD1 4.37Å; C656-L660 WeakPolarHBondContact O-CB 3.3Å; C656-L660 WeakPolarHBondContact O-CG 3.42Å; C656-L660 PolarHBondContact O-N 3.28Å; T657-L660 PolarHBondContact O-N 3.28Å; V658-L660 VanDerWaalsContact C-N 3.25Å; V658-L660 PolarHBondContact O-N 3.15Å; L660-Q662 VanDerWaalsContact C-N 3.34Å; L660-L663 PolarHBondContact O-N 3.37Å; L660-A664 WeakPolarHBondContact O-CB 3.27Å; L660-A664 PolarHBondContact O-N 3.01Å
661I91.7Very high88.2Confident11 Ų1143.8 Ų43.86%0.05624%0.239CC..Hα-helixtrans-64-41.8174.4-64.8168.7000110.3F648 T657 V658 A664 S665 F675 Q697 L698 C701F648-I661 HydrophobicContact CE1-CG1 4.33Å; F648-I661 HydrophobicContact CZ-CG1 4.48Å; T657-I661 HydrophobicContact CG2-CD1 3.87Å; T657-I661 VanDerWaalsContact O-CG1 3.31Å; T657-I661 WeakPolarHBondContact O-CG1 3.32Å; T657-I661 PolarHBondContact O-N 3.12Å; V658-I661 PolarHBondContact O-N 3.44Å; I661-A664 WeakPolarHBondContact O-CB 3.18Å; I661-A664 PolarHBondContact O-N 2.94Å; I661-S665 PolarHBondContact O-N 3.06Å; I661-F675 HydrophobicContact CB-CZ 4.36Å; I661-F675 HydrophobicContact CD1-CZ 4.47Å; I661-F675 HydrophobicContact CG1-CE2 4.16Å; I661-F675 HydrophobicContact CG1-CZ 3.78Å; I661-F675 HydrophobicContact CG2-CE1 4.42Å; I661-F675 HydrophobicContact CG2-CZ 4.02Å; I661-Q697 HydrophobicContact CB-CB 4.45Å; I661-Q697 HydrophobicContact CD1-CB 4.44Å; I661-Q697 HydrophobicContact CG2-CB 3.88Å; I661-Q697 WeakPolarHBondContact CG2-O 3.45Å; I661-L698 HydrophobicContact CD1-CD2 4.17Å; I661-L698 HydrophobicContact CG2-CD2 4.48Å; I661-C701 HydrophobicContact CG2-CB 4.23Å
662Q90.8Very high88.1Confident28 Ų2843.6 Ų43.613%0.13124%0.239CC..Hα-helixtrans-68.2-34177-68.2179.4-900112.9V616 V658 P659 L660 S665 C666V616-Q662 HydrophobicContact CG1-CB 3.86Å; V616-Q662 HydrophobicContact CG2-CB 4.02Å; V658-Q662 HydrophobicContact CG1-CG 4.48Å; V658-Q662 WeakPolarHBondContact O-CG 3.46Å; V658-Q662 PolarHBondContact O-N 3.14Å; P659-Q662 PolarHBondContact O-N 3.41Å; L660-Q662 VanDerWaalsContact C-N 3.34Å; Q662-S665 PolarHBondContact O-N 2.97Å; Q662-S665 PolarHBondContact O-OG 3.32Å; Q662-C666 PolarHBondContact O-N 3.38Å; Q662-C666 PolarHBondContact O-SG 3.47Å
663L92.4Very high88.4Confident0 Ų038.5 Ų38.50%022%0.22CC..Hα-helixtrans-67.4-43.3173.3-176.857.6000110.4L612 V615 V616 F640 M644 P659 L660 S665 C666 M667L612-L663 HydrophobicContact CD2-CD2 4.3Å; V615-L663 HydrophobicContact CG1-CD1 3.77Å; V616-L663 HydrophobicContact CG2-CB 3.86Å; V616-L663 HydrophobicContact CG2-CD1 4.4Å; F640-L663 HydrophobicContact CD1-CD1 4.32Å; F640-L663 HydrophobicContact CD1-CD2 3.82Å; F640-L663 HydrophobicContact CD1-CG 4.42Å; F640-L663 HydrophobicContact CE1-CD1 4.49Å; F640-L663 HydrophobicContact CE1-CD2 4.01Å; M644-L663 HydrophobicContact SD-CD2 3.98Å; M644-L663 HydrophobicContact SD-CG 4.12Å; P659-L663 VanDerWaalsContact O-CB 3.26Å; P659-L663 WeakPolarHBondContact O-CB 3.4Å; P659-L663 PolarHBondContact O-N 3.16Å; L660-L663 PolarHBondContact O-N 3.37Å; L663-S665 VanDerWaalsContact C-N 3.27Å; L663-S665 PolarHBondContact O-N 3.36Å; L663-C666 WeakPolarHBondContact O-CB 3.47Å; L663-C666 PolarHBondContact O-N 2.91Å; L663-C666 VanDerWaalsContact O-N 3.1Å; L663-M667 HydrophobicContact CG-CE 4.43Å
664A91.9Very high88.5Confident1 Ų141.8 Ų41.81%0.00824%0.242CC..Hα-helixtrans-59.5-37.4173.400000112.1M644 L660 I661 C666 M667 F675 W705M644-A664 HydrophobicContact CE-CB 4.03Å; L660-A664 WeakPolarHBondContact O-CB 3.27Å; L660-A664 PolarHBondContact O-N 3.01Å; I661-A664 WeakPolarHBondContact O-CB 3.18Å; I661-A664 PolarHBondContact O-N 2.94Å; A664-C666 PolarHBondContact O-N 3.4Å; A664-M667 PolarHBondContact O-N 3.39Å; A664-M667 VanDerWaalsContact O-N 3.15Å; A664-M667 VanDerWaalsContact O-O 3.12Å; A664-F675 HydrophobicContact CB-CD1 4.12Å; A664-F675 HydrophobicContact CB-CE1 4.17Å; A664-W705 HydrophobicContact CB-CZ2 4.48Å; A664-W705 PolarHBondContact O-NE1 3.43Å
665S90.8Very high88.8Confident13 Ų1335.3 Ų35.39%0.09121%0.211CC..Hα-helixtrans-68.2-17.9177.984.60000113.6I661 Q662 L663 S704I661-S665 PolarHBondContact O-N 3.06Å; Q662-S665 PolarHBondContact O-N 2.97Å; Q662-S665 PolarHBondContact O-OG 3.32Å; L663-S665 VanDerWaalsContact C-N 3.27Å; L663-S665 PolarHBondContact O-N 3.36Å; S665-S704 WeakPolarHBondContact O-CB 3.44Å
666C89.9Confident88.9Confident22 Ų2229.8 Ų29.815%0.14919%0.193CC..THydrogen-bonded Turntrans-79.7-6175.8-63.30000112.8W619 Q662 L663 A664W619-C666 HydrophobicContact CD2-CB 4.27Å; W619-C666 HydrophobicContact CG-CB 4.09Å; Q662-C666 PolarHBondContact O-N 3.38Å; Q662-C666 PolarHBondContact O-SG 3.47Å; L663-C666 WeakPolarHBondContact O-CB 3.47Å; L663-C666 PolarHBondContact O-N 2.91Å; L663-C666 VanDerWaalsContact O-N 3.1Å; A664-C666 PolarHBondContact O-N 3.4Å
667M90.6Very high88.8Confident7 Ų740 Ų403%0.03423%0.231CC..SBendtrans-124.1158.9-176.1-61.9-177.5-76.800111.2W619 V637 F640 M644 L663 A664 A671 W705W619-M667 HydrophobicContact CH2-CG 4.34Å; W619-M667 HydrophobicContact CZ2-CG 4.36Å; V637-M667 HydrophobicContact CG1-CB 4.3Å; V637-M667 HydrophobicContact CG1-CG 4.3Å; V637-M667 HydrophobicContact CG1-SD 4.43Å; V637-M667 HydrophobicContact CG2-CG 4.2Å; F640-M667 HydrophobicContact CB-CE 4.07Å; F640-M667 HydrophobicContact CB-SD 3.61Å; M644-M667 HydrophobicContact CG-CE 3.59Å; M644-M667 HydrophobicContact SD-CE 3.67Å; L663-M667 HydrophobicContact CG-CE 4.43Å; A664-M667 PolarHBondContact O-N 3.39Å; A664-M667 VanDerWaalsContact O-N 3.15Å; A664-M667 VanDerWaalsContact O-O 3.12Å; M667-A671 HydrophobicContact CB-CB 4.05Å; M667-A671 HydrophobicContact SD-CB 4.36Å; M667-W705 VanDerWaalsContact O-CD1 3.23Å; M667-W705 PolarHBondContact O-NE1 3.05Å
668P89.1Confident88.6Confident62 Ų6239.2 Ų39.240%0.40323%0.234SC..  trans-60.3150.6171.7-21.633.3000112.2A670 A671P668-A670 PolarHBondContact O-N 3.26Å; P668-A671 WeakPolarHBondContact O-CB 3.31Å; P668-A671 PolarHBondContact O-N 3.31Å
669P88.4Confident88.7Confident38 Ų3836.3 Ų36.325%0.24722%0.216CC..G310 helixtrans-60.5-24.9-177.423.4-33.4000113.4A671 A672 S676 W705P669-A671 PolarHBondContact O-N 3.02Å; P669-A672 CarbonylContact O-C 3.54Å; P669-A672 PolarHBondContact O-N 2.96Å; P669-S676 WeakPolarHBondContact O-CB 3.41Å; P669-S676 PolarHBondContact O-OG 3.32Å; P669-W705 HydrophobicContact CB-CB 4.48Å; P669-W705 HydrophobicContact CB-CD2 3.84Å; P669-W705 HydrophobicContact CB-CE3 4.16Å; P669-W705 HydrophobicContact CB-CG 4.01Å; P669-W705 HydrophobicContact CG-CB 4.23Å; P669-W705 HydrophobicContact CG-CG 4.16Å
670A88.1Confident88.4Confident86 Ų8638.2 Ų38.271%0.71123%0.226SC*.G310 helixtrans-66-21.5175.300000113.9P668 A672P668-A670 PolarHBondContact O-N 3.26Å; A670-A672 VanDerWaalsContact C-N 3.34Å
671A87.4Confident88.2Confident20 Ų2040.5 Ų40.517%0.16524%0.242CC..G310 helixtrans-78.7-16.4179.200000113.3V637 G641 M667 P668 P669V637-A671 HydrophobicContact CG1-CB 4.06Å; G641-A671 VanDerWaalsContact CA-O 3.26Å; G641-A671 WeakPolarHBondContact CA-O 3.46Å; M667-A671 HydrophobicContact CB-CB 4.05Å; M667-A671 HydrophobicContact SD-CB 4.36Å; P668-A671 WeakPolarHBondContact O-CB 3.31Å; P668-A671 PolarHBondContact O-N 3.31Å; P669-A671 PolarHBondContact O-N 3.02Å
672A85.1Confident88.1Confident5 Ų546.4 Ų46.44%0.04126%0.263CS..SBendtrans-136.961.9177.900000111.2M644 P669 A670 T674 F675 S676M644-A672 HydrophobicContact CB-CB 4.25Å; M644-A672 HydrophobicContact CG-CB 4.41Å; P669-A672 CarbonylContact O-C 3.54Å; P669-A672 PolarHBondContact O-N 2.96Å; A670-A672 VanDerWaalsContact C-N 3.34Å; A672-T674 VanDerWaalsContact C-N 3.33Å; A672-T674 PolarHBondContact O-N 3.2Å; A672-F675 PolarHBondContact O-N 2.92Å; A672-S676 WeakPolarHBondContact O-CB 3.15Å; A672-S676 PolarHBondContact O-N 2.95Å; A672-S676 PolarHBondContact O-OG 3Å; A672-S676 VanDerWaalsContact O-OG 3.13Å
673P83.4Confident88.1Confident56 Ų5645.1 Ų45.136%0.36426%0.257SS..Hα-helixtrans-66.3-29.5-166.526.8-35.1000114.3S676 R677P673-S676 WeakPolarHBondContact CA-OG 3.38Å; P673-R677 WeakPolarHBondContact O-CB 3.42Å; P673-R677 WeakPolarHBondContact O-CD 3.38Å; P673-R677 VanDerWaalsContact O-CG 3.25Å; P673-R677 WeakPolarHBondContact O-CG 3.4Å; P673-R677 PolarHBondContact O-N 3.02Å
674T83.8Confident88Confident105 Ų10551.2 Ų51.264%0.64428%0.28SS*.Hα-helixtrans-67.3-38.2177.148.30000111.9A672A672-T674 VanDerWaalsContact C-N 3.33Å; A672-T674 PolarHBondContact O-N 3.2Å
675F87.1Confident87.8Confident31 Ų3159.6 Ų59.614%0.13631%0.312CS..Hα-helixtrans-79.9-52.3176.7175.8-110.2000111.2F648 I661 A664 A672 R677 G678 V679 L698 W705F648-F675 HydrophobicContact CE1-CD2 4.43Å; F648-F675 HydrophobicContact CE2-CB 4.12Å; F648-F675 HydrophobicContact CE2-CD1 4.43Å; F648-F675 HydrophobicContact CE2-CD2 4.41Å; F648-F675 HydrophobicContact CE2-CG 4.07Å; F648-F675 HydrophobicContact CZ-CD1 4.31Å; F648-F675 HydrophobicContact CZ-CD2 4.06Å; F648-F675 HydrophobicContact CZ-CE2 4.34Å; F648-F675 HydrophobicContact CZ-CG 4.06Å; I661-F675 HydrophobicContact CB-CZ 4.36Å; I661-F675 HydrophobicContact CD1-CZ 4.47Å; I661-F675 HydrophobicContact CG1-CE2 4.16Å; I661-F675 HydrophobicContact CG1-CZ 3.78Å; I661-F675 HydrophobicContact CG2-CE1 4.42Å; I661-F675 HydrophobicContact CG2-CZ 4.02Å; A664-F675 HydrophobicContact CB-CD1 4.12Å; A664-F675 HydrophobicContact CB-CE1 4.17Å; A672-F675 PolarHBondContact O-N 2.92Å; F675-R677 PolarHBondContact O-N 3.4Å; F675-G678 PolarHBondContact O-N 2.64Å; F675-V679 HydrophobicContact CD1-CG2 4.11Å; F675-V679 HydrophobicContact CD2-CG2 4.37Å; F675-V679 HydrophobicContact CE1-CG2 3.72Å; F675-V679 HydrophobicContact CE2-CG2 4.01Å; F675-V679 HydrophobicContact CG-CG2 4.41Å; F675-V679 HydrophobicContact CZ-CG2 3.65Å; F675-V679 WeakPolarHBondContact O-CG2 3.29Å; F675-V679 PolarHBondContact O-N 3.38Å; F675-L698 HydrophobicContact CE2-CD2 4.24Å; F675-L698 HydrophobicContact CZ-CD2 3.87Å; F675-W705 AromaticContact CD1-CH2 3.79Å; F675-W705 HydrophobicContact CD1-CH2 3.79Å; F675-W705 HydrophobicContact CD1-CZ2 4.3Å; F675-W705 AromaticContact CE1-CH2 3.76Å; F675-W705 HydrophobicContact CE1-CH2 3.76Å; F675-W705 HydrophobicContact CE1-CZ2 4.32Å
676S86.8Confident87.8Confident18 Ų1859.9 Ų59.913%0.12631%0.312CS..Hα-helixtrans-60.5-39.1-170.962.20000113.9P669 A672 P673 G678 V679 W705P669-S676 WeakPolarHBondContact O-CB 3.41Å; P669-S676 PolarHBondContact O-OG 3.32Å; A672-S676 WeakPolarHBondContact O-CB 3.15Å; A672-S676 PolarHBondContact O-N 2.95Å; A672-S676 PolarHBondContact O-OG 3Å; A672-S676 VanDerWaalsContact O-OG 3.13Å; P673-S676 WeakPolarHBondContact CA-OG 3.38Å; S676-G678 PolarHBondContact O-N 2.76Å; S676-V679 PolarHBondContact O-N 3.42Å; S676-W705 VanDerWaalsContact CB-CH2 3.46Å
677R85.8Confident87.7Confident214 Ų21466.2 Ų66.281%0.80834%0.339SS*.Hα-helixtrans-64.5-25.7176.7-68.6176.2-177.9-178.61.1113.5P673 F675P673-R677 WeakPolarHBondContact O-CB 3.42Å; P673-R677 WeakPolarHBondContact O-CD 3.38Å; P673-R677 VanDerWaalsContact O-CG 3.25Å; P673-R677 WeakPolarHBondContact O-CG 3.4Å; P673-R677 PolarHBondContact O-N 3.02Å; F675-R677 PolarHBondContact O-N 3.4Å
678G85.6Confident87.2Confident35 Ų3568.9 Ų68.936%0.36136%0.359SS..Hα-helixtrans-89.4-18-178.300000114.7F675 S676 S681 R682F675-G678 PolarHBondContact O-N 2.64Å; S676-G678 PolarHBondContact O-N 2.76Å; G678-S681 PolarHBondContact O-N 3.18Å; G678-R682 WeakPolarHBondContact O-CB 3.48Å; G678-R682 PolarHBondContact O-N 3.06Å
679V89.5Confident86.7Confident2 Ų269.7 Ų69.71%0.01238%0.378CS..Hα-helixtrans-63.8-51-169.9-179.90000112.6F675 S676 S681 R682 L683 L698 V702 W705F675-V679 HydrophobicContact CD1-CG2 4.11Å; F675-V679 HydrophobicContact CD2-CG2 4.37Å; F675-V679 HydrophobicContact CE1-CG2 3.72Å; F675-V679 HydrophobicContact CE2-CG2 4.01Å; F675-V679 HydrophobicContact CG-CG2 4.41Å; F675-V679 HydrophobicContact CZ-CG2 3.65Å; F675-V679 WeakPolarHBondContact O-CG2 3.29Å; F675-V679 PolarHBondContact O-N 3.38Å; S676-V679 PolarHBondContact O-N 3.42Å; V679-S681 VanDerWaalsContact C-N 3.31Å; V679-S681 PolarHBondContact O-N 3.21Å; V679-R682 WeakPolarHBondContact O-CB 3.37Å; V679-R682 PolarHBondContact O-N 3.33Å; V679-R682 VanDerWaalsContact O-N 3.12Å; V679-L683 HydrophobicContact CG1-CD1 4.23Å; V679-L683 WeakPolarHBondContact O-CG 3.36Å; V679-L683 PolarHBondContact O-N 3.34Å; V679-L698 HydrophobicContact CG1-CB 3.9Å; V679-L698 HydrophobicContact CG1-CD2 4.07Å; V679-L698 HydrophobicContact CG1-CG 4.4Å; V679-V702 HydrophobicContact CB-CG2 4.31Å; V679-V702 HydrophobicContact CG1-CG2 3.48Å; V679-V702 VanDerWaalsContact CG1-CG2 3.48Å; V679-W705 HydrophobicContact CB-CZ3 4.35Å; V679-W705 HydrophobicContact CG2-CH2 4.05Å; V679-W705 HydrophobicContact CG2-CZ3 3.93Å
680L86.7Confident86.7Confident48 Ų4868.8 Ų68.825%0.25137%0.373SS..Hα-helixtrans-62.9-38.2178.2-75.3173.7000111.9R682 L683 R684 V702 D710 V711L680-R682 VanDerWaalsContact C-N 3.32Å; L680-R682 PolarHBondContact O-N 3.03Å; L680-L683 HydrophobicContact CD2-CD1 4.44Å; L680-L683 PolarHBondContact O-N 3.27Å; L680-R684 WeakPolarHBondContact O-CB 3.47Å; L680-R684 PolarHBondContact O-N 3.4Å; L680-V702 HydrophobicContact CD2-CG1 4.18Å; L680-V702 HydrophobicContact CD2-CG2 4.45Å; L680-D710 HydrophobicContact CD1-CB 3.79Å; L680-D710 HydrophobicContact CD2-CB 4.04Å; L680-V711 HydrophobicContact CD2-CG2 4.2Å
681S88.2Confident86.6Confident49 Ų4967 Ų6734%0.34336%0.358SS..Hα-helixtrans-64.6-37.5174.6-177.10000111.8G678 V679 R684 R685G678-S681 PolarHBondContact O-N 3.18Å; V679-S681 VanDerWaalsContact C-N 3.31Å; V679-S681 PolarHBondContact O-N 3.21Å; S681-R684 PolarHBondContact O-N 3.31Å; S681-R685 WeakPolarHBondContact O-CB 3.5Å; S681-R685 WeakPolarHBondContact O-CG 3.33Å; S681-R685 PolarHBondContact O-N 3.41Å; S681-R685 VanDerWaalsContact O-N 3.11Å
682R89.6Confident86.5Confident135 Ų13570 Ų7051%0.50938%0.376SS..Hα-helixtrans-66.2-45.8176.6-174174.1174.4-178.6-0.9110.7G678 V679 L680 R684 R685 M686 L698G678-R682 WeakPolarHBondContact O-CB 3.48Å; G678-R682 PolarHBondContact O-N 3.06Å; V679-R682 WeakPolarHBondContact O-CB 3.37Å; V679-R682 PolarHBondContact O-N 3.33Å; V679-R682 VanDerWaalsContact O-N 3.12Å; L680-R682 VanDerWaalsContact C-N 3.32Å; L680-R682 PolarHBondContact O-N 3.03Å; R682-R684 PolarHBondContact O-N 2.66Å; R682-R685 PolarHBondContact O-N 2.87Å; R682-M686 HydrophobicContact CG-CE 4.3Å; R682-M686 WeakPolarHBondContact O-CG 3.47Å; R682-M686 PolarHBondContact O-N 3.12Å; R682-L698 HydrophobicContact CG-CD1 4.1Å
683L90.7Very high86.4Confident0 Ų073.7 Ų73.70%041%0.406CS..Hα-helixtrans-58.1-45.6174.4-70.5169.5000111.6V679 L680 R685 M686 F695 L698 L699 V702 Y752V679-L683 HydrophobicContact CG1-CD1 4.23Å; V679-L683 WeakPolarHBondContact O-CG 3.36Å; V679-L683 PolarHBondContact O-N 3.34Å; L680-L683 HydrophobicContact CD2-CD1 4.44Å; L680-L683 PolarHBondContact O-N 3.27Å; L683-R685 VanDerWaalsContact C-N 3.35Å; L683-R685 PolarHBondContact O-N 3.34Å; L683-M686 HydrophobicContact CD2-CE 4.15Å; L683-M686 HydrophobicContact CD2-SD 4.23Å; L683-M686 PolarHBondContact O-N 2.84Å; L683-F695 HydrophobicContact CD2-CB 3.97Å; L683-L698 HydrophobicContact CD2-CB 3.96Å; L683-L698 HydrophobicContact CD2-CD1 4.22Å; L683-L698 HydrophobicContact CG-CB 4.32Å; L683-L698 HydrophobicContact CG-CD1 4.47Å; L683-L699 HydrophobicContact CD1-CD2 3.92Å; L683-L699 HydrophobicContact CD2-CD2 4.01Å; L683-L699 HydrophobicContact CD2-CG 4.38Å; L683-V702 HydrophobicContact CD1-CG2 4.16Å; L683-Y752 HydrophobicContact CB-CE2 4.19Å; L683-Y752 HydrophobicContact CD2-CE2 4.08Å; L683-Y752 WeakPolarHBondContact CD2-OH 3.46Å; L683-Y752 PolarHBondContact O-OH 3.4Å; L683-Y752 VanDerWaalsContact O-OH 3.09Å
684R89.9Confident86.4Confident129 Ų12976.1 Ų76.149%0.48741%0.413SS..Hα-helixtrans-62.9-36.1178.5-173.9178.1-69.7167.9-2.3113.6L680 S681 R682 L714 W718 K745L680-R684 WeakPolarHBondContact O-CB 3.47Å; L680-R684 PolarHBondContact O-N 3.4Å; S681-R684 PolarHBondContact O-N 3.31Å; R682-R684 PolarHBondContact O-N 2.66Å; R684-L714 HydrophobicContact CB-CD1 4.42Å; R684-L714 HydrophobicContact CB-CD2 4.39Å; R684-L714 HydrophobicContact CG-CD1 4.1Å; R684-W718 HydrophobicContact CG-CZ2 4.32Å; R684-K745 PolarHBondContact O-NZ 3.34Å; R684-K745 VanDerWaalsContact O-NZ 3.08Å
685R88.5Confident86.7Confident176 Ų17671.3 Ų71.366%0.66438%0.383SS*.Hα-helixtrans-83.5-7.2-177.9-70.6-180-173.3-1790.8114.4S681 R682 L683S681-R685 WeakPolarHBondContact O-CB 3.5Å; S681-R685 WeakPolarHBondContact O-CG 3.33Å; S681-R685 PolarHBondContact O-N 3.41Å; S681-R685 VanDerWaalsContact O-N 3.11Å; R682-R685 PolarHBondContact O-N 2.87Å; L683-R685 VanDerWaalsContact C-N 3.35Å; L683-R685 PolarHBondContact O-N 3.34Å
686M89.9Confident86.9Confident19 Ų1970.4 Ų70.49%0.09438%0.381CS..SBendtrans-61.4148.1178.7-79.6179.5-174.900112.9R682 L683 Q694 F695 L698 K745 L748 Y752R682-M686 HydrophobicContact CG-CE 4.3Å; R682-M686 WeakPolarHBondContact O-CG 3.47Å; R682-M686 PolarHBondContact O-N 3.12Å; L683-M686 HydrophobicContact CD2-CE 4.15Å; L683-M686 HydrophobicContact CD2-SD 4.23Å; L683-M686 PolarHBondContact O-N 2.84Å; M686-Q694 WeakPolarHBondContact CE-O 3.32Å; M686-F695 HydrophobicContact CE-CB 3.95Å; M686-F695 HydrophobicContact SD-CB 3.66Å; M686-L698 HydrophobicContact CE-CD1 3.63Å; M686-K745 PolarHBondContact O-NZ 3.22Å; M686-L748 HydrophobicContact CB-CD2 3.9Å; M686-Y752 PolarHBondContact SD-OH 3.32Å
687E87.4Confident87.1Confident155 Ų15571.2 Ų71.272%0.72438%0.382SS*.  trans-76.9150.6177.8-63.8178.8-179.700111.1G689 S690E687-G689 PolarHBondContact O-N 3.27Å; E687-G689 VanDerWaalsContact O-N 3.08Å; E687-S690 PolarHBondContact N-OG 2.96Å; E687-S690 WeakPolarHBondContact O-CB 3.4Å; E687-S690 PolarHBondContact O-N 3.02Å; E687-S690 PolarHBondContact O-OG 3.33Å
688S79.9Confident87.3Confident63 Ų6361.1 Ų61.144%0.44135%0.345SS..THydrogen-bonded Turntrans-61.7-20.3-174.5-57.60000114.6
689G79.1Confident87.6Confident79 Ų7959.5 Ų59.581%0.81433%0.328SS*.THydrogen-bonded Turntrans-98.113.6176.500000115.5E687 A691E687-G689 PolarHBondContact O-N 3.27Å; E687-G689 VanDerWaalsContact O-N 3.08Å; G689-A691 PolarHBondContact O-N 2.61Å
690S87.4Confident87.7Confident19 Ų1960.4 Ų60.413%0.13333%0.332CS..  trans-60.8134.3-176.5-61.50000112.4E687 Q694E687-S690 PolarHBondContact N-OG 2.96Å; E687-S690 WeakPolarHBondContact O-CB 3.4Å; E687-S690 PolarHBondContact O-N 3.02Å; E687-S690 PolarHBondContact O-OG 3.33Å; S690-Q694 VanDerWaalsContact CB-OE1 3.3Å
691A86.5Confident87.8Confident49 Ų4958.1 Ų58.141%0.40532%0.32SS..  trans-72.2149.8-179.700000112.3G689 A693 Q694 F695G689-A691 PolarHBondContact O-N 2.61Å; A691-A693 PolarHBondContact O-N 2.86Å; A691-Q694 WeakPolarHBondContact O-CB 3.3Å; A691-Q694 PolarHBondContact O-N 3.18Å; A691-F695 WeakPolarHBondContact O-CD1 3.43Å
692P86.1Confident87.9Confident82 Ų8255.8 Ų55.853%0.53230%0.304SS..Hα-helixtrans-52.9-32.4179.7-2935.6000115.4Q694 F695 S696P692-Q694 PolarHBondContact O-N 3.05Å; P692-F695 VanDerWaalsContact CA-CE1 3.5Å; P692-F695 HydrophobicContact CB-CE1 4.44Å; P692-F695 HydrophobicContact CB-CZ 4.1Å; P692-F695 HydrophobicContact CG-CZ 4.27Å; P692-F695 PolarHBondContact O-N 3.23Å; P692-S696 WeakPolarHBondContact O-CB 3.32Å; P692-S696 PolarHBondContact O-N 3.09Å; P692-S696 PolarHBondContact O-OG 3.23Å
693A82.7Confident88Confident83 Ų8349.5 Ų49.569%0.68628%0.281SS*.Hα-helixtrans-59.3-27.7176.800000113.2A691A691-A693 PolarHBondContact O-N 2.86Å
694Q84.3Confident87.9Confident108 Ų10851.5 Ų51.551%0.50530%0.295SS..Hα-helixtrans-80.8-29-175.8-62.7177.1-14.100113.3M686 S690 A691 P692M686-Q694 WeakPolarHBondContact CE-O 3.32Å; S690-Q694 VanDerWaalsContact CB-OE1 3.3Å; A691-Q694 WeakPolarHBondContact O-CB 3.3Å; A691-Q694 PolarHBondContact O-N 3.18Å; P692-Q694 PolarHBondContact O-N 3.05Å
695F89.8Confident87.9Confident3 Ų346.7 Ų46.71%0.01328%0.277CS..Hα-helixtrans-113-24.3-176.461.6-105.6000114.8L683 M686 A691 P692 Q697 L698 L699 A751 Y752 Y755L683-F695 HydrophobicContact CD2-CB 3.97Å; M686-F695 HydrophobicContact CE-CB 3.95Å; M686-F695 HydrophobicContact SD-CB 3.66Å; A691-F695 WeakPolarHBondContact O-CD1 3.43Å; P692-F695 VanDerWaalsContact CA-CE1 3.5Å; P692-F695 HydrophobicContact CB-CE1 4.44Å; P692-F695 HydrophobicContact CB-CZ 4.1Å; P692-F695 HydrophobicContact CG-CZ 4.27Å; P692-F695 PolarHBondContact O-N 3.23Å; F695-Q697 PolarHBondContact O-N 3.12Å; F695-L698 WeakPolarHBondContact O-CB 3.41Å; F695-L698 PolarHBondContact O-N 3.28Å; F695-L699 HydrophobicContact CD2-CD1 3.52Å; F695-L699 HydrophobicContact CD2-CG 4.18Å; F695-L699 HydrophobicContact CE2-CD1 4Å; F695-L699 WeakPolarHBondContact O-CG 3.42Å; F695-L699 PolarHBondContact O-N 3.42Å; F695-A751 HydrophobicContact CZ-CB 4.17Å; F695-Y752 HydrophobicContact CB-CE1 3.72Å; F695-Y752 HydrophobicContact CD1-CD1 4.31Å; F695-Y752 AromaticContact CD1-CE1 3.76Å; F695-Y752 HydrophobicContact CD1-CE1 3.76Å; F695-Y752 AromaticContact CD2-CD1 3.77Å; F695-Y752 HydrophobicContact CD2-CD1 3.77Å; F695-Y752 AromaticContact CD2-CE1 3.79Å; F695-Y752 HydrophobicContact CD2-CE1 3.79Å; F695-Y752 HydrophobicContact CE1-CD1 4.4Å; F695-Y752 HydrophobicContact CE1-CE1 4.22Å; F695-Y752 AromaticContact CE2-CD1 3.89Å; F695-Y752 HydrophobicContact CE2-CD1 3.89Å; F695-Y752 HydrophobicContact CE2-CE1 4.26Å; F695-Y752 AromaticContact CG-CD1 3.98Å; F695-Y752 HydrophobicContact CG-CD1 3.98Å; F695-Y752 AromaticContact CG-CE1 3.5Å; F695-Y752 HydrophobicContact CG-CE1 3.5Å; F695-Y752 HydrophobicContact CZ-CD1 4.2Å; F695-Y752 HydrophobicContact CZ-CE1 4.45Å; F695-Y755 HydrophobicContact CE2-CD2 4.49Å; F695-Y755 HydrophobicContact CE2-CG 4.19Å
696S90.9Very high87.8Confident13 Ų1341.4 Ų41.49%0.09128%0.277CS..Hα-helixtrans-48.5-55.2-176.9480000113.9P692 L698 L699 D700 Y755P692-S696 WeakPolarHBondContact O-CB 3.32Å; P692-S696 PolarHBondContact O-N 3.09Å; P692-S696 PolarHBondContact O-OG 3.23Å; S696-L698 VanDerWaalsContact C-N 3.27Å; S696-L698 PolarHBondContact O-N 3.28Å; S696-L699 PolarHBondContact O-N 3.45Å; S696-D700 PolarHBondContact O-N 3.07Å; S696-Y755 WeakPolarHBondContact CB-OH 3.46Å; S696-Y755 PolarHBondContact O-OH 2.96Å
697Q89.7Confident87.8Confident34 Ų3443.2 Ų43.216%0.15929%0.286CS..Hα-helixtrans-66.2-30-178.7-59.4-55-59.100112.7V658 I661 F695 C701V658-Q697 HydrophobicContact CG1-CG 4.02Å; V658-Q697 HydrophobicContact CG2-CG 4.32Å; I661-Q697 HydrophobicContact CB-CB 4.45Å; I661-Q697 HydrophobicContact CD1-CB 4.44Å; I661-Q697 HydrophobicContact CG2-CB 3.88Å; I661-Q697 WeakPolarHBondContact CG2-O 3.45Å; F695-Q697 PolarHBondContact O-N 3.12Å; Q697-C701 WeakPolarHBondContact O-CB 3.45Å; Q697-C701 PolarHBondContact O-N 2.96Å; Q697-C701 VanDerWaalsContact O-N 3.11Å
698L91.1Very high88Confident3 Ų336 Ų362%0.01625%0.252CS..Hα-helixtrans-72.5-42.3175.7-60.6-178.3000110.8I661 F675 V679 R682 L683 M686 F695 S696 C701 V702I661-L698 HydrophobicContact CD1-CD2 4.17Å; I661-L698 HydrophobicContact CG2-CD2 4.48Å; F675-L698 HydrophobicContact CE2-CD2 4.24Å; F675-L698 HydrophobicContact CZ-CD2 3.87Å; V679-L698 HydrophobicContact CG1-CB 3.9Å; V679-L698 HydrophobicContact CG1-CD2 4.07Å; V679-L698 HydrophobicContact CG1-CG 4.4Å; R682-L698 HydrophobicContact CG-CD1 4.1Å; L683-L698 HydrophobicContact CD2-CB 3.96Å; L683-L698 HydrophobicContact CD2-CD1 4.22Å; L683-L698 HydrophobicContact CG-CB 4.32Å; L683-L698 HydrophobicContact CG-CD1 4.47Å; M686-L698 HydrophobicContact CE-CD1 3.63Å; F695-L698 WeakPolarHBondContact O-CB 3.41Å; F695-L698 PolarHBondContact O-N 3.28Å; S696-L698 VanDerWaalsContact C-N 3.27Å; S696-L698 PolarHBondContact O-N 3.28Å; L698-C701 WeakPolarHBondContact O-CB 3.25Å; L698-C701 PolarHBondContact O-N 3.38Å; L698-V702 WeakPolarHBondContact O-CG2 3.44Å; L698-V702 PolarHBondContact O-N 3.35Å
699L92.4Very high88.5Confident0 Ų034.8 Ų34.80%025%0.246CC..Hα-helixtrans-62.8-44.1174.4-67.5-175.7000111.6L683 F695 S696 C701 V702 C703 V711 Y752 Y755 L756L683-L699 HydrophobicContact CD1-CD2 3.92Å; L683-L699 HydrophobicContact CD2-CD2 4.01Å; L683-L699 HydrophobicContact CD2-CG 4.38Å; F695-L699 HydrophobicContact CD2-CD1 3.52Å; F695-L699 HydrophobicContact CD2-CG 4.18Å; F695-L699 HydrophobicContact CE2-CD1 4Å; F695-L699 WeakPolarHBondContact O-CG 3.42Å; F695-L699 PolarHBondContact O-N 3.42Å; S696-L699 PolarHBondContact O-N 3.45Å; L699-C701 PolarHBondContact O-N 3.35Å; L699-V702 PolarHBondContact O-N 2.67Å; L699-C703 WeakPolarHBondContact O-CB 3.41Å; L699-C703 PolarHBondContact O-N 3.49Å; L699-C703 PolarHBondContact O-SG 2.9Å; L699-V711 HydrophobicContact CD2-CG1 3.85Å; L699-V711 HydrophobicContact CD2-CG2 4.36Å; L699-Y752 HydrophobicContact CD1-CD1 4.07Å; L699-Y752 HydrophobicContact CD1-CG 4.09Å; L699-Y752 HydrophobicContact CD2-CD2 4.24Å; L699-Y752 HydrophobicContact CD2-CG 4.39Å; L699-Y755 HydrophobicContact CB-CD1 4.02Å; L699-Y755 HydrophobicContact CB-CE1 4.07Å; L699-Y755 HydrophobicContact CD1-CD1 3.67Å; L699-Y755 HydrophobicContact CD1-CE1 4.48Å; L699-Y755 HydrophobicContact CD1-CG 4.19Å; L699-Y755 HydrophobicContact CG-CD1 4.48Å; L699-L756 HydrophobicContact CB-CD2 4.31Å; L699-L756 HydrophobicContact CD1-CD2 4.48Å; L699-L756 HydrophobicContact CD1-CG 4.42Å
700D89.9Confident89.1Confident21 Ų2134 Ų3411%0.11222%0.223CC..Hα-helixtrans-56.2-42.2173.7-72.5-13.7000111.2S696 S704 Y755 T762S696-D700 PolarHBondContact O-N 3.07Å; D700-S704 VanDerWaalsContact O-CB 3.32Å; D700-S704 WeakPolarHBondContact O-CB 3.49Å; D700-S704 PolarHBondContact O-N 3.31Å; D700-S704 PolarHBondContact O-OG 3.4Å; D700-Y755 VanDerWaalsContact OD1-CE1 3.29Å; D700-Y755 WeakPolarHBondContact OD1-CE1 3.36Å; D700-Y755 PolarHBondContact OD1-OH 2.93Å; D700-Y755 PolarHBondContact OD2-OH 2.98Å; D700-T762 VanDerWaalsContact OD1-CG2 3.24Å; D700-T762 WeakPolarHBondContact OD1-CG2 3.32Å
701C90.5Very high89.3Confident0 Ų033.2 Ų33.20%022%0.217CC..Hα-helixtrans-65.6-52.8-179.8-153.90000111.6I661 Q697 L698 L699 C703 S704 W705I661-C701 HydrophobicContact CG2-CB 4.23Å; Q697-C701 WeakPolarHBondContact O-CB 3.45Å; Q697-C701 PolarHBondContact O-N 2.96Å; Q697-C701 VanDerWaalsContact O-N 3.11Å; L698-C701 WeakPolarHBondContact O-CB 3.25Å; L698-C701 PolarHBondContact O-N 3.38Å; L699-C701 PolarHBondContact O-N 3.35Å; C701-C703 VanDerWaalsContact C-N 3.33Å; C701-C703 PolarHBondContact O-N 3.02Å; C701-S704 WeakPolarHBondContact O-CB 3.21Å; C701-S704 PolarHBondContact O-N 3.41Å; C701-W705 PolarHBondContact O-N 3.14Å; C701-W705 VanDerWaalsContact SG-CE2 3.57Å; C701-W705 WeakPolarHBondContact SG-CH2 3.42Å; C701-W705 WeakPolarHBondContact SG-CZ2 3.44Å
702V90.6Very high89.5Confident0 Ų031 Ų310%020%0.199CC..Hα-helixtrans-60.5-42.3179.3175.70000111.3V679 L680 L683 L698 L699 S704 W705 G706 Q707 V711V679-V702 HydrophobicContact CB-CG2 4.31Å; V679-V702 HydrophobicContact CG1-CG2 3.48Å; V679-V702 VanDerWaalsContact CG1-CG2 3.48Å; L680-V702 HydrophobicContact CD2-CG1 4.18Å; L680-V702 HydrophobicContact CD2-CG2 4.45Å; L683-V702 HydrophobicContact CD1-CG2 4.16Å; L698-V702 WeakPolarHBondContact O-CG2 3.44Å; L698-V702 PolarHBondContact O-N 3.35Å; L699-V702 PolarHBondContact O-N 2.67Å; V702-S704 PolarHBondContact O-N 3.2Å; V702-W705 PolarHBondContact O-N 3.47Å; V702-G706 PolarHBondContact O-N 3.15Å; V702-Q707 HydrophobicContact CG1-CB 3.61Å; V702-Q707 VanDerWaalsContact CG1-O 3.3Å; V702-Q707 WeakPolarHBondContact CG1-O 3.21Å; V702-Q707 PolarHBondContact O-N 3.27Å; V702-V711 HydrophobicContact CB-CG2 4.26Å; V702-V711 HydrophobicContact CG1-CG2 3.48Å; V702-V711 VanDerWaalsContact CG1-CG2 3.48Å
703C90.8Very high89.8Confident3 Ų330.5 Ų30.52%0.0219%0.189CC..Hα-helixtrans-61.2-45.9173.9-680000111.1L699 C701 W705 G706 L756 T762 K765L699-C703 WeakPolarHBondContact O-CB 3.41Å; L699-C703 PolarHBondContact O-N 3.49Å; L699-C703 PolarHBondContact O-SG 2.9Å; C701-C703 VanDerWaalsContact C-N 3.33Å; C701-C703 PolarHBondContact O-N 3.02Å; C703-W705 PolarHBondContact O-N 3.22Å; C703-G706 PolarHBondContact O-N 3.11Å; C703-L756 WeakPolarHBondContact SG-CD2 3.47Å; C703-T762 HydrophobicContact CB-CG2 4.23Å; C703-K765 HydrophobicContact CB-CB 4.18Å; C703-K765 HydrophobicContact CB-CD 3.79Å; C703-K765 WeakPolarHBondContact O-CD 3.42Å
704S88Confident90.3Very high43 Ų4326.9 Ų26.930%0.30116%0.159SC..Hα-helixtrans-62.1-27.5179.4-57.30000113.5S665 D700 C701 V702 G706 K765S665-S704 WeakPolarHBondContact O-CB 3.44Å; D700-S704 VanDerWaalsContact O-CB 3.32Å; D700-S704 WeakPolarHBondContact O-CB 3.49Å; D700-S704 PolarHBondContact O-N 3.31Å; D700-S704 PolarHBondContact O-OG 3.4Å; C701-S704 WeakPolarHBondContact O-CB 3.21Å; C701-S704 PolarHBondContact O-N 3.41Å; V702-S704 PolarHBondContact O-N 3.2Å; S704-G706 VanDerWaalsContact C-N 3.26Å; S704-G706 PolarHBondContact O-N 3.21Å; S704-K765 PolarHBondContact OG-NZ 3.28Å
705W90.6Very high90.6Very high27 Ų2721.8 Ų21.810%0.10214%0.135CC..THydrogen-bonded Turntrans-81.41.9173.4-64.2-25.8000114.3A664 M667 P669 F675 S676 V679 C701 V702 C703 Q707A664-W705 HydrophobicContact CB-CZ2 4.48Å; A664-W705 PolarHBondContact O-NE1 3.43Å; M667-W705 VanDerWaalsContact O-CD1 3.23Å; M667-W705 PolarHBondContact O-NE1 3.05Å; P669-W705 HydrophobicContact CB-CB 4.48Å; P669-W705 HydrophobicContact CB-CD2 3.84Å; P669-W705 HydrophobicContact CB-CE3 4.16Å; P669-W705 HydrophobicContact CB-CG 4.01Å; P669-W705 HydrophobicContact CG-CB 4.23Å; P669-W705 HydrophobicContact CG-CG 4.16Å; F675-W705 AromaticContact CD1-CH2 3.79Å; F675-W705 HydrophobicContact CD1-CH2 3.79Å; F675-W705 HydrophobicContact CD1-CZ2 4.3Å; F675-W705 AromaticContact CE1-CH2 3.76Å; F675-W705 HydrophobicContact CE1-CH2 3.76Å; F675-W705 HydrophobicContact CE1-CZ2 4.32Å; S676-W705 VanDerWaalsContact CB-CH2 3.46Å; V679-W705 HydrophobicContact CB-CZ3 4.35Å; V679-W705 HydrophobicContact CG2-CH2 4.05Å; V679-W705 HydrophobicContact CG2-CZ3 3.93Å; C701-W705 PolarHBondContact O-N 3.14Å; C701-W705 VanDerWaalsContact SG-CE2 3.57Å; C701-W705 WeakPolarHBondContact SG-CH2 3.42Å; C701-W705 WeakPolarHBondContact SG-CZ2 3.44Å; V702-W705 PolarHBondContact O-N 3.47Å; C703-W705 PolarHBondContact O-N 3.22Å; W705-Q707 HydrophobicContact CB-CG 4.34Å; W705-Q707 PolarHBondContact O-N 2.88Å
706G86.9Confident90.8Very high65 Ų6522.9 Ų22.967%0.6714%0.143SC*.THydrogen-bonded Turntrans7415.1-17700000113.6V702 C703 S704V702-G706 PolarHBondContact O-N 3.15Å; C703-G706 PolarHBondContact O-N 3.11Å; S704-G706 VanDerWaalsContact C-N 3.26Å; S704-G706 PolarHBondContact O-N 3.21Å
707Q90.3Very high90.7Very high58 Ų5826.1 Ų26.127%0.27116%0.159SC..  trans-98.622.1-177.3-70.8-178.2-38.500112.4V702 W705 A709 D710V702-Q707 HydrophobicContact CG1-CB 3.61Å; V702-Q707 VanDerWaalsContact CG1-O 3.3Å; V702-Q707 WeakPolarHBondContact CG1-O 3.21Å; V702-Q707 PolarHBondContact O-N 3.27Å; W705-Q707 HydrophobicContact CB-CG 4.34Å; W705-Q707 PolarHBondContact O-N 2.88Å; Q707-A709 PolarHBondContact O-N 3Å; Q707-D710 WeakPolarHBondContact CB-OD2 3.43Å; Q707-D710 PolarHBondContact O-N 3.22Å; Q707-D710 VanDerWaalsContact O-N 3.15Å
708A90.9Very high90.8Very high2 Ų224.9 Ų24.92%0.01715%0.153CC..Hα-helixtrans-60-29.8178.100000112.3D710 V711 L712 V766 V769A708-D710 VanDerWaalsContact C-N 3.32Å; A708-D710 PolarHBondContact O-N 2.77Å; A708-V711 PolarHBondContact O-N 3.41Å; A708-L712 WeakPolarHBondContact O-CG 3.32Å; A708-L712 PolarHBondContact O-N 3.25Å; A708-V766 HydrophobicContact CB-CG2 4.09Å; A708-V769 HydrophobicContact CB-CG2 3.57Å
709A90.4Very high90.8Very high39 Ų3924.7 Ų24.732%0.32215%0.152SC..Hα-helixtrans-57.3-42.1174.600000112.8Q707 V711 L712 E713 V769Q707-A709 PolarHBondContact O-N 3Å; A709-V711 VanDerWaalsContact C-N 3.27Å; A709-V711 PolarHBondContact O-N 2.92Å; A709-L712 PolarHBondContact O-N 2.98Å; A709-E713 WeakPolarHBondContact O-CB 3.41Å; A709-E713 PolarHBondContact O-N 3.13Å; A709-V769 HydrophobicContact CB-CG1 3.61Å
710D90.4Very high90.6Very high63 Ų6326.1 Ų26.134%0.33717%0.166SC..Hα-helixtrans-65.6-32.8-179.1-58.6-46.1000111.6L680 Q707 A708 L714L680-D710 HydrophobicContact CD1-CB 3.79Å; L680-D710 HydrophobicContact CD2-CB 4.04Å; Q707-D710 WeakPolarHBondContact CB-OD2 3.43Å; Q707-D710 PolarHBondContact O-N 3.22Å; Q707-D710 VanDerWaalsContact O-N 3.15Å; A708-D710 VanDerWaalsContact C-N 3.32Å; A708-D710 PolarHBondContact O-N 2.77Å; D710-L714 WeakPolarHBondContact O-CB 3.45Å; D710-L714 PolarHBondContact O-N 3.31Å; D710-L714 VanDerWaalsContact O-N 3.13Å
711V91.7Very high90.5Very high1 Ų131 Ų311%0.00619%0.189CC..Hα-helixtrans-73.3-42.5174.9-175.80000110.7L680 L699 V702 A708 A709 E713 L714 V715 Y752 L756L680-V711 HydrophobicContact CD2-CG2 4.2Å; L699-V711 HydrophobicContact CD2-CG1 3.85Å; L699-V711 HydrophobicContact CD2-CG2 4.36Å; V702-V711 HydrophobicContact CB-CG2 4.26Å; V702-V711 HydrophobicContact CG1-CG2 3.48Å; V702-V711 VanDerWaalsContact CG1-CG2 3.48Å; A708-V711 PolarHBondContact O-N 3.41Å; A709-V711 VanDerWaalsContact C-N 3.27Å; A709-V711 PolarHBondContact O-N 2.92Å; V711-E713 VanDerWaalsContact C-N 3.31Å; V711-E713 PolarHBondContact O-N 3.29Å; V711-L714 PolarHBondContact O-N 3.32Å; V711-V715 HydrophobicContact CG1-CG2 4.49Å; V711-V715 WeakPolarHBondContact O-CB 3.38Å; V711-V715 VanDerWaalsContact O-CG2 3.29Å; V711-V715 WeakPolarHBondContact O-CG2 3.33Å; V711-V715 PolarHBondContact O-N 3.07Å; V711-Y752 HydrophobicContact CG1-CD2 4.31Å; V711-L756 HydrophobicContact CG1-CD1 4.07Å
712L92.3Very high90.2Very high2 Ų232 Ų321%0.0120%0.197CC..Hα-helixtrans-63.9-38.2176.3-67.2-179.1000111.9A708 A709 V715 S716 L753 V766 V769 L774 L777A708-L712 WeakPolarHBondContact O-CG 3.32Å; A708-L712 PolarHBondContact O-N 3.25Å; A709-L712 PolarHBondContact O-N 2.98Å; L712-V715 PolarHBondContact O-N 3.03Å; L712-S716 VanDerWaalsContact O-CB 3.29Å; L712-S716 WeakPolarHBondContact O-CB 3.34Å; L712-S716 PolarHBondContact O-N 2.95Å; L712-S716 PolarHBondContact O-OG 3.39Å; L712-L753 HydrophobicContact CD2-CD2 4.07Å; L712-V766 HydrophobicContact CD1-CG1 4.19Å; L712-V766 HydrophobicContact CD2-CG1 4.14Å; L712-V769 HydrophobicContact CD1-CB 4.46Å; L712-V769 HydrophobicContact CD1-CG1 4.31Å; L712-V769 HydrophobicContact CD1-CG2 4.48Å; L712-L774 HydrophobicContact CD1-CD2 3.78Å; L712-L774 HydrophobicContact CD1-CG 4.48Å; L712-L777 HydrophobicContact CD2-CD2 4.04Å
713E92.1Very high89.8Confident72 Ų7233.1 Ų33.134%0.33620%0.203SC..Hα-helixtrans-61.6-49173.6-175.5174.4-150.400110.8A709 V711 V715 S716 D717 R737A709-E713 WeakPolarHBondContact O-CB 3.41Å; A709-E713 PolarHBondContact O-N 3.13Å; V711-E713 VanDerWaalsContact C-N 3.31Å; V711-E713 PolarHBondContact O-N 3.29Å; E713-V715 VanDerWaalsContact C-N 3.32Å; E713-V715 PolarHBondContact O-N 2.82Å; E713-S716 PolarHBondContact O-N 3.48Å; E713-S716 VanDerWaalsContact O-N 3.12Å; E713-D717 WeakPolarHBondContact O-CB 3.35Å; E713-D717 PolarHBondContact O-N 3.13Å; E713-R737 IonicContact OE1-CZ 2.64Å; E713-R737 IonicContact OE1-NH1 3.73Å; E713-R737 PolarHBondContact OE1-NH1 3.4Å; E713-R737 IonicContact OE1-NH2 3.48Å; E713-R737 PolarHBondContact OE1-NH2 2.93Å; E713-R737 IonicContact OE2-NH2 3.08Å; E713-R737 PolarHBondContact OE2-NH2 3.29Å
714L91.8Very high88.8Confident8 Ų836.5 Ų36.54%0.04223%0.225CC..Hα-helixtrans-56.6-44.9175.7178.664000112.6R684 D710 V711 S716 W718R684-L714 HydrophobicContact CB-CD1 4.42Å; R684-L714 HydrophobicContact CB-CD2 4.39Å; R684-L714 HydrophobicContact CG-CD1 4.1Å; D710-L714 WeakPolarHBondContact O-CB 3.45Å; D710-L714 PolarHBondContact O-N 3.31Å; D710-L714 VanDerWaalsContact O-N 3.13Å; V711-L714 PolarHBondContact O-N 3.32Å; L714-S716 VanDerWaalsContact C-N 3.35Å; L714-W718 HydrophobicContact CD1-CD2 4.14Å; L714-W718 HydrophobicContact CD1-CH2 4.18Å; L714-W718 HydrophobicContact CD1-CZ2 3.7Å; L714-W718 HydrophobicContact CD2-CH2 3.85Å; L714-W718 HydrophobicContact CD2-CZ2 4.19Å; L714-W718 HydrophobicContact CD2-CZ3 4.12Å; L714-W718 HydrophobicContact CG-CD2 4.23Å; L714-W718 HydrophobicContact CG-CE3 4.17Å; L714-W718 HydrophobicContact CG-CH2 4.03Å; L714-W718 HydrophobicContact CG-CZ2 4.07Å; L714-W718 HydrophobicContact CG-CZ3 4.08Å; L714-W718 PolarHBondContact O-N 3.38Å; L714-W718 VanDerWaalsContact O-N 3.11Å
715V92.5Very high87.7Confident0 Ų043.6 Ų43.60%025%0.251CS..Hα-helixtrans-62.6-43.4176.6163.40000110.9V711 L712 E713 W718 L719 A749 Y752 L753 L777V711-V715 HydrophobicContact CG1-CG2 4.49Å; V711-V715 WeakPolarHBondContact O-CB 3.38Å; V711-V715 VanDerWaalsContact O-CG2 3.29Å; V711-V715 WeakPolarHBondContact O-CG2 3.33Å; V711-V715 PolarHBondContact O-N 3.07Å; L712-V715 PolarHBondContact O-N 3.03Å; E713-V715 VanDerWaalsContact C-N 3.32Å; E713-V715 PolarHBondContact O-N 2.82Å; V715-W718 PolarHBondContact O-N 3.45Å; V715-L719 HydrophobicContact CG1-CD1 3.83Å; V715-L719 HydrophobicContact CG1-CG 4.5Å; V715-L719 WeakPolarHBondContact O-CB 3.24Å; V715-L719 WeakPolarHBondContact O-CG 3.43Å; V715-L719 PolarHBondContact O-N 3.03Å; V715-A749 HydrophobicContact CB-CB 4.39Å; V715-A749 HydrophobicContact CG1-CB 4.09Å; V715-A749 HydrophobicContact CG2-CB 4.35Å; V715-Y752 HydrophobicContact CG2-CD2 4.45Å; V715-L753 HydrophobicContact CG1-CD1 3.62Å; V715-L753 HydrophobicContact CG1-CD2 3.91Å; V715-L753 HydrophobicContact CG1-CG 3.64Å; V715-L753 HydrophobicContact CG2-CG 4.48Å; V715-L777 HydrophobicContact CG1-CD1 4.15Å
716S92.1Very high85.5Confident26 Ų2651.1 Ų51.118%0.18229%0.287CS..Hα-helixtrans-68.8-38.4-178.2-57.90000111.5L712 E713 L714 G720 L780L712-S716 VanDerWaalsContact O-CB 3.29Å; L712-S716 WeakPolarHBondContact O-CB 3.34Å; L712-S716 PolarHBondContact O-N 2.95Å; L712-S716 PolarHBondContact O-OG 3.39Å; E713-S716 PolarHBondContact O-N 3.48Å; E713-S716 VanDerWaalsContact O-N 3.12Å; L714-S716 VanDerWaalsContact C-N 3.35Å; S716-G720 PolarHBondContact O-N 3.47Å; S716-L780 VanDerWaalsContact O-CD2 3.26Å; S716-L780 WeakPolarHBondContact O-CD2 3.34Å
717D90.4Very high83.5Confident81 Ų8151.2 Ų51.243%0.43329%0.289SS..Hα-helixtrans-61.1-50.1173.9-74.8-16.8000110.9E713 L719 G720 E721E713-D717 WeakPolarHBondContact O-CB 3.35Å; E713-D717 PolarHBondContact O-N 3.13Å; D717-L719 PolarHBondContact O-N 3.28Å; D717-G720 PolarHBondContact O-N 2.89Å; D717-E721 WeakPolarHBondContact O-CB 3.31Å; D717-E721 PolarHBondContact O-N 3.19Å
718W91.8Very high81.2Confident8 Ų856.6 Ų56.63%0.0332%0.319CS..Hα-helixtrans-63.1-40.3178.6-74.8-19.7000113.4R684 L714 V715 K745 L748 A749 Y752R684-W718 HydrophobicContact CG-CZ2 4.32Å; L714-W718 HydrophobicContact CD1-CD2 4.14Å; L714-W718 HydrophobicContact CD1-CH2 4.18Å; L714-W718 HydrophobicContact CD1-CZ2 3.7Å; L714-W718 HydrophobicContact CD2-CH2 3.85Å; L714-W718 HydrophobicContact CD2-CZ2 4.19Å; L714-W718 HydrophobicContact CD2-CZ3 4.12Å; L714-W718 HydrophobicContact CG-CD2 4.23Å; L714-W718 HydrophobicContact CG-CE3 4.17Å; L714-W718 HydrophobicContact CG-CH2 4.03Å; L714-W718 HydrophobicContact CG-CZ2 4.07Å; L714-W718 HydrophobicContact CG-CZ3 4.08Å; L714-W718 PolarHBondContact O-N 3.38Å; L714-W718 VanDerWaalsContact O-N 3.11Å; V715-W718 PolarHBondContact O-N 3.45Å; W718-K745 HydrophobicContact CD2-CB 3.99Å; W718-K745 HydrophobicContact CE3-CB 4.17Å; W718-K745 HydrophobicContact CG-CB 4.37Å; W718-K745 HydrophobicContact CH2-CD 4.28Å; W718-K745 HydrophobicContact CZ2-CB 4.45Å; W718-K745 HydrophobicContact CZ2-CD 3.97Å; W718-K745 HydrophobicContact CZ3-CB 4.48Å; W718-L748 HydrophobicContact CH2-CD2 3.94Å; W718-L748 HydrophobicContact CZ3-CB 4.38Å; W718-L748 HydrophobicContact CZ3-CD2 3.98Å; W718-L748 HydrophobicContact CZ3-CG 4.14Å; W718-A749 HydrophobicContact CB-CB 4.08Å; W718-A749 HydrophobicContact CE3-CB 3.94Å; W718-Y752 HydrophobicContact CZ3-CD2 4.46Å; W718-Y752 HydrophobicContact CZ3-CE2 4.11Å
719L90.8Very high78.5Confident0 Ų065.9 Ų65.90%036%0.359CS..Hα-helixtrans-72.2-36.7176.9-71.7173.9000112V715 D717 V723 P746 A749 L750 L753 L777 L780 L781 W784V715-L719 HydrophobicContact CG1-CD1 3.83Å; V715-L719 HydrophobicContact CG1-CG 4.5Å; V715-L719 WeakPolarHBondContact O-CB 3.24Å; V715-L719 WeakPolarHBondContact O-CG 3.43Å; V715-L719 PolarHBondContact O-N 3.03Å; D717-L719 PolarHBondContact O-N 3.28Å; L719-V723 WeakPolarHBondContact O-CG2 3.49Å; L719-P746 HydrophobicContact CD2-CB 4.11Å; L719-A749 HydrophobicContact CD2-CB 4.27Å; L719-A749 HydrophobicContact CG-CB 4.01Å; L719-L750 HydrophobicContact CD1-CD2 4.35Å; L719-L750 HydrophobicContact CD2-CD2 4.08Å; L719-L750 HydrophobicContact CD2-CG 4.12Å; L719-L753 HydrophobicContact CD1-CD1 4.28Å; L719-L777 HydrophobicContact CD1-CD1 4.09Å; L719-L780 HydrophobicContact CB-CD2 3.71Å; L719-L780 HydrophobicContact CB-CG 4.23Å; L719-L781 HydrophobicContact CD1-CD2 3.78Å; L719-L781 HydrophobicContact CD1-CG 4.48Å; L719-W784 HydrophobicContact CB-CZ2 4.38Å; L719-W784 HydrophobicContact CD2-CZ2 3.73Å; L719-W784 WeakPolarHBondContact O-CZ2 3.45Å
720G88.9Confident76.2Confident29 Ų2969 Ų6930%0.29939%0.385SS..Hα-helixtrans-72.4-37.8-178.400000113.7S716 D717 A722S716-G720 PolarHBondContact O-N 3.47Å; D717-G720 PolarHBondContact O-N 2.89Å; G720-A722 VanDerWaalsContact C-N 3.3Å
721E87.3Confident73.4Confident124 Ų12470.4 Ų70.458%0.57941%0.405SS*.Hα-helixtrans-69.4-29176.9-172.2168.5-172.600112.5D717 A744D717-E721 WeakPolarHBondContact O-CB 3.31Å; D717-E721 PolarHBondContact O-N 3.19Å; E721-A744 HydrophobicContact CB-CB 4.01Å; E721-A744 HydrophobicContact CG-CB 4.07Å
722A84.5Confident71.1Confident21 Ų2180.3 Ų80.317%0.17445%0.448CS..Hα-helixtrans-77.4-19.5179.500000114.5G720 P746 W784 P802G720-A722 VanDerWaalsContact C-N 3.3Å; A722-P746 HydrophobicContact CB-CB 4.11Å; A722-P746 HydrophobicContact CB-CG 4.11Å; A722-W784 HydrophobicContact CB-CH2 3.86Å; A722-W784 HydrophobicContact CB-CZ2 3.98Å; A722-P802 WeakPolarHBondContact O-CG 3.45Å
723V81.4Confident68.2Low23 Ų2385.8 Ų85.814%0.13949%0.486CS..SBendtrans-82.4124.6-1781770000111L719 K725 W784 V787L719-V723 WeakPolarHBondContact O-CG2 3.49Å; V723-K725 PolarHBondContact O-N 3Å; V723-W784 HydrophobicContact CG2-CD2 3.93Å; V723-W784 VanDerWaalsContact CG2-CE2 3.42Å; V723-W784 HydrophobicContact CG2-CG 4.17Å; V723-W784 HydrophobicContact CG2-CZ2 3.83Å; V723-W784 VanDerWaalsContact CG2-NE1 3.3Å; V723-V787 HydrophobicContact CG1-CG2 4.44Å
724P68.9Low65.5Low74 Ų7493.7 Ų93.748%0.48151%0.513SS..PPolyproline II helixtrans-62.9124.1176.5-1930.6000111.7Q726P724-Q726 PolarHBondContact O-N 3.27Å
725K66Low62.6Low192 Ų192103.1 Ų103.184%0.83555%0.554SS**PPolyproline II helixtrans-75.2120.7175.7-64.8-179.4-177.1175.70109.9V723 G727V723-K725 PolarHBondContact O-N 3Å; K725-G727 PolarHBondContact O-N 3.26Å
726Q44.3Very low59.7Low185 Ų185109.7 Ų109.786%0.86459%0.594SS**SBendtrans-69.1112.6172.5-82.1-172.8-8.800110.1P724P724-Q726 PolarHBondContact O-N 3.27Å
727G44.5Very low57Low68 Ų68116 Ų11670%0.70161%0.614SS**SBendtrans103.292.217500000112.8K725 K729K725-G727 PolarHBondContact O-N 3.26Å; G727-K729 VanDerWaalsContact C-N 3.34Å; G727-K729 PolarHBondContact O-N 3.48Å
728D41.7Very low54.4Low171 Ų171120.4 Ų120.491%0.91464%0.635SS**  trans-63.895.5160.8-97.7-30.4000109.5
729K34.3Very low51.9Low196 Ų196127.6 Ų127.685%0.85267%0.669SS**  trans-128.9106.6140.3-78.5-168.9179.3178.20107.7G727 A731G727-K729 VanDerWaalsContact C-N 3.34Å; G727-K729 PolarHBondContact O-N 3.48Å; K729-A731 PolarHBondContact O-N 3.07Å
730A42.7Very low49.6Very low104 Ų104134.7 Ų134.786%0.8670%0.702SS**  trans-52.3102170.900000110.6
731A31.1Very low47.5Very low93 Ų93140.1 Ų140.177%0.76973%0.73SS**  trans-114.294.6160.700000107.6K729 S733K729-A731 PolarHBondContact O-N 3.07Å; A731-S733 PolarHBondContact O-N 2.97Å
732K43.2Very low46.1Very low210 Ų210136 Ų13691%0.91372%0.717SS**  trans-63100.5169.3-74.8177.9176.4175.10108.7
733S31.7Very low45.7Very low116 Ų116142.8 Ų142.881%0.81175%0.745SS**  trans-100.5106.2155.265.30000108.5A731 K735A731-S733 PolarHBondContact O-N 2.97Å; S733-K735 PolarHBondContact O-N 3.39Å; S733-K735 VanDerWaalsContact O-N 3.15Å
734R36.4Very low45.8Very low238 Ų238143 Ų14390%0.89875%0.749SS**  trans-63.3109.2171.5-97.6175.2166.3167.2-5.3108.5
735K29.9Very low46.8Very low207 Ų207140.8 Ų140.890%0.973%0.732SS**  trans-104.4112146.4-108.9-179.1176.2-179.60106.6S733 R737S733-K735 PolarHBondContact O-N 3.39Å; S733-K735 VanDerWaalsContact O-N 3.15Å; K735-R737 PolarHBondContact O-N 2.91Å
736V33Very low47.9Very low137 Ų137132.5 Ų132.583%0.8370%0.698SS**  trans-70.1101.2176.6177.40000107.5
737R34.5Very low50.1Low160 Ų160126 Ų12660%0.60467%0.669SS**  trans-120.4129.9161.2-148.4176.6-170.2176.32.8105.5E713 K735 Q739E713-R737 IonicContact OE1-CZ 2.64Å; E713-R737 IonicContact OE1-NH1 3.73Å; E713-R737 PolarHBondContact OE1-NH1 3.4Å; E713-R737 IonicContact OE1-NH2 3.48Å; E713-R737 PolarHBondContact OE1-NH2 2.93Å; E713-R737 IonicContact OE2-NH2 3.08Å; E713-R737 PolarHBondContact OE2-NH2 3.29Å; K735-R737 PolarHBondContact O-N 2.91Å; R737-Q739 PolarHBondContact O-N 2.86Å
738I36.5Very low52.3Low173 Ų173122.8 Ų122.889%0.88764%0.636SS**  trans-60.1101-178.2-61.6167.4000107.6
739Q37.6Very low54.8Low159 Ų159114.7 Ų114.774%0.74359%0.593SS**  trans-100.4100.6179.3-107173.5-1300107.9R737 T741R737-Q739 PolarHBondContact O-N 2.86Å; Q739-T741 PolarHBondContact O-N 3.37Å
740E43.9Very low57.6Low148 Ų148105.5 Ų105.569%0.69255%0.553SS**  trans-60.9120.1143.1-81.5179.7158.800105.2A742E740-A742 VanDerWaalsContact C-N 3.26Å; E740-A742 PolarHBondContact O-N 3.35Å
741T44Very low59.9Low143 Ų143102 Ų10288%0.87752%0.524SS*.  trans-62.786.1178.845.20000109.4Q739Q739-T741 PolarHBondContact O-N 3.37Å
742A59.1Low62.9Low39 Ų3997.6 Ų97.632%0.32249%0.488SS..PPolyproline II helixtrans-88.3120174.200000108E740 A744E740-A742 VanDerWaalsContact C-N 3.26Å; E740-A742 PolarHBondContact O-N 3.35Å; A742-A744 PolarHBondContact O-N 3.09Å
743E75.9Confident65.3Low162 Ų16287.7 Ų87.776%0.75745%0.445SS*.PPolyproline II helixtrans-47.5134.1167.7-174177.4-17000110.4K745E743-K745 WeakPolarHBondContact O-CG 3.49Å; E743-K745 PolarHBondContact O-N 3.18Å
744A82.5Confident68.2Low27 Ų2786.7 Ų86.722%0.22343%0.427CS..PPolyproline II helixtrans-65.4129.617800000110.4E721 A742 P746E721-A744 HydrophobicContact CB-CB 4.01Å; E721-A744 HydrophobicContact CG-CB 4.07Å; A742-A744 PolarHBondContact O-N 3.09Å; A744-P746 VanDerWaalsContact C-CD 3.44Å; A744-P746 WeakPolarHBondContact O-CD 3.41Å
745K90.3Very high70.9Confident28 Ų2876.4 Ų76.412%0.12239%0.389CS..  trans-117.869.9-176.5-59177.1-172.5171.40111.7R684 M686 W718 E743 D747 L748 A749R684-K745 PolarHBondContact O-NZ 3.34Å; R684-K745 VanDerWaalsContact O-NZ 3.08Å; M686-K745 PolarHBondContact O-NZ 3.22Å; W718-K745 HydrophobicContact CD2-CB 3.99Å; W718-K745 HydrophobicContact CE3-CB 4.17Å; W718-K745 HydrophobicContact CG-CB 4.37Å; W718-K745 HydrophobicContact CH2-CD 4.28Å; W718-K745 HydrophobicContact CZ2-CB 4.45Å; W718-K745 HydrophobicContact CZ2-CD 3.97Å; W718-K745 HydrophobicContact CZ3-CB 4.48Å; E743-K745 WeakPolarHBondContact O-CG 3.49Å; E743-K745 PolarHBondContact O-N 3.18Å; K745-D747 PolarHBondContact O-N 3.28Å; K745-L748 HydrophobicContact CB-CB 4.09Å; K745-L748 HydrophobicContact CD-CD2 4.15Å; K745-L748 PolarHBondContact O-N 3.11Å; K745-A749 PolarHBondContact O-N 3.34Å
746P89.6Confident73.9Confident18 Ų1866.6 Ų66.612%0.11735%0.346CS..Hα-helixtrans-64.5-36.3-172.227.3-36.2000113.4L719 A722 A744 A749 L750 W784 T806L719-P746 HydrophobicContact CD2-CB 4.11Å; A722-P746 HydrophobicContact CB-CB 4.11Å; A722-P746 HydrophobicContact CB-CG 4.11Å; A744-P746 VanDerWaalsContact C-CD 3.44Å; A744-P746 WeakPolarHBondContact O-CD 3.41Å; P746-A749 WeakPolarHBondContact O-CB 3.29Å; P746-A749 PolarHBondContact O-N 2.91Å; P746-L750 WeakPolarHBondContact O-CG 3.14Å; P746-L750 PolarHBondContact O-N 3.17Å; P746-W784 HydrophobicContact CB-CH2 3.89Å; P746-W784 HydrophobicContact CB-CZ2 4.29Å; P746-T806 HydrophobicContact CB-CG2 3.7Å; P746-T806 HydrophobicContact CG-CG2 3.96Å
747D89.9Confident76.7Confident49 Ų4960.7 Ų60.726%0.26231%0.309SS..Hα-helixtrans-66.4-41.1177.8-63.2-63.9000113K745 A749 L750 A751 T806K745-D747 PolarHBondContact O-N 3.28Å; D747-A749 VanDerWaalsContact C-N 3.32Å; D747-L750 PolarHBondContact O-N 3.4Å; D747-A751 PolarHBondContact O-N 3.21Å; D747-T806 WeakPolarHBondContact OD1-CB 3.39Å; D747-T806 WeakPolarHBondContact OD1-CG2 3.4Å; D747-T806 PolarHBondContact OD1-OG1 3.18Å; D747-T806 PolarHBondContact OD2-OG1 2.94Å
748L91.2Very high79.3Confident1 Ų157.3 Ų57.31%0.00531%0.307CS..Hα-helixtrans-67-36.9175.7-171.161.6000111.4M686 W718 K745 L750 A751 Y752M686-L748 HydrophobicContact CB-CD2 3.9Å; W718-L748 HydrophobicContact CH2-CD2 3.94Å; W718-L748 HydrophobicContact CZ3-CB 4.38Å; W718-L748 HydrophobicContact CZ3-CD2 3.98Å; W718-L748 HydrophobicContact CZ3-CG 4.14Å; K745-L748 HydrophobicContact CB-CB 4.09Å; K745-L748 HydrophobicContact CD-CD2 4.15Å; K745-L748 PolarHBondContact O-N 3.11Å; L748-L750 VanDerWaalsContact C-N 3.34Å; L748-L750 PolarHBondContact O-N 3.03Å; L748-A751 PolarHBondContact O-N 3.04Å; L748-Y752 HydrophobicContact CD1-CD1 4.21Å; L748-Y752 HydrophobicContact CD1-CE1 3.63Å; L748-Y752 HydrophobicContact CG-CD1 4.38Å; L748-Y752 HydrophobicContact CG-CE1 3.88Å; L748-Y752 WeakPolarHBondContact O-CD1 3.42Å; L748-Y752 PolarHBondContact O-N 3.33Å
749A92.8Very high81.7Confident0 Ų052.8 Ų52.80%028%0.281CS..Hα-helixtrans-58.8-45.8174.100000111.3V715 W718 L719 K745 P746 D747 Y752 L753V715-A749 HydrophobicContact CB-CB 4.39Å; V715-A749 HydrophobicContact CG1-CB 4.09Å; V715-A749 HydrophobicContact CG2-CB 4.35Å; W718-A749 HydrophobicContact CB-CB 4.08Å; W718-A749 HydrophobicContact CE3-CB 3.94Å; L719-A749 HydrophobicContact CD2-CB 4.27Å; L719-A749 HydrophobicContact CG-CB 4.01Å; K745-A749 PolarHBondContact O-N 3.34Å; P746-A749 WeakPolarHBondContact O-CB 3.29Å; P746-A749 PolarHBondContact O-N 2.91Å; D747-A749 VanDerWaalsContact C-N 3.32Å; A749-Y752 PolarHBondContact O-N 3.02Å; A749-L753 PolarHBondContact O-N 2.76Å
750L92.9Very high84Confident3 Ų348.8 Ų48.82%0.01627%0.268CS..Hα-helixtrans-68.1-36.6176.9-64.3172.4000112L719 P746 D747 L748 Y752 L753 E754 L781 T806 K809 A810 Y813L719-L750 HydrophobicContact CD1-CD2 4.35Å; L719-L750 HydrophobicContact CD2-CD2 4.08Å; L719-L750 HydrophobicContact CD2-CG 4.12Å; P746-L750 WeakPolarHBondContact O-CG 3.14Å; P746-L750 PolarHBondContact O-N 3.17Å; D747-L750 PolarHBondContact O-N 3.4Å; L748-L750 VanDerWaalsContact C-N 3.34Å; L748-L750 PolarHBondContact O-N 3.03Å; L750-Y752 VanDerWaalsContact C-N 3.32Å; L750-Y752 PolarHBondContact O-N 3.33Å; L750-L753 HydrophobicContact CD2-CD1 4.38Å; L750-L753 PolarHBondContact O-N 2.94Å; L750-E754 WeakPolarHBondContact O-CB 3.11Å; L750-E754 PolarHBondContact O-N 2.93Å; L750-L781 HydrophobicContact CD2-CD2 4Å; L750-T806 HydrophobicContact CD1-CG2 3.98Å; L750-T806 WeakPolarHBondContact CD1-O 3.3Å; L750-K809 HydrophobicContact CD1-CB 3.67Å; L750-A810 HydrophobicContact CD1-CB 4.21Å; L750-A810 HydrophobicContact CD2-CB 4.19Å; L750-Y813 HydrophobicContact CD2-CD2 4.04Å
751A92.6Very high85.9Confident32 Ų3244.7 Ų44.726%0.26426%0.256SS..Hα-helixtrans-64.1-35.517400000112.5F695 D747 L748 Y755F695-A751 HydrophobicContact CZ-CB 4.17Å; D747-A751 PolarHBondContact O-N 3.21Å; L748-A751 PolarHBondContact O-N 3.04Å; A751-Y755 PolarHBondContact O-N 2.85Å; A751-Y755 VanDerWaalsContact O-N 3.15Å
752Y94.4Very high88.1Confident0 Ų037.9 Ų37.90%021%0.214CC..Hα-helixtrans-67-46.5172.7-74.16.8000111.1L683 M686 F695 L699 V711 V715 W718 L748 A749 L750 E754 Y755 L756L683-Y752 HydrophobicContact CB-CE2 4.19Å; L683-Y752 HydrophobicContact CD2-CE2 4.08Å; L683-Y752 WeakPolarHBondContact CD2-OH 3.46Å; L683-Y752 PolarHBondContact O-OH 3.4Å; L683-Y752 VanDerWaalsContact O-OH 3.09Å; M686-Y752 PolarHBondContact SD-OH 3.32Å; F695-Y752 HydrophobicContact CB-CE1 3.72Å; F695-Y752 HydrophobicContact CD1-CD1 4.31Å; F695-Y752 AromaticContact CD1-CE1 3.76Å; F695-Y752 HydrophobicContact CD1-CE1 3.76Å; F695-Y752 AromaticContact CD2-CD1 3.77Å; F695-Y752 HydrophobicContact CD2-CD1 3.77Å; F695-Y752 AromaticContact CD2-CE1 3.79Å; F695-Y752 HydrophobicContact CD2-CE1 3.79Å; F695-Y752 HydrophobicContact CE1-CD1 4.4Å; F695-Y752 HydrophobicContact CE1-CE1 4.22Å; F695-Y752 AromaticContact CE2-CD1 3.89Å; F695-Y752 HydrophobicContact CE2-CD1 3.89Å; F695-Y752 HydrophobicContact CE2-CE1 4.26Å; F695-Y752 AromaticContact CG-CD1 3.98Å; F695-Y752 HydrophobicContact CG-CD1 3.98Å; F695-Y752 AromaticContact CG-CE1 3.5Å; F695-Y752 HydrophobicContact CG-CE1 3.5Å; F695-Y752 HydrophobicContact CZ-CD1 4.2Å; F695-Y752 HydrophobicContact CZ-CE1 4.45Å; L699-Y752 HydrophobicContact CD1-CD1 4.07Å; L699-Y752 HydrophobicContact CD1-CG 4.09Å; L699-Y752 HydrophobicContact CD2-CD2 4.24Å; L699-Y752 HydrophobicContact CD2-CG 4.39Å; V711-Y752 HydrophobicContact CG1-CD2 4.31Å; V715-Y752 HydrophobicContact CG2-CD2 4.45Å; W718-Y752 HydrophobicContact CZ3-CD2 4.46Å; W718-Y752 HydrophobicContact CZ3-CE2 4.11Å; L748-Y752 HydrophobicContact CD1-CD1 4.21Å; L748-Y752 HydrophobicContact CD1-CE1 3.63Å; L748-Y752 HydrophobicContact CG-CD1 4.38Å; L748-Y752 HydrophobicContact CG-CE1 3.88Å; L748-Y752 WeakPolarHBondContact O-CD1 3.42Å; L748-Y752 PolarHBondContact O-N 3.33Å; A749-Y752 PolarHBondContact O-N 3.02Å; L750-Y752 VanDerWaalsContact C-N 3.32Å; L750-Y752 PolarHBondContact O-N 3.33Å; Y752-E754 VanDerWaalsContact C-N 3.31Å; Y752-E754 PolarHBondContact O-N 3.48Å; Y752-Y755 PolarHBondContact O-N 3.32Å; Y752-L756 WeakPolarHBondContact O-CB 3.2Å; Y752-L756 WeakPolarHBondContact O-CG 3.49Å; Y752-L756 PolarHBondContact O-N 3.18Å
753L93.3Very high89.7Confident2 Ų239.3 Ų39.31%0.0121%0.211CC..Hα-helixtrans-59.1-42.8175.7-71.5178.7000112.2L712 V715 L719 A749 L750 Y755 L756 F757 L777 L781L712-L753 HydrophobicContact CD2-CD2 4.07Å; V715-L753 HydrophobicContact CG1-CD1 3.62Å; V715-L753 HydrophobicContact CG1-CD2 3.91Å; V715-L753 HydrophobicContact CG1-CG 3.64Å; V715-L753 HydrophobicContact CG2-CG 4.48Å; L719-L753 HydrophobicContact CD1-CD1 4.28Å; A749-L753 PolarHBondContact O-N 2.76Å; L750-L753 HydrophobicContact CD2-CD1 4.38Å; L750-L753 PolarHBondContact O-N 2.94Å; L753-Y755 PolarHBondContact O-N 3.21Å; L753-L756 PolarHBondContact O-N 3.35Å; L753-F757 HydrophobicContact CD2-CE2 4.19Å; L753-F757 WeakPolarHBondContact O-CD2 3.48Å; L753-F757 PolarHBondContact O-N 3.21Å; L753-L777 HydrophobicContact CD1-CD1 4.29Å; L753-L777 HydrophobicContact CD1-CD2 4.24Å; L753-L777 HydrophobicContact CD2-CD2 3.73Å; L753-L781 HydrophobicContact CD1-CD1 4.41Å
754E92.5Very high90.3Very high94 Ų9437.6 Ų37.644%0.43920%0.203SC..Hα-helixtrans-52.7-56.8174.3-174.2146.1-178.600111.1L750 Y752 L756 F757 T758 Y813L750-E754 WeakPolarHBondContact O-CB 3.11Å; L750-E754 PolarHBondContact O-N 2.93Å; Y752-E754 VanDerWaalsContact C-N 3.31Å; Y752-E754 PolarHBondContact O-N 3.48Å; E754-L756 VanDerWaalsContact C-N 3.33Å; E754-L756 PolarHBondContact O-N 2.84Å; E754-F757 PolarHBondContact O-N 3.26Å; E754-T758 VanDerWaalsContact O-CB 3.27Å; E754-T758 WeakPolarHBondContact O-CB 3.31Å; E754-T758 PolarHBondContact O-N 3.22Å; E754-T758 PolarHBondContact O-OG1 2.88Å; E754-Y813 VanDerWaalsContact CA-OH 3.27Å; E754-Y813 WeakPolarHBondContact CA-OH 3.18Å; E754-Y813 HydrophobicContact CB-CE1 4.4Å; E754-Y813 WeakPolarHBondContact CB-OH 3.45Å; E754-Y813 WeakPolarHBondContact CG-OH 3.32Å; E754-Y813 PolarHBondContact OE2-OH 2.85Å
755Y93Very high90.7Very high23 Ų2339.9 Ų39.99%0.0921%0.208CC..Hα-helixtrans-58.9-45.4-179-177.7-89.6000112F695 S696 L699 D700 A751 Y752 L753 F757 H759 T762F695-Y755 HydrophobicContact CE2-CD2 4.49Å; F695-Y755 HydrophobicContact CE2-CG 4.19Å; S696-Y755 WeakPolarHBondContact CB-OH 3.46Å; S696-Y755 PolarHBondContact O-OH 2.96Å; L699-Y755 HydrophobicContact CB-CD1 4.02Å; L699-Y755 HydrophobicContact CB-CE1 4.07Å; L699-Y755 HydrophobicContact CD1-CD1 3.67Å; L699-Y755 HydrophobicContact CD1-CE1 4.48Å; L699-Y755 HydrophobicContact CD1-CG 4.19Å; L699-Y755 HydrophobicContact CG-CD1 4.48Å; D700-Y755 VanDerWaalsContact OD1-CE1 3.29Å; D700-Y755 WeakPolarHBondContact OD1-CE1 3.36Å; D700-Y755 PolarHBondContact OD1-OH 2.93Å; D700-Y755 PolarHBondContact OD2-OH 2.98Å; A751-Y755 PolarHBondContact O-N 2.85Å; A751-Y755 VanDerWaalsContact O-N 3.15Å; Y752-Y755 PolarHBondContact O-N 3.32Å; L753-Y755 PolarHBondContact O-N 3.21Å; Y755-F757 PolarHBondContact O-N 3.44Å; Y755-H759 AromaticContact CD2-CE1 3.3Å; Y755-H759 WeakPolarHBondContact CD2-CE1 3.4Å; Y755-H759 AromaticContact CD2-ND1 3.57Å; Y755-H759 AromaticContact CE2-CE1 3.14Å; Y755-H759 WeakPolarHBondContact CE2-CE1 3.3Å; Y755-H759 AromaticContact CE2-ND1 3.49Å; Y755-H759 WeakPolarHBondContact CE2-ND1 3.24Å; Y755-H759 AromaticContact CE2-NE2 3.66Å; Y755-H759 AromaticContact CG-ND1 3.91Å; Y755-H759 AromaticContact CZ-CE1 3.84Å; Y755-H759 AromaticContact CZ-ND1 3.8Å; Y755-H759 PolarHBondContact O-N 3.37Å; Y755-H759 PolarHBondContact O-ND1 3.26Å; Y755-T762 HydrophobicContact CE1-CG2 4.29Å
756L93.1Very high90.7Very high0 Ų038.6 Ų38.60%020%0.202CC..Hα-helixtrans-60.7-40.4-177.5-74.5176000112.8L699 C703 V711 Y752 L753 E754 T762 R763 V766L699-L756 HydrophobicContact CB-CD2 4.31Å; L699-L756 HydrophobicContact CD1-CD2 4.48Å; L699-L756 HydrophobicContact CD1-CG 4.42Å; C703-L756 WeakPolarHBondContact SG-CD2 3.47Å; V711-L756 HydrophobicContact CG1-CD1 4.07Å; Y752-L756 WeakPolarHBondContact O-CB 3.2Å; Y752-L756 WeakPolarHBondContact O-CG 3.49Å; Y752-L756 PolarHBondContact O-N 3.18Å; L753-L756 PolarHBondContact O-N 3.35Å; E754-L756 VanDerWaalsContact C-N 3.33Å; E754-L756 PolarHBondContact O-N 2.84Å; L756-T762 HydrophobicContact CD2-CG2 4.38Å; L756-T762 CarbonylContact O-C 3.56Å; L756-T762 PolarHBondContact O-OG1 2.89Å; L756-R763 WeakPolarHBondContact O-CA 3.37Å; L756-R763 PolarHBondContact O-N 2.92Å; L756-V766 HydrophobicContact CB-CG2 4.2Å; L756-V766 HydrophobicContact CD1-CG2 4.2Å; L756-V766 HydrophobicContact CD2-CG2 3.97Å; L756-V766 HydrophobicContact CG-CG2 4.34Å
757F90.1Very high90.7Very high13 Ų1338.6 Ų38.66%0.05720%0.201CC..Hα-helixtrans-90.7-22.8-177.6-77.5-80.6000114L753 E754 Y755 R763 V766 L767 L774 L817 H820L753-F757 HydrophobicContact CD2-CE2 4.19Å; L753-F757 WeakPolarHBondContact O-CD2 3.48Å; L753-F757 PolarHBondContact O-N 3.21Å; E754-F757 PolarHBondContact O-N 3.26Å; Y755-F757 PolarHBondContact O-N 3.44Å; F757-R763 HydrophobicContact CD1-CG 3.99Å; F757-R763 WeakPolarHBondContact O-CD 3.39Å; F757-R763 PolarHBondContact O-NH1 3.15Å; F757-V766 HydrophobicContact CE1-CG1 4.26Å; F757-V766 HydrophobicContact CE2-CG1 4Å; F757-V766 HydrophobicContact CZ-CG1 3.59Å; F757-L767 HydrophobicContact CE1-CD2 4.08Å; F757-L767 HydrophobicContact CE1-CG 4.43Å; F757-L774 HydrophobicContact CZ-CD2 4.45Å; F757-L817 HydrophobicContact CE1-CD1 3.84Å; F757-L817 HydrophobicContact CE2-CD1 4Å; F757-L817 HydrophobicContact CZ-CD1 3.39Å; F757-H820 HydrophobicContact CD1-CB 4.3Å; F757-H820 AromaticContact CD1-CD2 3.44Å; F757-H820 VanDerWaalsContact CD1-CD2 3.44Å; F757-H820 WeakPolarHBondContact CD1-CD2 3.47Å; F757-H820 AromaticContact CD1-CG 3.85Å; F757-H820 AromaticContact CD1-NE2 3.92Å; F757-H820 HydrophobicContact CE1-CB 4.22Å
758T89.3Confident90.6Very high90 Ų9040 Ų4055%0.55222%0.219SC*.Hα-helixtrans-72.2-32.8175.2-65.80000112.7E754E754-T758 VanDerWaalsContact O-CB 3.27Å; E754-T758 WeakPolarHBondContact O-CB 3.31Å; E754-T758 PolarHBondContact O-N 3.22Å; E754-T758 PolarHBondContact O-OG1 2.88Å
759H87.8Confident90.3Very high77 Ų7741.9 Ų41.936%0.35623%0.231SC..SBendtrans-96.1122.7-178.4-61.280.1000111.6Y755 S761 T762 R763Y755-H759 AromaticContact CD2-CE1 3.3Å; Y755-H759 WeakPolarHBondContact CD2-CE1 3.4Å; Y755-H759 AromaticContact CD2-ND1 3.57Å; Y755-H759 AromaticContact CE2-CE1 3.14Å; Y755-H759 WeakPolarHBondContact CE2-CE1 3.3Å; Y755-H759 AromaticContact CE2-ND1 3.49Å; Y755-H759 WeakPolarHBondContact CE2-ND1 3.24Å; Y755-H759 AromaticContact CE2-NE2 3.66Å; Y755-H759 AromaticContact CG-ND1 3.91Å; Y755-H759 AromaticContact CZ-CE1 3.84Å; Y755-H759 AromaticContact CZ-ND1 3.8Å; Y755-H759 PolarHBondContact O-N 3.37Å; Y755-H759 PolarHBondContact O-ND1 3.26Å; H759-S761 VanDerWaalsContact C-N 3.28Å; H759-S761 PolarHBondContact O-N 3.39Å; H759-T762 WeakPolarHBondContact CB-OG1 3.28Å; H759-T762 PolarHBondContact O-N 3.3Å; H759-T762 PolarHBondContact O-OG1 2.84Å; H759-R763 WeakPolarHBondContact O-CB 3.28Å; H759-R763 PolarHBondContact O-N 3Å
760T86.2Confident89.7Confident75 Ų7543.5 Ų43.546%0.4625%0.247SC..Hα-helixtrans-52.8-43.7-176.5-52.10000112.9T762 R763 E764T760-T762 PolarHBondContact O-N 3.44Å; T760-R763 PolarHBondContact O-N 3.24Å; T760-E764 WeakPolarHBondContact CG2-OE1 3.44Å; T760-E764 WeakPolarHBondContact O-CG 3.37Å; T760-E764 PolarHBondContact O-N 3.12Å
761S84.5Confident89.1Confident63 Ų6349.9 Ų49.944%0.44128%0.277SS..Hα-helixtrans-69.2-30.2-174.8760000114.5H759 K765H759-S761 VanDerWaalsContact C-N 3.28Å; H759-S761 PolarHBondContact O-N 3.39Å; S761-K765 WeakPolarHBondContact O-CD 3.41Å; S761-K765 WeakPolarHBondContact O-CG 3.33Å
762T90.1Very high88.8Confident0 Ų050.3 Ų50.30%029%0.285CS..Hα-helixtrans-84.7-39.2174.649.10000110.3D700 C703 Y755 L756 H759 T760 E764 K765 V766D700-T762 VanDerWaalsContact OD1-CG2 3.24Å; D700-T762 WeakPolarHBondContact OD1-CG2 3.32Å; C703-T762 HydrophobicContact CB-CG2 4.23Å; Y755-T762 HydrophobicContact CE1-CG2 4.29Å; L756-T762 HydrophobicContact CD2-CG2 4.38Å; L756-T762 CarbonylContact O-C 3.56Å; L756-T762 PolarHBondContact O-OG1 2.89Å; H759-T762 WeakPolarHBondContact CB-OG1 3.28Å; H759-T762 PolarHBondContact O-N 3.3Å; H759-T762 PolarHBondContact O-OG1 2.84Å; T760-T762 PolarHBondContact O-N 3.44Å; T762-E764 PolarHBondContact O-N 3.13Å; T762-K765 PolarHBondContact O-N 3.38Å; T762-K765 VanDerWaalsContact O-N 3.09Å; T762-V766 VanDerWaalsContact O-CG2 3.31Å; T762-V766 WeakPolarHBondContact O-CG2 3.45Å; T762-V766 PolarHBondContact O-N 3.34Å
763R91.7Very high88.5Confident68 Ų6852.8 Ų52.826%0.25730%0.301SS..Hα-helixtrans-56.4-48.4178.6-179.7175.463.4-140.74.8111.8L756 F757 H759 T760 K765 V766 L767L756-R763 WeakPolarHBondContact O-CA 3.37Å; L756-R763 PolarHBondContact O-N 2.92Å; F757-R763 HydrophobicContact CD1-CG 3.99Å; F757-R763 WeakPolarHBondContact O-CD 3.39Å; F757-R763 PolarHBondContact O-NH1 3.15Å; H759-R763 WeakPolarHBondContact O-CB 3.28Å; H759-R763 PolarHBondContact O-N 3Å; T760-R763 PolarHBondContact O-N 3.24Å; R763-K765 VanDerWaalsContact C-N 3.27Å; R763-K765 PolarHBondContact O-N 3.22Å; R763-V766 PolarHBondContact O-N 3.49Å; R763-L767 HydrophobicContact CG-CD1 3.84Å; R763-L767 HydrophobicContact CG-CG 4.35Å; R763-L767 WeakPolarHBondContact O-CB 3.41Å; R763-L767 VanDerWaalsContact O-CG 3.29Å; R763-L767 WeakPolarHBondContact O-CG 3.19Å; R763-L767 PolarHBondContact O-N 3.45Å
764E89.1Confident88.4Confident127 Ų12752.9 Ų52.959%0.59330%0.302SS*.Hα-helixtrans-58.5-40.2177.5-73.5172.9-177.100112T760 T762 A768T760-E764 WeakPolarHBondContact CG2-OE1 3.44Å; T760-E764 WeakPolarHBondContact O-CG 3.37Å; T760-E764 PolarHBondContact O-N 3.12Å; T762-E764 PolarHBondContact O-N 3.13Å; E764-A768 WeakPolarHBondContact O-CB 3.49Å; E764-A768 PolarHBondContact O-N 2.92Å
765K90.1Very high88.3Confident75 Ų7554.1 Ų54.133%0.32631%0.305SS..Hα-helixtrans-72.6-37-180-66.2170.4-179.7167.30112.4C703 S704 S761 T762 R763 A768C703-K765 HydrophobicContact CB-CB 4.18Å; C703-K765 HydrophobicContact CB-CD 3.79Å; C703-K765 WeakPolarHBondContact O-CD 3.42Å; S704-K765 PolarHBondContact OG-NZ 3.28Å; S761-K765 WeakPolarHBondContact O-CD 3.41Å; S761-K765 WeakPolarHBondContact O-CG 3.33Å; T762-K765 PolarHBondContact O-N 3.38Å; T762-K765 VanDerWaalsContact O-N 3.09Å; R763-K765 VanDerWaalsContact C-N 3.27Å; R763-K765 PolarHBondContact O-N 3.22Å; K765-A768 PolarHBondContact O-N 2.95Å
766V90.9Very high88.1Confident0 Ų059.9 Ų59.90%033%0.333CS..Hα-helixtrans-67.9-44176.1169.10000110.7A708 L712 L756 F757 T762 R763 A768 V769 L774A708-V766 HydrophobicContact CB-CG2 4.09Å; L712-V766 HydrophobicContact CD1-CG1 4.19Å; L712-V766 HydrophobicContact CD2-CG1 4.14Å; L756-V766 HydrophobicContact CB-CG2 4.2Å; L756-V766 HydrophobicContact CD1-CG2 4.2Å; L756-V766 HydrophobicContact CD2-CG2 3.97Å; L756-V766 HydrophobicContact CG-CG2 4.34Å; F757-V766 HydrophobicContact CE1-CG1 4.26Å; F757-V766 HydrophobicContact CE2-CG1 4Å; F757-V766 HydrophobicContact CZ-CG1 3.59Å; T762-V766 VanDerWaalsContact O-CG2 3.31Å; T762-V766 WeakPolarHBondContact O-CG2 3.45Å; T762-V766 PolarHBondContact O-N 3.34Å; R763-V766 PolarHBondContact O-N 3.49Å; V766-A768 PolarHBondContact O-N 3.07Å; V766-V769 WeakPolarHBondContact O-CB 3.35Å; V766-V769 WeakPolarHBondContact O-CG2 3.34Å; V766-V769 PolarHBondContact O-N 3.18Å; V766-L774 HydrophobicContact CG1-CD2 4.11Å
767L88.9Confident88.1Confident18 Ų1859.9 Ų59.99%0.09433%0.333CS..Hα-helixtrans-64.4-24.7176-68.7173000112.5F757 R763 L774 L821 H824F757-L767 HydrophobicContact CE1-CD2 4.08Å; F757-L767 HydrophobicContact CE1-CG 4.43Å; R763-L767 HydrophobicContact CG-CD1 3.84Å; R763-L767 HydrophobicContact CG-CG 4.35Å; R763-L767 WeakPolarHBondContact O-CB 3.41Å; R763-L767 VanDerWaalsContact O-CG 3.29Å; R763-L767 WeakPolarHBondContact O-CG 3.19Å; R763-L767 PolarHBondContact O-N 3.45Å; L767-L774 HydrophobicContact CD2-CD1 4.38Å; L767-L821 HydrophobicContact CD2-CD2 4.1Å; L767-H824 HydrophobicContact CD1-CB 4.37Å; L767-H824 HydrophobicContact CD2-CB 4.46Å
768A88.2Confident88.3Confident78 Ų7859.8 Ų59.865%0.64533%0.333SS*.THydrogen-bonded Turntrans-79.6-6.6176.300000115.2E764 K765 V766 G770E764-A768 WeakPolarHBondContact O-CB 3.49Å; E764-A768 PolarHBondContact O-N 2.92Å; K765-A768 PolarHBondContact O-N 2.95Å; V766-A768 PolarHBondContact O-N 3.07Å; A768-G770 PolarHBondContact O-N 3.29Å
769V85.6Confident88.5Confident42 Ų4259.9 Ų59.926%0.25533%0.333SS..THydrogen-bonded Turntrans-66-22.2-179.1171.70000112.9A708 A709 L712 V766 P773A708-V769 HydrophobicContact CB-CG2 3.57Å; A709-V769 HydrophobicContact CB-CG1 3.61Å; L712-V769 HydrophobicContact CD1-CB 4.46Å; L712-V769 HydrophobicContact CD1-CG1 4.31Å; L712-V769 HydrophobicContact CD1-CG2 4.48Å; V766-V769 WeakPolarHBondContact O-CB 3.35Å; V766-V769 WeakPolarHBondContact O-CG2 3.34Å; V766-V769 PolarHBondContact O-N 3.18Å; V769-P773 HydrophobicContact CG1-CB 4.44Å; V769-P773 HydrophobicContact CG1-CG 4.2Å
770G80.1Confident88.7Confident33 Ų3357.8 Ų57.834%0.3433%0.325SS..  trans111.8156.7-178.800000112.9A768 G772A768-G770 PolarHBondContact O-N 3.29Å; G770-G772 PolarHBondContact O-N 3.34Å
771E80.4Confident89.1Confident138 Ų13854.3 Ų54.365%0.64530%0.303SS*.Hα-helixtrans-67.6-30.7-170.9-67.3-17517400114.2L774 K775E771-L774 PolarHBondContact O-N 3.41Å; E771-K775 WeakPolarHBondContact O-CB 3.38Å; E771-K775 PolarHBondContact O-N 3.08Å
772G85.6Confident89.4Confident41 Ų4152 Ų5242%0.42329%0.289SS..Hα-helixtrans-57.3-64.1-175.500000113.3G770 L774 K775 E776G770-G772 PolarHBondContact O-N 3.34Å; G772-L774 VanDerWaalsContact C-N 3.26Å; G772-L774 PolarHBondContact O-N 2.96Å; G772-K775 PolarHBondContact O-N 3.32Å; G772-K775 VanDerWaalsContact O-N 3.16Å; G772-E776 WeakPolarHBondContact O-CG 3.45Å; G772-E776 PolarHBondContact O-N 3.18Å
773P88.4Confident89.5Confident52 Ų5253.9 Ų53.934%0.33830%0.303SS..Hα-helixtrans-58.1-36.3179.8-26.435.6000113.4V769 L777V769-P773 HydrophobicContact CG1-CB 4.44Å; V769-P773 HydrophobicContact CG1-CG 4.2Å; P773-L777 WeakPolarHBondContact O-CB 3.42Å; P773-L777 PolarHBondContact O-N 3.4Å
774L91Very high89.5Confident4 Ų450.7 Ų50.72%0.02129%0.29CS..Hα-helixtrans-71.7-36.9179.4-66.5171.2000112.3L712 F757 V766 L767 E771 G772 H778 L821L712-L774 HydrophobicContact CD1-CD2 3.78Å; L712-L774 HydrophobicContact CD1-CG 4.48Å; F757-L774 HydrophobicContact CZ-CD2 4.45Å; V766-L774 HydrophobicContact CG1-CD2 4.11Å; L767-L774 HydrophobicContact CD2-CD1 4.38Å; E771-L774 PolarHBondContact O-N 3.41Å; G772-L774 VanDerWaalsContact C-N 3.26Å; G772-L774 PolarHBondContact O-N 2.96Å; L774-H778 VanDerWaalsContact O-CB 3.28Å; L774-H778 WeakPolarHBondContact O-CB 3.43Å; L774-H778 PolarHBondContact O-N 3.09Å; L774-L821 HydrophobicContact CB-CD1 4.42Å; L774-L821 HydrophobicContact CB-CD2 3.89Å; L774-L821 HydrophobicContact CD1-CD2 3.87Å; L774-L821 HydrophobicContact CG-CD2 4.39Å
775K89.3Confident89.6Confident120 Ų12048.5 Ų48.552%0.52228%0.279SS..Hα-helixtrans-70.8-37.4175.2-173.4174.6-176.9169.90111.6E771 G772 T779E771-K775 WeakPolarHBondContact O-CB 3.38Å; E771-K775 PolarHBondContact O-N 3.08Å; G772-K775 PolarHBondContact O-N 3.32Å; G772-K775 VanDerWaalsContact O-N 3.16Å; K775-T779 WeakPolarHBondContact O-CB 3.21Å; K775-T779 PolarHBondContact O-N 3.34Å; K775-T779 PolarHBondContact O-OG1 2.59Å
776E90.1Very high89.6Confident143 Ų14347.1 Ų47.167%0.66828%0.279SS*.Hα-helixtrans-62.4-49.2172-73.9177.9-177.600110.9G772 H778 T779 L780G772-E776 WeakPolarHBondContact O-CG 3.45Å; G772-E776 PolarHBondContact O-N 3.18Å; E776-H778 PolarHBondContact O-N 2.9Å; E776-T779 PolarHBondContact O-N 2.94Å; E776-L780 WeakPolarHBondContact O-CB 3.39Å; E776-L780 PolarHBondContact O-N 3.36Å
777L93.4Very high89.5Confident0 Ų047.5 Ų47.50%028%0.281CS..Hα-helixtrans-60.3-44.7176.4177.862.2000112.3L712 V715 L719 L753 P773 T779 L780 L781 L817L712-L777 HydrophobicContact CD2-CD2 4.04Å; V715-L777 HydrophobicContact CG1-CD1 4.15Å; L719-L777 HydrophobicContact CD1-CD1 4.09Å; L753-L777 HydrophobicContact CD1-CD1 4.29Å; L753-L777 HydrophobicContact CD1-CD2 4.24Å; L753-L777 HydrophobicContact CD2-CD2 3.73Å; P773-L777 WeakPolarHBondContact O-CB 3.42Å; P773-L777 PolarHBondContact O-N 3.4Å; L777-T779 VanDerWaalsContact C-N 3.35Å; L777-T779 PolarHBondContact O-N 3.29Å; L777-L780 PolarHBondContact O-N 2.94Å; L777-L781 HydrophobicContact CD1-CD1 4.19Å; L777-L781 HydrophobicContact CD1-CG 4.2Å; L777-L781 HydrophobicContact CG-CD1 4.05Å; L777-L781 WeakPolarHBondContact O-CB 3.42Å; L777-L781 WeakPolarHBondContact O-CG 3.4Å; L777-L781 PolarHBondContact O-N 3.39Å; L777-L817 HydrophobicContact CB-CD2 4.41Å; L777-L817 HydrophobicContact CD2-CD2 3.99Å; L777-L817 HydrophobicContact CG-CD2 3.95Å
778H93.6Very high89.5Confident12 Ų1246.7 Ų46.76%0.05628%0.277CS..Hα-helixtrans-59.5-45.4175.3177.4-94.1000111.4L774 E776 L780 L781 G782 H814 L817 L821 Y831 S834L774-H778 VanDerWaalsContact O-CB 3.28Å; L774-H778 WeakPolarHBondContact O-CB 3.43Å; L774-H778 PolarHBondContact O-N 3.09Å; E776-H778 PolarHBondContact O-N 2.9Å; H778-L780 VanDerWaalsContact C-N 3.34Å; H778-L780 PolarHBondContact O-N 3.47Å; H778-L781 PolarHBondContact O-N 3.34Å; H778-G782 PolarHBondContact O-N 3.01Å; H778-H814 AromaticContact CD2-CD2 3.71Å; H778-H814 PolarHBondContact CD2-O 3.23Å; H778-H814 AromaticContact CE1-CD2 3.79Å; H778-H814 AromaticContact CE1-NE2 3.38Å; H778-H814 PolarHBondContact CE1-NE2 3.4Å; H778-H814 AromaticContact NE2-CD2 3.53Å; H778-H814 AromaticContact NE2-NE2 3.4Å; H778-H814 PolarHBondContact NE2-NE2 2.85Å; H778-H814 PolarHBondContact O-CD2 3.19Å; H778-H814 VanDerWaalsContact O-CD2 3.29Å; H778-L817 HydrophobicContact CB-CD2 3.92Å; H778-L817 HydrophobicContact CB-CG 4.46Å; H778-L821 HydrophobicContact CB-CD1 4.18Å; H778-Y831 AromaticContact CE1-CD1 3.94Å; H778-Y831 AromaticContact NE2-CD1 3.93Å; H778-S834 PolarHBondContact CE1-OG 3.28Å; H778-S834 VanDerWaalsContact CE1-OG 3.31Å
779T92.5Very high89.5Confident91 Ų9145.6 Ų45.656%0.55826%0.257SS*.Hα-helixtrans-61.4-43.3176.4-54.20000111.7K775 E776 L777 G782 S783K775-T779 WeakPolarHBondContact O-CB 3.21Å; K775-T779 PolarHBondContact O-N 3.34Å; K775-T779 PolarHBondContact O-OG1 2.59Å; E776-T779 PolarHBondContact O-N 2.94Å; L777-T779 VanDerWaalsContact C-N 3.35Å; L777-T779 PolarHBondContact O-N 3.29Å; T779-G782 PolarHBondContact O-N 3.05Å; T779-S783 PolarHBondContact O-N 3.21Å; T779-S783 VanDerWaalsContact O-N 3.14Å
780L93.4Very high89.6Confident34 Ų3446.2 Ų46.218%0.17826%0.261CS..Hα-helixtrans-61.7-51.2178.1174.459.8000111.3S716 L719 E776 L777 H778 G782 S783 W784S716-L780 VanDerWaalsContact O-CD2 3.26Å; S716-L780 WeakPolarHBondContact O-CD2 3.34Å; L719-L780 HydrophobicContact CB-CD2 3.71Å; L719-L780 HydrophobicContact CB-CG 4.23Å; E776-L780 WeakPolarHBondContact O-CB 3.39Å; E776-L780 PolarHBondContact O-N 3.36Å; L777-L780 PolarHBondContact O-N 2.94Å; H778-L780 VanDerWaalsContact C-N 3.34Å; H778-L780 PolarHBondContact O-N 3.47Å; L780-G782 VanDerWaalsContact C-N 3.25Å; L780-G782 PolarHBondContact O-N 3.19Å; L780-S783 VanDerWaalsContact O-CB 3.31Å; L780-S783 WeakPolarHBondContact O-CB 3.38Å; L780-S783 PolarHBondContact O-N 3.43Å; L780-S783 PolarHBondContact O-OG 2.91Å; L780-W784 VanDerWaalsContact O-CD1 3.3Å
781L93.9Very high89.9Confident1 Ų146.4 Ų46.41%0.00525%0.252CS..Hα-helixtrans-56.8-40.3175.3-71.3167.7000111.3L719 L750 L753 L777 H778 S783 W784 A810 H814 L817L719-L781 HydrophobicContact CD1-CD2 3.78Å; L719-L781 HydrophobicContact CD1-CG 4.48Å; L750-L781 HydrophobicContact CD2-CD2 4Å; L753-L781 HydrophobicContact CD1-CD1 4.41Å; L777-L781 HydrophobicContact CD1-CD1 4.19Å; L777-L781 HydrophobicContact CD1-CG 4.2Å; L777-L781 HydrophobicContact CG-CD1 4.05Å; L777-L781 WeakPolarHBondContact O-CB 3.42Å; L777-L781 WeakPolarHBondContact O-CG 3.4Å; L777-L781 PolarHBondContact O-N 3.39Å; H778-L781 PolarHBondContact O-N 3.34Å; L781-S783 PolarHBondContact O-N 3Å; L781-W784 WeakPolarHBondContact O-CB 3.41Å; L781-W784 PolarHBondContact O-N 3.21Å; L781-A810 HydrophobicContact CD2-CB 4.04Å; L781-H814 HydrophobicContact CB-CB 3.82Å; L781-L817 HydrophobicContact CD1-CD2 3.92Å
782G91.4Very high90.2Very high14 Ų1439.9 Ų39.914%0.14422%0.222CC..Hα-helixtrans-62-26.6175.200000114.2H778 T779 L780 W784 K785H778-G782 PolarHBondContact O-N 3.01Å; T779-G782 PolarHBondContact O-N 3.05Å; L780-G782 VanDerWaalsContact C-N 3.25Å; L780-G782 PolarHBondContact O-N 3.19Å; G782-W784 VanDerWaalsContact C-N 3.28Å; G782-W784 PolarHBondContact O-N 2.9Å; G782-K785 WeakPolarHBondContact O-CD 3.32Å; G782-K785 WeakPolarHBondContact O-CG 3.3Å
783S91.9Very high90.1Very high41 Ų4146.5 Ų46.529%0.28723%0.234SC..Hα-helixtrans-69.5-23.4177.479.40000113.5T779 L780 L781 K785 S786T779-S783 PolarHBondContact O-N 3.21Å; T779-S783 VanDerWaalsContact O-N 3.14Å; L780-S783 VanDerWaalsContact O-CB 3.31Å; L780-S783 WeakPolarHBondContact O-CB 3.38Å; L780-S783 PolarHBondContact O-N 3.43Å; L780-S783 PolarHBondContact O-OG 2.91Å; L781-S783 PolarHBondContact O-N 3Å; S783-K785 PolarHBondContact O-N 3.41Å; S783-K785 VanDerWaalsContact O-N 3.16Å; S783-S786 WeakPolarHBondContact O-CB 3.44Å; S783-S786 PolarHBondContact O-N 3.33Å; S783-S786 PolarHBondContact O-OG 3.22Å
784W92.4Very high89.6Confident0 Ų045.5 Ų45.50%023%0.228CC..THydrogen-bonded Turntrans-66.4-15179.6-74.476.9000113.8L719 A722 V723 P746 L780 L781 G782 S786 V787 L788 P802 T806 A807 A810L719-W784 HydrophobicContact CB-CZ2 4.38Å; L719-W784 HydrophobicContact CD2-CZ2 3.73Å; L719-W784 WeakPolarHBondContact O-CZ2 3.45Å; A722-W784 HydrophobicContact CB-CH2 3.86Å; A722-W784 HydrophobicContact CB-CZ2 3.98Å; V723-W784 HydrophobicContact CG2-CD2 3.93Å; V723-W784 VanDerWaalsContact CG2-CE2 3.42Å; V723-W784 HydrophobicContact CG2-CG 4.17Å; V723-W784 HydrophobicContact CG2-CZ2 3.83Å; V723-W784 VanDerWaalsContact CG2-NE1 3.3Å; P746-W784 HydrophobicContact CB-CH2 3.89Å; P746-W784 HydrophobicContact CB-CZ2 4.29Å; L780-W784 VanDerWaalsContact O-CD1 3.3Å; L781-W784 WeakPolarHBondContact O-CB 3.41Å; L781-W784 PolarHBondContact O-N 3.21Å; G782-W784 VanDerWaalsContact C-N 3.28Å; G782-W784 PolarHBondContact O-N 2.9Å; W784-S786 PolarHBondContact O-N 3.49Å; W784-V787 HydrophobicContact CE3-CG2 4.42Å; W784-V787 WeakPolarHBondContact O-CB 3.37Å; W784-V787 PolarHBondContact O-N 3.39Å; W784-V787 VanDerWaalsContact O-N 3.09Å; W784-L788 PolarHBondContact O-N 2.86Å; W784-P802 HydrophobicContact CH2-CB 4.06Å; W784-P802 HydrophobicContact CH2-CG 4.2Å; W784-P802 HydrophobicContact CZ3-CB 3.62Å; W784-P802 HydrophobicContact CZ3-CG 4.01Å; W784-T806 HydrophobicContact CH2-CG2 4.15Å; W784-T806 HydrophobicContact CZ3-CG2 4.11Å; W784-A807 HydrophobicContact CE3-CB 3.82Å; W784-A807 HydrophobicContact CZ3-CB 4.26Å; W784-A810 HydrophobicContact CB-CB 3.9Å; W784-A810 HydrophobicContact CD2-CB 3.75Å; W784-A810 HydrophobicContact CE3-CB 4.15Å; W784-A810 HydrophobicContact CG-CB 3.65Å
785K91.1Very high88.1Confident81 Ų8150.3 Ų50.335%0.35226%0.262SS..Hα-helixtrans-58.8-29.5169.377-171.9176.2176.70112.6G782 S783 L788 Y789 F811 W841G782-K785 WeakPolarHBondContact O-CD 3.32Å; G782-K785 WeakPolarHBondContact O-CG 3.3Å; S783-K785 PolarHBondContact O-N 3.41Å; S783-K785 VanDerWaalsContact O-N 3.16Å; K785-L788 PolarHBondContact O-N 3.29Å; K785-Y789 WeakPolarHBondContact O-CB 3.29Å; K785-Y789 PolarHBondContact O-N 3.2Å; K785-F811 HydrophobicContact CB-CD2 4.48Å; K785-W841 HydrophobicContact CB-CH2 4Å; K785-W841 HydrophobicContact CB-CZ2 3.95Å; K785-W841 HydrophobicContact CB-CZ3 4.43Å; K785-W841 HydrophobicContact CG-CZ2 4.45Å; K785-W841 WeakPolarHBondContact O-CZ2 3.43Å
786S89.1Confident86.7Confident47 Ų4749.2 Ų49.233%0.32927%0.266SS..Hα-helixtrans-67.3-39175.966.30000111.8S783 W784 Y789 T790S783-S786 WeakPolarHBondContact O-CB 3.44Å; S783-S786 PolarHBondContact O-N 3.33Å; S783-S786 PolarHBondContact O-OG 3.22Å; W784-S786 PolarHBondContact O-N 3.49Å; S786-Y789 PolarHBondContact O-N 2.95Å; S786-T790 PolarHBondContact O-N 3.45Å; S786-T790 PolarHBondContact O-OG1 3.39Å; S786-T790 VanDerWaalsContact O-OG1 3.06Å
787V89Confident85.3Confident8 Ų849.4 Ų49.45%0.04827%0.267CS..Hα-helixtrans-63.8-45175.9-176.30000110.5V723 W784 Y789 T790 H791 P802 A807V723-V787 HydrophobicContact CG1-CG2 4.44Å; W784-V787 HydrophobicContact CE3-CG2 4.42Å; W784-V787 WeakPolarHBondContact O-CB 3.37Å; W784-V787 PolarHBondContact O-N 3.39Å; W784-V787 VanDerWaalsContact O-N 3.09Å; V787-Y789 VanDerWaalsContact C-N 3.34Å; V787-Y789 PolarHBondContact O-N 3.05Å; V787-T790 PolarHBondContact O-N 3.49Å; V787-H791 PolarHBondContact O-CD2 3.38Å; V787-H791 PolarHBondContact O-N 3.44Å; V787-P802 HydrophobicContact CG1-CB 4.5Å; V787-P802 HydrophobicContact CG1-CG 4.49Å; V787-A807 HydrophobicContact CB-CB 4.38Å; V787-A807 HydrophobicContact CG1-CB 4.08Å
788L89.5Confident83.8Confident0 Ų052.4 Ų52.40%028%0.283CS..Hα-helixtrans-60-42.9174-71.7174.3000112.1W784 K785 T790 H791 L792 A807 L808 F811 I869W784-L788 PolarHBondContact O-N 2.86Å; K785-L788 PolarHBondContact O-N 3.29Å; L788-T790 VanDerWaalsContact C-N 3.35Å; L788-T790 PolarHBondContact O-N 2.93Å; L788-H791 PolarHBondContact O-N 2.87Å; L788-L792 PolarHBondContact O-N 2.94Å; L788-A807 HydrophobicContact CD2-CB 3.74Å; L788-A807 HydrophobicContact CG-CB 3.98Å; L788-L808 HydrophobicContact CD2-CB 4.42Å; L788-F811 HydrophobicContact CD1-CB 3.59Å; L788-F811 HydrophobicContact CD1-CD1 4.35Å; L788-F811 HydrophobicContact CD1-CD2 4.17Å; L788-F811 HydrophobicContact CD1-CG 3.8Å; L788-I869 HydrophobicContact CB-CD1 4.04Å; L788-I869 HydrophobicContact CD1-CD1 4.45Å; L788-I869 HydrophobicContact CD1-CG1 4.29Å; L788-I869 HydrophobicContact CD2-CD1 4.31Å; L788-I869 HydrophobicContact CD2-CG1 4.39Å
789Y88.6Confident82.2Confident56 Ų5658 Ų5822%0.2232%0.32CS..Hα-helixtrans-65.7-36.8177.3-167.3-117.4000112.7K785 S786 V787 L792 R793 K845 F849K785-Y789 WeakPolarHBondContact O-CB 3.29Å; K785-Y789 PolarHBondContact O-N 3.2Å; S786-Y789 PolarHBondContact O-N 2.95Å; V787-Y789 VanDerWaalsContact C-N 3.34Å; V787-Y789 PolarHBondContact O-N 3.05Å; Y789-L792 PolarHBondContact O-N 3.36Å; Y789-R793 HydrophobicContact CE1-CG 4.39Å; Y789-R793 WeakPolarHBondContact O-CG 3.43Å; Y789-R793 PolarHBondContact O-N 3.4Å; Y789-K845 HydrophobicContact CD2-CB 4.16Å; Y789-K845 HydrophobicContact CE2-CB 3.79Å; Y789-K845 HydrophobicContact CE2-CD 4.33Å; Y789-K845 HydrophobicContact CE2-CG 4.45Å; Y789-F849 HydrophobicContact CE2-CE2 4.17Å
790T87.2Confident80.8Confident55 Ų5562.8 Ų62.834%0.33733%0.333SS..Hα-helixtrans-63.7-45.1174.5-60.30000111.3S786 V787 L788 L792 R793 S794S786-T790 PolarHBondContact O-N 3.45Å; S786-T790 PolarHBondContact O-OG1 3.39Å; S786-T790 VanDerWaalsContact O-OG1 3.06Å; V787-T790 PolarHBondContact O-N 3.49Å; L788-T790 VanDerWaalsContact C-N 3.35Å; L788-T790 PolarHBondContact O-N 2.93Å; T790-L792 VanDerWaalsContact C-N 3.28Å; T790-L792 PolarHBondContact O-N 2.9Å; T790-R793 PolarHBondContact O-N 3.24Å; T790-R793 VanDerWaalsContact O-N 3.13Å; T790-S794 PolarHBondContact O-N 3.19Å; T790-S794 PolarHBondContact O-OG 3.23Å
791H86.9Confident79.8Confident36 Ų3664.6 Ų64.617%0.16734%0.338CS..Hα-helixtrans-61.7-33.4175.5-80.1-61.1000113.1V787 L788 R793 P802 V804 L865V787-H791 PolarHBondContact O-CD2 3.38Å; V787-H791 PolarHBondContact O-N 3.44Å; L788-H791 PolarHBondContact O-N 2.87Å; H791-R793 VanDerWaalsContact C-N 3.35Å; H791-P802 PolarHBondContact NE2-O 2.97Å; H791-V804 HydrophobicContact CB-CG2 4.21Å; H791-L865 HydrophobicContact CB-CD2 3.84Å
792L86.4Confident79.1Confident1 Ų165.3 Ų65.31%0.00534%0.342CS..Hα-helixtrans-66.2-34.5173.7-78.9169.9000113.4L788 Y789 T790 I846 F849 S862 L865 A866 I869L788-L792 PolarHBondContact O-N 2.94Å; Y789-L792 PolarHBondContact O-N 3.36Å; T790-L792 VanDerWaalsContact C-N 3.28Å; T790-L792 PolarHBondContact O-N 2.9Å; L792-I846 HydrophobicContact CD1-CD1 3.28Å; L792-F849 HydrophobicContact CB-CE2 4.39Å; L792-F849 HydrophobicContact CB-CZ 4.27Å; L792-S862 WeakPolarHBondContact CD2-O 3.38Å; L792-S862 PolarHBondContact O-OG 2.96Å; L792-L865 HydrophobicContact CD2-CB 3.84Å; L792-L865 HydrophobicContact CD2-CD2 3.93Å; L792-L865 HydrophobicContact CD2-CG 3.76Å; L792-L865 HydrophobicContact CG-CD2 3.96Å; L792-L865 HydrophobicContact CG-CG 4.14Å; L792-A866 HydrophobicContact CD2-CB 4.01Å; L792-I869 HydrophobicContact CD1-CD1 3.7Å; L792-I869 HydrophobicContact CD2-CD1 4.5Å; L792-I869 HydrophobicContact CG-CD1 4.14Å
793R83.2Confident78.8Confident181 Ų18170.9 Ų70.968%0.68337%0.365SS*.Hα-helixtrans-89.7-25.1-176.7-65.5-171.598.8179.46.6114.3Y789 T790 H791 F849Y789-R793 HydrophobicContact CE1-CG 4.39Å; Y789-R793 WeakPolarHBondContact O-CG 3.43Å; Y789-R793 PolarHBondContact O-N 3.4Å; T790-R793 PolarHBondContact O-N 3.24Å; T790-R793 VanDerWaalsContact O-N 3.13Å; H791-R793 VanDerWaalsContact C-N 3.35Å; R793-F849 HydrophobicContact CG-CZ 4.23Å
794S77Confident78.7Confident30 Ų3070.7 Ų70.721%0.2136%0.362CS..  trans-100.2127.7-177.466.40000112.4T790 R801T790-S794 PolarHBondContact O-N 3.19Å; T790-S794 PolarHBondContact O-OG 3.23Å; S794-R801 PolarHBondContact OG-NH1 3.22Å
795S60.9Low78.5Confident106 Ų10676.1 Ų76.174%0.74139%0.387SS*.  trans-83.8-8.2171.651.70000113.9
796T59.5Low78.5Confident97 Ų9772.3 Ų72.360%0.59537%0.371SS*.SBendtrans-100.8129.3-178.149.80000112.1D798T796-D798 PolarHBondContact O-N 3.33Å
797E59.6Low78.6Confident147 Ų14770.1 Ų70.169%0.68736%0.355SS*.  trans-74.5112.5170.9-70.1-176.6176.700109.3R861E797-R861 IonicContact OE1-CZ 3.24Å; E797-R861 VanDerWaalsContact OE1-CZ 3.24Å; E797-R861 IonicContact OE1-NH1 2.8Å; E797-R861 PolarHBondContact OE1-NH1 3.38Å; E797-R861 IonicContact OE1-NH2 2.74Å; E797-R861 PolarHBondContact OE1-NH2 3.36Å
798D62.9Low78.7Confident63 Ų6371 Ų7134%0.33736%0.359SS..  trans-95.4113.6172.31760.2000107.9T796 K800 R801T796-D798 PolarHBondContact O-N 3.33Å; D798-K800 PolarHBondContact O-N 3.43Å; D798-K800 PolarHBondContact OD1-N 2.84Å; D798-R801 HydrophobicContact CB-CG 3.77Å; D798-R801 VanDerWaalsContact CB-NE 3.3Å; D798-R801 WeakPolarHBondContact O-CB 3.5Å; D798-R801 PolarHBondContact O-N 3.41Å; D798-R801 IonicContact OD2-CZ 3.69Å; D798-R801 IonicContact OD2-NE 3Å; D798-R801 PolarHBondContact OD2-NE 2.87Å; D798-R801 IonicContact OD2-NH2 3.63Å
799P59.4Low78.9Confident130 Ų13074.8 Ų74.884%0.84438%0.376SS*.THydrogen-bonded Turntrans-66.1-8.2-174.125.5-33.3000113.7
800K64Low79.1Confident191 Ų19172.1 Ų72.183%0.8337%0.365SS*.THydrogen-bonded Turntrans-90.7-1.9173.9-66.7-176.8178179.80113.7D798D798-K800 PolarHBondContact O-N 3.43Å; D798-K800 PolarHBondContact OD1-N 2.84Å
801R70.9Confident79.5Confident72 Ų7269.9 Ų69.927%0.27235%0.351SS..SBendtrans-92.5144.3-178.7-66.3-177.8-166.2170.43.8111.4S794 D798S794-R801 PolarHBondContact OG-NH1 3.22Å; D798-R801 HydrophobicContact CB-CG 3.77Å; D798-R801 VanDerWaalsContact CB-NE 3.3Å; D798-R801 WeakPolarHBondContact O-CB 3.5Å; D798-R801 PolarHBondContact O-N 3.41Å; D798-R801 IonicContact OD2-CZ 3.69Å; D798-R801 IonicContact OD2-NE 3Å; D798-R801 PolarHBondContact OD2-NE 2.87Å; D798-R801 IonicContact OD2-NH2 3.63Å
802P80.7Confident79.8Confident16 Ų1669.3 Ų69.310%0.10435%0.35CS..PPolyproline II helixtrans-57.2146.8170.6-23.533.6000112A722 W784 V787 H791A722-P802 WeakPolarHBondContact O-CG 3.45Å; W784-P802 HydrophobicContact CH2-CB 4.06Å; W784-P802 HydrophobicContact CH2-CG 4.2Å; W784-P802 HydrophobicContact CZ3-CB 3.62Å; W784-P802 HydrophobicContact CZ3-CG 4.01Å; V787-P802 HydrophobicContact CG1-CB 4.5Å; V787-P802 HydrophobicContact CG1-CG 4.49Å; H791-P802 PolarHBondContact NE2-O 2.97Å
803E85.7Confident80.1Confident131 Ų13170 Ų7061%0.61235%0.353SS*.PPolyproline II helixtrans-60.7147.1177.3-62.3-172.9175.700111.5E805 T806 A807E803-E805 PolarHBondContact O-N 2.71Å; E803-T806 PolarHBondContact O-N 3.29Å; E803-A807 PolarHBondContact O-N 3.45Å; E803-A807 VanDerWaalsContact O-N 3.09Å
804V88.1Confident80.7Confident37 Ų3762 Ų6222%0.22432%0.323CS..Hα-helixtrans-59.4-38.1179.2176.80000111H791 A807 L808 L865H791-V804 HydrophobicContact CB-CG2 4.21Å; V804-A807 PolarHBondContact O-N 3.4Å; V804-L808 WeakPolarHBondContact O-CB 3.2Å; V804-L808 PolarHBondContact O-N 3.26Å; V804-L865 HydrophobicContact CG1-CD1 3.42Å; V804-L865 VanDerWaalsContact CG1-CD1 3.42Å; V804-L865 HydrophobicContact CG1-CD2 4.18Å; V804-L865 HydrophobicContact CG1-CG 4.44Å
805E89.3Confident81.4Confident114 Ų11460.9 Ų60.953%0.53332%0.316SS..Hα-helixtrans-65.5-44.9179.8-169.8180154.100111.8E803 A807 L808 K809E803-E805 PolarHBondContact O-N 2.71Å; E805-A807 VanDerWaalsContact C-N 3.34Å; E805-A807 PolarHBondContact O-N 3.39Å; E805-L808 PolarHBondContact O-N 2.94Å; E805-K809 HydrophobicContact CG-CD 4.48Å; E805-K809 WeakPolarHBondContact O-CG 3.44Å; E805-K809 PolarHBondContact O-N 3.5Å; E805-K809 WeakPolarHBondContact OE1-CE 3.37Å; E805-K809 IonicContact OE1-NZ 3.45Å; E805-K809 PolarHBondContact OE1-NZ 2.87Å
806T90.4Very high82.9Confident1 Ų159.4 Ų59.41%0.00630%0.295CS..Hα-helixtrans-59.5-45.1175.1-46.20000111.1P746 D747 L750 W784 E803 L808 K809 A810P746-T806 HydrophobicContact CB-CG2 3.7Å; P746-T806 HydrophobicContact CG-CG2 3.96Å; D747-T806 WeakPolarHBondContact OD1-CB 3.39Å; D747-T806 WeakPolarHBondContact OD1-CG2 3.4Å; D747-T806 PolarHBondContact OD1-OG1 3.18Å; D747-T806 PolarHBondContact OD2-OG1 2.94Å; L750-T806 HydrophobicContact CD1-CG2 3.98Å; L750-T806 WeakPolarHBondContact CD1-O 3.3Å; W784-T806 HydrophobicContact CH2-CG2 4.15Å; W784-T806 HydrophobicContact CZ3-CG2 4.11Å; E803-T806 PolarHBondContact O-N 3.29Å; T806-L808 PolarHBondContact O-N 2.99Å; T806-K809 PolarHBondContact O-N 3.39Å; T806-A810 PolarHBondContact O-N 3.33Å
807A91.2Very high84.4Confident0 Ų055 Ų550%027%0.268CS..Hα-helixtrans-65.4-37.8178.200000112.7W784 V787 L788 E803 V804 E805 A810 F811W784-A807 HydrophobicContact CE3-CB 3.82Å; W784-A807 HydrophobicContact CZ3-CB 4.26Å; V787-A807 HydrophobicContact CB-CB 4.38Å; V787-A807 HydrophobicContact CG1-CB 4.08Å; L788-A807 HydrophobicContact CD2-CB 3.74Å; L788-A807 HydrophobicContact CG-CB 3.98Å; E803-A807 PolarHBondContact O-N 3.45Å; E803-A807 VanDerWaalsContact O-N 3.09Å; V804-A807 PolarHBondContact O-N 3.4Å; E805-A807 VanDerWaalsContact C-N 3.34Å; E805-A807 PolarHBondContact O-N 3.39Å; A807-A810 PolarHBondContact O-N 3.29Å; A807-F811 WeakPolarHBondContact O-CB 3.34Å; A807-F811 PolarHBondContact O-N 3Å
808L92.3Very high85.9Confident27 Ų2748.1 Ų48.114%0.14124%0.235CC..Hα-helixtrans-67.2-41.8175.4-170.366.9000111.4L788 V804 E805 T806 F811 V812 Q868 I869L788-L808 HydrophobicContact CD2-CB 4.42Å; V804-L808 WeakPolarHBondContact O-CB 3.2Å; V804-L808 PolarHBondContact O-N 3.26Å; E805-L808 PolarHBondContact O-N 2.94Å; T806-L808 PolarHBondContact O-N 2.99Å; L808-F811 HydrophobicContact CD1-CD1 4.49Å; L808-F811 WeakPolarHBondContact O-CB 3.33Å; L808-F811 PolarHBondContact O-N 3.29Å; L808-V812 WeakPolarHBondContact O-CG2 3.47Å; L808-V812 PolarHBondContact O-N 3.03Å; L808-Q868 HydrophobicContact CD2-CB 4.43Å; L808-I869 HydrophobicContact CD1-CG1 4.03Å
809K92.6Very high87.2Confident79 Ų7945.9 Ų45.934%0.34323%0.226SC..Hα-helixtrans-61.1-46.9173.6-74173.3-176161.50111.2L750 E805 T806 F811 V812 Y813L750-K809 HydrophobicContact CD1-CB 3.67Å; E805-K809 HydrophobicContact CG-CD 4.48Å; E805-K809 WeakPolarHBondContact O-CG 3.44Å; E805-K809 PolarHBondContact O-N 3.5Å; E805-K809 WeakPolarHBondContact OE1-CE 3.37Å; E805-K809 IonicContact OE1-NZ 3.45Å; E805-K809 PolarHBondContact OE1-NZ 2.87Å; T806-K809 PolarHBondContact O-N 3.39Å; K809-F811 VanDerWaalsContact C-N 3.31Å; K809-F811 PolarHBondContact O-N 3.23Å; K809-V812 PolarHBondContact O-N 3.23Å; K809-Y813 VanDerWaalsContact O-CD2 3.25Å; K809-Y813 WeakPolarHBondContact O-CD2 3.27Å; K809-Y813 PolarHBondContact O-N 2.89Å
810A93.6Very high88.6Confident0 Ų042 Ų420%020%0.196CC..Hα-helixtrans-59.4-41.3176.500000112.2L750 L781 W784 T806 A807 Y813 H814L750-A810 HydrophobicContact CD1-CB 4.21Å; L750-A810 HydrophobicContact CD2-CB 4.19Å; L781-A810 HydrophobicContact CD2-CB 4.04Å; W784-A810 HydrophobicContact CB-CB 3.9Å; W784-A810 HydrophobicContact CD2-CB 3.75Å; W784-A810 HydrophobicContact CE3-CB 4.15Å; W784-A810 HydrophobicContact CG-CB 3.65Å; T806-A810 PolarHBondContact O-N 3.33Å; A807-A810 PolarHBondContact O-N 3.29Å; A810-Y813 PolarHBondContact O-N 3.33Å; A810-H814 PolarHBondContact O-N 2.94Å
811F94.2Very high89.8Confident9 Ų933.4 Ų33.44%0.03916%0.159CC..Hα-helixtrans-62.2-42.1174.7172.9-102.2000113K785 L788 A807 L808 K809 H814 V838 W841 I869 F873K785-F811 HydrophobicContact CB-CD2 4.48Å; L788-F811 HydrophobicContact CD1-CB 3.59Å; L788-F811 HydrophobicContact CD1-CD1 4.35Å; L788-F811 HydrophobicContact CD1-CD2 4.17Å; L788-F811 HydrophobicContact CD1-CG 3.8Å; A807-F811 WeakPolarHBondContact O-CB 3.34Å; A807-F811 PolarHBondContact O-N 3Å; L808-F811 HydrophobicContact CD1-CD1 4.49Å; L808-F811 WeakPolarHBondContact O-CB 3.33Å; L808-F811 PolarHBondContact O-N 3.29Å; K809-F811 VanDerWaalsContact C-N 3.31Å; K809-F811 PolarHBondContact O-N 3.23Å; F811-H814 WeakPolarHBondContact O-CB 3.39Å; F811-H814 PolarHBondContact O-N 3.12Å; F811-V838 HydrophobicContact CE2-CG1 3.49Å; F811-V838 VanDerWaalsContact CE2-CG1 3.49Å; F811-V838 HydrophobicContact CZ-CG1 3.61Å; F811-W841 HydrophobicContact CE2-CE3 4.45Å; F811-W841 AromaticContact CE2-CZ3 3.94Å; F811-W841 HydrophobicContact CE2-CZ3 3.94Å; F811-W841 HydrophobicContact CZ-CZ3 4.29Å; F811-I869 HydrophobicContact CE1-CG2 4.19Å; F811-I869 HydrophobicContact CZ-CG2 4.3Å; F811-F873 HydrophobicContact CE1-CB 3.87Å; F811-F873 HydrophobicContact CE1-CD2 4.4Å; F811-F873 HydrophobicContact CZ-CB 3.97Å; F811-F873 AromaticContact CZ-CD2 3.94Å; F811-F873 HydrophobicContact CZ-CD2 3.94Å; F811-F873 HydrophobicContact CZ-CG 4.28Å
812V93.9Very high90.7Very high24 Ų2431.2 Ų31.215%0.14515%0.152CC..Hα-helixtrans-64.8-42.5174.11700000111.1L808 K809 H814 G815 R816 V876L808-V812 WeakPolarHBondContact O-CG2 3.47Å; L808-V812 PolarHBondContact O-N 3.03Å; K809-V812 PolarHBondContact O-N 3.23Å; V812-H814 VanDerWaalsContact C-N 3.34Å; V812-H814 PolarHBondContact O-N 2.89Å; V812-G815 PolarHBondContact O-N 2.92Å; V812-R816 HydrophobicContact CG1-CG 4.36Å; V812-R816 PolarHBondContact O-N 3.38Å; V812-V876 HydrophobicContact CB-CG2 4.44Å; V812-V876 HydrophobicContact CG1-CG2 3.89Å
813Y93.6Very high91Very high16 Ų1637 Ų376%0.06318%0.178CC..Hα-helixtrans-67.1-31.2178.3-86.3-69000113.4L750 E754 K809 A810 G815 R816 L817L750-Y813 HydrophobicContact CD2-CD2 4.04Å; E754-Y813 VanDerWaalsContact CA-OH 3.27Å; E754-Y813 WeakPolarHBondContact CA-OH 3.18Å; E754-Y813 HydrophobicContact CB-CE1 4.4Å; E754-Y813 WeakPolarHBondContact CB-OH 3.45Å; E754-Y813 WeakPolarHBondContact CG-OH 3.32Å; E754-Y813 PolarHBondContact OE2-OH 2.85Å; K809-Y813 VanDerWaalsContact O-CD2 3.25Å; K809-Y813 WeakPolarHBondContact O-CD2 3.27Å; K809-Y813 PolarHBondContact O-N 2.89Å; A810-Y813 PolarHBondContact O-N 3.33Å; Y813-G815 VanDerWaalsContact C-N 3.34Å; Y813-G815 PolarHBondContact O-N 3.09Å; Y813-R816 PolarHBondContact O-N 3.49Å; Y813-L817 WeakPolarHBondContact O-CB 3.16Å; Y813-L817 PolarHBondContact O-N 2.87Å
814H94.7Very high90.8Very high12 Ų1235.8 Ų35.86%0.05617%0.172CC..Hα-helixtrans-54-51.9170.2167.9-112.6000110.9H778 L781 A810 F811 V812 G818 S834H778-H814 AromaticContact CD2-CD2 3.71Å; H778-H814 PolarHBondContact CD2-O 3.23Å; H778-H814 AromaticContact CE1-CD2 3.79Å; H778-H814 AromaticContact CE1-NE2 3.38Å; H778-H814 PolarHBondContact CE1-NE2 3.4Å; H778-H814 AromaticContact NE2-CD2 3.53Å; H778-H814 AromaticContact NE2-NE2 3.4Å; H778-H814 PolarHBondContact NE2-NE2 2.85Å; H778-H814 PolarHBondContact O-CD2 3.19Å; H778-H814 VanDerWaalsContact O-CD2 3.29Å; L781-H814 HydrophobicContact CB-CB 3.82Å; A810-H814 PolarHBondContact O-N 2.94Å; F811-H814 WeakPolarHBondContact O-CB 3.39Å; F811-H814 PolarHBondContact O-N 3.12Å; V812-H814 VanDerWaalsContact C-N 3.34Å; V812-H814 PolarHBondContact O-N 2.89Å; H814-G818 PolarHBondContact O-N 3.44Å; H814-S834 PolarHBondContact NE2-OG 3.5Å
815G91.6Very high90.3Very high7 Ų735.8 Ų35.87%0.07217%0.173CC..Hα-helixtrans-71.3-38.1-178.800000113.8V812 Y813 G818 A819V812-G815 PolarHBondContact O-N 2.92Å; Y813-G815 VanDerWaalsContact C-N 3.34Å; Y813-G815 PolarHBondContact O-N 3.09Å; G815-G818 PolarHBondContact O-N 3.14Å; G815-A819 PolarHBondContact O-N 3.02Å
816R92Very high89Confident75 Ų7537.5 Ų37.528%0.28319%0.191SC..Hα-helixtrans-65.2-43174.7-72.8-179.7170.9-177.3-6112.8V812 Y813 G818 A819 H820 V876 D879V812-R816 HydrophobicContact CG1-CG 4.36Å; V812-R816 PolarHBondContact O-N 3.38Å; Y813-R816 PolarHBondContact O-N 3.49Å; R816-G818 VanDerWaalsContact C-N 3.32Å; R816-A819 WeakPolarHBondContact O-CB 3.46Å; R816-A819 PolarHBondContact O-N 3Å; R816-H820 PolarHBondContact O-CD2 3.41Å; R816-H820 VanDerWaalsContact O-CD2 3.29Å; R816-H820 PolarHBondContact O-N 2.95Å; R816-V876 HydrophobicContact CG-CG2 4.43Å; R816-D879 IonicContact NH2-OD2 3.79Å
817L91.8Very high87.5Confident5 Ų541.1 Ų41.13%0.02622%0.221CC..Hα-helixtrans-63.1-42.9173.8179.959.3000110F757 L777 H778 L781 Y813 A819 H820 L821F757-L817 HydrophobicContact CE1-CD1 3.84Å; F757-L817 HydrophobicContact CE2-CD1 4Å; F757-L817 HydrophobicContact CZ-CD1 3.39Å; L777-L817 HydrophobicContact CB-CD2 4.41Å; L777-L817 HydrophobicContact CD2-CD2 3.99Å; L777-L817 HydrophobicContact CG-CD2 3.95Å; H778-L817 HydrophobicContact CB-CD2 3.92Å; H778-L817 HydrophobicContact CB-CG 4.46Å; L781-L817 HydrophobicContact CD1-CD2 3.92Å; Y813-L817 WeakPolarHBondContact O-CB 3.16Å; Y813-L817 PolarHBondContact O-N 2.87Å; L817-A819 VanDerWaalsContact C-N 3.29Å; L817-A819 PolarHBondContact O-N 3.36Å; L817-H820 PolarHBondContact O-N 3.36Å; L817-H820 VanDerWaalsContact O-N 3.14Å; L817-L821 HydrophobicContact CD1-CD1 4.15Å; L817-L821 HydrophobicContact CD1-CD2 4.41Å; L817-L821 HydrophobicContact CD1-CG 4.04Å; L817-L821 HydrophobicContact CG-CD1 3.91Å; L817-L821 HydrophobicContact CG-CG 4.24Å; L817-L821 VanDerWaalsContact O-CG 3.28Å; L817-L821 WeakPolarHBondContact O-CG 3.39Å; L817-L821 PolarHBondContact O-N 3.29Å
818G90.9Very high86.8Confident1 Ų143.5 Ų43.51%0.0125%0.246CC..Hα-helixtrans-53.9-44.4172.500000112.6H814 G815 R816 L821 Q822 Y831H814-G818 PolarHBondContact O-N 3.44Å; G815-G818 PolarHBondContact O-N 3.14Å; R816-G818 VanDerWaalsContact C-N 3.32Å; G818-L821 PolarHBondContact O-N 3.15Å; G818-Q822 WeakPolarHBondContact O-CB 3.49Å; G818-Q822 PolarHBondContact O-N 3.35Å; G818-Y831 WeakPolarHBondContact O-CB 3.48Å
819A90.3Very high86.5Confident16 Ų1646.1 Ų46.113%0.13225%0.254CS..Hα-helixtrans-63-44.1175.400000112.7G815 R816 L817 L821 Q822 H823 I880 L885G815-A819 PolarHBondContact O-N 3.02Å; R816-A819 WeakPolarHBondContact O-CB 3.46Å; R816-A819 PolarHBondContact O-N 3Å; L817-A819 VanDerWaalsContact C-N 3.29Å; L817-A819 PolarHBondContact O-N 3.36Å; A819-L821 PolarHBondContact O-N 3.49Å; A819-Q822 PolarHBondContact O-N 3.06Å; A819-H823 PolarHBondContact O-N 2.92Å; A819-I880 HydrophobicContact CB-CD1 4.33Å; A819-I880 HydrophobicContact CB-CG1 3.78Å; A819-L885 HydrophobicContact CB-CD1 4.24Å; A819-L885 WeakPolarHBondContact O-CD1 3.47Å
820H89.7Confident86.3Confident49 Ų4948 Ų4823%0.22727%0.268CS..Hα-helixtrans-62.6-41.6175.9-77.5-54.6000112.7F757 R816 L817 H823 H824F757-H820 HydrophobicContact CD1-CB 4.3Å; F757-H820 AromaticContact CD1-CD2 3.44Å; F757-H820 VanDerWaalsContact CD1-CD2 3.44Å; F757-H820 WeakPolarHBondContact CD1-CD2 3.47Å; F757-H820 AromaticContact CD1-CG 3.85Å; F757-H820 AromaticContact CD1-NE2 3.92Å; F757-H820 HydrophobicContact CE1-CB 4.22Å; R816-H820 PolarHBondContact O-CD2 3.41Å; R816-H820 VanDerWaalsContact O-CD2 3.29Å; R816-H820 PolarHBondContact O-N 2.95Å; L817-H820 PolarHBondContact O-N 3.36Å; L817-H820 VanDerWaalsContact O-N 3.14Å; H820-H823 PolarHBondContact O-N 3.33Å; H820-H824 WeakPolarHBondContact O-CB 3.44Å; H820-H824 PolarHBondContact O-N 2.97Å; H820-H824 VanDerWaalsContact O-N 3.09Å
821L89.4Confident86.1Confident11 Ų1149.4 Ų49.46%0.05827%0.274CS..Hα-helixtrans-70.2-37.9177.9-64.3176.2000111.7L767 L774 H778 L817 G818 A819 H823 H824 S825 Y831L767-L821 HydrophobicContact CD2-CD2 4.1Å; L774-L821 HydrophobicContact CB-CD1 4.42Å; L774-L821 HydrophobicContact CB-CD2 3.89Å; L774-L821 HydrophobicContact CD1-CD2 3.87Å; L774-L821 HydrophobicContact CG-CD2 4.39Å; H778-L821 HydrophobicContact CB-CD1 4.18Å; L817-L821 HydrophobicContact CD1-CD1 4.15Å; L817-L821 HydrophobicContact CD1-CD2 4.41Å; L817-L821 HydrophobicContact CD1-CG 4.04Å; L817-L821 HydrophobicContact CG-CD1 3.91Å; L817-L821 HydrophobicContact CG-CG 4.24Å; L817-L821 VanDerWaalsContact O-CG 3.28Å; L817-L821 WeakPolarHBondContact O-CG 3.39Å; L817-L821 PolarHBondContact O-N 3.29Å; G818-L821 PolarHBondContact O-N 3.15Å; A819-L821 PolarHBondContact O-N 3.49Å; L821-H823 VanDerWaalsContact C-N 3.34Å; L821-H823 PolarHBondContact O-N 2.94Å; L821-H824 PolarHBondContact O-N 3.29Å; L821-S825 WeakPolarHBondContact O-CB 3.5Å; L821-S825 PolarHBondContact O-N 3.12Å; L821-Y831 HydrophobicContact CB-CD1 3.95Å; L821-Y831 HydrophobicContact CB-CD2 3.74Å; L821-Y831 HydrophobicContact CB-CE1 3.85Å; L821-Y831 HydrophobicContact CB-CE2 3.64Å; L821-Y831 HydrophobicContact CB-CG 3.89Å; L821-Y831 HydrophobicContact CD1-CD1 3.98Å; L821-Y831 HydrophobicContact CD1-CE1 3.39Å; L821-Y831 HydrophobicContact CG-CE1 4.25Å
822Q88.6Confident85.9Confident25 Ų2549.3 Ų49.312%0.11727%0.273CS..Hα-helixtrans-61.9-41.6173.5-173.165.346.900111.8G818 A819 H824 G828 L832G818-Q822 WeakPolarHBondContact O-CB 3.49Å; G818-Q822 PolarHBondContact O-N 3.35Å; A819-Q822 PolarHBondContact O-N 3.06Å; Q822-H824 VanDerWaalsContact C-N 3.35Å; Q822-G828 PolarHBondContact NE2-O 3.19Å; Q822-L832 HydrophobicContact CG-CD1 4.03Å; Q822-L832 HydrophobicContact CG-CD2 4.28Å; Q822-L832 HydrophobicContact CG-CG 3.73Å
823H87.1Confident85.8Confident139 Ų13950 Ų5064%0.64428%0.277SS*.Hα-helixtrans-68.3-34.2178.1-173.267.6000112.9A819 H820 L821 L885A819-H823 PolarHBondContact O-N 2.92Å; H820-H823 PolarHBondContact O-N 3.33Å; L821-H823 VanDerWaalsContact C-N 3.34Å; L821-H823 PolarHBondContact O-N 2.94Å; H823-L885 HydrophobicContact CB-CD1 4.02Å; H823-L885 HydrophobicContact CB-CD2 3.95Å
824H82.6Confident85.7Confident105 Ų10550.3 Ų50.349%0.48628%0.282SS..Hα-helixtrans-83.9-26-178.5-169.8-88.3000113.1L767 H820 L821 Q822L767-H824 HydrophobicContact CD1-CB 4.37Å; L767-H824 HydrophobicContact CD2-CB 4.46Å; H820-H824 WeakPolarHBondContact O-CB 3.44Å; H820-H824 PolarHBondContact O-N 2.97Å; H820-H824 VanDerWaalsContact O-N 3.09Å; L821-H824 PolarHBondContact O-N 3.29Å; Q822-H824 VanDerWaalsContact C-N 3.35Å
825S77.4Confident85.6Confident36 Ų3649.9 Ų49.925%0.25228%0.28SS..  trans-74.6129.4175.8-176.30000111.1L821 A827L821-S825 WeakPolarHBondContact O-CB 3.5Å; L821-S825 PolarHBondContact O-N 3.12Å; S825-A827 VanDerWaalsContact C-N 3.34Å; S825-A827 PolarHBondContact OG-N 3.49Å; S825-A827 PolarHBondContact OG-O 2.73Å
826T60.4Low85.7Confident150 Ų15050.4 Ų50.492%0.9228%0.281SS*.SBendtrans-83.6-7.5178.153.50000113.6
827A59.5Low85.8Confident77 Ų7755 Ų5564%0.63630%0.298SS*.SBendtrans-148.3137.6-178.500000112.6S825S825-A827 VanDerWaalsContact C-N 3.34Å; S825-A827 PolarHBondContact OG-N 3.49Å; S825-A827 PolarHBondContact OG-O 2.73Å
828G76.1Confident85.9Confident50 Ų5055 Ų5552%0.51530%0.298SS..  trans98.5166.6171.500000115.5Q822Q822-G828 PolarHBondContact NE2-O 3.19Å
829R87.1Confident86.1Confident83 Ų8355.3 Ų55.331%0.31330%0.3SS..  trans-116.215.8179.2-62.9-18067.8-134.8-12.6112.2Y831 L832 V833 E836 D887R829-Y831 VanDerWaalsContact C-N 3.27Å; R829-Y831 PolarHBondContact O-N 3.18Å; R829-L832 PolarHBondContact O-N 2.91Å; R829-L832 VanDerWaalsContact O-N 3.14Å; R829-V833 HydrophobicContact CB-CG2 4.19Å; R829-V833 WeakPolarHBondContact O-CB 3.47Å; R829-V833 VanDerWaalsContact O-CG2 3.26Å; R829-V833 WeakPolarHBondContact O-CG2 3.42Å; R829-V833 PolarHBondContact O-N 3.05Å; R829-E836 IonicContact CZ-OE1 3.65Å; R829-E836 IonicContact NH2-OE1 2.88Å; R829-E836 PolarHBondContact NH2-OE1 3.43Å; R829-D887 IonicContact CZ-OD1 2.65Å; R829-D887 IonicContact CZ-OD2 3.12Å; R829-D887 IonicContact NE-OD1 3.73Å; R829-D887 IonicContact NE-OD2 2.7Å; R829-D887 PolarHBondContact NE-OD2 3.41Å; R829-D887 IonicContact NH2-OD1 2.71Å; R829-D887 PolarHBondContact NH2-OD1 3.4Å; R829-D887 IonicContact NH2-OD2 3.29Å; R829-D887 PolarHBondContact NH2-OD2 3.15Å
830D87.5Confident86.2Confident118 Ų11856.6 Ų56.663%0.63131%0.311SS*.Hα-helixtrans-57.7-37.8-167.7-69.1-3.2000113.5S834D830-S834 PolarHBondContact O-N 2.9Å
831Y90.3Very high86.5Confident30 Ų3055.8 Ų55.812%0.11831%0.306CS..Hα-helixtrans-80-35.6179.8-61.2-73.3000112.2H778 G818 L821 R829 S834 V835H778-Y831 AromaticContact CE1-CD1 3.94Å; H778-Y831 AromaticContact NE2-CD1 3.93Å; G818-Y831 WeakPolarHBondContact O-CB 3.48Å; L821-Y831 HydrophobicContact CB-CD1 3.95Å; L821-Y831 HydrophobicContact CB-CD2 3.74Å; L821-Y831 HydrophobicContact CB-CE1 3.85Å; L821-Y831 HydrophobicContact CB-CE2 3.64Å; L821-Y831 HydrophobicContact CB-CG 3.89Å; L821-Y831 HydrophobicContact CD1-CD1 3.98Å; L821-Y831 HydrophobicContact CD1-CE1 3.39Å; L821-Y831 HydrophobicContact CG-CE1 4.25Å; R829-Y831 VanDerWaalsContact C-N 3.27Å; R829-Y831 PolarHBondContact O-N 3.18Å; Y831-S834 WeakPolarHBondContact O-CB 3.49Å; Y831-S834 PolarHBondContact O-N 2.98Å; Y831-V835 WeakPolarHBondContact O-CG2 3.41Å; Y831-V835 PolarHBondContact O-N 2.67Å; Y831-V835 VanDerWaalsContact O-N 3.15Å
832L90.2Very high86.7Confident6 Ų655.3 Ų55.33%0.03130%0.304CS..Hα-helixtrans-61.7-46.5168.1-70.3173.2000111Q822 R829 S834 V835 E836 I880 L885 D887 F890Q822-L832 HydrophobicContact CG-CD1 4.03Å; Q822-L832 HydrophobicContact CG-CD2 4.28Å; Q822-L832 HydrophobicContact CG-CG 3.73Å; R829-L832 PolarHBondContact O-N 2.91Å; R829-L832 VanDerWaalsContact O-N 3.14Å; L832-S834 PolarHBondContact O-N 3.13Å; L832-V835 CarbonylContact O-C 3.4Å; L832-V835 WeakPolarHBondContact O-CA 3.11Å; L832-V835 WeakPolarHBondContact O-CB 3.33Å; L832-V835 PolarHBondContact O-N 3.42Å; L832-E836 WeakPolarHBondContact O-CG 3.48Å; L832-E836 PolarHBondContact O-N 3.04Å; L832-I880 HydrophobicContact CD2-CG2 4.19Å; L832-L885 WeakPolarHBondContact CD1-O 3.4Å; L832-D887 WeakPolarHBondContact CD1-OD2 3.4Å; L832-F890 HydrophobicContact CD2-CD2 4.39Å; L832-F890 HydrophobicContact CD2-CG 4.41Å
833V91.9Very high86.9Confident39 Ų3955.3 Ų55.324%0.23631%0.308CS..Hα-helixtrans-59.7-33.3175.5173.80000111.2R829 E836 R837R829-V833 HydrophobicContact CB-CG2 4.19Å; R829-V833 WeakPolarHBondContact O-CB 3.47Å; R829-V833 VanDerWaalsContact O-CG2 3.26Å; R829-V833 WeakPolarHBondContact O-CG2 3.42Å; R829-V833 PolarHBondContact O-N 3.05Å; V833-E836 WeakPolarHBondContact O-CB 3.29Å; V833-E836 PolarHBondContact O-N 3.37Å; V833-R837 VanDerWaalsContact O-CG 3.26Å; V833-R837 WeakPolarHBondContact O-CG 3.06Å; V833-R837 PolarHBondContact O-N 3.29Å
834S91.4Very high87.1Confident23 Ų2355 Ų5516%0.16131%0.307CS..Hα-helixtrans-62.3-43.8171.4-169.40000112.1H778 H814 D830 Y831 L832 R837 V838H778-S834 PolarHBondContact CE1-OG 3.28Å; H778-S834 VanDerWaalsContact CE1-OG 3.31Å; H814-S834 PolarHBondContact NE2-OG 3.5Å; D830-S834 PolarHBondContact O-N 2.9Å; Y831-S834 WeakPolarHBondContact O-CB 3.49Å; Y831-S834 PolarHBondContact O-N 2.98Å; L832-S834 PolarHBondContact O-N 3.13Å; S834-R837 WeakPolarHBondContact O-CB 3.48Å; S834-R837 PolarHBondContact O-N 3.05Å; S834-V838 WeakPolarHBondContact O-CG2 3.42Å; S834-V838 PolarHBondContact O-N 3Å; S834-V838 VanDerWaalsContact O-N 3.13Å
835V92.1Very high87.5Confident2 Ų254.1 Ų54.11%0.01230%0.302CS..Hα-helixtrans-68.2-38.2176.3-178.60000111.1Y831 L832 R837 V838 A839 F873 I880 F890Y831-V835 WeakPolarHBondContact O-CG2 3.41Å; Y831-V835 PolarHBondContact O-N 2.67Å; Y831-V835 VanDerWaalsContact O-N 3.15Å; L832-V835 CarbonylContact O-C 3.4Å; L832-V835 WeakPolarHBondContact O-CA 3.11Å; L832-V835 WeakPolarHBondContact O-CB 3.33Å; L832-V835 PolarHBondContact O-N 3.42Å; V835-R837 VanDerWaalsContact C-N 3.34Å; V835-R837 PolarHBondContact O-N 3.28Å; V835-V838 CarbonylContact O-C 3.46Å; V835-V838 WeakPolarHBondContact O-CA 3.4Å; V835-V838 WeakPolarHBondContact O-CB 3.39Å; V835-V838 PolarHBondContact O-N 3.16Å; V835-A839 PolarHBondContact O-N 3.33Å; V835-F873 HydrophobicContact CG1-CE2 3.81Å; V835-F873 HydrophobicContact CG1-CZ 3.96Å; V835-I880 HydrophobicContact CG1-CD1 4.16Å; V835-I880 HydrophobicContact CG2-CD1 4.27Å; V835-F890 HydrophobicContact CB-CE2 4.03Å; V835-F890 HydrophobicContact CB-CZ 4.49Å; V835-F890 HydrophobicContact CG1-CE2 3.71Å; V835-F890 HydrophobicContact CG1-CZ 3.8Å
836E93.8Very high88.1Confident18 Ų1852.4 Ų52.48%0.08429%0.29CS..Hα-helixtrans-58.3-43.2171.5-69.8-179.3179.200111.9R829 L832 V833 V838 A839 A840 F890 Q893R829-E836 IonicContact CZ-OE1 3.65Å; R829-E836 IonicContact NH2-OE1 2.88Å; R829-E836 PolarHBondContact NH2-OE1 3.43Å; L832-E836 WeakPolarHBondContact O-CG 3.48Å; L832-E836 PolarHBondContact O-N 3.04Å; V833-E836 WeakPolarHBondContact O-CB 3.29Å; V833-E836 PolarHBondContact O-N 3.37Å; E836-V838 PolarHBondContact O-N 3.39Å; E836-A839 WeakPolarHBondContact O-CA 3.46Å; E836-A839 VanDerWaalsContact O-CB 3.31Å; E836-A839 WeakPolarHBondContact O-CB 3.23Å; E836-A839 PolarHBondContact O-N 3.43Å; E836-A839 VanDerWaalsContact O-N 3.08Å; E836-A840 PolarHBondContact O-N 3.31Å; E836-F890 HydrophobicContact CG-CD2 3.65Å; E836-F890 HydrophobicContact CG-CE2 4.17Å; E836-Q893 PolarHBondContact OE2-NE2 3.24Å; E836-Q893 VanDerWaalsContact OE2-NE2 3.15Å
837R93.6Very high89.5Confident173 Ų17346.1 Ų46.165%0.65325%0.251SS*.Hα-helixtrans-63.8-30.8173.3-71.5169.6-176177.23.2112.4V833 S834 V835 W841V833-R837 VanDerWaalsContact O-CG 3.26Å; V833-R837 WeakPolarHBondContact O-CG 3.06Å; V833-R837 PolarHBondContact O-N 3.29Å; S834-R837 WeakPolarHBondContact O-CB 3.48Å; S834-R837 PolarHBondContact O-N 3.05Å; V835-R837 VanDerWaalsContact C-N 3.34Å; V835-R837 PolarHBondContact O-N 3.28Å; R837-W841 WeakPolarHBondContact O-CB 3.48Å; R837-W841 PolarHBondContact O-N 3.01Å
838V93.8Very high91Very high5 Ų545.3 Ų45.33%0.0324%0.239CC..Hα-helixtrans-70.8-39.7171.6178.70000110.6F811 S834 V835 E836 A840 W841 V842 F873F811-V838 HydrophobicContact CE2-CG1 3.49Å; F811-V838 VanDerWaalsContact CE2-CG1 3.49Å; F811-V838 HydrophobicContact CZ-CG1 3.61Å; S834-V838 WeakPolarHBondContact O-CG2 3.42Å; S834-V838 PolarHBondContact O-N 3Å; S834-V838 VanDerWaalsContact O-N 3.13Å; V835-V838 CarbonylContact O-C 3.46Å; V835-V838 WeakPolarHBondContact O-CA 3.4Å; V835-V838 WeakPolarHBondContact O-CB 3.39Å; V835-V838 PolarHBondContact O-N 3.16Å; E836-V838 PolarHBondContact O-N 3.39Å; V838-A840 VanDerWaalsContact C-N 3.33Å; V838-A840 PolarHBondContact O-N 2.99Å; V838-W841 HydrophobicContact CG1-CE3 4.47Å; V838-W841 CarbonylContact O-C 3.53Å; V838-W841 WeakPolarHBondContact O-CB 3.47Å; V838-W841 PolarHBondContact O-N 3.25Å; V838-W841 VanDerWaalsContact O-N 3.15Å; V838-V842 HydrophobicContact CG1-CG2 4.36Å; V838-V842 WeakPolarHBondContact O-CG2 3.46Å; V838-V842 PolarHBondContact O-N 3.36Å; V838-F873 HydrophobicContact CB-CD2 4.37Å; V838-F873 HydrophobicContact CB-CE2 3.69Å; V838-F873 HydrophobicContact CB-CZ 4.19Å; V838-F873 HydrophobicContact CG1-CD2 3.53Å; V838-F873 HydrophobicContact CG1-CE2 3.36Å; V838-F873 HydrophobicContact CG1-CG 4.37Å; V838-F873 HydrophobicContact CG1-CZ 4.07Å
839A94.3Very high91.5Very high6 Ų644.6 Ų44.65%0.0522%0.222CC..Hα-helixtrans-58-46.1173.600000111.5V835 E836 W841 V842 A843 F873 I894 L897V835-A839 PolarHBondContact O-N 3.33Å; E836-A839 WeakPolarHBondContact O-CA 3.46Å; E836-A839 VanDerWaalsContact O-CB 3.31Å; E836-A839 WeakPolarHBondContact O-CB 3.23Å; E836-A839 PolarHBondContact O-N 3.43Å; E836-A839 VanDerWaalsContact O-N 3.08Å; A839-W841 PolarHBondContact O-N 3.2Å; A839-V842 PolarHBondContact O-N 2.93Å; A839-A843 PolarHBondContact O-N 2.95Å; A839-F873 HydrophobicContact CB-CE1 3.73Å; A839-F873 HydrophobicContact CB-CZ 3.74Å; A839-I894 HydrophobicContact CB-CD1 3.94Å; A839-L897 HydrophobicContact CB-CD2 3.99Å
840A94.2Very high91.3Very high44 Ų4440.8 Ų40.836%0.36421%0.207SC..Hα-helixtrans-60.2-43.3173.900000111.9E836 V838 V842 A843 E844E836-A840 PolarHBondContact O-N 3.31Å; V838-A840 VanDerWaalsContact C-N 3.33Å; V838-A840 PolarHBondContact O-N 2.99Å; A840-V842 PolarHBondContact O-N 2.94Å; A840-A843 PolarHBondContact O-N 3.49Å; A840-E844 WeakPolarHBondContact O-CB 3.29Å; A840-E844 WeakPolarHBondContact O-CG 3.22Å; A840-E844 PolarHBondContact O-N 2.91Å
841W94.9Very high90.7Very high31 Ų3137.9 Ų37.912%0.11719%0.194CC..Hα-helixtrans-63.5-39.5175.8175.981.7000113K785 F811 R837 V838 A839 E844 K845 I846 I869K785-W841 HydrophobicContact CB-CH2 4Å; K785-W841 HydrophobicContact CB-CZ2 3.95Å; K785-W841 HydrophobicContact CB-CZ3 4.43Å; K785-W841 HydrophobicContact CG-CZ2 4.45Å; K785-W841 WeakPolarHBondContact O-CZ2 3.43Å; F811-W841 HydrophobicContact CE2-CE3 4.45Å; F811-W841 AromaticContact CE2-CZ3 3.94Å; F811-W841 HydrophobicContact CE2-CZ3 3.94Å; F811-W841 HydrophobicContact CZ-CZ3 4.29Å; R837-W841 WeakPolarHBondContact O-CB 3.48Å; R837-W841 PolarHBondContact O-N 3.01Å; V838-W841 HydrophobicContact CG1-CE3 4.47Å; V838-W841 CarbonylContact O-C 3.53Å; V838-W841 WeakPolarHBondContact O-CB 3.47Å; V838-W841 PolarHBondContact O-N 3.25Å; V838-W841 VanDerWaalsContact O-N 3.15Å; A839-W841 PolarHBondContact O-N 3.2Å; W841-E844 PolarHBondContact O-N 3.43Å; W841-K845 HydrophobicContact CG-CB 4.49Å; W841-K845 HydrophobicContact CG-CG 4.4Å; W841-K845 WeakPolarHBondContact O-CA 3.49Å; W841-K845 VanDerWaalsContact O-CB 3.3Å; W841-K845 WeakPolarHBondContact O-CB 3.29Å; W841-K845 PolarHBondContact O-N 3.03Å; W841-I846 HydrophobicContact CD2-CG1 4.49Å; W841-I846 HydrophobicContact CE3-CD1 4.47Å; W841-I846 HydrophobicContact CE3-CG1 4.03Å; W841-I846 HydrophobicContact CH2-CD1 3.45Å; W841-I846 VanDerWaalsContact CH2-CD1 3.45Å; W841-I846 HydrophobicContact CH2-CG1 3.88Å; W841-I846 HydrophobicContact CZ2-CD1 3.75Å; W841-I846 HydrophobicContact CZ2-CG1 4.32Å; W841-I846 HydrophobicContact CZ3-CD1 3.84Å; W841-I846 HydrophobicContact CZ3-CG1 3.7Å; W841-I869 HydrophobicContact CH2-CG2 4.42Å; W841-I869 HydrophobicContact CZ3-CG2 4.05Å
842V94.1Very high89.3Confident1 Ų138.8 Ų38.81%0.00621%0.212CC..Iπ-helixtrans-61.5-46.3173.9172.40000110V838 A839 A840 I846 L847 T870 F873 L897V838-V842 HydrophobicContact CG1-CG2 4.36Å; V838-V842 WeakPolarHBondContact O-CG2 3.46Å; V838-V842 PolarHBondContact O-N 3.36Å; A839-V842 PolarHBondContact O-N 2.93Å; A840-V842 PolarHBondContact O-N 2.94Å; V842-I846 HydrophobicContact CG1-CB 4.3Å; V842-I846 HydrophobicContact CG2-CG1 4.5Å; V842-I846 WeakPolarHBondContact O-CA 3.23Å; V842-I846 WeakPolarHBondContact O-CB 3.26Å; V842-I846 PolarHBondContact O-N 3.04Å; V842-I846 VanDerWaalsContact O-N 3.08Å; V842-L847 PolarHBondContact O-N 3.24Å; V842-T870 HydrophobicContact CG1-CG2 4.38Å; V842-F873 HydrophobicContact CG2-CB 4.4Å; V842-F873 HydrophobicContact CG2-CD1 4.06Å; V842-F873 HydrophobicContact CG2-CG 4.15Å; V842-L897 HydrophobicContact CG1-CD1 4.26Å; V842-L897 HydrophobicContact CG1-CD2 4.49Å
843A91.8Very high87.3Confident26 Ų2641.3 Ų41.322%0.21523%0.23CC..Iπ-helixtrans-62.1-44.5177.300000113A839 A840 L847 L897 L900A839-A843 PolarHBondContact O-N 2.95Å; A840-A843 PolarHBondContact O-N 3.49Å; A843-L847 VanDerWaalsContact O-CB 3.31Å; A843-L847 WeakPolarHBondContact O-CB 3.24Å; A843-L897 HydrophobicContact CB-CD1 3.97Å; A843-L900 HydrophobicContact CB-CD1 4.19Å
844E91.7Very high85.1Confident133 Ų13347.9 Ų47.962%0.62126%0.264SS*.Iπ-helixtrans-83.3-33.3-173.8-71.2177-169.800114.3A840 W841 P848A840-E844 WeakPolarHBondContact O-CB 3.29Å; A840-E844 WeakPolarHBondContact O-CG 3.22Å; A840-E844 PolarHBondContact O-N 2.91Å; W841-E844 PolarHBondContact O-N 3.43Å; E844-P848 WeakPolarHBondContact O-CG 3.4Å
845K90.4Very high83Confident86 Ų8654.3 Ų54.337%0.37430%0.297SS..Iπ-helixtrans-114.8-25.3-168.6-59.5-59.9-179.8-169.40114.1Y789 W841 F849Y789-K845 HydrophobicContact CD2-CB 4.16Å; Y789-K845 HydrophobicContact CE2-CB 3.79Å; Y789-K845 HydrophobicContact CE2-CD 4.33Å; Y789-K845 HydrophobicContact CE2-CG 4.45Å; W841-K845 HydrophobicContact CG-CB 4.49Å; W841-K845 HydrophobicContact CG-CG 4.4Å; W841-K845 WeakPolarHBondContact O-CA 3.49Å; W841-K845 VanDerWaalsContact O-CB 3.3Å; W841-K845 WeakPolarHBondContact O-CB 3.29Å; W841-K845 PolarHBondContact O-N 3.03Å; K845-F849 WeakPolarHBondContact O-CD2 3.28Å; K845-F849 VanDerWaalsContact O-CE2 3.23Å; K845-F849 WeakPolarHBondContact O-CE2 3.13Å
846I91.7Very high81.2Confident0 Ų056.8 Ų56.80%032%0.322CS..Iπ-helixtrans-103.5-44.9-175.7-50-61.3000110.9L792 W841 V842 P848 F849 A866 I869L792-I846 HydrophobicContact CD1-CD1 3.28Å; W841-I846 HydrophobicContact CD2-CG1 4.49Å; W841-I846 HydrophobicContact CE3-CD1 4.47Å; W841-I846 HydrophobicContact CE3-CG1 4.03Å; W841-I846 HydrophobicContact CH2-CD1 3.45Å; W841-I846 VanDerWaalsContact CH2-CD1 3.45Å; W841-I846 HydrophobicContact CH2-CG1 3.88Å; W841-I846 HydrophobicContact CZ2-CD1 3.75Å; W841-I846 HydrophobicContact CZ2-CG1 4.32Å; W841-I846 HydrophobicContact CZ3-CD1 3.84Å; W841-I846 HydrophobicContact CZ3-CG1 3.7Å; V842-I846 HydrophobicContact CG1-CB 4.3Å; V842-I846 HydrophobicContact CG2-CG1 4.5Å; V842-I846 WeakPolarHBondContact O-CA 3.23Å; V842-I846 WeakPolarHBondContact O-CB 3.26Å; V842-I846 PolarHBondContact O-N 3.04Å; V842-I846 VanDerWaalsContact O-N 3.08Å; I846-P848 VanDerWaalsContact C-N 3.31Å; I846-F849 WeakPolarHBondContact O-CB 3.41Å; I846-F849 PolarHBondContact O-N 3.48Å; I846-A866 HydrophobicContact CG2-CB 3.82Å; I846-I869 HydrophobicContact CD1-CD1 4.35Å; I846-I869 HydrophobicContact CD1-CG2 4.41Å; I846-I869 HydrophobicContact CG1-CG2 4.25Å; I846-I869 HydrophobicContact CG2-CB 4.4Å; I846-I869 HydrophobicContact CG2-CG2 4.31Å
847L89.5Confident79.5Confident18 Ų1865.7 Ų65.79%0.09436%0.364CS..G310 helixtrans-55.9-33.9179.1-165.662.8000114.5V842 A843 F849 L850 T851 L900 I901V842-L847 PolarHBondContact O-N 3.24Å; A843-L847 VanDerWaalsContact O-CB 3.31Å; A843-L847 WeakPolarHBondContact O-CB 3.24Å; L847-F849 PolarHBondContact O-N 3.03Å; L847-F849 VanDerWaalsContact O-N 3.1Å; L847-L850 HydrophobicContact CD1-CB 4.33Å; L847-L850 HydrophobicContact CD1-CD1 4.13Å; L847-L850 WeakPolarHBondContact O-CA 3.45Å; L847-L850 WeakPolarHBondContact O-CB 3.46Å; L847-L850 PolarHBondContact O-N 3.2Å; L847-T851 PolarHBondContact O-N 3.47Å; L847-L900 HydrophobicContact CD2-CB 3.87Å; L847-I901 HydrophobicContact CD1-CG1 4.25Å
848P89.7Confident78.1Confident59 Ų5959.1 Ų59.138%0.38334%0.343SS..G310 helixtrans-57.6-22.9174.2-28.337.1000115E844 I846 L850 T851E844-P848 WeakPolarHBondContact O-CG 3.4Å; I846-P848 VanDerWaalsContact C-N 3.31Å; P848-L850 VanDerWaalsContact C-N 3.29Å; P848-T851 WeakPolarHBondContact CA-OG1 3.35Å; P848-T851 PolarHBondContact O-OG1 2.91Å; P848-T851 VanDerWaalsContact O-OG1 3.12Å
849F87Confident77.2Confident36 Ų3661.8 Ų61.816%0.15836%0.362CS..G310 helixtrans-82.1-8.5175.2-64.6-87.5000113.1Y789 L792 R793 K845 I846 L847 V858 A866Y789-F849 HydrophobicContact CE2-CE2 4.17Å; L792-F849 HydrophobicContact CB-CE2 4.39Å; L792-F849 HydrophobicContact CB-CZ 4.27Å; R793-F849 HydrophobicContact CG-CZ 4.23Å; K845-F849 WeakPolarHBondContact O-CD2 3.28Å; K845-F849 VanDerWaalsContact O-CE2 3.23Å; K845-F849 WeakPolarHBondContact O-CE2 3.13Å; I846-F849 WeakPolarHBondContact O-CB 3.41Å; I846-F849 PolarHBondContact O-N 3.48Å; L847-F849 PolarHBondContact O-N 3.03Å; L847-F849 VanDerWaalsContact O-N 3.1Å; F849-V858 HydrophobicContact CB-CG1 4.5Å; F849-V858 HydrophobicContact CD1-CG1 3.97Å; F849-A866 HydrophobicContact CB-CB 3.82Å
850L84.3Confident76.5Confident3 Ų367.3 Ų67.32%0.01639%0.387CS..THydrogen-bonded Turntrans-103.5-15.2175.3-58.2179.6000112.5L847 P848 R863 A866 E905 A906L847-L850 HydrophobicContact CD1-CB 4.33Å; L847-L850 HydrophobicContact CD1-CD1 4.13Å; L847-L850 WeakPolarHBondContact O-CA 3.45Å; L847-L850 WeakPolarHBondContact O-CB 3.46Å; L847-L850 PolarHBondContact O-N 3.2Å; P848-L850 VanDerWaalsContact C-N 3.29Å; L850-R863 HydrophobicContact CD2-CG 4.27Å; L850-A866 HydrophobicContact CD2-CB 3.97Å; L850-A866 HydrophobicContact CG-CB 4.23Å; L850-E905 PolarHBondContact O-N 3.42Å; L850-A906 HydrophobicContact CB-CB 4.29Å; L850-A906 HydrophobicContact CD2-CB 4.28Å; L850-A906 WeakPolarHBondContact O-CB 3.45Å; L850-A906 PolarHBondContact O-N 3.04Å
851T73.4Confident75.9Confident57 Ų5771.9 Ų71.935%0.3540%0.395SS..SBendtrans-94.3111.8168.6550000107.7L847 P848 S853L847-T851 PolarHBondContact O-N 3.47Å; P848-T851 WeakPolarHBondContact CA-OG1 3.35Å; P848-T851 PolarHBondContact O-OG1 2.91Å; P848-T851 VanDerWaalsContact O-OG1 3.12Å; T851-S853 PolarHBondContact O-N 3.02Å
852G61.9Low75.5Confident48 Ų4871.1 Ų71.150%0.49539%0.394SS..  trans-54.8117.9175.200000109.9E905G852-E905 WeakPolarHBondContact CA-OE2 3.32Å; G852-E905 PolarHBondContact N-OE2 3.49Å
853S47.3Very low75.1Confident60 Ų6075 Ų7542%0.4241%0.409SS..  trans-90.1135.1174.254.40000109.8T851 D855T851-S853 PolarHBondContact O-N 3.02Å; S853-D855 PolarHBondContact O-N 3.11Å; S853-D855 VanDerWaalsContact O-N 3.12Å
854D45.9Very low74.9Confident176 Ų17680.2 Ų80.294%0.94143%0.426SS*.SBendtrans-61.7-9.9169.6-86.2-31.6000113.3
855D48.5Very low74.8Confident158 Ų15874.5 Ų74.585%0.84540%0.4SS*.SBendtrans-10779.4174.7-81.7-31.7000111.5S853S853-D855 PolarHBondContact O-N 3.11Å; S853-D855 VanDerWaalsContact O-N 3.12Å
856G54.1Low74.8Confident54 Ų5470.4 Ų70.456%0.55738%0.382SS*.SBendtrans101.5129.6164.800000115.6V858G856-V858 PolarHBondContact O-N 3.27Å
857E56.5Low74.8Confident206 Ų20671.3 Ų71.396%0.96339%0.388SS*.  trans-56.9102.6175.6-71.1-176.3157.400111.3S859E857-S859 PolarHBondContact O-N 3.15Å
858V65.1Low75Confident34 Ų3473.9 Ų73.921%0.20640%0.399CS..  trans-64121.8167.9176.60000108.6F849 G856F849-V858 HydrophobicContact CB-CG1 4.5Å; F849-V858 HydrophobicContact CD1-CG1 3.97Å; G856-V858 PolarHBondContact O-N 3.27Å
859S75.9Confident75.2Confident62 Ų6271.1 Ų71.143%0.43438%0.381SS..  trans-58.7139.2177.2-178.80000111.6E857 R861 S862 R863E857-S859 PolarHBondContact O-N 3.15Å; S859-R861 PolarHBondContact O-N 3.06Å; S859-R861 VanDerWaalsContact O-N 3.12Å; S859-R861 PolarHBondContact OG-N 3.46Å; S859-S862 WeakPolarHBondContact O-CB 3.4Å; S859-S862 PolarHBondContact O-N 3.3Å; S859-R863 PolarHBondContact O-N 2.75Å
860E79.4Confident75.5Confident122 Ų12269.4 Ų69.457%0.5737%0.374SS*.Hα-helixtrans-53.6-32.4174.9-174.759.6-162.600112.6R863 K864E860-R863 PolarHBondContact O-N 2.74Å; E860-R863 IonicContact OE2-CZ 3.72Å; E860-R863 IonicContact OE2-NH1 2.68Å; E860-R863 PolarHBondContact OE2-NH1 3.01Å; E860-K864 WeakPolarHBondContact O-CB 3.34Å; E860-K864 PolarHBondContact O-N 3.42Å
861R81.6Confident76Confident140 Ų14072.5 Ų72.553%0.52839%0.388SS..Hα-helixtrans-63.6-43.4174.6-174179.1179.4161.84.8111.9E797 S859 L865E797-R861 IonicContact OE1-CZ 3.24Å; E797-R861 VanDerWaalsContact OE1-CZ 3.24Å; E797-R861 IonicContact OE1-NH1 2.8Å; E797-R861 PolarHBondContact OE1-NH1 3.38Å; E797-R861 IonicContact OE1-NH2 2.74Å; E797-R861 PolarHBondContact OE1-NH2 3.36Å; S859-R861 PolarHBondContact O-N 3.06Å; S859-R861 VanDerWaalsContact O-N 3.12Å; S859-R861 PolarHBondContact OG-N 3.46Å; R861-L865 WeakPolarHBondContact O-CB 3.05Å; R861-L865 PolarHBondContact O-N 3.5Å; R861-L865 VanDerWaalsContact O-N 3.07Å
862S85.3Confident77Confident14 Ų1471 Ų7110%0.09838%0.38CS..Hα-helixtrans-68.9-38.5177.9-61.80000111.4L792 S859 L865 A866L792-S862 WeakPolarHBondContact CD2-O 3.38Å; L792-S862 PolarHBondContact O-OG 2.96Å; S859-S862 WeakPolarHBondContact O-CB 3.4Å; S859-S862 PolarHBondContact O-N 3.3Å; S862-L865 PolarHBondContact O-N 3.23Å; S862-A866 WeakPolarHBondContact O-CB 3.45Å; S862-A866 PolarHBondContact O-N 3.18Å
863R85.8Confident78.7Confident84 Ų8469 Ų6932%0.31736%0.358SS..Hα-helixtrans-61.8-48.8174.9-171.8-179-65137.7-2.6111.6L850 S859 E860 L865 A866 T867L850-R863 HydrophobicContact CD2-CG 4.27Å; S859-R863 PolarHBondContact O-N 2.75Å; E860-R863 PolarHBondContact O-N 2.74Å; E860-R863 IonicContact OE2-CZ 3.72Å; E860-R863 IonicContact OE2-NH1 2.68Å; E860-R863 PolarHBondContact OE2-NH1 3.01Å; R863-L865 VanDerWaalsContact C-N 3.34Å; R863-L865 PolarHBondContact O-N 2.79Å; R863-A866 WeakPolarHBondContact O-CB 3.45Å; R863-A866 PolarHBondContact O-N 3.23Å; R863-T867 PolarHBondContact O-N 3.16Å; R863-T867 PolarHBondContact O-OG1 3.25Å
864K87.6Confident81Confident135 Ų13566.2 Ų66.259%0.58734%0.338SS*.Hα-helixtrans-60-41.9176.9-172.2176-177.6176.60112.3E860 T867 Q868E860-K864 WeakPolarHBondContact O-CB 3.34Å; E860-K864 PolarHBondContact O-N 3.42Å; K864-T867 PolarHBondContact O-N 2.66Å; K864-Q868 WeakPolarHBondContact O-CG 3.27Å; K864-Q868 PolarHBondContact O-N 3.21Å
865L89.9Confident83.3Confident13 Ų1363 Ų637%0.06832%0.315CS..Hα-helixtrans-66.4-39.7176179.655.8000112H791 L792 V804 R861 S862 R863 T867 Q868 I869H791-L865 HydrophobicContact CB-CD2 3.84Å; L792-L865 HydrophobicContact CD2-CB 3.84Å; L792-L865 HydrophobicContact CD2-CD2 3.93Å; L792-L865 HydrophobicContact CD2-CG 3.76Å; L792-L865 HydrophobicContact CG-CD2 3.96Å; L792-L865 HydrophobicContact CG-CG 4.14Å; V804-L865 HydrophobicContact CG1-CD1 3.42Å; V804-L865 VanDerWaalsContact CG1-CD1 3.42Å; V804-L865 HydrophobicContact CG1-CD2 4.18Å; V804-L865 HydrophobicContact CG1-CG 4.44Å; R861-L865 WeakPolarHBondContact O-CB 3.05Å; R861-L865 PolarHBondContact O-N 3.5Å; R861-L865 VanDerWaalsContact O-N 3.07Å; S862-L865 PolarHBondContact O-N 3.23Å; R863-L865 VanDerWaalsContact C-N 3.34Å; R863-L865 PolarHBondContact O-N 2.79Å; L865-T867 VanDerWaalsContact C-N 3.34Å; L865-T867 PolarHBondContact O-N 3.22Å; L865-Q868 PolarHBondContact O-N 3.31Å; L865-I869 HydrophobicContact CD1-CD1 4.04Å; L865-I869 HydrophobicContact CD1-CG1 4.14Å; L865-I869 HydrophobicContact CG-CD1 3.92Å; L865-I869 HydrophobicContact CG-CG1 4.49Å; L865-I869 VanDerWaalsContact O-CG1 3.3Å; L865-I869 WeakPolarHBondContact O-CG1 3.4Å; L865-I869 PolarHBondContact O-N 2.88Å
866A91.3Very high85.5Confident0 Ų055.7 Ų55.70%028%0.277CS..Hα-helixtrans-62.3-41.1176.100000111.7L792 I846 F849 L850 S862 R863 T870L792-A866 HydrophobicContact CD2-CB 4.01Å; I846-A866 HydrophobicContact CG2-CB 3.82Å; F849-A866 HydrophobicContact CB-CB 3.82Å; L850-A866 HydrophobicContact CD2-CB 3.97Å; L850-A866 HydrophobicContact CG-CB 4.23Å; S862-A866 WeakPolarHBondContact O-CB 3.45Å; S862-A866 PolarHBondContact O-N 3.18Å; R863-A866 WeakPolarHBondContact O-CB 3.45Å; R863-A866 PolarHBondContact O-N 3.23Å; A866-T870 WeakPolarHBondContact O-CB 3.29Å; A866-T870 PolarHBondContact O-N 3.48Å; A866-T870 PolarHBondContact O-OG1 3.03Å
867T91.1Very high87.5Confident18 Ų1853.1 Ų53.111%0.1125%0.25CS..Hα-helixtrans-60.3-49.7171.4-590000111R863 K864 L865 I869 T870 E871R863-T867 PolarHBondContact O-N 3.16Å; R863-T867 PolarHBondContact O-OG1 3.25Å; K864-T867 PolarHBondContact O-N 2.66Å; L865-T867 VanDerWaalsContact C-N 3.34Å; L865-T867 PolarHBondContact O-N 3.22Å; T867-I869 PolarHBondContact O-N 3.49Å; T867-T870 PolarHBondContact O-N 2.92Å; T867-T870 VanDerWaalsContact O-N 3.13Å; T867-E871 HydrophobicContact CG2-CG 4.2Å; T867-E871 WeakPolarHBondContact O-CG 3.44Å; T867-E871 PolarHBondContact O-N 3.15Å
868Q92.6Very high89.3Confident73 Ų7346.7 Ų46.734%0.34122%0.217SC..Hα-helixtrans-59.9-40.5179.9-74.7177-1100113.5L808 K864 L865 S872L808-Q868 HydrophobicContact CD2-CB 4.43Å; K864-Q868 WeakPolarHBondContact O-CG 3.27Å; K864-Q868 PolarHBondContact O-N 3.21Å; L865-Q868 PolarHBondContact O-N 3.31Å; Q868-S872 WeakPolarHBondContact O-CB 3.4Å; Q868-S872 PolarHBondContact O-N 2.92Å; Q868-S872 PolarHBondContact O-OG 3.49Å
869I94.6Very high90.6Very high0 Ų046.9 Ų46.90%022%0.217CC..Hα-helixtrans-63.9-45.4175.9-68.7164.5000110.1L788 L792 L808 F811 W841 I846 L865 T867 S872 F873L788-I869 HydrophobicContact CB-CD1 4.04Å; L788-I869 HydrophobicContact CD1-CD1 4.45Å; L788-I869 HydrophobicContact CD1-CG1 4.29Å; L788-I869 HydrophobicContact CD2-CD1 4.31Å; L788-I869 HydrophobicContact CD2-CG1 4.39Å; L792-I869 HydrophobicContact CD1-CD1 3.7Å; L792-I869 HydrophobicContact CD2-CD1 4.5Å; L792-I869 HydrophobicContact CG-CD1 4.14Å; L808-I869 HydrophobicContact CD1-CG1 4.03Å; F811-I869 HydrophobicContact CE1-CG2 4.19Å; F811-I869 HydrophobicContact CZ-CG2 4.3Å; W841-I869 HydrophobicContact CH2-CG2 4.42Å; W841-I869 HydrophobicContact CZ3-CG2 4.05Å; I846-I869 HydrophobicContact CD1-CD1 4.35Å; I846-I869 HydrophobicContact CD1-CG2 4.41Å; I846-I869 HydrophobicContact CG1-CG2 4.25Å; I846-I869 HydrophobicContact CG2-CB 4.4Å; I846-I869 HydrophobicContact CG2-CG2 4.31Å; L865-I869 HydrophobicContact CD1-CD1 4.04Å; L865-I869 HydrophobicContact CD1-CG1 4.14Å; L865-I869 HydrophobicContact CG-CD1 3.92Å; L865-I869 HydrophobicContact CG-CG1 4.49Å; L865-I869 VanDerWaalsContact O-CG1 3.3Å; L865-I869 WeakPolarHBondContact O-CG1 3.4Å; L865-I869 PolarHBondContact O-N 2.88Å; T867-I869 PolarHBondContact O-N 3.49Å; I869-S872 PolarHBondContact O-N 2.89Å; I869-F873 WeakPolarHBondContact O-CB 3.33Å; I869-F873 PolarHBondContact O-N 2.78Å
870T94.4Very high91.4Very high1 Ų144 Ų441%0.00620%0.197CC..Hα-helixtrans-63.8-48.8-179.6-56.40000111.3V842 A866 T867 S872 F873 L874 I901V842-T870 HydrophobicContact CG1-CG2 4.38Å; A866-T870 WeakPolarHBondContact O-CB 3.29Å; A866-T870 PolarHBondContact O-N 3.48Å; A866-T870 PolarHBondContact O-OG1 3.03Å; T867-T870 PolarHBondContact O-N 2.92Å; T867-T870 VanDerWaalsContact O-N 3.13Å; T870-S872 PolarHBondContact O-N 3.35Å; T870-F873 PolarHBondContact O-N 3.31Å; T870-L874 HydrophobicContact CG2-CD1 4.33Å; T870-L874 WeakPolarHBondContact O-CG 3.17Å; T870-L874 PolarHBondContact O-N 3.39Å; T870-I901 HydrophobicContact CG2-CD1 3.46Å; T870-I901 VanDerWaalsContact CG2-CD1 3.46Å; T870-I901 HydrophobicContact CG2-CG1 4.03Å; T870-I901 HydrophobicContact CG2-CG2 4.5Å
871E94Very high92Very high68 Ų6838.9 Ų38.932%0.31817%0.173SC..Hα-helixtrans-61.9-42.6177.2-70.3-179.8159.700112.3T867 F873 L874 K875 A913T867-E871 HydrophobicContact CG2-CG 4.2Å; T867-E871 WeakPolarHBondContact O-CG 3.44Å; T867-E871 PolarHBondContact O-N 3.15Å; E871-F873 VanDerWaalsContact C-N 3.32Å; E871-F873 PolarHBondContact O-N 3.15Å; E871-L874 PolarHBondContact O-N 3.28Å; E871-K875 WeakPolarHBondContact O-CB 3.45Å; E871-K875 PolarHBondContact O-N 3.23Å; E871-A913 HydrophobicContact CB-CB 4.28Å; E871-A913 HydrophobicContact CG-CB 4.01Å
872S94.8Very high92.4Very high24 Ų2437.2 Ų37.217%0.16817%0.174CC..Hα-helixtrans-63.1-40177.7-640000111.6Q868 I869 T870 V876Q868-S872 WeakPolarHBondContact O-CB 3.4Å; Q868-S872 PolarHBondContact O-N 2.92Å; Q868-S872 PolarHBondContact O-OG 3.49Å; I869-S872 PolarHBondContact O-N 2.89Å; T870-S872 PolarHBondContact O-N 3.35Å; S872-V876 WeakPolarHBondContact O-CG2 3.47Å; S872-V876 PolarHBondContact O-N 3.31Å
873F96.3Very high92.6Very high8 Ų841 Ų414%0.03520%0.196CC..Hα-helixtrans-65.8-49.2174.9-178.4-113.5000112F811 V835 V838 A839 V842 I869 T870 E871 K875 V876 C877 I894 L897F811-F873 HydrophobicContact CE1-CB 3.87Å; F811-F873 HydrophobicContact CE1-CD2 4.4Å; F811-F873 HydrophobicContact CZ-CB 3.97Å; F811-F873 AromaticContact CZ-CD2 3.94Å; F811-F873 HydrophobicContact CZ-CD2 3.94Å; F811-F873 HydrophobicContact CZ-CG 4.28Å; V835-F873 HydrophobicContact CG1-CE2 3.81Å; V835-F873 HydrophobicContact CG1-CZ 3.96Å; V838-F873 HydrophobicContact CB-CD2 4.37Å; V838-F873 HydrophobicContact CB-CE2 3.69Å; V838-F873 HydrophobicContact CB-CZ 4.19Å; V838-F873 HydrophobicContact CG1-CD2 3.53Å; V838-F873 HydrophobicContact CG1-CE2 3.36Å; V838-F873 HydrophobicContact CG1-CG 4.37Å; V838-F873 HydrophobicContact CG1-CZ 4.07Å; A839-F873 HydrophobicContact CB-CE1 3.73Å; A839-F873 HydrophobicContact CB-CZ 3.74Å; V842-F873 HydrophobicContact CG2-CB 4.4Å; V842-F873 HydrophobicContact CG2-CD1 4.06Å; V842-F873 HydrophobicContact CG2-CG 4.15Å; I869-F873 WeakPolarHBondContact O-CB 3.33Å; I869-F873 PolarHBondContact O-N 2.78Å; T870-F873 PolarHBondContact O-N 3.31Å; E871-F873 VanDerWaalsContact C-N 3.32Å; E871-F873 PolarHBondContact O-N 3.15Å; F873-K875 VanDerWaalsContact C-N 3.25Å; F873-K875 PolarHBondContact O-N 3.08Å; F873-V876 WeakPolarHBondContact O-CB 3.5Å; F873-V876 PolarHBondContact O-N 2.98Å; F873-C877 WeakPolarHBondContact CZ-SG 3.28Å; F873-C877 PolarHBondContact O-N 2.99Å; F873-C877 PolarHBondContact O-SG 3.35Å; F873-I894 HydrophobicContact CE1-CD1 4.21Å; F873-I894 HydrophobicContact CZ-CD1 4.32Å; F873-L897 HydrophobicContact CD1-CD2 3.91Å; F873-L897 HydrophobicContact CE1-CD2 3.59Å
874L95.9Very high92.6Very high1 Ų140.1 Ų40.11%0.00521%0.213CC..Hα-helixtrans-59.2-37.8177.6-69.4178.5000111.6T870 E871 V876 C877 R878 I901 A913 V914 I917T870-L874 HydrophobicContact CG2-CD1 4.33Å; T870-L874 WeakPolarHBondContact O-CG 3.17Å; T870-L874 PolarHBondContact O-N 3.39Å; E871-L874 PolarHBondContact O-N 3.28Å; L874-V876 VanDerWaalsContact C-N 3.3Å; L874-V876 PolarHBondContact O-N 3.34Å; L874-C877 PolarHBondContact O-N 2.91Å; L874-R878 WeakPolarHBondContact O-CB 3.28Å; L874-R878 PolarHBondContact O-N 3.23Å; L874-I901 HydrophobicContact CD1-CD1 4.02Å; L874-I901 HydrophobicContact CD2-CD1 4.25Å; L874-I901 HydrophobicContact CG-CD1 4.4Å; L874-A913 HydrophobicContact CB-CB 4.24Å; L874-A913 HydrophobicContact CD1-CB 3.92Å; L874-V914 HydrophobicContact CD1-CG2 3.82Å; L874-I917 HydrophobicContact CD2-CG1 4.44Å; L874-I917 WeakPolarHBondContact O-CD1 3.43Å
875K94.8Very high92.6Very high108 Ų10835.2 Ų35.247%0.4719%0.193SC..Hα-helixtrans-59.3-40.7174.4-172.7178.4-179.8178.40112.3E871 F873 R878 D879E871-K875 WeakPolarHBondContact O-CB 3.45Å; E871-K875 PolarHBondContact O-N 3.23Å; F873-K875 VanDerWaalsContact C-N 3.25Å; F873-K875 PolarHBondContact O-N 3.08Å; K875-R878 PolarHBondContact O-N 3.41Å; K875-D879 PolarHBondContact O-N 3.11Å
876V94.5Very high92.5Very high5 Ų535.2 Ų35.23%0.0320%0.196CC..Hα-helixtrans-66.6-44.8175.3175.90000111.2V812 R816 S872 F873 L874 R878 D879 I880V812-V876 HydrophobicContact CB-CG2 4.44Å; V812-V876 HydrophobicContact CG1-CG2 3.89Å; R816-V876 HydrophobicContact CG-CG2 4.43Å; S872-V876 WeakPolarHBondContact O-CG2 3.47Å; S872-V876 PolarHBondContact O-N 3.31Å; F873-V876 WeakPolarHBondContact O-CB 3.5Å; F873-V876 PolarHBondContact O-N 2.98Å; L874-V876 VanDerWaalsContact C-N 3.3Å; L874-V876 PolarHBondContact O-N 3.34Å; V876-R878 VanDerWaalsContact C-N 3.29Å; V876-R878 PolarHBondContact O-N 3.29Å; V876-D879 PolarHBondContact O-N 3.36Å; V876-D879 VanDerWaalsContact O-N 3.13Å; V876-I880 HydrophobicContact CG1-CD1 4.1Å; V876-I880 WeakPolarHBondContact O-CG1 3.45Å; V876-I880 PolarHBondContact O-N 2.76Å
877C95.9Very high92.4Very high0 Ų037.4 Ų37.40%021%0.207CC..Hα-helixtrans-60.4-39.6176.9-63.60000112.1F873 L874 I880 F881 I894 I917F873-C877 WeakPolarHBondContact CZ-SG 3.28Å; F873-C877 PolarHBondContact O-N 2.99Å; F873-C877 PolarHBondContact O-SG 3.35Å; L874-C877 PolarHBondContact O-N 2.91Å; C877-I880 WeakPolarHBondContact O-CB 3.26Å; C877-I880 PolarHBondContact O-N 3.48Å; C877-F881 HydrophobicContact CB-CE2 4.49Å; C877-F881 WeakPolarHBondContact O-CD2 3.29Å; C877-F881 WeakPolarHBondContact O-CG 3.35Å; C877-F881 PolarHBondContact O-N 3.48Å; C877-I894 HydrophobicContact CB-CD1 4.41Å; C877-I894 HydrophobicContact CB-CG1 4.41Å; C877-I894 HydrophobicContact CB-CG2 4.14Å; C877-I917 HydrophobicContact CB-CD1 3.87Å
878R94.9Very high92.2Very high71 Ų7140 Ų4027%0.26822%0.218SC..Hα-helixtrans-60.2-47.2173179.2-153.665.9-178.72.8111.2L874 K875 V876 I880 F881 L882 P916 I917 E920L874-R878 WeakPolarHBondContact O-CB 3.28Å; L874-R878 PolarHBondContact O-N 3.23Å; K875-R878 PolarHBondContact O-N 3.41Å; V876-R878 VanDerWaalsContact C-N 3.29Å; V876-R878 PolarHBondContact O-N 3.29Å; R878-I880 VanDerWaalsContact C-N 3.25Å; R878-I880 PolarHBondContact O-N 2.81Å; R878-F881 PolarHBondContact O-N 3.33Å; R878-L882 WeakPolarHBondContact O-CB 3.48Å; R878-L882 PolarHBondContact O-N 3.15Å; R878-P916 HydrophobicContact CG-CB 4.02Å; R878-I917 HydrophobicContact CB-CD1 3.69Å; R878-I917 HydrophobicContact CB-CG1 4.5Å; R878-I917 VanDerWaalsContact N-CD1 3.27Å; R878-E920 HydrophobicContact CG-CG 3.83Å
879D92.3Very high92.1Very high38 Ų3839.9 Ų39.920%0.20322%0.223CC..Hα-helixtrans-61.2-36.9179.3-67.1-10.8000110.9R816 K875 V876 L882 V883R816-D879 IonicContact NH2-OD2 3.79Å; K875-D879 PolarHBondContact O-N 3.11Å; V876-D879 PolarHBondContact O-N 3.36Å; V876-D879 VanDerWaalsContact O-N 3.13Å; D879-L882 PolarHBondContact O-N 3.32Å; D879-V883 WeakPolarHBondContact O-CG2 3.15Å; D879-V883 PolarHBondContact O-N 3.33Å
880I92.5Very high92Very high2 Ų239.9 Ų39.91%0.0122%0.223CC..Hα-helixtrans-62.9-44.2173.8-68.9168.9000111.7A819 L832 V835 V876 C877 R878 V883 G884 L885 F890A819-I880 HydrophobicContact CB-CD1 4.33Å; A819-I880 HydrophobicContact CB-CG1 3.78Å; L832-I880 HydrophobicContact CD2-CG2 4.19Å; V835-I880 HydrophobicContact CG1-CD1 4.16Å; V835-I880 HydrophobicContact CG2-CD1 4.27Å; V876-I880 HydrophobicContact CG1-CD1 4.1Å; V876-I880 WeakPolarHBondContact O-CG1 3.45Å; V876-I880 PolarHBondContact O-N 2.76Å; C877-I880 WeakPolarHBondContact O-CB 3.26Å; C877-I880 PolarHBondContact O-N 3.48Å; R878-I880 VanDerWaalsContact C-N 3.25Å; R878-I880 PolarHBondContact O-N 2.81Å; I880-V883 VanDerWaalsContact O-CG2 3.32Å; I880-V883 WeakPolarHBondContact O-CG2 3.38Å; I880-G884 PolarHBondContact O-N 2.97Å; I880-L885 HydrophobicContact CG2-CB 3.91Å; I880-L885 PolarHBondContact O-N 2.72Å; I880-L885 VanDerWaalsContact O-N 3.12Å; I880-F890 HydrophobicContact CB-CE1 4.38Å; I880-F890 HydrophobicContact CD1-CZ 4.21Å; I880-F890 HydrophobicContact CG2-CD1 4.36Å; I880-F890 HydrophobicContact CG2-CE1 3.76Å; I880-F890 HydrophobicContact CG2-CZ 4.36Å
881F92.3Very high91.9Very high14 Ų1440.5 Ų40.56%0.06123%0.226CC..Hα-helixtrans-65.3-43175.8-65.8-47.7000112.2C877 R878 V883 G884 F890 K891 I894 I917 E920 V921C877-F881 HydrophobicContact CB-CE2 4.49Å; C877-F881 WeakPolarHBondContact O-CD2 3.29Å; C877-F881 WeakPolarHBondContact O-CG 3.35Å; C877-F881 PolarHBondContact O-N 3.48Å; R878-F881 PolarHBondContact O-N 3.33Å; F881-V883 PolarHBondContact O-N 3.42Å; F881-G884 PolarHBondContact O-N 3.13Å; F881-F890 HydrophobicContact CD1-CD1 4.37Å; F881-F890 HydrophobicContact CD1-CE1 4.44Å; F881-F890 AromaticContact CE1-CD1 3.49Å; F881-F890 HydrophobicContact CE1-CD1 3.49Å; F881-F890 VanDerWaalsContact CE1-CD1 3.49Å; F881-F890 AromaticContact CE1-CE1 3.73Å; F881-F890 HydrophobicContact CE1-CE1 3.73Å; F881-F890 AromaticContact CZ-CD1 3.82Å; F881-F890 HydrophobicContact CZ-CD1 3.82Å; F881-F890 AromaticContact CZ-CE1 3.75Å; F881-F890 HydrophobicContact CZ-CE1 3.75Å; F881-K891 HydrophobicContact CD1-CG 4.2Å; F881-K891 HydrophobicContact CE1-CB 4.28Å; F881-K891 HydrophobicContact CE1-CG 3.58Å; F881-K891 HydrophobicContact CZ-CG 4.34Å; F881-I894 HydrophobicContact CE2-CB 4.2Å; F881-I894 HydrophobicContact CE2-CG1 4.49Å; F881-I894 HydrophobicContact CE2-CG2 3.92Å; F881-I894 HydrophobicContact CZ-CB 3.93Å; F881-I894 HydrophobicContact CZ-CG1 4.03Å; F881-I894 HydrophobicContact CZ-CG2 4.18Å; F881-I917 HydrophobicContact CD2-CD1 4Å; F881-I917 HydrophobicContact CD2-CG2 4.41Å; F881-I917 HydrophobicContact CE2-CD1 3.97Å; F881-I917 HydrophobicContact CE2-CG2 3.96Å; F881-E920 HydrophobicContact CB-CB 3.73Å; F881-V921 HydrophobicContact CD1-CG2 4.35Å; F881-V921 HydrophobicContact CD2-CG2 3.86Å; F881-V921 HydrophobicContact CE1-CG2 4.24Å; F881-V921 HydrophobicContact CE2-CG2 3.74Å; F881-V921 HydrophobicContact CG-CG2 4.18Å; F881-V921 HydrophobicContact CZ-CG2 3.96Å
882L90.1Very high91.8Very high105 Ų10538.6 Ų38.655%0.5522%0.224SC..Hα-helixtrans-59.3-34.5-179.8-178.867.2000112.4R878 D879 G884 E920R878-L882 WeakPolarHBondContact O-CB 3.48Å; R878-L882 PolarHBondContact O-N 3.15Å; D879-L882 PolarHBondContact O-N 3.32Å; L882-G884 VanDerWaalsContact C-N 3.32Å; L882-E920 HydrophobicContact CB-CG 4.49Å; L882-E920 WeakPolarHBondContact CD1-OE2 3.4Å
883V88.6Confident91.7Very high92 Ų9240.9 Ų40.956%0.55823%0.232SC*.THydrogen-bonded Turntrans-88.35.8176.4-58.70000113.8D879 I880 F881 L885D879-V883 WeakPolarHBondContact O-CG2 3.15Å; D879-V883 PolarHBondContact O-N 3.33Å; I880-V883 VanDerWaalsContact O-CG2 3.32Å; I880-V883 WeakPolarHBondContact O-CG2 3.38Å; F881-V883 PolarHBondContact O-N 3.42Å; V883-L885 HydrophobicContact CG2-CB 4.22Å; V883-L885 HydrophobicContact CG2-CD1 3.55Å; V883-L885 HydrophobicContact CG2-CG 3.73Å
884G87.3Confident91.7Very high66 Ų6640.5 Ų40.568%0.6823%0.23SC*.THydrogen-bonded Turntrans73.822.2174.900000115.3I880 F881 L882I880-G884 PolarHBondContact O-N 2.97Å; F881-G884 PolarHBondContact O-N 3.13Å; L882-G884 VanDerWaalsContact C-N 3.32Å
885L87.7Confident91.7Very high33 Ų3340.6 Ų40.617%0.17323%0.231CC..  trans-92.3-10.5-177.3-71.5174.2000114.4A819 H823 L832 I880 V883 D887A819-L885 HydrophobicContact CB-CD1 4.24Å; A819-L885 WeakPolarHBondContact O-CD1 3.47Å; H823-L885 HydrophobicContact CB-CD1 4.02Å; H823-L885 HydrophobicContact CB-CD2 3.95Å; L832-L885 WeakPolarHBondContact CD1-O 3.4Å; I880-L885 HydrophobicContact CG2-CB 3.91Å; I880-L885 PolarHBondContact O-N 2.72Å; I880-L885 VanDerWaalsContact O-N 3.12Å; V883-L885 HydrophobicContact CG2-CB 4.22Å; V883-L885 HydrophobicContact CG2-CD1 3.55Å; V883-L885 HydrophobicContact CG2-CG 3.73Å; L885-D887 PolarHBondContact O-N 2.94Å
886G86.8Confident91.7Very high12 Ų1241 Ų4112%0.12423%0.234CC..  trans-84111.9-178.700000112.3K891G886-K891 WeakPolarHBondContact O-CE 3.47Å
887D88.5Confident91.7Very high46 Ų4641 Ų4125%0.24623%0.234CC..  trans-74.6173.6168.261.956.2000112.7R829 L832 L885 T889 F890 K891R829-D887 IonicContact CZ-OD1 2.65Å; R829-D887 IonicContact CZ-OD2 3.12Å; R829-D887 IonicContact NE-OD1 3.73Å; R829-D887 IonicContact NE-OD2 2.7Å; R829-D887 PolarHBondContact NE-OD2 3.41Å; R829-D887 IonicContact NH2-OD1 2.71Å; R829-D887 PolarHBondContact NH2-OD1 3.4Å; R829-D887 IonicContact NH2-OD2 3.29Å; R829-D887 PolarHBondContact NH2-OD2 3.15Å; L832-D887 WeakPolarHBondContact CD1-OD2 3.4Å; L885-D887 PolarHBondContact O-N 2.94Å; D887-T889 VanDerWaalsContact C-N 3.3Å; D887-T889 PolarHBondContact O-N 3.46Å; D887-T889 WeakPolarHBondContact OD1-CA 3.4Å; D887-T889 WeakPolarHBondContact OD1-CB 3.39Å; D887-T889 PolarHBondContact OD1-N 3.44Å; D887-F890 PolarHBondContact O-N 3.41Å; D887-F890 PolarHBondContact OD1-N 2.9Å; D887-K891 VanDerWaalsContact O-CG 3.31Å; D887-K891 WeakPolarHBondContact O-CG 3.45Å; D887-K891 PolarHBondContact O-N 3.49Å
888E87.2Confident91.8Very high72 Ų7241 Ų4134%0.33623%0.234SC..Hα-helixtrans-60.7-33.9-177-65-51.412600114K891 G892 F925E888-K891 WeakPolarHBondContact OE1-CD 3.49Å; E888-K891 WeakPolarHBondContact OE1-CE 3.44Å; E888-K891 IonicContact OE1-NZ 3.9Å; E888-K891 PolarHBondContact OE1-NZ 2.85Å; E888-G892 PolarHBondContact O-N 3.39Å; E888-F925 WeakPolarHBondContact OE1-CE1 3.46Å; E888-F925 WeakPolarHBondContact OE1-CZ 3.27Å
889T90.1Very high91.8Very high71 Ų7139.8 Ų39.844%0.43624%0.236SC..Hα-helixtrans-68.3-45.6177.2-58.70000110.3D887 G892 Q893D887-T889 VanDerWaalsContact C-N 3.3Å; D887-T889 PolarHBondContact O-N 3.46Å; D887-T889 WeakPolarHBondContact OD1-CA 3.4Å; D887-T889 WeakPolarHBondContact OD1-CB 3.39Å; D887-T889 PolarHBondContact OD1-N 3.44Å; T889-G892 PolarHBondContact O-N 3.41Å; T889-Q893 WeakPolarHBondContact O-CG 3.45Å; T889-Q893 PolarHBondContact O-N 2.95Å
890F92.4Very high91.8Very high0 Ų040.5 Ų40.50%024%0.24CC..Hα-helixtrans-63.5-46.4177.7-174.7-105.3000111.2L832 V835 E836 I880 F881 D887 G892 Q893 I894L832-F890 HydrophobicContact CD2-CD2 4.39Å; L832-F890 HydrophobicContact CD2-CG 4.41Å; V835-F890 HydrophobicContact CB-CE2 4.03Å; V835-F890 HydrophobicContact CB-CZ 4.49Å; V835-F890 HydrophobicContact CG1-CE2 3.71Å; V835-F890 HydrophobicContact CG1-CZ 3.8Å; E836-F890 HydrophobicContact CG-CD2 3.65Å; E836-F890 HydrophobicContact CG-CE2 4.17Å; I880-F890 HydrophobicContact CB-CE1 4.38Å; I880-F890 HydrophobicContact CD1-CZ 4.21Å; I880-F890 HydrophobicContact CG2-CD1 4.36Å; I880-F890 HydrophobicContact CG2-CE1 3.76Å; I880-F890 HydrophobicContact CG2-CZ 4.36Å; F881-F890 HydrophobicContact CD1-CD1 4.37Å; F881-F890 HydrophobicContact CD1-CE1 4.44Å; F881-F890 AromaticContact CE1-CD1 3.49Å; F881-F890 HydrophobicContact CE1-CD1 3.49Å; F881-F890 VanDerWaalsContact CE1-CD1 3.49Å; F881-F890 AromaticContact CE1-CE1 3.73Å; F881-F890 HydrophobicContact CE1-CE1 3.73Å; F881-F890 AromaticContact CZ-CD1 3.82Å; F881-F890 HydrophobicContact CZ-CD1 3.82Å; F881-F890 AromaticContact CZ-CE1 3.75Å; F881-F890 HydrophobicContact CZ-CE1 3.75Å; D887-F890 PolarHBondContact O-N 3.41Å; D887-F890 PolarHBondContact OD1-N 2.9Å; F890-G892 VanDerWaalsContact C-N 3.32Å; F890-G892 PolarHBondContact O-N 3.48Å; F890-Q893 PolarHBondContact O-N 3.37Å; F890-I894 HydrophobicContact CD1-CG1 4.3Å; F890-I894 HydrophobicContact CD2-CG1 4.4Å; F890-I894 HydrophobicContact CE1-CG1 3.89Å; F890-I894 HydrophobicContact CE2-CD1 4.06Å; F890-I894 HydrophobicContact CE2-CG1 4Å; F890-I894 HydrophobicContact CZ-CD1 4Å; F890-I894 HydrophobicContact CZ-CG1 3.73Å; F890-I894 WeakPolarHBondContact O-CG1 3.38Å; F890-I894 PolarHBondContact O-N 3.13Å
891K92.6Very high91.9Very high15 Ų1540.4 Ų40.47%0.06524%0.24CC..Hα-helixtrans-53.8-49.2173.9-70.5175-169.3176.80110.8F881 G886 D887 E888 Q893 I894 L895 V921 S924 F925 M940F881-K891 HydrophobicContact CD1-CG 4.2Å; F881-K891 HydrophobicContact CE1-CB 4.28Å; F881-K891 HydrophobicContact CE1-CG 3.58Å; F881-K891 HydrophobicContact CZ-CG 4.34Å; G886-K891 WeakPolarHBondContact O-CE 3.47Å; D887-K891 VanDerWaalsContact O-CG 3.31Å; D887-K891 WeakPolarHBondContact O-CG 3.45Å; D887-K891 PolarHBondContact O-N 3.49Å; E888-K891 WeakPolarHBondContact OE1-CD 3.49Å; E888-K891 WeakPolarHBondContact OE1-CE 3.44Å; E888-K891 IonicContact OE1-NZ 3.9Å; E888-K891 PolarHBondContact OE1-NZ 2.85Å; K891-Q893 PolarHBondContact O-N 3.32Å; K891-I894 PolarHBondContact O-N 2.86Å; K891-L895 WeakPolarHBondContact O-CB 3.45Å; K891-L895 VanDerWaalsContact O-CG 3.29Å; K891-L895 WeakPolarHBondContact O-CG 2.96Å; K891-L895 PolarHBondContact O-N 3.21Å; K891-V921 HydrophobicContact CD-CG1 4.43Å; K891-S924 WeakPolarHBondContact CE-OG 3.44Å; K891-S924 PolarHBondContact NZ-OG 3.32Å; K891-F925 HydrophobicContact CD-CE2 4.23Å; K891-F925 HydrophobicContact CD-CZ 3.87Å; K891-F925 VanDerWaalsContact NZ-CZ 3.3Å; K891-M940 HydrophobicContact CB-CE 3.42Å; K891-M940 VanDerWaalsContact CB-CE 3.42Å; K891-M940 HydrophobicContact CD-CE 4.45Å
892G91.9Very high92Very high28 Ų2839.9 Ų39.929%0.28924%0.237SC..Hα-helixtrans-60.3-45.8-179.700000113.3E888 T889 F890 L895 H896E888-G892 PolarHBondContact O-N 3.39Å; T889-G892 PolarHBondContact O-N 3.41Å; F890-G892 VanDerWaalsContact C-N 3.32Å; F890-G892 PolarHBondContact O-N 3.48Å; G892-L895 PolarHBondContact O-N 3.14Å; G892-H896 WeakPolarHBondContact O-CB 3.31Å; G892-H896 PolarHBondContact O-N 3.5Å
893Q93.5Very high92Very high72 Ų7240.3 Ų40.334%0.33624%0.239SC..Hα-helixtrans-65.6-41179-71.3-175.220.300112.9E836 T889 F890 K891 H896 L897E836-Q893 PolarHBondContact OE2-NE2 3.24Å; E836-Q893 VanDerWaalsContact OE2-NE2 3.15Å; T889-Q893 WeakPolarHBondContact O-CG 3.45Å; T889-Q893 PolarHBondContact O-N 2.95Å; F890-Q893 PolarHBondContact O-N 3.37Å; K891-Q893 PolarHBondContact O-N 3.32Å; Q893-H896 WeakPolarHBondContact O-CB 3.35Å; Q893-H896 PolarHBondContact O-N 3.48Å; Q893-L897 PolarHBondContact O-N 2.93Å
894I96.2Very high92Very high0 Ų036.3 Ų36.30%022%0.216CC..Hα-helixtrans-70-39.5178.3-60.2-54.4000111.1A839 F873 C877 F881 F890 K891 H896 L897 C898 I917A839-I894 HydrophobicContact CB-CD1 3.94Å; F873-I894 HydrophobicContact CE1-CD1 4.21Å; F873-I894 HydrophobicContact CZ-CD1 4.32Å; C877-I894 HydrophobicContact CB-CD1 4.41Å; C877-I894 HydrophobicContact CB-CG1 4.41Å; C877-I894 HydrophobicContact CB-CG2 4.14Å; F881-I894 HydrophobicContact CE2-CB 4.2Å; F881-I894 HydrophobicContact CE2-CG1 4.49Å; F881-I894 HydrophobicContact CE2-CG2 3.92Å; F881-I894 HydrophobicContact CZ-CB 3.93Å; F881-I894 HydrophobicContact CZ-CG1 4.03Å; F881-I894 HydrophobicContact CZ-CG2 4.18Å; F890-I894 HydrophobicContact CD1-CG1 4.3Å; F890-I894 HydrophobicContact CD2-CG1 4.4Å; F890-I894 HydrophobicContact CE1-CG1 3.89Å; F890-I894 HydrophobicContact CE2-CD1 4.06Å; F890-I894 HydrophobicContact CE2-CG1 4Å; F890-I894 HydrophobicContact CZ-CD1 4Å; F890-I894 HydrophobicContact CZ-CG1 3.73Å; F890-I894 WeakPolarHBondContact O-CG1 3.38Å; F890-I894 PolarHBondContact O-N 3.13Å; K891-I894 PolarHBondContact O-N 2.86Å; I894-H896 VanDerWaalsContact C-N 3.3Å; I894-H896 PolarHBondContact O-N 3.38Å; I894-L897 WeakPolarHBondContact O-CB 2.97Å; I894-L897 PolarHBondContact O-N 2.89Å; I894-C898 PolarHBondContact O-N 3.18Å; I894-C898 PolarHBondContact O-SG 2.8Å; I894-C898 VanDerWaalsContact O-SG 3.33Å; I894-I917 HydrophobicContact CG2-CD1 4.36Å; I894-I917 HydrophobicContact CG2-CG2 4.04Å
895L95.6Very high91.9Very high3 Ų339.1 Ų39.12%0.01621%0.211CC..Hα-helixtrans-61.6-39.6172.6-70.8177.2000111.6K891 G892 C898 S899 L918 V921 M940 V943 V944 I947K891-L895 WeakPolarHBondContact O-CB 3.45Å; K891-L895 VanDerWaalsContact O-CG 3.29Å; K891-L895 WeakPolarHBondContact O-CG 2.96Å; K891-L895 PolarHBondContact O-N 3.21Å; G892-L895 PolarHBondContact O-N 3.14Å; L895-C898 WeakPolarHBondContact O-CB 3.45Å; L895-C898 PolarHBondContact O-N 3.36Å; L895-S899 PolarHBondContact O-N 3.11Å; L895-L918 HydrophobicContact CD2-CD2 3.75Å; L895-V921 HydrophobicContact CD1-CG1 4.21Å; L895-V921 HydrophobicContact CD2-CG2 4.45Å; L895-M940 HydrophobicContact CD1-CE 3.84Å; L895-M940 HydrophobicContact CD1-SD 4.33Å; L895-V943 HydrophobicContact CB-CG1 4.3Å; L895-V943 HydrophobicContact CD1-CG1 4.12Å; L895-V944 HydrophobicContact CD1-CG2 4.08Å; L895-V944 HydrophobicContact CD2-CG2 4.04Å; L895-I947 HydrophobicContact CB-CD1 4.05Å; L895-I947 HydrophobicContact CD2-CD1 3.95Å; L895-I947 WeakPolarHBondContact O-CD1 3.48Å
896H94.8Very high91.8Very high117 Ų11738 Ų3854%0.54221%0.207SC..Hα-helixtrans-61.3-45.7173.5-178.162.5000111.7G892 Q893 I894 C898 S899 L900G892-H896 WeakPolarHBondContact O-CB 3.31Å; G892-H896 PolarHBondContact O-N 3.5Å; Q893-H896 WeakPolarHBondContact O-CB 3.35Å; Q893-H896 PolarHBondContact O-N 3.48Å; I894-H896 VanDerWaalsContact C-N 3.3Å; I894-H896 PolarHBondContact O-N 3.38Å; H896-C898 PolarHBondContact O-N 3.09Å; H896-S899 WeakPolarHBondContact O-CB 3.5Å; H896-S899 PolarHBondContact O-N 3.27Å; H896-S899 VanDerWaalsContact O-N 3.17Å; H896-L900 WeakPolarHBondContact O-CG 3.29Å; H896-L900 PolarHBondContact O-N 2.94Å
897L95.3Very high91.7Very high5 Ų537.5 Ų37.53%0.02620%0.201CC..Hα-helixtrans-59.5-44.5173.9176.364.7000111.9A839 V842 A843 F873 Q893 I894 S899 L900 I901A839-L897 HydrophobicContact CB-CD2 3.99Å; V842-L897 HydrophobicContact CG1-CD1 4.26Å; V842-L897 HydrophobicContact CG1-CD2 4.49Å; A843-L897 HydrophobicContact CB-CD1 3.97Å; F873-L897 HydrophobicContact CD1-CD2 3.91Å; F873-L897 HydrophobicContact CE1-CD2 3.59Å; Q893-L897 PolarHBondContact O-N 2.93Å; I894-L897 WeakPolarHBondContact O-CB 2.97Å; I894-L897 PolarHBondContact O-N 2.89Å; L897-S899 VanDerWaalsContact C-N 3.26Å; L897-S899 PolarHBondContact O-N 3.35Å; L897-L900 PolarHBondContact O-N 3.32Å; L897-I901 HydrophobicContact CD1-CD1 4.07Å; L897-I901 HydrophobicContact CD1-CG1 4.16Å; L897-I901 HydrophobicContact CD2-CD1 4.38Å; L897-I901 HydrophobicContact CG-CD1 3.78Å; L897-I901 HydrophobicContact CG-CG1 4.34Å; L897-I901 VanDerWaalsContact O-CG1 3.27Å; L897-I901 WeakPolarHBondContact O-CG1 3.46Å; L897-I901 PolarHBondContact O-N 2.86Å
898C96.4Very high91.8Very high0 Ų036.4 Ų36.40%019%0.194CC..Hα-helixtrans-57.2-40.9175.4-710000111.8I894 L895 H896 I901 L902 V914I894-C898 PolarHBondContact O-N 3.18Å; I894-C898 PolarHBondContact O-SG 2.8Å; I894-C898 VanDerWaalsContact O-SG 3.33Å; L895-C898 WeakPolarHBondContact O-CB 3.45Å; L895-C898 PolarHBondContact O-N 3.36Å; H896-C898 PolarHBondContact O-N 3.09Å; C898-I901 PolarHBondContact O-N 2.84Å; C898-L902 VanDerWaalsContact O-CG 3.3Å; C898-L902 WeakPolarHBondContact O-CG 3.15Å; C898-L902 PolarHBondContact O-N 3.3Å; C898-V914 HydrophobicContact CB-CG1 3.84Å; C898-V914 HydrophobicContact CB-CG2 4.43Å
899S94.8Very high91.9Very high45 Ų4534.8 Ų34.832%0.31519%0.189SC..Hα-helixtrans-62.4-49.1174.5-1730000111.8L895 H896 L897 I901 L902 L903L895-S899 PolarHBondContact O-N 3.11Å; H896-S899 WeakPolarHBondContact O-CB 3.5Å; H896-S899 PolarHBondContact O-N 3.27Å; H896-S899 VanDerWaalsContact O-N 3.17Å; L897-S899 VanDerWaalsContact C-N 3.26Å; L897-S899 PolarHBondContact O-N 3.35Å; S899-I901 VanDerWaalsContact C-N 3.32Å; S899-I901 PolarHBondContact O-N 3Å; S899-L902 PolarHBondContact O-N 3.26Å; S899-L903 VanDerWaalsContact O-CG 3.29Å; S899-L903 WeakPolarHBondContact O-CG 3.33Å; S899-L903 PolarHBondContact O-N 2.94Å
900L93.8Very high92Very high53 Ų5331.4 Ų31.428%0.27717%0.168SC..Hα-helixtrans-58.7-42176.9-67.7177.9000112.4A843 L847 H896 L897 L903 S904A843-L900 HydrophobicContact CB-CD1 4.19Å; L847-L900 HydrophobicContact CD2-CB 3.87Å; H896-L900 WeakPolarHBondContact O-CG 3.29Å; H896-L900 PolarHBondContact O-N 2.94Å; L897-L900 PolarHBondContact O-N 3.32Å; L900-L903 PolarHBondContact O-N 2.86Å; L900-S904 PolarHBondContact O-N 2.64Å
901I94.2Very high92.1Very high0 Ų031.4 Ų31.40%017%0.168CC..Hα-helixtrans-58.7-52.9175.7-69.1163.8000109.7L847 T870 L874 L897 C898 S899 L903 S904 G907 C910L847-I901 HydrophobicContact CD1-CG1 4.25Å; T870-I901 HydrophobicContact CG2-CD1 3.46Å; T870-I901 VanDerWaalsContact CG2-CD1 3.46Å; T870-I901 HydrophobicContact CG2-CG1 4.03Å; T870-I901 HydrophobicContact CG2-CG2 4.5Å; L874-I901 HydrophobicContact CD1-CD1 4.02Å; L874-I901 HydrophobicContact CD2-CD1 4.25Å; L874-I901 HydrophobicContact CG-CD1 4.4Å; L897-I901 HydrophobicContact CD1-CD1 4.07Å; L897-I901 HydrophobicContact CD1-CG1 4.16Å; L897-I901 HydrophobicContact CD2-CD1 4.38Å; L897-I901 HydrophobicContact CG-CD1 3.78Å; L897-I901 HydrophobicContact CG-CG1 4.34Å; L897-I901 VanDerWaalsContact O-CG1 3.27Å; L897-I901 WeakPolarHBondContact O-CG1 3.46Å; L897-I901 PolarHBondContact O-N 2.86Å; C898-I901 PolarHBondContact O-N 2.84Å; S899-I901 VanDerWaalsContact C-N 3.32Å; S899-I901 PolarHBondContact O-N 3Å; I901-L903 PolarHBondContact O-N 2.79Å; I901-S904 WeakPolarHBondContact O-CB 3.47Å; I901-S904 PolarHBondContact O-N 3.19Å; I901-S904 PolarHBondContact O-OG 3.29Å; I901-G907 WeakPolarHBondContact O-CA 3.41Å; I901-C910 HydrophobicContact CG2-CB 3.69Å
902L93.9Very high92.1Very high3 Ų332.3 Ų32.32%0.01618%0.176CC..Hα-helixtrans-66.4-23.3-177.6-67.4174.7000113.7C898 S899 S904 I911 V914 I947 K950 I951 L954C898-L902 VanDerWaalsContact O-CG 3.3Å; C898-L902 WeakPolarHBondContact O-CG 3.15Å; C898-L902 PolarHBondContact O-N 3.3Å; S899-L902 PolarHBondContact O-N 3.26Å; L902-S904 VanDerWaalsContact C-N 3.35Å; L902-I911 HydrophobicContact CD2-CG1 3.66Å; L902-V914 HydrophobicContact CD1-CG1 4.18Å; L902-V914 HydrophobicContact CD2-CG2 4.49Å; L902-I947 HydrophobicContact CD1-CG2 3.54Å; L902-K950 HydrophobicContact CB-CG 4.42Å; L902-I951 HydrophobicContact CD1-CD1 4.23Å; L902-I951 HydrophobicContact CD1-CG1 3.64Å; L902-I951 HydrophobicContact CD2-CG1 4.22Å; L902-L954 HydrophobicContact CB-CD1 3.86Å; L902-L954 HydrophobicContact CD2-CD1 3.87Å; L902-L954 HydrophobicContact CG-CD1 4.38Å; L902-L954 WeakPolarHBondContact O-CD1 3.42Å
903L90.6Very high92.1Very high113 Ų11332 Ų3259%0.59217%0.17SC*.Hα-helixtrans-78.3-18.1174.2-69.8171.4000113.3S899 L900 I901S899-L903 VanDerWaalsContact O-CG 3.29Å; S899-L903 WeakPolarHBondContact O-CG 3.33Å; S899-L903 PolarHBondContact O-N 2.94Å; L900-L903 PolarHBondContact O-N 2.86Å; I901-L903 PolarHBondContact O-N 2.79Å
904S89.1Confident92.3Very high9 Ų928.5 Ų28.56%0.06315%0.154CC..SBendtrans-72.3153.9175.672.60000112.5L900 I901 L902 A906 G907L900-S904 PolarHBondContact O-N 2.64Å; I901-S904 WeakPolarHBondContact O-CB 3.47Å; I901-S904 PolarHBondContact O-N 3.19Å; I901-S904 PolarHBondContact O-OG 3.29Å; L902-S904 VanDerWaalsContact C-N 3.35Å; S904-A906 PolarHBondContact O-N 3.06Å; S904-G907 PolarHBondContact O-N 3.33Å; S904-G907 WeakPolarHBondContact OG-CA 3.3Å; S904-G907 PolarHBondContact OG-N 2.94Å; S904-G907 VanDerWaalsContact OG-N 3.15Å
905E83.9Confident92.2Very high124 Ų12428.5 Ų28.558%0.57915%0.154SC*.THydrogen-bonded Turntrans-61.5-46-173-173.4179.7-169.600113.3L850 G852 Y908 R958L850-E905 PolarHBondContact O-N 3.42Å; G852-E905 WeakPolarHBondContact CA-OE2 3.32Å; G852-E905 PolarHBondContact N-OE2 3.49Å; E905-Y908 VanDerWaalsContact O-CD1 3.23Å; E905-Y908 WeakPolarHBondContact O-CD1 3.42Å; E905-Y908 WeakPolarHBondContact O-CE1 3.36Å; E905-R958 PolarHBondContact O-NH2 3.47Å
906A85.3Confident92.2Very high11 Ų1129.4 Ų29.49%0.09116%0.16CC..THydrogen-bonded Turntrans-930.617700000113.7L850 S904 Y908 T909L850-A906 HydrophobicContact CB-CB 4.29Å; L850-A906 HydrophobicContact CD2-CB 4.28Å; L850-A906 WeakPolarHBondContact O-CB 3.45Å; L850-A906 PolarHBondContact O-N 3.04Å; S904-A906 PolarHBondContact O-N 3.06Å; A906-Y908 PolarHBondContact O-N 2.93Å; A906-T909 WeakPolarHBondContact O-CG2 3.47Å; A906-T909 PolarHBondContact O-N 2.85Å; A906-T909 PolarHBondContact O-OG1 2.83Å
907G86.3Confident92.2Very high0 Ų023.8 Ų23.80%013%0.134CC..G310 helixtrans-67.7-16.7-174.500000115.6I901 S904 T909 C910I901-G907 WeakPolarHBondContact O-CA 3.41Å; S904-G907 PolarHBondContact O-N 3.33Å; S904-G907 WeakPolarHBondContact OG-CA 3.3Å; S904-G907 PolarHBondContact OG-N 2.94Å; S904-G907 VanDerWaalsContact OG-N 3.15Å; G907-T909 PolarHBondContact O-N 3.27Å; G907-C910 WeakPolarHBondContact O-CB 3Å; G907-C910 PolarHBondContact O-N 3.47Å
908Y89.8Confident92.2Very high24 Ų2423.6 Ų23.69%0.09413%0.132CC..G310 helixtrans-58.2-26.6172.967.6-87.6000112.5E905 A906 C910 I911 R958 E965 L969E905-Y908 VanDerWaalsContact O-CD1 3.23Å; E905-Y908 WeakPolarHBondContact O-CD1 3.42Å; E905-Y908 WeakPolarHBondContact O-CE1 3.36Å; A906-Y908 PolarHBondContact O-N 2.93Å; Y908-C910 PolarHBondContact O-N 3.47Å; Y908-I911 WeakPolarHBondContact O-CB 3.39Å; Y908-I911 WeakPolarHBondContact O-CD1 3.47Å; Y908-I911 WeakPolarHBondContact O-CG1 3.44Å; Y908-I911 PolarHBondContact O-N 3.02Å; Y908-I911 VanDerWaalsContact O-N 3.16Å; Y908-R958 VanDerWaalsContact CD1-CZ 3.4Å; Y908-R958 VanDerWaalsContact CD1-NH2 3.34Å; Y908-R958 HydrophobicContact CD2-CG 3.91Å; Y908-R958 HydrophobicContact CE2-CG 4.35Å; Y908-R958 HydrophobicContact CG-CG 3.97Å; Y908-E965 VanDerWaalsContact CE2-OE1 3.29Å; Y908-E965 WeakPolarHBondContact CE2-OE1 3.45Å; Y908-E965 VanDerWaalsContact OH-CD 3.24Å; Y908-E965 PolarHBondContact OH-OE1 2.95Å; Y908-E965 PolarHBondContact OH-OE2 3.44Å; Y908-L969 HydrophobicContact CD2-CD2 3.73Å
909T89.8Confident92.1Very high38 Ų3825.8 Ų25.823%0.23314%0.142CC..G310 helixtrans-61.1-27.5175.3580000112.2A906 G907 I911 P912A906-T909 WeakPolarHBondContact O-CG2 3.47Å; A906-T909 PolarHBondContact O-N 2.85Å; A906-T909 PolarHBondContact O-OG1 2.83Å; G907-T909 PolarHBondContact O-N 3.27Å; T909-I911 PolarHBondContact O-N 2.86Å; T909-P912 WeakPolarHBondContact O-CD 3.36Å
910C92.6Very high92Very high0 Ų024.5 Ų24.50%013%0.131CC..G310 helixtrans-85.50.5179.7-63.20000113.9I901 G907 Y908 P912 A913 V914I901-C910 HydrophobicContact CG2-CB 3.69Å; G907-C910 WeakPolarHBondContact O-CB 3Å; G907-C910 PolarHBondContact O-N 3.47Å; Y908-C910 PolarHBondContact O-N 3.47Å; C910-P912 VanDerWaalsContact C-CD 3.47Å; C910-P912 VanDerWaalsContact C-N 3.33Å; C910-A913 WeakPolarHBondContact O-CA 3.48Å; C910-A913 WeakPolarHBondContact O-CB 3.27Å; C910-A913 PolarHBondContact O-N 3.32Å; C910-V914 WeakPolarHBondContact O-CG2 3.39Å; C910-V914 PolarHBondContact O-N 3.39Å
911I93.8Very high91.9Very high0 Ų022 Ų220%012%0.118CC..Hα-helixtrans-51.1-44.9179.5-75.3169.3000112.7L902 Y908 T909 A913 V914 L915 I951 L954 L955 L969 A973L902-I911 HydrophobicContact CD2-CG1 3.66Å; Y908-I911 WeakPolarHBondContact O-CB 3.39Å; Y908-I911 WeakPolarHBondContact O-CD1 3.47Å; Y908-I911 WeakPolarHBondContact O-CG1 3.44Å; Y908-I911 PolarHBondContact O-N 3.02Å; Y908-I911 VanDerWaalsContact O-N 3.16Å; T909-I911 PolarHBondContact O-N 2.86Å; I911-A913 PolarHBondContact O-N 3.03Å; I911-V914 PolarHBondContact O-N 3.2Å; I911-L915 HydrophobicContact CG2-CD1 3.89Å; I911-L915 HydrophobicContact CG2-CG 4.34Å; I911-L915 PolarHBondContact O-N 3.03Å; I911-I951 HydrophobicContact CD1-CG2 4.37Å; I911-I951 HydrophobicContact CG1-CG2 4.38Å; I911-I951 HydrophobicContact CG2-CG2 3.66Å; I911-L954 HydrophobicContact CD1-CB 4.04Å; I911-L955 HydrophobicContact CD1-CD2 4.06Å; I911-L955 HydrophobicContact CD1-CG 4.29Å; I911-L969 HydrophobicContact CB-CD1 4.46Å; I911-L969 HydrophobicContact CD1-CD2 4.24Å; I911-A973 HydrophobicContact CG2-CB 4.38Å
912P91.8Very high91.6Very high34 Ų3422 Ų2222%0.22112%0.118CC..Hα-helixtrans-61.4-26.2177.9-25.437000114.1T909 C910 P916 L969 S972T909-P912 WeakPolarHBondContact O-CD 3.36Å; C910-P912 VanDerWaalsContact C-CD 3.47Å; C910-P912 VanDerWaalsContact C-N 3.33Å; P912-P916 WeakPolarHBondContact O-CD 3.42Å; P912-P916 WeakPolarHBondContact O-CG 3.43Å; P912-L969 HydrophobicContact CG-CD1 4.3Å; P912-S972 VanDerWaalsContact CG-OG 3.29Å; P912-S972 WeakPolarHBondContact CG-OG 3.23Å
913A93.1Very high91.3Very high20 Ų2025.6 Ų25.617%0.16514%0.137CC..Hα-helixtrans-87.2-29.2176.500000113.1E871 L874 C910 I911E871-A913 HydrophobicContact CB-CB 4.28Å; E871-A913 HydrophobicContact CG-CB 4.01Å; L874-A913 HydrophobicContact CB-CB 4.24Å; L874-A913 HydrophobicContact CD1-CB 3.92Å; C910-A913 WeakPolarHBondContact O-CA 3.48Å; C910-A913 WeakPolarHBondContact O-CB 3.27Å; C910-A913 PolarHBondContact O-N 3.32Å; I911-A913 PolarHBondContact O-N 3.03Å
914V96.5Very high90.9Very high0 Ų023 Ų230%013%0.128CC..Hα-helixtrans-75.3-39.9177.1175.30000112.1L874 C898 L902 C910 I911 I917 L918 I947 I951L874-V914 HydrophobicContact CD1-CG2 3.82Å; C898-V914 HydrophobicContact CB-CG1 3.84Å; C898-V914 HydrophobicContact CB-CG2 4.43Å; L902-V914 HydrophobicContact CD1-CG1 4.18Å; L902-V914 HydrophobicContact CD2-CG2 4.49Å; C910-V914 WeakPolarHBondContact O-CG2 3.39Å; C910-V914 PolarHBondContact O-N 3.39Å; I911-V914 PolarHBondContact O-N 3.2Å; V914-I917 VanDerWaalsContact O-CB 3.3Å; V914-I917 WeakPolarHBondContact O-CB 3.33Å; V914-I917 PolarHBondContact O-N 3.3Å; V914-L918 HydrophobicContact CG1-CG 4.35Å; V914-L918 PolarHBondContact O-N 2.67Å; V914-I947 HydrophobicContact CG1-CG2 4.31Å; V914-I951 HydrophobicContact CG1-CD1 4.08Å
915L94.9Very high90.3Very high0 Ų023.9 Ų23.90%013%0.131CC..Hα-helixtrans-56.6-44.4-178.2-79.4166.1000114I911 I917 L918 K919 F948 I951 A973 S976 L977I911-L915 HydrophobicContact CG2-CD1 3.89Å; I911-L915 HydrophobicContact CG2-CG 4.34Å; I911-L915 PolarHBondContact O-N 3.03Å; L915-I917 VanDerWaalsContact C-N 3.28Å; L915-I917 PolarHBondContact O-N 2.96Å; L915-L918 PolarHBondContact O-N 2.83Å; L915-K919 PolarHBondContact O-N 3.3Å; L915-F948 HydrophobicContact CD2-CD2 4.36Å; L915-I951 HydrophobicContact CD2-CD1 3.74Å; L915-I951 HydrophobicContact CD2-CG2 4.31Å; L915-I951 HydrophobicContact CG-CD1 4Å; L915-I951 HydrophobicContact CG-CG2 4.49Å; L915-A973 HydrophobicContact CD1-CB 4.02Å; L915-S976 VanDerWaalsContact CB-CB 3.48Å; L915-L977 HydrophobicContact CD1-CD2 3.91Å; L915-L977 HydrophobicContact CD1-CG 3.82Å; L915-L977 HydrophobicContact CD2-CD2 3.78Å
916P95.1Very high89.2Confident21 Ų2120.8 Ų20.814%0.13612%0.12CC..Hα-helixtrans-60.5-32.3173.4-26.735.7000114.1R878 P912 K919 E920R878-P916 HydrophobicContact CG-CB 4.02Å; P912-P916 WeakPolarHBondContact O-CD 3.42Å; P912-P916 WeakPolarHBondContact O-CG 3.43Å; P916-K919 PolarHBondContact O-N 3.33Å; P916-E920 WeakPolarHBondContact O-CG 3.18Å; P916-E920 PolarHBondContact O-N 3.37Å
917I96.1Very high87.8Confident0 Ų025.2 Ų25.20%015%0.148CC..Hα-helixtrans-63.3-49.4174.2-65.1-72.4000110L874 C877 R878 F881 I894 V914 L915 K919 E920 V921L874-I917 HydrophobicContact CD2-CG1 4.44Å; L874-I917 WeakPolarHBondContact O-CD1 3.43Å; C877-I917 HydrophobicContact CB-CD1 3.87Å; R878-I917 HydrophobicContact CB-CD1 3.69Å; R878-I917 HydrophobicContact CB-CG1 4.5Å; R878-I917 VanDerWaalsContact N-CD1 3.27Å; F881-I917 HydrophobicContact CD2-CD1 4Å; F881-I917 HydrophobicContact CD2-CG2 4.41Å; F881-I917 HydrophobicContact CE2-CD1 3.97Å; F881-I917 HydrophobicContact CE2-CG2 3.96Å; I894-I917 HydrophobicContact CG2-CD1 4.36Å; I894-I917 HydrophobicContact CG2-CG2 4.04Å; V914-I917 VanDerWaalsContact O-CB 3.3Å; V914-I917 WeakPolarHBondContact O-CB 3.33Å; V914-I917 PolarHBondContact O-N 3.3Å; L915-I917 VanDerWaalsContact C-N 3.28Å; L915-I917 PolarHBondContact O-N 2.96Å; I917-K919 VanDerWaalsContact C-N 3.25Å; I917-K919 PolarHBondContact O-N 3.49Å; I917-E920 PolarHBondContact O-N 3.38Å; I917-V921 HydrophobicContact CG2-CG2 4.23Å; I917-V921 WeakPolarHBondContact O-CB 3.29Å; I917-V921 WeakPolarHBondContact O-CG2 3.38Å; I917-V921 PolarHBondContact O-N 2.87Å
918L95Very high85.7Confident0 Ų032.1 Ų32.10%019%0.185CC..Hα-helixtrans-57.6-42178.3-60.9-171.8000111.3L895 V914 L915 A922 V944 I947 F948 I951 F980L895-L918 HydrophobicContact CD2-CD2 3.75Å; V914-L918 HydrophobicContact CG1-CG 4.35Å; V914-L918 PolarHBondContact O-N 2.67Å; L915-L918 PolarHBondContact O-N 2.83Å; L918-A922 WeakPolarHBondContact O-CB 3.19Å; L918-A922 PolarHBondContact O-N 3.49Å; L918-V944 HydrophobicContact CB-CG1 4.02Å; L918-V944 HydrophobicContact CD2-CG1 4.23Å; L918-I947 HydrophobicContact CD1-CB 4.19Å; L918-I947 HydrophobicContact CD1-CG2 3.88Å; L918-I947 HydrophobicContact CD2-CB 4.02Å; L918-I947 HydrophobicContact CD2-CD1 4.13Å; L918-I947 HydrophobicContact CD2-CG2 3.9Å; L918-I947 HydrophobicContact CG-CG2 4.41Å; L918-F948 HydrophobicContact CD1-CB 4.26Å; L918-I951 HydrophobicContact CD1-CD1 3.64Å; L918-F980 HydrophobicContact CB-CD2 3.94Å; L918-F980 HydrophobicContact CB-CE2 3.85Å
919K93.3Very high83.3Confident46 Ų4642.1 Ų42.120%0.223%0.225CC..Hα-helixtrans-60.8-51.5176179.1-148.2176.1177.70112.3L915 P916 I917 A922 N923 D979 F980 V983L915-K919 PolarHBondContact O-N 3.3Å; P916-K919 PolarHBondContact O-N 3.33Å; I917-K919 VanDerWaalsContact C-N 3.25Å; I917-K919 PolarHBondContact O-N 3.49Å; K919-A922 WeakPolarHBondContact O-CB 3.33Å; K919-A922 PolarHBondContact O-N 3.03Å; K919-N923 VanDerWaalsContact O-CB 3.3Å; K919-N923 WeakPolarHBondContact O-CB 3.35Å; K919-N923 PolarHBondContact O-N 3.01Å; K919-D979 HydrophobicContact CD-CB 3.79Å; K919-D979 HydrophobicContact CG-CB 4.36Å; K919-D979 IonicContact NZ-OD2 2.79Å; K919-D979 PolarHBondContact NZ-OD2 3.48Å; K919-F980 HydrophobicContact CB-CD2 4.47Å; K919-V983 HydrophobicContact CG-CG2 3.81Å
920E93.5Very high81.3Confident18 Ų1846.9 Ų46.98%0.08425%0.249CC..Hα-helixtrans-70-38.3-176-63.5-50.2145.600111.9R878 F881 L882 P916 I917 N923 S924R878-E920 HydrophobicContact CG-CG 3.83Å; F881-E920 HydrophobicContact CB-CB 3.73Å; L882-E920 HydrophobicContact CB-CG 4.49Å; L882-E920 WeakPolarHBondContact CD1-OE2 3.4Å; P916-E920 WeakPolarHBondContact O-CG 3.18Å; P916-E920 PolarHBondContact O-N 3.37Å; I917-E920 PolarHBondContact O-N 3.38Å; E920-N923 PolarHBondContact O-N 3.23Å; E920-S924 PolarHBondContact O-N 3.41Å; E920-S924 VanDerWaalsContact O-N 3.12Å
921V91.4Very high79.1Confident0 Ų053.6 Ų53.60%029%0.285CS..Hα-helixtrans-62.2-45.7172.8175.90000110.3F881 K891 L895 I917 N923 S924 F925 V944F881-V921 HydrophobicContact CD1-CG2 4.35Å; F881-V921 HydrophobicContact CD2-CG2 3.86Å; F881-V921 HydrophobicContact CE1-CG2 4.24Å; F881-V921 HydrophobicContact CE2-CG2 3.74Å; F881-V921 HydrophobicContact CG-CG2 4.18Å; F881-V921 HydrophobicContact CZ-CG2 3.96Å; K891-V921 HydrophobicContact CD-CG1 4.43Å; L895-V921 HydrophobicContact CD1-CG1 4.21Å; L895-V921 HydrophobicContact CD2-CG2 4.45Å; I917-V921 HydrophobicContact CG2-CG2 4.23Å; I917-V921 WeakPolarHBondContact O-CB 3.29Å; I917-V921 WeakPolarHBondContact O-CG2 3.38Å; I917-V921 PolarHBondContact O-N 2.87Å; V921-N923 VanDerWaalsContact C-N 3.32Å; V921-N923 PolarHBondContact O-N 2.97Å; V921-S924 PolarHBondContact O-N 3.22Å; V921-S924 PolarHBondContact O-OG 3.36Å; V921-F925 HydrophobicContact CG1-CE2 3.97Å; V921-F925 WeakPolarHBondContact O-CD2 3.32Å; V921-F925 WeakPolarHBondContact O-CE2 3.43Å; V921-V944 HydrophobicContact CG1-CG2 4.04Å
922A88.7Confident76.9Confident0 Ų062.9 Ų62.90%033%0.328CS..Hα-helixtrans-58.5-41.1175.200000113.5L918 K919 S924 F925 L941 F980 V983 W987L918-A922 WeakPolarHBondContact O-CB 3.19Å; L918-A922 PolarHBondContact O-N 3.49Å; K919-A922 WeakPolarHBondContact O-CB 3.33Å; K919-A922 PolarHBondContact O-N 3.03Å; A922-S924 VanDerWaalsContact C-N 3.27Å; A922-S924 PolarHBondContact O-N 3.17Å; A922-F925 PolarHBondContact O-N 3.01Å; A922-L941 HydrophobicContact CB-CD2 4.5Å; A922-F980 HydrophobicContact CB-CE2 4.49Å; A922-V983 HydrophobicContact CB-CG1 3.71Å; A922-W987 HydrophobicContact CB-CZ2 3.45Å; A922-W987 VanDerWaalsContact CB-CZ2 3.45Å
923N86.8Confident75.2Confident80 Ų8066.6 Ų66.643%0.42835%0.346SS..Hα-helixtrans-71-24.4-177.9-165.952.6000112.2K919 E920 V921 F925 V926 V983K919-N923 VanDerWaalsContact O-CB 3.3Å; K919-N923 WeakPolarHBondContact O-CB 3.35Å; K919-N923 PolarHBondContact O-N 3.01Å; E920-N923 PolarHBondContact O-N 3.23Å; V921-N923 VanDerWaalsContact C-N 3.32Å; V921-N923 PolarHBondContact O-N 2.97Å; N923-F925 PolarHBondContact O-N 3.01Å; N923-V926 WeakPolarHBondContact O-CG2 3.26Å; N923-V926 PolarHBondContact O-N 3.48Å; N923-V983 HydrophobicContact CB-CG1 4.03Å; N923-V983 HydrophobicContact CB-CG2 4.37Å
924S82.1Confident73.7Confident57 Ų5773 Ų7340%0.39937%0.372SS..THydrogen-bonded Turntrans-68.1-11.4176.376.20000114.5K891 E920 V921 A922K891-S924 WeakPolarHBondContact CE-OG 3.44Å; K891-S924 PolarHBondContact NZ-OG 3.32Å; E920-S924 PolarHBondContact O-N 3.41Å; E920-S924 VanDerWaalsContact O-N 3.12Å; V921-S924 PolarHBondContact O-N 3.22Å; V921-S924 PolarHBondContact O-OG 3.36Å; A922-S924 VanDerWaalsContact C-N 3.27Å; A922-S924 PolarHBondContact O-N 3.17Å
925F75.8Confident72.3Confident29 Ų2980.8 Ų80.813%0.12741%0.409CS..THydrogen-bonded Turntrans-112.415.1-179.2-59.1-72.3000113.3E888 K891 V921 A922 N923 N937 M940 L941E888-F925 WeakPolarHBondContact OE1-CE1 3.46Å; E888-F925 WeakPolarHBondContact OE1-CZ 3.27Å; K891-F925 HydrophobicContact CD-CE2 4.23Å; K891-F925 HydrophobicContact CD-CZ 3.87Å; K891-F925 VanDerWaalsContact NZ-CZ 3.3Å; V921-F925 HydrophobicContact CG1-CE2 3.97Å; V921-F925 WeakPolarHBondContact O-CD2 3.32Å; V921-F925 WeakPolarHBondContact O-CE2 3.43Å; A922-F925 PolarHBondContact O-N 3.01Å; N923-F925 PolarHBondContact O-N 3.01Å; F925-N937 HydrophobicContact CD1-CB 3.88Å; F925-N937 VanDerWaalsContact CD1-CG 3.49Å; F925-N937 WeakPolarHBondContact CD1-OD1 3.46Å; F925-N937 HydrophobicContact CE1-CB 4.22Å; F925-N937 WeakPolarHBondContact CE1-OD1 3.41Å; F925-M940 HydrophobicContact CE2-CB 4.22Å; F925-M940 HydrophobicContact CZ-CB 4.14Å; F925-L941 HydrophobicContact CB-CD1 4.28Å; F925-L941 HydrophobicContact CB-CD2 4.33Å; F925-L941 HydrophobicContact CB-CG 4.47Å; F925-L941 HydrophobicContact CD2-CD2 3.91Å; F925-L941 HydrophobicContact CD2-CG 4.28Å; F925-L941 HydrophobicContact CG-CD2 4.48Å
926V62.8Low71Confident58 Ų5883.9 Ų83.935%0.35243%0.431SS..SBendtrans-68130.8173.41790000108.6N923 D928N923-V926 WeakPolarHBondContact O-CG2 3.26Å; N923-V926 PolarHBondContact O-N 3.48Å; V926-D928 PolarHBondContact O-N 3Å; V926-D928 VanDerWaalsContact O-N 3.08Å
927P53.9Low70.2Confident104 Ų10484.8 Ų84.868%0.67543%0.434SS*.  trans-66.3113.3-167.6-5.413.4000112.2
928D43.2Very low69.4Low146 Ų14688.9 Ų88.978%0.78146%0.456SS*.  trans-83.8149.5150.6-101.5-28.6000108.6V926 N930V926-D928 PolarHBondContact O-N 3Å; V926-D928 VanDerWaalsContact O-N 3.08Å; D928-N930 PolarHBondContact O-N 3.23Å
929Y39.7Very low68.8Low233 Ų23393.3 Ų93.391%0.91448%0.483SS*.SBendtrans-61.88.9-164.6-88.2-86.5000117.3
930N46.6Very low68.4Low138 Ų13892.2 Ų92.274%0.73848%0.478SS*.  trans-147.5115.5176.8-78.1-32.8000108.6D928D928-N930 PolarHBondContact O-N 3.23Å
931D48Very low68.1Low142 Ų14292 Ų9276%0.75948%0.478SS*.  trans-166.1144.8143-99.2-23.2000113.5
932Q46.9Very low68Low194 Ų19492.9 Ų92.991%0.90749%0.487SS*.SBendtrans-892.5-172.4-71.5-178.7-39.800114.1
933D55.2Low68.1Low112 Ų11295.4 Ų95.460%0.59950%0.503SS*.  trans-115.350-170.4-70.6-32.3000114.1E935 N937D933-E935 VanDerWaalsContact C-N 3.35Å; D933-E935 PolarHBondContact O-N 3.44Å; D933-N937 VanDerWaalsContact O-CG 3.23Å; D933-N937 PolarHBondContact O-ND2 3.18Å
934Q62.9Low68.4Low154 Ų15491.6 Ų91.672%0.7248%0.482SS*.Hα-helixtrans-64.2-32.2-176.5-76.9-174.4-22.100114.4L938Q934-L938 VanDerWaalsContact O-CG 3.31Å; Q934-L938 WeakPolarHBondContact O-CG 3.18Å; Q934-L938 PolarHBondContact O-N 3.01Å
935E67Low68.9Low164 Ų16489.7 Ų89.777%0.76647%0.469SS*.Hα-helixtrans-75.4-44.4-171-164.4172-172.700113.1D933 N937 L938 V939D933-E935 VanDerWaalsContact C-N 3.35Å; D933-E935 PolarHBondContact O-N 3.44Å; E935-N937 VanDerWaalsContact C-N 3.29Å; E935-N937 PolarHBondContact O-N 3.05Å; E935-L938 PolarHBondContact O-N 2.94Å; E935-V939 PolarHBondContact O-N 3.48Å
936S67.6Low69.7Low66 Ų6693.1 Ų93.146%0.46249%0.489SS..Hα-helixtrans-62.6-37.2176.2-173.50000111.9V939 M940S936-V939 PolarHBondContact O-N 3.01Å; S936-M940 PolarHBondContact O-N 2.89Å; S936-M940 VanDerWaalsContact O-N 3.16Å
937N77.1Confident71.3Confident39 Ų3990.8 Ų90.821%0.20948%0.475CS..Hα-helixtrans-65.4-39.8178.6-66.1-10.6000111.7F925 D933 E935 M940 L941F925-N937 HydrophobicContact CD1-CB 3.88Å; F925-N937 VanDerWaalsContact CD1-CG 3.49Å; F925-N937 WeakPolarHBondContact CD1-OD1 3.46Å; F925-N937 HydrophobicContact CE1-CB 4.22Å; F925-N937 WeakPolarHBondContact CE1-OD1 3.41Å; D933-N937 VanDerWaalsContact O-CG 3.23Å; D933-N937 PolarHBondContact O-ND2 3.18Å; E935-N937 VanDerWaalsContact C-N 3.29Å; E935-N937 PolarHBondContact O-N 3.05Å; N937-M940 PolarHBondContact O-N 3.28Å; N937-L941 WeakPolarHBondContact O-CG 3.44Å; N937-L941 PolarHBondContact O-N 3.28Å
938L79.7Confident73.2Confident87 Ų8785.9 Ų85.946%0.45544%0.443SS..Hα-helixtrans-65.3-39.1176.6-71.8170.4000112.1Q934 E935 L941 G942 L991Q934-L938 VanDerWaalsContact O-CG 3.31Å; Q934-L938 WeakPolarHBondContact O-CG 3.18Å; Q934-L938 PolarHBondContact O-N 3.01Å; E935-L938 PolarHBondContact O-N 2.94Å; L938-L941 PolarHBondContact O-N 3.39Å; L938-G942 PolarHBondContact O-N 3.42Å; L938-L991 HydrophobicContact CD2-CD1 3.59Å
939V83Confident75.7Confident93 Ų9383.7 Ų83.756%0.56443%0.428SS*.Hα-helixtrans-62.2-46.7176.4175.70000110.8E935 S936 G942 V943E935-V939 PolarHBondContact O-N 3.48Å; S936-V939 PolarHBondContact O-N 3.01Å; V939-G942 PolarHBondContact O-N 3.11Å; V939-V943 PolarHBondContact O-N 3.17Å
940M85.3Confident78.3Confident22 Ų2275.2 Ų75.211%0.10840%0.396CS..Hα-helixtrans-64.6-42.8179.3-73.3-68-84.200112.4K891 L895 F925 S936 N937 G942 V943 V944K891-M940 HydrophobicContact CB-CE 3.42Å; K891-M940 VanDerWaalsContact CB-CE 3.42Å; K891-M940 HydrophobicContact CD-CE 4.45Å; L895-M940 HydrophobicContact CD1-CE 3.84Å; L895-M940 HydrophobicContact CD1-SD 4.33Å; F925-M940 HydrophobicContact CE2-CB 4.22Å; F925-M940 HydrophobicContact CZ-CB 4.14Å; S936-M940 PolarHBondContact O-N 2.89Å; S936-M940 VanDerWaalsContact O-N 3.16Å; N937-M940 PolarHBondContact O-N 3.28Å; M940-G942 VanDerWaalsContact C-N 3.28Å; M940-G942 PolarHBondContact O-N 3.05Å; M940-V943 WeakPolarHBondContact O-CB 3.4Å; M940-V943 PolarHBondContact O-N 3.36Å; M940-V944 WeakPolarHBondContact O-CG2 3.28Å; M940-V944 PolarHBondContact O-N 2.82Å
941L87.7Confident80.7Confident13 Ų1368.6 Ų68.67%0.06836%0.36CS..Hα-helixtrans-64.4-33.5173.8-68.8176.6000112.3A922 F925 N937 L938 V944 A945 W987 L991A922-L941 HydrophobicContact CB-CD2 4.5Å; F925-L941 HydrophobicContact CB-CD1 4.28Å; F925-L941 HydrophobicContact CB-CD2 4.33Å; F925-L941 HydrophobicContact CB-CG 4.47Å; F925-L941 HydrophobicContact CD2-CD2 3.91Å; F925-L941 HydrophobicContact CD2-CG 4.28Å; F925-L941 HydrophobicContact CG-CD2 4.48Å; N937-L941 WeakPolarHBondContact O-CG 3.44Å; N937-L941 PolarHBondContact O-N 3.28Å; L938-L941 PolarHBondContact O-N 3.39Å; L941-V944 WeakPolarHBondContact O-CB 3.07Å; L941-V944 PolarHBondContact O-N 3.46Å; L941-A945 PolarHBondContact O-N 3.34Å; L941-W987 HydrophobicContact CD2-CH2 4.35Å; L941-W987 HydrophobicContact CD2-CZ2 3.73Å; L941-L991 HydrophobicContact CB-CD1 3.74Å; L941-L991 HydrophobicContact CD1-CD1 3.98Å
942G87.9Confident82.9Confident19 Ų1962.1 Ų62.120%0.19633%0.326CS..Hα-helixtrans-61.4-43.4170.400000112.7L938 V939 M940 V944 A945 N946L938-G942 PolarHBondContact O-N 3.42Å; V939-G942 PolarHBondContact O-N 3.11Å; M940-G942 VanDerWaalsContact C-N 3.28Å; M940-G942 PolarHBondContact O-N 3.05Å; G942-V944 VanDerWaalsContact C-N 3.34Å; G942-V944 PolarHBondContact O-N 3.33Å; G942-A945 PolarHBondContact O-N 3.34Å; G942-N946 VanDerWaalsContact O-CG 3.31Å; G942-N946 PolarHBondContact O-N 3.47Å; G942-N946 PolarHBondContact O-ND2 3.36Å
943V91.1Very high85.2Confident54 Ų5457.2 Ų57.233%0.32730%0.303SS..Hα-helixtrans-61.1-43.6173.41760000111L895 V939 M940 A945 N946 I947L895-V943 HydrophobicContact CB-CG1 4.3Å; L895-V943 HydrophobicContact CD1-CG1 4.12Å; V939-V943 PolarHBondContact O-N 3.17Å; M940-V943 WeakPolarHBondContact O-CB 3.4Å; M940-V943 PolarHBondContact O-N 3.36Å; V943-A945 VanDerWaalsContact C-N 3.33Å; V943-A945 PolarHBondContact O-N 3.03Å; V943-N946 PolarHBondContact O-N 3.43Å; V943-I947 HydrophobicContact CG1-CD1 3.97Å; V943-I947 HydrophobicContact CG1-CG1 4.46Å; V943-I947 WeakPolarHBondContact O-CG1 3.41Å; V943-I947 PolarHBondContact O-N 3.12Å
944V93.6Very high86.9Confident0 Ų052.5 Ų52.50%028%0.277CS..Hα-helixtrans-59.1-44.5176.2172.80000111.2L895 L918 V921 M940 L941 G942 N946 I947 F948 F980 W987L895-V944 HydrophobicContact CD1-CG2 4.08Å; L895-V944 HydrophobicContact CD2-CG2 4.04Å; L918-V944 HydrophobicContact CB-CG1 4.02Å; L918-V944 HydrophobicContact CD2-CG1 4.23Å; V921-V944 HydrophobicContact CG1-CG2 4.04Å; M940-V944 WeakPolarHBondContact O-CG2 3.28Å; M940-V944 PolarHBondContact O-N 2.82Å; L941-V944 WeakPolarHBondContact O-CB 3.07Å; L941-V944 PolarHBondContact O-N 3.46Å; G942-V944 VanDerWaalsContact C-N 3.34Å; G942-V944 PolarHBondContact O-N 3.33Å; V944-N946 PolarHBondContact O-N 3.14Å; V944-I947 PolarHBondContact O-N 3.11Å; V944-F948 WeakPolarHBondContact O-CB 3.47Å; V944-F948 PolarHBondContact O-N 3.4Å; V944-F980 HydrophobicContact CG1-CE2 3.65Å; V944-F980 HydrophobicContact CG1-CZ 3.99Å; V944-W987 HydrophobicContact CB-CH2 4.39Å; V944-W987 HydrophobicContact CG1-CH2 3.87Å; V944-W987 HydrophobicContact CG1-CZ2 4.18Å
945A91.6Very high88.4Confident16 Ų1645.1 Ų45.113%0.13224%0.243CC..Hα-helixtrans-61.9-41.1176.800000112.3L941 G942 V943 F948 Q949 V995L941-A945 PolarHBondContact O-N 3.34Å; G942-A945 PolarHBondContact O-N 3.34Å; V943-A945 VanDerWaalsContact C-N 3.33Å; V943-A945 PolarHBondContact O-N 3.03Å; A945-F948 WeakPolarHBondContact O-CB 3.34Å; A945-F948 PolarHBondContact O-N 2.93Å; A945-Q949 PolarHBondContact O-N 2.93Å; A945-V995 HydrophobicContact CB-CG2 4.32Å
946N93Very high89.6Confident102 Ų10238.6 Ų38.655%0.54522%0.217SC..Hα-helixtrans-64.7-41.5176.9-69.6-23.2000112.5G942 V943 V944 F948 Q949 K950G942-N946 VanDerWaalsContact O-CG 3.31Å; G942-N946 PolarHBondContact O-N 3.47Å; G942-N946 PolarHBondContact O-ND2 3.36Å; V943-N946 PolarHBondContact O-N 3.43Å; V944-N946 PolarHBondContact O-N 3.14Å; N946-F948 VanDerWaalsContact C-N 3.33Å; N946-Q949 PolarHBondContact O-N 3.46Å; N946-K950 PolarHBondContact O-N 3.18Å
947I95.5Very high90.7Very high9 Ų941.6 Ų41.65%0.04622%0.218CC..Hα-helixtrans-66-40.5175.7-61.7169.9000110L895 L902 V914 L918 V943 V944 Q949 K950 I951L895-I947 HydrophobicContact CB-CD1 4.05Å; L895-I947 HydrophobicContact CD2-CD1 3.95Å; L895-I947 WeakPolarHBondContact O-CD1 3.48Å; L902-I947 HydrophobicContact CD1-CG2 3.54Å; V914-I947 HydrophobicContact CG1-CG2 4.31Å; L918-I947 HydrophobicContact CD1-CB 4.19Å; L918-I947 HydrophobicContact CD1-CG2 3.88Å; L918-I947 HydrophobicContact CD2-CB 4.02Å; L918-I947 HydrophobicContact CD2-CD1 4.13Å; L918-I947 HydrophobicContact CD2-CG2 3.9Å; L918-I947 HydrophobicContact CG-CG2 4.41Å; V943-I947 HydrophobicContact CG1-CD1 3.97Å; V943-I947 HydrophobicContact CG1-CG1 4.46Å; V943-I947 WeakPolarHBondContact O-CG1 3.41Å; V943-I947 PolarHBondContact O-N 3.12Å; V944-I947 PolarHBondContact O-N 3.11Å; I947-Q949 PolarHBondContact O-N 3.37Å; I947-K950 WeakPolarHBondContact O-CB 3.4Å; I947-K950 PolarHBondContact O-N 3.34Å; I947-K950 VanDerWaalsContact O-N 3.15Å; I947-I951 HydrophobicContact CG2-CD1 4.42Å; I947-I951 WeakPolarHBondContact O-CG1 3.25Å; I947-I951 PolarHBondContact O-N 2.88Å
948F95.9Very high91.3Very high0 Ų041 Ų410%021%0.213CC..Hα-helixtrans-59.3-45.1174.1176.3-99.8000112L915 L918 V944 A945 N946 K950 I951 I952 L977 F980 L981 V995 T998 V999L915-F948 HydrophobicContact CD2-CD2 4.36Å; L918-F948 HydrophobicContact CD1-CB 4.26Å; V944-F948 WeakPolarHBondContact O-CB 3.47Å; V944-F948 PolarHBondContact O-N 3.4Å; A945-F948 WeakPolarHBondContact O-CB 3.34Å; A945-F948 PolarHBondContact O-N 2.93Å; N946-F948 VanDerWaalsContact C-N 3.33Å; F948-K950 VanDerWaalsContact C-N 3.28Å; F948-K950 PolarHBondContact O-N 2.78Å; F948-I951 WeakPolarHBondContact O-CB 3.29Å; F948-I951 PolarHBondContact O-N 2.71Å; F948-I951 VanDerWaalsContact O-N 3.12Å; F948-I952 HydrophobicContact CD1-CG1 4.44Å; F948-I952 HydrophobicContact CE1-CD1 4.44Å; F948-I952 HydrophobicContact CE1-CG1 3.98Å; F948-I952 HydrophobicContact CE2-CD1 4.19Å; F948-I952 HydrophobicContact CE2-CG1 4.45Å; F948-I952 HydrophobicContact CZ-CD1 3.94Å; F948-I952 HydrophobicContact CZ-CG1 4Å; F948-I952 PolarHBondContact O-N 2.62Å; F948-I952 VanDerWaalsContact O-N 3.1Å; F948-L977 HydrophobicContact CE2-CD2 3.75Å; F948-F980 HydrophobicContact CB-CE1 3.99Å; F948-F980 HydrophobicContact CB-CZ 4.02Å; F948-F980 HydrophobicContact CD1-CE1 4.07Å; F948-F980 AromaticContact CD2-CD1 3.48Å; F948-F980 HydrophobicContact CD2-CD1 3.48Å; F948-F980 VanDerWaalsContact CD2-CD1 3.48Å; F948-F980 AromaticContact CD2-CE1 3.25Å; F948-F980 HydrophobicContact CD2-CE1 3.25Å; F948-F980 HydrophobicContact CD2-CG 4.4Å; F948-F980 HydrophobicContact CD2-CZ 4.05Å; F948-F980 HydrophobicContact CE1-CE1 4.39Å; F948-F980 AromaticContact CE2-CD1 3.52Å; F948-F980 HydrophobicContact CE2-CD1 3.52Å; F948-F980 AromaticContact CE2-CE1 3.64Å; F948-F980 HydrophobicContact CE2-CE1 3.64Å; F948-F980 HydrophobicContact CG-CD1 4.19Å; F948-F980 AromaticContact CG-CE1 3.49Å; F948-F980 HydrophobicContact CG-CE1 3.49Å; F948-F980 VanDerWaalsContact CG-CE1 3.49Å; F948-F980 HydrophobicContact CG-CZ 4.04Å; F948-F980 HydrophobicContact CZ-CD1 4.28Å; F948-F980 HydrophobicContact CZ-CE1 4.2Å; F948-L981 HydrophobicContact CZ-CD2 4.09Å; F948-V995 HydrophobicContact CD1-CG1 4.05Å; F948-V995 HydrophobicContact CE1-CG1 3.73Å; F948-V995 HydrophobicContact CZ-CG1 4.28Å; F948-T998 HydrophobicContact CD1-CG2 4.41Å; F948-T998 HydrophobicContact CE1-CG2 4.34Å; F948-V999 HydrophobicContact CE1-CG2 3.86Å; F948-V999 HydrophobicContact CZ-CG2 3.88Å
949Q94.6Very high91.8Very high101 Ų10137.7 Ų37.747%0.47220%0.196SC..Hα-helixtrans-56.7-43.2173.5-179.3-178.9300111.9A945 N946 I947 I951 I952 E953 T998A945-Q949 PolarHBondContact O-N 2.93Å; N946-Q949 PolarHBondContact O-N 3.46Å; I947-Q949 PolarHBondContact O-N 3.37Å; Q949-I951 VanDerWaalsContact C-N 3.31Å; Q949-I951 PolarHBondContact O-N 3.22Å; Q949-I952 PolarHBondContact O-N 3.04Å; Q949-E953 PolarHBondContact O-N 3.45Å; Q949-T998 HydrophobicContact CB-CG2 3.9Å; Q949-T998 HydrophobicContact CG-CG2 3.92Å
950K95.1Very high92Very high54 Ų5442.4 Ų42.424%0.23520%0.204CC..Hα-helixtrans-62.9-37.5177.1-169.864.2-174.4176.10112.6L902 N946 I947 F948 E953 L954L902-K950 HydrophobicContact CB-CG 4.42Å; N946-K950 PolarHBondContact O-N 3.18Å; I947-K950 WeakPolarHBondContact O-CB 3.4Å; I947-K950 PolarHBondContact O-N 3.34Å; I947-K950 VanDerWaalsContact O-N 3.15Å; F948-K950 VanDerWaalsContact C-N 3.28Å; F948-K950 PolarHBondContact O-N 2.78Å; K950-E953 VanDerWaalsContact CD-OE2 3.31Å; K950-E953 WeakPolarHBondContact CD-OE2 3.39Å; K950-E953 IonicContact NZ-OE1 3.49Å; K950-E953 PolarHBondContact NZ-OE1 3.11Å; K950-E953 IonicContact NZ-OE2 2.83Å; K950-E953 PolarHBondContact NZ-OE2 3.12Å; K950-E953 WeakPolarHBondContact O-CB 3.47Å; K950-E953 PolarHBondContact O-N 2.77Å; K950-L954 HydrophobicContact CG-CD1 4.23Å; K950-L954 VanDerWaalsContact O-CG 3.31Å; K950-L954 WeakPolarHBondContact O-CG 3.46Å; K950-L954 PolarHBondContact O-N 3.08Å
951I95.6Very high92.2Very high0 Ų047.1 Ų47.10%022%0.223CC..Hα-helixtrans-60.7-47.8174.9-69.7167.2000110.4L902 I911 V914 L915 L918 I947 F948 Q949 E953 L954 L955L902-I951 HydrophobicContact CD1-CD1 4.23Å; L902-I951 HydrophobicContact CD1-CG1 3.64Å; L902-I951 HydrophobicContact CD2-CG1 4.22Å; I911-I951 HydrophobicContact CD1-CG2 4.37Å; I911-I951 HydrophobicContact CG1-CG2 4.38Å; I911-I951 HydrophobicContact CG2-CG2 3.66Å; V914-I951 HydrophobicContact CG1-CD1 4.08Å; L915-I951 HydrophobicContact CD2-CD1 3.74Å; L915-I951 HydrophobicContact CD2-CG2 4.31Å; L915-I951 HydrophobicContact CG-CD1 4Å; L915-I951 HydrophobicContact CG-CG2 4.49Å; L918-I951 HydrophobicContact CD1-CD1 3.64Å; I947-I951 HydrophobicContact CG2-CD1 4.42Å; I947-I951 WeakPolarHBondContact O-CG1 3.25Å; I947-I951 PolarHBondContact O-N 2.88Å; F948-I951 WeakPolarHBondContact O-CB 3.29Å; F948-I951 PolarHBondContact O-N 2.71Å; F948-I951 VanDerWaalsContact O-N 3.12Å; Q949-I951 VanDerWaalsContact C-N 3.31Å; Q949-I951 PolarHBondContact O-N 3.22Å; I951-E953 VanDerWaalsContact C-N 3.33Å; I951-E953 PolarHBondContact O-N 3.47Å; I951-L954 PolarHBondContact O-N 2.63Å; I951-L955 HydrophobicContact CG2-CD1 4.11Å; I951-L955 HydrophobicContact CG2-CG 4.42Å; I951-L955 WeakPolarHBondContact O-CG 3.48Å; I951-L955 PolarHBondContact O-N 3.04Å
952I95.3Very high92.3Very high5 Ų551.1 Ų51.13%0.02624%0.242CC..Hα-helixtrans-61.5-42.4178.2-58.3-50.2000111.2F948 Q949 L954 L955 A956 L977 T998 A1002 L1036F948-I952 HydrophobicContact CD1-CG1 4.44Å; F948-I952 HydrophobicContact CE1-CD1 4.44Å; F948-I952 HydrophobicContact CE1-CG1 3.98Å; F948-I952 HydrophobicContact CE2-CD1 4.19Å; F948-I952 HydrophobicContact CE2-CG1 4.45Å; F948-I952 HydrophobicContact CZ-CD1 3.94Å; F948-I952 HydrophobicContact CZ-CG1 4Å; F948-I952 PolarHBondContact O-N 2.62Å; F948-I952 VanDerWaalsContact O-N 3.1Å; Q949-I952 PolarHBondContact O-N 3.04Å; I952-L954 PolarHBondContact O-N 3.46Å; I952-L955 HydrophobicContact CD1-CD1 4.38Å; I952-L955 PolarHBondContact O-N 3.5Å; I952-A956 WeakPolarHBondContact O-CB 3.35Å; I952-A956 PolarHBondContact O-N 3.27Å; I952-L977 HydrophobicContact CD1-CD2 4.27Å; I952-T998 HydrophobicContact CB-CG2 4.43Å; I952-T998 HydrophobicContact CG1-CG2 4.28Å; I952-A1002 HydrophobicContact CG2-CB 3.54Å; I952-L1036 HydrophobicContact CD1-CD2 4Å
953E93.8Very high92.2Very high92 Ų9253.7 Ų53.743%0.4326%0.255SS..Hα-helixtrans-58.9-44.4175.1-170.5-156.3135.200112.1Q949 K950 I951 A956 R957Q949-E953 PolarHBondContact O-N 3.45Å; K950-E953 VanDerWaalsContact CD-OE2 3.31Å; K950-E953 WeakPolarHBondContact CD-OE2 3.39Å; K950-E953 IonicContact NZ-OE1 3.49Å; K950-E953 PolarHBondContact NZ-OE1 3.11Å; K950-E953 IonicContact NZ-OE2 2.83Å; K950-E953 PolarHBondContact NZ-OE2 3.12Å; K950-E953 WeakPolarHBondContact O-CB 3.47Å; K950-E953 PolarHBondContact O-N 2.77Å; I951-E953 VanDerWaalsContact C-N 3.33Å; I951-E953 PolarHBondContact O-N 3.47Å; E953-A956 WeakPolarHBondContact O-CB 3.38Å; E953-A956 PolarHBondContact O-N 3.42Å; E953-R957 WeakPolarHBondContact O-CB 3.33Å; E953-R957 PolarHBondContact O-N 2.96Å
954L92.8Very high92.1Very high12 Ų1259.2 Ų59.26%0.06328%0.277CS..Hα-helixtrans-68.1-41179.9-72.7170000112.5L902 I911 K950 I951 I952 A956 R957 R958L902-L954 HydrophobicContact CB-CD1 3.86Å; L902-L954 HydrophobicContact CD2-CD1 3.87Å; L902-L954 HydrophobicContact CG-CD1 4.38Å; L902-L954 WeakPolarHBondContact O-CD1 3.42Å; I911-L954 HydrophobicContact CD1-CB 4.04Å; K950-L954 HydrophobicContact CG-CD1 4.23Å; K950-L954 VanDerWaalsContact O-CG 3.31Å; K950-L954 WeakPolarHBondContact O-CG 3.46Å; K950-L954 PolarHBondContact O-N 3.08Å; I951-L954 PolarHBondContact O-N 2.63Å; I952-L954 PolarHBondContact O-N 3.46Å; L954-A956 VanDerWaalsContact C-N 3.33Å; L954-R957 PolarHBondContact O-N 3.06Å; L954-R958 WeakPolarHBondContact O-CB 3.42Å; L954-R958 WeakPolarHBondContact O-CG 3.35Å; L954-R958 PolarHBondContact O-N 2.94Å
955L93.4Very high91.8Very high0 Ų062.2 Ų62.20%029%0.291CS..Hα-helixtrans-58.8-47.1173.2-68.6174.6000110.5I911 I951 I952 R957 R958 L959 L969 L977 L1032 L1035I911-L955 HydrophobicContact CD1-CD2 4.06Å; I911-L955 HydrophobicContact CD1-CG 4.29Å; I951-L955 HydrophobicContact CG2-CD1 4.11Å; I951-L955 HydrophobicContact CG2-CG 4.42Å; I951-L955 WeakPolarHBondContact O-CG 3.48Å; I951-L955 PolarHBondContact O-N 3.04Å; I952-L955 HydrophobicContact CD1-CD1 4.38Å; I952-L955 PolarHBondContact O-N 3.5Å; L955-R957 PolarHBondContact O-N 3.49Å; L955-R958 PolarHBondContact O-N 3.25Å; L955-L959 WeakPolarHBondContact O-CB 3.49Å; L955-L959 WeakPolarHBondContact O-CG 3.49Å; L955-L959 PolarHBondContact O-N 2.73Å; L955-L969 HydrophobicContact CD2-CD2 3.81Å; L955-L969 HydrophobicContact CD2-CG 3.82Å; L955-L977 HydrophobicContact CD1-CD1 4.43Å; L955-L1032 HydrophobicContact CB-CD1 4.04Å; L955-L1035 HydrophobicContact CD1-CD2 4.3Å
956A91.6Very high91.6Very high27 Ų2761.5 Ų61.522%0.22329%0.285CS..Hα-helixtrans-60.4-43.7176.300000112.4I952 E953 L954 R960 L1032I952-A956 WeakPolarHBondContact O-CB 3.35Å; I952-A956 PolarHBondContact O-N 3.27Å; E953-A956 WeakPolarHBondContact O-CB 3.38Å; E953-A956 PolarHBondContact O-N 3.42Å; L954-A956 VanDerWaalsContact C-N 3.33Å; A956-R960 PolarHBondContact O-N 3.11Å; A956-L1032 HydrophobicContact CB-CD2 3.55Å
957R90.7Very high91.4Very high128 Ų12860.6 Ų60.648%0.48328%0.278SS..Hα-helixtrans-65.6-41.2179.9-171.6178.7-171.7-1690.4111.8E953 L954 L955 R960 K961E953-R957 WeakPolarHBondContact O-CB 3.33Å; E953-R957 PolarHBondContact O-N 2.96Å; L954-R957 PolarHBondContact O-N 3.06Å; L955-R957 PolarHBondContact O-N 3.49Å; R957-R960 PolarHBondContact O-N 3.39Å; R957-K961 PolarHBondContact O-N 3.48Å
958R91.2Very high91.1Very high26 Ų2666 Ų6610%0.09831%0.306CS..Hα-helixtrans-70.2-44.1-179.9-73-71.7162.9-169.41.5111.8E905 Y908 L954 L955 R960 K961 E962E905-R958 PolarHBondContact O-NH2 3.47Å; Y908-R958 VanDerWaalsContact CD1-CZ 3.4Å; Y908-R958 VanDerWaalsContact CD1-NH2 3.34Å; Y908-R958 HydrophobicContact CD2-CG 3.91Å; Y908-R958 HydrophobicContact CE2-CG 4.35Å; Y908-R958 HydrophobicContact CG-CG 3.97Å; L954-R958 WeakPolarHBondContact O-CB 3.42Å; L954-R958 WeakPolarHBondContact O-CG 3.35Å; L954-R958 PolarHBondContact O-N 2.94Å; L955-R958 PolarHBondContact O-N 3.25Å; R958-R960 PolarHBondContact O-N 2.96Å; R958-R960 VanDerWaalsContact O-N 3.12Å; R958-K961 PolarHBondContact O-N 3.16Å; R958-K961 VanDerWaalsContact O-N 3.14Å; R958-E962 IonicContact NH1-OE1 2.75Å; R958-E962 CarbonylContact O-C 3.38Å; R958-E962 PolarHBondContact O-N 2.98Å
959L90.1Very high90.8Very high18 Ų1866.8 Ų66.89%0.09431%0.31CS..Hα-helixtrans-55.1-31.4171.7-77.1168.9000113.2L955 Q967 P1031 L1032L955-L959 WeakPolarHBondContact O-CB 3.49Å; L955-L959 WeakPolarHBondContact O-CG 3.49Å; L955-L959 PolarHBondContact O-N 2.73Å; L959-Q967 HydrophobicContact CD2-CG 3.98Å; L959-P1031 HydrophobicContact CD1-CB 4.1Å; L959-P1031 HydrophobicContact CD2-CB 3.8Å; L959-L1032 HydrophobicContact CD1-CB 3.66Å; L959-L1032 HydrophobicContact CD1-CD1 4.22Å
960R86.9Confident90.6Very high193 Ų19362.3 Ų62.373%0.72829%0.29SS*.Hα-helixtrans-80.2-38.9177.4-168.6-176.2-57.4178.32.8113.7A956 R957 R958A956-R960 PolarHBondContact O-N 3.11Å; R957-R960 PolarHBondContact O-N 3.39Å; R958-R960 PolarHBondContact O-N 2.96Å; R958-R960 VanDerWaalsContact O-N 3.12Å
961K88.8Confident90.3Very high121 Ų12168.2 Ų68.253%0.52631%0.311SS..Hα-helixtrans-81.6-47.8-177.1-76.6-171.3168.7-164.80112.4R957 R958R957-K961 PolarHBondContact O-N 3.48Å; R958-K961 PolarHBondContact O-N 3.16Å; R958-K961 VanDerWaalsContact O-N 3.14Å
962E89.2Confident90Very high96 Ų9671 Ų7145%0.44933%0.33SS..  trans-137.286.9-174.2-70.1-178.8-130.200109R958 E964 E965 G966R958-E962 IonicContact NH1-OE1 2.75Å; R958-E962 CarbonylContact O-C 3.38Å; R958-E962 PolarHBondContact O-N 2.98Å; E962-E964 PolarHBondContact O-N 3.23Å; E962-E965 HydrophobicContact CB-CB 4.26Å; E962-G966 PolarHBondContact O-N 3.39Å
963P87Confident89.8Confident73 Ų7370.7 Ų70.747%0.47433%0.328SS..Hα-helixtrans-60.4-40.1-169.3-27.135.2000114.9Q967P963-Q967 WeakPolarHBondContact O-CB 3.32Å; P963-Q967 VanDerWaalsContact O-CG 3.25Å; P963-Q967 WeakPolarHBondContact O-CG 3.48Å; P963-Q967 PolarHBondContact O-N 3.02Å
964E88Confident89.7Confident170 Ų17067.2 Ų67.279%0.79431%0.313SS*.Hα-helixtrans-67.9-48.9-178.1-64.3-174.2176.900111.9E962 Q967 L968E962-E964 PolarHBondContact O-N 3.23Å; E964-Q967 PolarHBondContact O-N 3.15Å; E964-L968 PolarHBondContact O-N 3.28Å; E964-L968 VanDerWaalsContact O-N 3.15Å
965E87Confident89.6Confident64 Ų6470.4 Ų70.430%0.29934%0.335SS..Hα-helixtrans-63.7-42.9176.1-166.3-162.3-164.500110.9Y908 E962 Q967 L968 L969Y908-E965 VanDerWaalsContact CE2-OE1 3.29Å; Y908-E965 WeakPolarHBondContact CE2-OE1 3.45Å; Y908-E965 VanDerWaalsContact OH-CD 3.24Å; Y908-E965 PolarHBondContact OH-OE1 2.95Å; Y908-E965 PolarHBondContact OH-OE2 3.44Å; E962-E965 HydrophobicContact CB-CB 4.26Å; E965-Q967 VanDerWaalsContact C-N 3.34Å; E965-Q967 PolarHBondContact O-N 3.19Å; E965-L968 PolarHBondContact O-N 3.29Å; E965-L969 WeakPolarHBondContact O-CB 3.36Å; E965-L969 PolarHBondContact O-N 2.65Å
966G88.9Confident89.4Confident0 Ų071.4 Ų71.40%034%0.342CS..Hα-helixtrans-58.7-41.4175.600000112.8E962 L969 C970E962-G966 PolarHBondContact O-N 3.39Å; G966-L969 PolarHBondContact O-N 2.95Å; G966-C970 WeakPolarHBondContact O-CB 3.48Å; G966-C970 PolarHBondContact O-N 3.26Å; G966-C970 PolarHBondContact O-SG 2.86Å
967Q88.1Confident89.5Confident83 Ų8370.2 Ų70.239%0.38833%0.332SS..Hα-helixtrans-65.9-42.1176.4-78.4178.716.600112.4L959 P963 E964 E965 C970 R971L959-Q967 HydrophobicContact CD2-CG 3.98Å; P963-Q967 WeakPolarHBondContact O-CB 3.32Å; P963-Q967 VanDerWaalsContact O-CG 3.25Å; P963-Q967 WeakPolarHBondContact O-CG 3.48Å; P963-Q967 PolarHBondContact O-N 3.02Å; E964-Q967 PolarHBondContact O-N 3.15Å; E965-Q967 VanDerWaalsContact C-N 3.34Å; E965-Q967 PolarHBondContact O-N 3.19Å; Q967-C970 PolarHBondContact O-N 3.12Å; Q967-R971 WeakPolarHBondContact O-CG 3.44Å; Q967-R971 PolarHBondContact O-N 2.84Å
968L88.9Confident89.6Confident123 Ų12365.3 Ų65.364%0.64432%0.316SS*.Hα-helixtrans-62.5-45.2177.2-176.365000111.1E964 E965 R971 S972E964-L968 PolarHBondContact O-N 3.28Å; E964-L968 VanDerWaalsContact O-N 3.15Å; E965-L968 PolarHBondContact O-N 3.29Å; L968-R971 PolarHBondContact O-N 2.7Å; L968-S972 PolarHBondContact O-N 3.36Å
969L90.4Very high89.6Confident17 Ų1767.7 Ų67.79%0.08933%0.33CS..Hα-helixtrans-59.9-47176.1-178.764.9000111.6Y908 I911 P912 L955 E965 G966 R971 S972 A973Y908-L969 HydrophobicContact CD2-CD2 3.73Å; I911-L969 HydrophobicContact CB-CD1 4.46Å; I911-L969 HydrophobicContact CD1-CD2 4.24Å; P912-L969 HydrophobicContact CG-CD1 4.3Å; L955-L969 HydrophobicContact CD2-CD2 3.81Å; L955-L969 HydrophobicContact CD2-CG 3.82Å; E965-L969 WeakPolarHBondContact O-CB 3.36Å; E965-L969 PolarHBondContact O-N 2.65Å; G966-L969 PolarHBondContact O-N 2.95Å; L969-R971 PolarHBondContact O-N 3.16Å; L969-S972 PolarHBondContact O-N 3.43Å; L969-S972 VanDerWaalsContact O-N 3.17Å; L969-S972 PolarHBondContact O-OG 2.95Å; L969-A973 PolarHBondContact O-N 3.22Å
970C89.6Confident89.8Confident6 Ų666.8 Ų66.84%0.04133%0.326CS..Hα-helixtrans-56.7-48.5176.7-74.30000111.5G966 Q967 S972 A973 V974 L1035G966-C970 WeakPolarHBondContact O-CB 3.48Å; G966-C970 PolarHBondContact O-N 3.26Å; G966-C970 PolarHBondContact O-SG 2.86Å; Q967-C970 PolarHBondContact O-N 3.12Å; C970-S972 VanDerWaalsContact C-N 3.31Å; C970-S972 PolarHBondContact O-N 2.7Å; C970-A973 PolarHBondContact O-N 2.93Å; C970-A973 VanDerWaalsContact O-N 3.11Å; C970-V974 PolarHBondContact O-N 3.46Å; C970-L1035 HydrophobicContact CB-CD1 3.9Å; C970-L1035 HydrophobicContact CB-CD2 3.62Å; C970-L1035 HydrophobicContact CB-CG 4.24Å; C970-L1035 VanDerWaalsContact O-CD1 3.23Å; C970-L1035 WeakPolarHBondContact O-CD1 3.26Å
971R88.5Confident90Very high179 Ų17957.8 Ų57.868%0.67529%0.292SS*.Hα-helixtrans-58.4-41.7176.5-72.5176.4-177.3169.63.7112.3Q967 L968 L969 A973 V974Q967-R971 WeakPolarHBondContact O-CG 3.44Å; Q967-R971 PolarHBondContact O-N 2.84Å; L968-R971 PolarHBondContact O-N 2.7Å; L969-R971 PolarHBondContact O-N 3.16Å; R971-A973 VanDerWaalsContact C-N 3.29Å; R971-A973 PolarHBondContact O-N 3.48Å; R971-V974 PolarHBondContact O-N 2.85Å
972S89.9Confident90.2Very high57 Ų5756.1 Ų56.140%0.39929%0.286SS..Hα-helixtrans-67.1-27.5178.176.70000113.6P912 L968 L969 C970P912-S972 VanDerWaalsContact CG-OG 3.29Å; P912-S972 WeakPolarHBondContact CG-OG 3.23Å; L968-S972 PolarHBondContact O-N 3.36Å; L969-S972 PolarHBondContact O-N 3.43Å; L969-S972 VanDerWaalsContact O-N 3.17Å; L969-S972 PolarHBondContact O-OG 2.95Å; C970-S972 VanDerWaalsContact C-N 3.31Å; C970-S972 PolarHBondContact O-N 2.7Å
973A91.2Very high90.2Very high0 Ų052.3 Ų52.30%027%0.269CS..Hα-helixtrans-82.2-18.4-179.300000113.9I911 L915 L969 C970 R971 S976 L977I911-A973 HydrophobicContact CG2-CB 4.38Å; L915-A973 HydrophobicContact CD1-CB 4.02Å; L969-A973 PolarHBondContact O-N 3.22Å; C970-A973 PolarHBondContact O-N 2.93Å; C970-A973 VanDerWaalsContact O-N 3.11Å; R971-A973 VanDerWaalsContact C-N 3.29Å; R971-A973 PolarHBondContact O-N 3.48Å; A973-S976 PolarHBondContact O-N 3.11Å; A973-L977 HydrophobicContact CB-CD1 3.99Å; A973-L977 HydrophobicContact CB-CG 4.32Å; A973-L977 WeakPolarHBondContact O-CB 3.36Å; A973-L977 WeakPolarHBondContact O-CG 3.46Å; A973-L977 PolarHBondContact O-N 2.98Å
974V90.7Very high90.4Very high19 Ų1948.8 Ų48.812%0.11525%0.247CC..Hα-helixtrans-50.2-50.5-175.2171.70000113.8C970 R971 L977 T978 L1035 V1039 K1042C970-V974 PolarHBondContact O-N 3.46Å; R971-V974 PolarHBondContact O-N 2.85Å; V974-L977 PolarHBondContact O-N 3.46Å; V974-T978 PolarHBondContact O-N 3.45Å; V974-T978 PolarHBondContact O-OG1 3.38Å; V974-L1035 HydrophobicContact CG2-CD1 3.23Å; V974-V1039 HydrophobicContact CG1-CG2 4.14Å; V974-K1042 VanDerWaalsContact CG1-NZ 3.26Å
975P90.6Very high90.4Very high79 Ų7941.8 Ų41.851%0.51321%0.214SC..Hα-helixtrans-62.6-46.9-177.4-21.434.8000111.5L977 T978 D979P975-L977 PolarHBondContact O-N 2.71Å; P975-T978 WeakPolarHBondContact O-CB 3.42Å; P975-T978 PolarHBondContact O-N 2.99Å; P975-D979 PolarHBondContact O-N 3.08Å
976S90.8Very high90.2Very high21 Ų2142 Ų4215%0.14722%0.22CC..Hα-helixtrans-68.7-34.3-178-51.60000112.9L915 A973 F980L915-S976 VanDerWaalsContact CB-CB 3.48Å; A973-S976 PolarHBondContact O-N 3.11Å; S976-F980 WeakPolarHBondContact O-CB 3.37Å; S976-F980 PolarHBondContact O-N 3.31Å
977L93.3Very high90.1Very high1 Ų142.6 Ų42.61%0.00522%0.222CC..Hα-helixtrans-64.8-40.7171.8-74.4170.8000111.7L915 F948 I952 L955 A973 V974 P975 F980 L981 L1035 V1039L915-L977 HydrophobicContact CD1-CD2 3.91Å; L915-L977 HydrophobicContact CD1-CG 3.82Å; L915-L977 HydrophobicContact CD2-CD2 3.78Å; F948-L977 HydrophobicContact CE2-CD2 3.75Å; I952-L977 HydrophobicContact CD1-CD2 4.27Å; L955-L977 HydrophobicContact CD1-CD1 4.43Å; A973-L977 HydrophobicContact CB-CD1 3.99Å; A973-L977 HydrophobicContact CB-CG 4.32Å; A973-L977 WeakPolarHBondContact O-CB 3.36Å; A973-L977 WeakPolarHBondContact O-CG 3.46Å; A973-L977 PolarHBondContact O-N 2.98Å; V974-L977 PolarHBondContact O-N 3.46Å; P975-L977 PolarHBondContact O-N 2.71Å; L977-F980 PolarHBondContact O-N 3.15Å; L977-L981 WeakPolarHBondContact O-CB 3.44Å; L977-L981 WeakPolarHBondContact O-CG 3.25Å; L977-L981 PolarHBondContact O-N 2.97Å; L977-L1035 HydrophobicContact CD1-CD2 4.21Å; L977-V1039 HydrophobicContact CB-CG1 4.25Å; L977-V1039 HydrophobicContact CB-CG2 4.15Å
978T92.2Very high89.8Confident25 Ų2543 Ų4315%0.15323%0.227CC..Hα-helixtrans-62.2-49.1177.8-51.40000110.6V974 P975 F980 L981 Q982 K1042V974-T978 PolarHBondContact O-N 3.45Å; V974-T978 PolarHBondContact O-OG1 3.38Å; P975-T978 WeakPolarHBondContact O-CB 3.42Å; P975-T978 PolarHBondContact O-N 2.99Å; T978-F980 PolarHBondContact O-N 3.29Å; T978-L981 PolarHBondContact O-N 2.89Å; T978-Q982 WeakPolarHBondContact O-CB 3.35Å; T978-Q982 PolarHBondContact O-N 3.4Å; T978-K1042 HydrophobicContact CG2-CD 4.37Å
979D91.4Very high89.5Confident76 Ų7639.7 Ų39.741%0.40622%0.217SC..Hα-helixtrans-60.7-45.2178.6-83.514.3000112.3K919 P975 Q982 V983K919-D979 HydrophobicContact CD-CB 3.79Å; K919-D979 HydrophobicContact CG-CB 4.36Å; K919-D979 IonicContact NZ-OD2 2.79Å; K919-D979 PolarHBondContact NZ-OD2 3.48Å; P975-D979 PolarHBondContact O-N 3.08Å; D979-Q982 PolarHBondContact O-N 3.36Å; D979-V983 PolarHBondContact O-N 3.15Å; D979-V983 VanDerWaalsContact O-N 3.13Å
980F93.8Very high89.1Confident0 Ų044.1 Ų44.10%024%0.244CC..Hα-helixtrans-62.4-48.2178.8176.2-99.1000112L918 K919 A922 V944 F948 S976 L977 T978 Q982 V983 A984 W987 V995L918-F980 HydrophobicContact CB-CD2 3.94Å; L918-F980 HydrophobicContact CB-CE2 3.85Å; K919-F980 HydrophobicContact CB-CD2 4.47Å; A922-F980 HydrophobicContact CB-CE2 4.49Å; V944-F980 HydrophobicContact CG1-CE2 3.65Å; V944-F980 HydrophobicContact CG1-CZ 3.99Å; F948-F980 HydrophobicContact CB-CE1 3.99Å; F948-F980 HydrophobicContact CB-CZ 4.02Å; F948-F980 HydrophobicContact CD1-CE1 4.07Å; F948-F980 AromaticContact CD2-CD1 3.48Å; F948-F980 HydrophobicContact CD2-CD1 3.48Å; F948-F980 VanDerWaalsContact CD2-CD1 3.48Å; F948-F980 AromaticContact CD2-CE1 3.25Å; F948-F980 HydrophobicContact CD2-CE1 3.25Å; F948-F980 HydrophobicContact CD2-CG 4.4Å; F948-F980 HydrophobicContact CD2-CZ 4.05Å; F948-F980 HydrophobicContact CE1-CE1 4.39Å; F948-F980 AromaticContact CE2-CD1 3.52Å; F948-F980 HydrophobicContact CE2-CD1 3.52Å; F948-F980 AromaticContact CE2-CE1 3.64Å; F948-F980 HydrophobicContact CE2-CE1 3.64Å; F948-F980 HydrophobicContact CG-CD1 4.19Å; F948-F980 AromaticContact CG-CE1 3.49Å; F948-F980 HydrophobicContact CG-CE1 3.49Å; F948-F980 VanDerWaalsContact CG-CE1 3.49Å; F948-F980 HydrophobicContact CG-CZ 4.04Å; F948-F980 HydrophobicContact CZ-CD1 4.28Å; F948-F980 HydrophobicContact CZ-CE1 4.2Å; S976-F980 WeakPolarHBondContact O-CB 3.37Å; S976-F980 PolarHBondContact O-N 3.31Å; L977-F980 PolarHBondContact O-N 3.15Å; T978-F980 PolarHBondContact O-N 3.29Å; F980-Q982 PolarHBondContact O-N 3.35Å; F980-V983 PolarHBondContact O-N 2.92Å; F980-V983 VanDerWaalsContact O-N 3.15Å; F980-A984 PolarHBondContact O-N 2.82Å; F980-W987 HydrophobicContact CE2-CH2 4.29Å; F980-W987 HydrophobicContact CE2-CZ2 4.33Å; F980-W987 AromaticContact CZ-CH2 3.93Å; F980-W987 HydrophobicContact CZ-CH2 3.93Å; F980-W987 HydrophobicContact CZ-CZ2 4.37Å; F980-V995 HydrophobicContact CE1-CG1 4.06Å
981L92.6Very high88.9Confident3 Ų345.2 Ų45.22%0.01625%0.25CC..Hα-helixtrans-65.1-27.1179.3-72.3-179.1000113F948 L977 T978 Q985 V995 V1039 I1046F948-L981 HydrophobicContact CZ-CD2 4.09Å; L977-L981 WeakPolarHBondContact O-CB 3.44Å; L977-L981 WeakPolarHBondContact O-CG 3.25Å; L977-L981 PolarHBondContact O-N 2.97Å; T978-L981 PolarHBondContact O-N 2.89Å; L981-Q985 WeakPolarHBondContact O-CG 3.4Å; L981-Q985 PolarHBondContact O-N 2.94Å; L981-Q985 PolarHBondContact O-NE2 3.13Å; L981-V995 HydrophobicContact CD2-CG1 3.6Å; L981-V1039 HydrophobicContact CD1-CG1 3.76Å; L981-I1046 HydrophobicContact CB-CD1 3.88Å; L981-I1046 HydrophobicContact CB-CG2 4.35Å; L981-I1046 HydrophobicContact CD1-CG2 4.41Å
982Q91.7Very high88.8Confident87 Ų8740.2 Ų40.241%0.40723%0.231SC..Hα-helixtrans-70-42.7173.5-171.964.834.700111.3T978 D979 F980 Q985 S1043 I1046T978-Q982 WeakPolarHBondContact O-CB 3.35Å; T978-Q982 PolarHBondContact O-N 3.4Å; D979-Q982 PolarHBondContact O-N 3.36Å; F980-Q982 PolarHBondContact O-N 3.35Å; Q982-Q985 WeakPolarHBondContact O-CB 3.42Å; Q982-Q985 PolarHBondContact O-N 3.25Å; Q982-S1043 PolarHBondContact OE1-OG 3.25Å; Q982-I1046 HydrophobicContact CB-CD1 4.33Å
983V90.6Very high88.6Confident15 Ų1539.5 Ų39.59%0.09123%0.226CC..Hα-helixtrans-64.5-44.5174.11740000110.6K919 A922 N923 D979 F980 Q985 T986K919-V983 HydrophobicContact CG-CG2 3.81Å; A922-V983 HydrophobicContact CB-CG1 3.71Å; N923-V983 HydrophobicContact CB-CG1 4.03Å; N923-V983 HydrophobicContact CB-CG2 4.37Å; D979-V983 PolarHBondContact O-N 3.15Å; D979-V983 VanDerWaalsContact O-N 3.13Å; F980-V983 PolarHBondContact O-N 2.92Å; F980-V983 VanDerWaalsContact O-N 3.15Å; V983-Q985 PolarHBondContact O-N 3.43Å; V983-T986 WeakPolarHBondContact O-CB 3.41Å; V983-T986 PolarHBondContact O-N 3.04Å; V983-T986 PolarHBondContact O-OG1 3.06Å
984A89.5Confident88.5Confident0 Ų041.1 Ų41.10%024%0.243CC..G310 helixtrans-59.6-17.5178.500000113.9F980 T986 W987 V995F980-A984 PolarHBondContact O-N 2.82Å; A984-T986 PolarHBondContact O-N 3.48Å; A984-W987 HydrophobicContact CB-CD2 4.17Å; A984-W987 HydrophobicContact CB-CE3 4.29Å; A984-W987 WeakPolarHBondContact O-CB 3.49Å; A984-W987 PolarHBondContact O-N 3.32Å; A984-V995 HydrophobicContact CB-CG1 4.45Å
985Q88.1Confident88.5Confident23 Ų2340.2 Ų40.211%0.10724%0.237CC..G310 helixtrans-63.4-27.4172.8-62.6-53.3-54.900113.3L981 Q982 V983 W987 R992 H996 I1046 S1049L981-Q985 WeakPolarHBondContact O-CG 3.4Å; L981-Q985 PolarHBondContact O-N 2.94Å; L981-Q985 PolarHBondContact O-NE2 3.13Å; Q982-Q985 WeakPolarHBondContact O-CB 3.42Å; Q982-Q985 PolarHBondContact O-N 3.25Å; V983-Q985 PolarHBondContact O-N 3.43Å; Q985-W987 VanDerWaalsContact C-N 3.32Å; Q985-R992 PolarHBondContact O-NH1 2.72Å; Q985-H996 PolarHBondContact NE2-CE1 3.28Å; Q985-H996 VanDerWaalsContact NE2-CE1 3.34Å; Q985-H996 PolarHBondContact NE2-NE2 3.37Å; Q985-I1046 HydrophobicContact CG-CG1 4.02Å; Q985-S1049 VanDerWaalsContact OE1-CB 3.29Å; Q985-S1049 PolarHBondContact OE1-OG 3.4Å
986T83.8Confident88.6Confident68 Ų6836.6 Ų36.642%0.41721%0.213SC..G310 helixtrans-83.1-10.5-177.665.30000113.4V983 A984V983-T986 WeakPolarHBondContact O-CB 3.41Å; V983-T986 PolarHBondContact O-N 3.04Å; V983-T986 PolarHBondContact O-OG1 3.06Å; A984-T986 PolarHBondContact O-N 3.48Å
987W85.8Confident88.6Confident13 Ų1337.7 Ų37.75%0.04922%0.221CC..SBendtrans-71.2165.4-179.3-63.1-0000112.6A922 L941 V944 F980 A984 Q985 L991 R992 V995A922-W987 HydrophobicContact CB-CZ2 3.45Å; A922-W987 VanDerWaalsContact CB-CZ2 3.45Å; L941-W987 HydrophobicContact CD2-CH2 4.35Å; L941-W987 HydrophobicContact CD2-CZ2 3.73Å; V944-W987 HydrophobicContact CB-CH2 4.39Å; V944-W987 HydrophobicContact CG1-CH2 3.87Å; V944-W987 HydrophobicContact CG1-CZ2 4.18Å; F980-W987 HydrophobicContact CE2-CH2 4.29Å; F980-W987 HydrophobicContact CE2-CZ2 4.33Å; F980-W987 AromaticContact CZ-CH2 3.93Å; F980-W987 HydrophobicContact CZ-CH2 3.93Å; F980-W987 HydrophobicContact CZ-CZ2 4.37Å; A984-W987 HydrophobicContact CB-CD2 4.17Å; A984-W987 HydrophobicContact CB-CE3 4.29Å; A984-W987 WeakPolarHBondContact O-CB 3.49Å; A984-W987 PolarHBondContact O-N 3.32Å; Q985-W987 VanDerWaalsContact C-N 3.32Å; W987-L991 HydrophobicContact CB-CB 4.48Å; W987-L991 HydrophobicContact CE3-CB 3.84Å; W987-L991 HydrophobicContact CZ3-CB 4.45Å; W987-R992 HydrophobicContact CB-CB 4.42Å; W987-R992 PolarHBondContact O-NH1 3.32Å; W987-V995 HydrophobicContact CE3-CG2 4.18Å; W987-V995 HydrophobicContact CH2-CG2 4.33Å; W987-V995 HydrophobicContact CZ3-CG2 3.55Å
988D82.7Confident88.6Confident91 Ų9139 Ų3949%0.48723%0.229SC..  trans-53.4152.2169.6178.762.2000111.9V990 L991 R992D988-V990 VanDerWaalsContact C-N 3.26Å; D988-V990 PolarHBondContact O-N 3.47Å; D988-V990 WeakPolarHBondContact OD2-CB 3.48Å; D988-V990 PolarHBondContact OD2-N 2.91Å; D988-L991 PolarHBondContact O-N 3.44Å; D988-R992 WeakPolarHBondContact O-CB 3.44Å; D988-R992 PolarHBondContact O-N 3.3Å
989A81.9Confident88.7Confident53 Ų5337.8 Ų37.844%0.43822%0.222SC..Hα-helixtrans-54.6-38.9-176.900000113.4S993A989-S993 VanDerWaalsContact O-CB 3.24Å; A989-S993 WeakPolarHBondContact O-CB 3.5Å; A989-S993 PolarHBondContact O-N 2.89Å
990V83.2Confident88.8Confident110 Ų11034.5 Ų34.567%0.66720%0.204SC*.Hα-helixtrans-69.7-50.8-177.3-179.90000111.1D988 S993 G994D988-V990 VanDerWaalsContact C-N 3.26Å; D988-V990 PolarHBondContact O-N 3.47Å; D988-V990 WeakPolarHBondContact OD2-CB 3.48Å; D988-V990 PolarHBondContact OD2-N 2.91Å; V990-S993 PolarHBondContact O-N 3.48Å; V990-G994 PolarHBondContact O-N 3.2Å
991L83.9Confident88.7Confident29 Ų2936.7 Ų36.715%0.15222%0.222CC..Hα-helixtrans-67.2-39.5-179.9-73.9167.5000111.9L938 L941 W987 D988 G994 V995L938-L991 HydrophobicContact CD2-CD1 3.59Å; L941-L991 HydrophobicContact CB-CD1 3.74Å; L941-L991 HydrophobicContact CD1-CD1 3.98Å; W987-L991 HydrophobicContact CB-CB 4.48Å; W987-L991 HydrophobicContact CE3-CB 3.84Å; W987-L991 HydrophobicContact CZ3-CB 4.45Å; D988-L991 PolarHBondContact O-N 3.44Å; L991-G994 PolarHBondContact O-N 2.98Å; L991-V995 PolarHBondContact O-N 3.47Å; L991-V995 VanDerWaalsContact O-N 3.15Å
992R87.4Confident88.7Confident75 Ų7537.4 Ų37.428%0.28323%0.228SC..Hα-helixtrans-60.4-46.6174.2179.1172.955.6-141.5-11.1110.8Q985 W987 D988 V995 H996Q985-R992 PolarHBondContact O-NH1 2.72Å; W987-R992 HydrophobicContact CB-CB 4.42Å; W987-R992 PolarHBondContact O-NH1 3.32Å; D988-R992 WeakPolarHBondContact O-CB 3.44Å; D988-R992 PolarHBondContact O-N 3.3Å; R992-V995 PolarHBondContact O-N 2.91Å; R992-H996 PolarHBondContact O-CD2 3.03Å; R992-H996 PolarHBondContact O-N 3.27Å
993S85.8Confident88.7Confident42 Ų4233.3 Ų33.329%0.29421%0.209SC..Hα-helixtrans-58.9-461751690000111A989 V990 V995 H996 S997 E1053A989-S993 VanDerWaalsContact O-CB 3.24Å; A989-S993 WeakPolarHBondContact O-CB 3.5Å; A989-S993 PolarHBondContact O-N 2.89Å; V990-S993 PolarHBondContact O-N 3.48Å; S993-V995 VanDerWaalsContact C-N 3.35Å; S993-V995 PolarHBondContact O-N 3.3Å; S993-H996 CarbonylContact O-C 3.52Å; S993-H996 PolarHBondContact O-N 3.46Å; S993-H996 VanDerWaalsContact O-N 3.11Å; S993-S997 VanDerWaalsContact O-CB 3.29Å; S993-S997 WeakPolarHBondContact O-CB 3.16Å; S993-S997 PolarHBondContact O-N 3.05Å; S993-E1053 WeakPolarHBondContact CB-OE2 3.42Å; S993-E1053 PolarHBondContact OG-OE2 3.08Å
994G87.9Confident88.8Confident34 Ų3432.9 Ų32.935%0.35121%0.206SC..Hα-helixtrans-57.1-40.117800000114.9V990 L991 S997 T998V990-G994 PolarHBondContact O-N 3.2Å; L991-G994 PolarHBondContact O-N 2.98Å; G994-S997 PolarHBondContact O-N 2.97Å; G994-T998 PolarHBondContact O-N 3.46Å; G994-T998 PolarHBondContact O-OG1 3.28Å
995V92.1Very high88.9Confident0 Ų037 Ų370%023%0.232CC..Hα-helixtrans-66.3-45.6175173.30000111.3A945 F948 F980 L981 A984 W987 L991 R992 S993 S997 T998 V999A945-V995 HydrophobicContact CB-CG2 4.32Å; F948-V995 HydrophobicContact CD1-CG1 4.05Å; F948-V995 HydrophobicContact CE1-CG1 3.73Å; F948-V995 HydrophobicContact CZ-CG1 4.28Å; F980-V995 HydrophobicContact CE1-CG1 4.06Å; L981-V995 HydrophobicContact CD2-CG1 3.6Å; A984-V995 HydrophobicContact CB-CG1 4.45Å; W987-V995 HydrophobicContact CE3-CG2 4.18Å; W987-V995 HydrophobicContact CH2-CG2 4.33Å; W987-V995 HydrophobicContact CZ3-CG2 3.55Å; L991-V995 PolarHBondContact O-N 3.47Å; L991-V995 VanDerWaalsContact O-N 3.15Å; R992-V995 PolarHBondContact O-N 2.91Å; S993-V995 VanDerWaalsContact C-N 3.35Å; S993-V995 PolarHBondContact O-N 3.3Å; V995-S997 VanDerWaalsContact C-N 3.32Å; V995-S997 PolarHBondContact O-N 3.45Å; V995-T998 WeakPolarHBondContact O-CB 3.2Å; V995-T998 PolarHBondContact O-N 3.35Å; V995-V999 WeakPolarHBondContact O-CG2 3.5Å; V995-V999 PolarHBondContact O-N 2.94Å
996H91.5Very high89Confident2 Ų238.1 Ų38.11%0.00924%0.237CC..Hα-helixtrans-67-34.6176.8-72.7-63.8000112.1Q985 R992 S993 V999 F1000 E1053Q985-H996 PolarHBondContact NE2-CE1 3.28Å; Q985-H996 VanDerWaalsContact NE2-CE1 3.34Å; Q985-H996 PolarHBondContact NE2-NE2 3.37Å; R992-H996 PolarHBondContact O-CD2 3.03Å; R992-H996 PolarHBondContact O-N 3.27Å; S993-H996 CarbonylContact O-C 3.52Å; S993-H996 PolarHBondContact O-N 3.46Å; S993-H996 VanDerWaalsContact O-N 3.11Å; H996-V999 PolarHBondContact O-N 3.23Å; H996-F1000 VanDerWaalsContact O-CB 3.29Å; H996-F1000 WeakPolarHBondContact O-CB 3.36Å; H996-F1000 PolarHBondContact O-N 2.87Å; H996-E1053 HydrophobicContact CB-CB 3.78Å; H996-E1053 HydrophobicContact CB-CG 3.84Å
997S91Very high89.2Confident44 Ų4435.4 Ų35.431%0.30822%0.219SC..Hα-helixtrans-63.5-42.4177.2-164.20000111S993 G994 V995 V999 F1000 A1001 E1053S993-S997 VanDerWaalsContact O-CB 3.29Å; S993-S997 WeakPolarHBondContact O-CB 3.16Å; S993-S997 PolarHBondContact O-N 3.05Å; G994-S997 PolarHBondContact O-N 2.97Å; V995-S997 VanDerWaalsContact C-N 3.32Å; V995-S997 PolarHBondContact O-N 3.45Å; S997-V999 VanDerWaalsContact C-N 3.35Å; S997-V999 PolarHBondContact O-N 2.74Å; S997-F1000 PolarHBondContact O-N 3.33Å; S997-A1001 VanDerWaalsContact O-CB 3.27Å; S997-A1001 WeakPolarHBondContact O-CB 3.48Å; S997-A1001 PolarHBondContact O-N 2.94Å; S997-E1053 VanDerWaalsContact CB-OE1 3.23Å; S997-E1053 WeakPolarHBondContact CB-OE1 3.47Å; S997-E1053 PolarHBondContact OG-OE1 3.34Å
998T93.3Very high89.3Confident28 Ų2838.9 Ų38.917%0.17223%0.232CC..Hα-helixtrans-57.9-46.1172.7-63.10000112F948 Q949 I952 G994 V995 A1002F948-T998 HydrophobicContact CD1-CG2 4.41Å; F948-T998 HydrophobicContact CE1-CG2 4.34Å; Q949-T998 HydrophobicContact CB-CG2 3.9Å; Q949-T998 HydrophobicContact CG-CG2 3.92Å; I952-T998 HydrophobicContact CB-CG2 4.43Å; I952-T998 HydrophobicContact CG1-CG2 4.28Å; G994-T998 PolarHBondContact O-N 3.46Å; G994-T998 PolarHBondContact O-OG1 3.28Å; V995-T998 WeakPolarHBondContact O-CB 3.2Å; V995-T998 PolarHBondContact O-N 3.35Å; T998-A1002 WeakPolarHBondContact O-CB 3.49Å; T998-A1002 PolarHBondContact O-N 2.71Å; T998-A1002 VanDerWaalsContact O-N 3.12Å
999V94.3Very high89.5Confident0 Ų038.7 Ų38.70%023%0.228CC..Hα-helixtrans-66.8-44.5178.9173.30000111F948 V995 H996 S997 A1002 I1003 L1036 I1040 F1050F948-V999 HydrophobicContact CE1-CG2 3.86Å; F948-V999 HydrophobicContact CZ-CG2 3.88Å; V995-V999 WeakPolarHBondContact O-CG2 3.5Å; V995-V999 PolarHBondContact O-N 2.94Å; H996-V999 PolarHBondContact O-N 3.23Å; S997-V999 VanDerWaalsContact C-N 3.35Å; S997-V999 PolarHBondContact O-N 2.74Å; V999-A1002 PolarHBondContact O-N 3.45Å; V999-I1003 HydrophobicContact CG1-CD1 4.02Å; V999-I1003 WeakPolarHBondContact O-CG1 3.39Å; V999-I1003 PolarHBondContact O-N 3.31Å; V999-I1003 VanDerWaalsContact O-N 3.14Å; V999-L1036 HydrophobicContact CG1-CB 4.19Å; V999-L1036 HydrophobicContact CG1-CD1 4.21Å; V999-L1036 HydrophobicContact CG1-CD2 4.34Å; V999-L1036 HydrophobicContact CG1-CG 4.47Å; V999-I1040 HydrophobicContact CG1-CD1 3.73Å; V999-I1040 HydrophobicContact CG1-CG1 4.49Å; V999-F1050 HydrophobicContact CG1-CD2 4.49Å; V999-F1050 HydrophobicContact CG1-CE2 4.19Å
1000F93.4Very high89.7Confident7 Ų739.8 Ų39.83%0.03123%0.226CC..Hα-helixtrans-61.2-50177.9177-117.2000111.5H996 S997 A1002 I1003 I1004 F1050 V1054 S1057 L1063 V1072H996-F1000 VanDerWaalsContact O-CB 3.29Å; H996-F1000 WeakPolarHBondContact O-CB 3.36Å; H996-F1000 PolarHBondContact O-N 2.87Å; S997-F1000 PolarHBondContact O-N 3.33Å; F1000-A1002 VanDerWaalsContact C-N 3.31Å; F1000-A1002 PolarHBondContact O-N 3.38Å; F1000-I1003 PolarHBondContact O-N 3.46Å; F1000-I1004 HydrophobicContact CD2-CD1 4.38Å; F1000-I1004 HydrophobicContact CD2-CG1 3.84Å; F1000-I1004 HydrophobicContact CE1-CG1 4.18Å; F1000-I1004 HydrophobicContact CE2-CD1 3.73Å; F1000-I1004 HydrophobicContact CE2-CG1 3.44Å; F1000-I1004 VanDerWaalsContact CE2-CG1 3.44Å; F1000-I1004 HydrophobicContact CG-CG1 4.38Å; F1000-I1004 HydrophobicContact CZ-CD1 4.17Å; F1000-I1004 HydrophobicContact CZ-CG1 3.65Å; F1000-I1004 WeakPolarHBondContact O-CG1 3.5Å; F1000-I1004 PolarHBondContact O-N 2.98Å; F1000-F1050 HydrophobicContact CB-CE2 3.96Å; F1000-F1050 HydrophobicContact CD2-CE2 4.26Å; F1000-F1050 HydrophobicContact CD2-CZ 4.09Å; F1000-V1054 HydrophobicContact CD2-CG2 3.69Å; F1000-V1054 HydrophobicContact CE2-CB 4.27Å; F1000-V1054 HydrophobicContact CE2-CG1 4.17Å; F1000-V1054 HydrophobicContact CE2-CG2 3.67Å; F1000-V1054 HydrophobicContact CZ-CG1 4.47Å; F1000-V1054 HydrophobicContact CZ-CG2 4.5Å; F1000-S1057 VanDerWaalsContact CE1-CB 3.46Å; F1000-L1063 HydrophobicContact CE1-CD1 3.79Å; F1000-L1063 HydrophobicContact CZ-CD1 3.65Å; F1000-V1072 HydrophobicContact CE2-CG2 4.21Å; F1000-V1072 HydrophobicContact CZ-CG2 3.95Å
1001A91.5Very high89.7Confident46 Ų4634.9 Ų34.938%0.3820%0.196SC..Hα-helixtrans-57.2-43.2177.100000111.9S997 I1003 I1004 V1005S997-A1001 VanDerWaalsContact O-CB 3.27Å; S997-A1001 WeakPolarHBondContact O-CB 3.48Å; S997-A1001 PolarHBondContact O-N 2.94Å; A1001-I1003 PolarHBondContact O-N 2.99Å; A1001-I1004 PolarHBondContact O-N 3.47Å; A1001-V1005 VanDerWaalsContact O-CB 3.29Å; A1001-V1005 WeakPolarHBondContact O-CB 3.42Å; A1001-V1005 WeakPolarHBondContact O-CG2 3.45Å; A1001-V1005 PolarHBondContact O-N 2.9Å
1002A92.6Very high89.7Confident19 Ų1938.3 Ų38.316%0.15721%0.211CC..Hα-helixtrans-61.3-43.3177.800000112.8I952 T998 V999 F1000 E1006 L1032 L1036I952-A1002 HydrophobicContact CG2-CB 3.54Å; T998-A1002 WeakPolarHBondContact O-CB 3.49Å; T998-A1002 PolarHBondContact O-N 2.71Å; T998-A1002 VanDerWaalsContact O-N 3.12Å; V999-A1002 PolarHBondContact O-N 3.45Å; F1000-A1002 VanDerWaalsContact C-N 3.31Å; F1000-A1002 PolarHBondContact O-N 3.38Å; A1002-E1006 WeakPolarHBondContact O-CB 3.39Å; A1002-E1006 PolarHBondContact O-N 2.93Å; A1002-L1032 HydrophobicContact CB-CD2 4.12Å; A1002-L1036 HydrophobicContact CB-CD1 3.99Å
1003I93.4Very high89.5Confident0 Ų041.1 Ų41.10%023%0.226CC..Hα-helixtrans-65-48177.4-65.7166.9000110.6V999 F1000 A1001 K1007 M1029 S1033 L1036 L1037 I1040 F1050 V1075V999-I1003 HydrophobicContact CG1-CD1 4.02Å; V999-I1003 WeakPolarHBondContact O-CG1 3.39Å; V999-I1003 PolarHBondContact O-N 3.31Å; V999-I1003 VanDerWaalsContact O-N 3.14Å; F1000-I1003 PolarHBondContact O-N 3.46Å; A1001-I1003 PolarHBondContact O-N 2.99Å; I1003-K1007 WeakPolarHBondContact O-CB 3.29Å; I1003-K1007 PolarHBondContact O-N 3.21Å; I1003-M1029 HydrophobicContact CG2-CE 4.47Å; I1003-S1033 PolarHBondContact O-OG 3.16Å; I1003-L1036 HydrophobicContact CD1-CB 3.99Å; I1003-L1036 HydrophobicContact CD1-CD1 4.5Å; I1003-L1036 HydrophobicContact CG1-CB 4.08Å; I1003-L1036 HydrophobicContact CG1-CD1 3.91Å; I1003-L1037 HydrophobicContact CD1-CD2 4.21Å; I1003-L1037 HydrophobicContact CD1-CG 4.22Å; I1003-I1040 HydrophobicContact CD1-CD1 4.08Å; I1003-F1050 HydrophobicContact CD1-CE2 4.06Å; I1003-F1050 HydrophobicContact CD1-CZ 3.83Å; I1003-V1075 HydrophobicContact CG2-CG2 3.44Å; I1003-V1075 VanDerWaalsContact CG2-CG2 3.44Å
1004I91.9Very high89.3Confident6 Ų640.6 Ų40.63%0.03122%0.219CC..Hα-helixtrans-67.4-43-176.9-63.6-54.5000111.4F1000 A1001 E1006 K1007 R1008 L1063 E1068 A1071 V1072 V1075F1000-I1004 HydrophobicContact CD2-CD1 4.38Å; F1000-I1004 HydrophobicContact CD2-CG1 3.84Å; F1000-I1004 HydrophobicContact CE1-CG1 4.18Å; F1000-I1004 HydrophobicContact CE2-CD1 3.73Å; F1000-I1004 HydrophobicContact CE2-CG1 3.44Å; F1000-I1004 VanDerWaalsContact CE2-CG1 3.44Å; F1000-I1004 HydrophobicContact CG-CG1 4.38Å; F1000-I1004 HydrophobicContact CZ-CD1 4.17Å; F1000-I1004 HydrophobicContact CZ-CG1 3.65Å; F1000-I1004 WeakPolarHBondContact O-CG1 3.5Å; F1000-I1004 PolarHBondContact O-N 2.98Å; A1001-I1004 PolarHBondContact O-N 3.47Å; I1004-E1006 PolarHBondContact O-N 3.18Å; I1004-K1007 PolarHBondContact O-N 3.48Å; I1004-R1008 WeakPolarHBondContact O-CB 3.33Å; I1004-R1008 PolarHBondContact O-N 2.96Å; I1004-L1063 HydrophobicContact CG2-CD2 4.31Å; I1004-E1068 HydrophobicContact CG2-CB 4.45Å; I1004-E1068 HydrophobicContact CG2-CG 4.15Å; I1004-A1071 HydrophobicContact CD1-CB 4.03Å; I1004-A1071 HydrophobicContact CG2-CB 4.38Å; I1004-V1072 HydrophobicContact CD1-CB 4.38Å; I1004-V1072 HydrophobicContact CD1-CG2 3.6Å; I1004-V1072 HydrophobicContact CG1-CG2 4.34Å; I1004-V1075 HydrophobicContact CD1-CG2 4.35Å
1005V90.7Very high88.4Confident88 Ų8843.8 Ų43.853%0.53323%0.232SC..Hα-helixtrans-61.3-44.8178.6168.50000111.4A1001 H1009A1001-V1005 VanDerWaalsContact O-CB 3.29Å; A1001-V1005 WeakPolarHBondContact O-CB 3.42Å; A1001-V1005 WeakPolarHBondContact O-CG2 3.45Å; A1001-V1005 PolarHBondContact O-N 2.9Å; V1005-H1009 WeakPolarHBondContact O-CB 3.22Å; V1005-H1009 PolarHBondContact O-N 2.99Å
1006E90.5Very high87.6Confident46 Ų4648.9 Ų48.922%0.21526%0.256CS..Hα-helixtrans-65.5-44.7179.1-169.4-173.6-148.200111.5A1002 I1004 H1009 L1010 P1030 L1032 S1033A1002-E1006 WeakPolarHBondContact O-CB 3.39Å; A1002-E1006 PolarHBondContact O-N 2.93Å; I1004-E1006 PolarHBondContact O-N 3.18Å; E1006-H1009 PolarHBondContact O-N 2.99Å; E1006-L1010 PolarHBondContact O-N 3.15Å; E1006-L1010 VanDerWaalsContact O-N 3.16Å; E1006-P1030 HydrophobicContact CG-CB 3.73Å; E1006-P1030 HydrophobicContact CG-CG 4.39Å; E1006-P1030 WeakPolarHBondContact OE2-CB 3.43Å; E1006-L1032 WeakPolarHBondContact OE1-CB 3.07Å; E1006-L1032 PolarHBondContact OE1-N 3.23Å; E1006-L1032 VanDerWaalsContact OE2-CB 3.32Å; E1006-L1032 WeakPolarHBondContact OE2-CB 3.37Å; E1006-L1032 PolarHBondContact OE2-N 3.35Å; E1006-S1033 VanDerWaalsContact OE2-CB 3.32Å; E1006-S1033 WeakPolarHBondContact OE2-CB 3.49Å; E1006-S1033 PolarHBondContact OE2-N 3.07Å; E1006-S1033 PolarHBondContact OE2-OG 3.46Å
1007K88.3Confident86.4Confident10 Ų1050.6 Ų50.64%0.04327%0.267CS..Hα-helixtrans-71.4-39.7-179.4-170.162.9176.5-178.40112.6I1003 I1004 H1009 L1010 L1011 M1029 P1030 A1071 H1074I1003-K1007 WeakPolarHBondContact O-CB 3.29Å; I1003-K1007 PolarHBondContact O-N 3.21Å; I1004-K1007 PolarHBondContact O-N 3.48Å; K1007-H1009 VanDerWaalsContact C-N 3.34Å; K1007-H1009 PolarHBondContact O-N 3.35Å; K1007-L1010 HydrophobicContact CD-CD2 4.37Å; K1007-L1010 WeakPolarHBondContact O-CB 3.43Å; K1007-L1010 PolarHBondContact O-N 3.23Å; K1007-L1011 HydrophobicContact CG-CD1 4.33Å; K1007-L1011 WeakPolarHBondContact O-CG 3.44Å; K1007-L1011 PolarHBondContact O-N 3.23Å; K1007-M1029 HydrophobicContact CD-CE 4.31Å; K1007-M1029 HydrophobicContact CG-CE 4.48Å; K1007-P1030 HydrophobicContact CD-CG 3.95Å; K1007-A1071 HydrophobicContact CB-CB 3.87Å; K1007-A1071 HydrophobicContact CG-CB 3.81Å; K1007-H1074 WeakPolarHBondContact CE-ND1 3.37Å
1008R88Confident85.3Confident86 Ų8657.4 Ų57.433%0.32529%0.294SS..Hα-helixtrans-57.2-47.2172.9175.7-165.5143.7152.2-4.3110.6I1004 L1010 L1011 Q1012 E1068I1004-R1008 WeakPolarHBondContact O-CB 3.33Å; I1004-R1008 PolarHBondContact O-N 2.96Å; R1008-L1010 VanDerWaalsContact C-N 3.3Å; R1008-L1010 PolarHBondContact O-N 3.1Å; R1008-L1011 PolarHBondContact O-N 3.44Å; R1008-Q1012 HydrophobicContact CG-CG 4.4Å; R1008-Q1012 VanDerWaalsContact NE-NE2 3.17Å; R1008-Q1012 WeakPolarHBondContact O-CB 3.39Å; R1008-Q1012 WeakPolarHBondContact O-CG 3.31Å; R1008-Q1012 PolarHBondContact O-N 3.03Å; R1008-E1068 HydrophobicContact CG-CG 4.21Å; R1008-E1068 IonicContact CZ-OE1 2.68Å; R1008-E1068 IonicContact NH1-OE1 2.83Å; R1008-E1068 PolarHBondContact NH1-OE1 3.37Å
1009H86.8Confident84.2Confident88 Ų8860.1 Ų60.141%0.40731%0.305SS..Hα-helixtrans-62.6-37.9179.6-17164.3000112.4V1005 E1006 K1007 K1013V1005-H1009 WeakPolarHBondContact O-CB 3.22Å; V1005-H1009 PolarHBondContact O-N 2.99Å; E1006-H1009 PolarHBondContact O-N 2.99Å; K1007-H1009 VanDerWaalsContact C-N 3.34Å; K1007-H1009 PolarHBondContact O-N 3.35Å; H1009-K1013 WeakPolarHBondContact NE2-CE 3.5Å; H1009-K1013 PolarHBondContact NE2-NZ 3.5Å; H1009-K1013 WeakPolarHBondContact O-CG 3.34Å; H1009-K1013 PolarHBondContact O-N 3.16Å
1010L85.8Confident83.3Confident76 Ų7661.1 Ų61.140%0.39831%0.311SS..Hα-helixtrans-62.9-47.2172.6-177.668.4000111.1E1006 K1007 R1008 Q1012 K1013 P1030E1006-L1010 PolarHBondContact O-N 3.15Å; E1006-L1010 VanDerWaalsContact O-N 3.16Å; K1007-L1010 HydrophobicContact CD-CD2 4.37Å; K1007-L1010 WeakPolarHBondContact O-CB 3.43Å; K1007-L1010 PolarHBondContact O-N 3.23Å; R1008-L1010 VanDerWaalsContact C-N 3.3Å; R1008-L1010 PolarHBondContact O-N 3.1Å; L1010-Q1012 VanDerWaalsContact C-N 3.32Å; L1010-Q1012 PolarHBondContact O-N 3.4Å; L1010-K1013 PolarHBondContact O-N 2.96Å; L1010-P1030 HydrophobicContact CD2-CG 3.85Å
1011L84.6Confident82.6Confident7 Ų765.3 Ų65.34%0.03734%0.337CS..Hα-helixtrans-64.2-33.8179.8-70.8171.8000112.9K1007 R1008 K1013 L1014 S1067 A1070 A1071 M1117K1007-L1011 HydrophobicContact CG-CD1 4.33Å; K1007-L1011 WeakPolarHBondContact O-CG 3.44Å; K1007-L1011 PolarHBondContact O-N 3.23Å; R1008-L1011 PolarHBondContact O-N 3.44Å; L1011-K1013 VanDerWaalsContact C-N 3.32Å; L1011-L1014 HydrophobicContact CD2-CD1 4.07Å; L1011-S1067 WeakPolarHBondContact CD1-O 3.36Å; L1011-A1070 HydrophobicContact CD1-CB 3.83Å; L1011-A1071 HydrophobicContact CD1-CB 4.17Å; L1011-M1117 HydrophobicContact CB-CE 3.95Å; L1011-M1117 HydrophobicContact CB-SD 4.49Å; L1011-M1117 HydrophobicContact CD2-CE 4.39Å
1012Q83.2Confident82.2Confident100 Ų10065.4 Ų65.447%0.46733%0.331SS..Hα-helixtrans-74.7-20.5177.2-73.5-179.5-15.300113.6R1008 L1010 S1067R1008-Q1012 HydrophobicContact CG-CG 4.4Å; R1008-Q1012 VanDerWaalsContact NE-NE2 3.17Å; R1008-Q1012 WeakPolarHBondContact O-CB 3.39Å; R1008-Q1012 WeakPolarHBondContact O-CG 3.31Å; R1008-Q1012 PolarHBondContact O-N 3.03Å; L1010-Q1012 VanDerWaalsContact C-N 3.32Å; L1010-Q1012 PolarHBondContact O-N 3.4Å; Q1012-S1067 PolarHBondContact NE2-OG 3.06Å; Q1012-S1067 VanDerWaalsContact NE2-OG 3.15Å
1013K81.9Confident81.9Confident135 Ų13564.7 Ų64.759%0.58732%0.324SS*.THydrogen-bonded Turntrans-85.9-8.2178.5-81.7-178.2166.5-173.90114.3H1009 L1010 L1011 T1015H1009-K1013 WeakPolarHBondContact NE2-CE 3.5Å; H1009-K1013 PolarHBondContact NE2-NZ 3.5Å; H1009-K1013 WeakPolarHBondContact O-CG 3.34Å; H1009-K1013 PolarHBondContact O-N 3.16Å; L1010-K1013 PolarHBondContact O-N 2.96Å; L1011-K1013 VanDerWaalsContact C-N 3.32Å; K1013-T1015 PolarHBondContact O-N 3.12Å
1014L81.9Confident81.4Confident30 Ų3071 Ų7116%0.15735%0.354CS..  trans-68.5123.8-178.5-57.9-177.4000110.6L1011 E1019 V1020L1011-L1014 HydrophobicContact CD2-CD1 4.07Å; L1014-E1019 HydrophobicContact CD1-CB 4.38Å; L1014-E1019 HydrophobicContact CD2-CB 3.72Å; L1014-E1019 WeakPolarHBondContact CD2-OE2 3.32Å; L1014-E1019 HydrophobicContact CG-CB 4.41Å; L1014-V1020 HydrophobicContact CD1-CB 4.46Å; L1014-V1020 HydrophobicContact CD1-CG2 3.75Å
1015T70.5Confident81.2Confident101 Ų10172.6 Ų72.662%0.6237%0.365SS*.  trans-100.4-20.2178.749.30000112.4K1013 E1019K1013-T1015 PolarHBondContact O-N 3.12Å; T1015-E1019 PolarHBondContact N-OE2 2.69Å
1016H74.7Confident81Confident108 Ų10869.9 Ų69.950%0.535%0.349SS..SBendtrans-120.1140-178.2-60.1-64.2000112E1018 E1019H1016-E1018 PolarHBondContact O-N 2.95Å; H1016-E1019 HydrophobicContact CB-CG 4.16Å; H1016-E1019 IonicContact CD2-OE1 3.77Å; H1016-E1019 PolarHBondContact CD2-OE1 2.98Å; H1016-E1019 PolarHBondContact O-N 3.36Å
1017P66.9Low80.8Confident38 Ų3874.5 Ų74.525%0.24738%0.375CS..G310 helixtrans-62.1-26.8-179.3-20.531000114.5E1019 V1020 E1112 T1113 V1116P1017-E1019 PolarHBondContact O-N 3.36Å; P1017-V1020 PolarHBondContact O-N 3.39Å; P1017-E1112 HydrophobicContact CG-CG 4.04Å; P1017-T1113 HydrophobicContact CG-CG2 4.34Å; P1017-V1116 HydrophobicContact CB-CB 4.21Å; P1017-V1116 HydrophobicContact CB-CG1 4.27Å; P1017-V1116 HydrophobicContact CB-CG2 3.83Å
1018E67.9Low80.7Confident187 Ų18778.3 Ų78.387%0.87439%0.393SS*.G310 helixtrans-69.1-14.6180-60.1-177.4-177.900113.5H1016H1016-E1018 PolarHBondContact O-N 2.95Å
1019E68.9Low80.8Confident85 Ų8574.6 Ų74.640%0.39738%0.379SS..G310 helixtrans-86-6.8-177.2-59.3172.8172.900113.4L1014 T1015 H1016 P1017 V1021L1014-E1019 HydrophobicContact CD1-CB 4.38Å; L1014-E1019 HydrophobicContact CD2-CB 3.72Å; L1014-E1019 WeakPolarHBondContact CD2-OE2 3.32Å; L1014-E1019 HydrophobicContact CG-CB 4.41Å; T1015-E1019 PolarHBondContact N-OE2 2.69Å; H1016-E1019 HydrophobicContact CB-CG 4.16Å; H1016-E1019 IonicContact CD2-OE1 3.77Å; H1016-E1019 PolarHBondContact CD2-OE1 2.98Å; H1016-E1019 PolarHBondContact O-N 3.36Å; P1017-E1019 PolarHBondContact O-N 3.36Å; E1019-V1021 VanDerWaalsContact C-N 3.31Å; E1019-V1021 PolarHBondContact O-N 2.95Å
1020V76.1Confident80.9Confident20 Ų2071.2 Ų71.212%0.12137%0.365CS..  trans-79.476.9178.5-172.40000110.2L1014 P1017 V1116L1014-V1020 HydrophobicContact CD1-CB 4.46Å; L1014-V1020 HydrophobicContact CD1-CG2 3.75Å; P1017-V1020 PolarHBondContact O-N 3.39Å; V1020-V1116 HydrophobicContact CB-CG1 4.3Å; V1020-V1116 HydrophobicContact CG2-CG1 4.27Å
1021V78.8Confident81Confident95 Ų9570.5 Ų70.558%0.57637%0.365SS*.PPolyproline II helixtrans-96.1132.9178.4-175.80000111.4E1019 H1074E1019-V1021 VanDerWaalsContact C-N 3.31Å; E1019-V1021 PolarHBondContact O-N 2.95Å; V1021-H1074 PolarHBondContact O-CE1 3.25Å
1022I82.9Confident81.3Confident49 Ų4970.4 Ų70.425%0.25136%0.364SS..PPolyproline II helixtrans-80.6120.8174.2-57.8157.9000108.3Q1024 A1077 T1124I1022-Q1024 PolarHBondContact O-N 3.43Å; I1022-A1077 HydrophobicContact CG2-CB 3.95Å; I1022-T1124 WeakPolarHBondContact CD1-OG1 3.34Å; I1022-T1124 WeakPolarHBondContact CG1-OG1 3.46Å; I1022-T1124 HydrophobicContact CG2-CG2 4.25Å
1023P86Confident81.8Confident3 Ų365.6 Ų65.62%0.01934%0.342CS..PPolyproline II helixtrans-69.3131.5-179.427-31.7000111.3E1028 M1029 H1074 V1078P1023-E1028 WeakPolarHBondContact CA-OE2 3.25Å; P1023-E1028 HydrophobicContact CB-CB 3.86Å; P1023-M1029 HydrophobicContact CB-CG 4.39Å; P1023-M1029 HydrophobicContact CB-SD 3.83Å; P1023-M1029 HydrophobicContact CG-SD 3.51Å; P1023-M1029 VanDerWaalsContact CG-SD 3.51Å; P1023-H1074 VanDerWaalsContact CD-CG 3.47Å; P1023-H1074 HydrophobicContact CG-CB 3.69Å; P1023-V1078 HydrophobicContact CB-CG2 3.79Å; P1023-V1078 HydrophobicContact CG-CG2 3.87Å
1024Q83.4Confident82.2Confident134 Ų13460.2 Ų60.263%0.62632%0.321SS*.  trans-103-9.7177.1-58.8-163.9-000113.3I1022 E1028 Q1081I1022-Q1024 PolarHBondContact O-N 3.43Å; Q1024-E1028 PolarHBondContact N-OE2 3.15Å; Q1024-Q1081 WeakPolarHBondContact O-CG 3.09Å
1025S86.9Confident82.7Confident38 Ų3859.3 Ų59.327%0.26632%0.317SS..SBendtrans-142.3164.317964.80000110.9D1027 E1028S1025-D1027 PolarHBondContact O-N 3.42Å; S1025-E1028 PolarHBondContact N-OE1 3.25Å; S1025-E1028 PolarHBondContact O-N 2.97Å; S1025-E1028 WeakPolarHBondContact OG-CG 3.39Å; S1025-E1028 PolarHBondContact OG-N 3.5Å; S1025-E1028 PolarHBondContact OG-OE1 3.32Å
1026V87.8Confident83.8Confident31 Ų3154.7 Ų54.719%0.18829%0.288CS..G310 helixtrans-63.3-28.9174.5-179.80000110.9E1028 M1029 S1034 L1037 L1041 V1078V1026-E1028 VanDerWaalsContact C-N 3.31Å; V1026-E1028 PolarHBondContact O-N 3Å; V1026-M1029 WeakPolarHBondContact O-CB 3.49Å; V1026-M1029 PolarHBondContact O-N 3Å; V1026-S1034 WeakPolarHBondContact CG1-O 3.5Å; V1026-S1034 WeakPolarHBondContact O-CB 3.5Å; V1026-S1034 PolarHBondContact O-OG 3.05Å; V1026-L1037 HydrophobicContact CG1-CB 4.1Å; V1026-L1041 HydrophobicContact CG2-CD1 3.59Å; V1026-V1078 HydrophobicContact CB-CG1 4.41Å; V1026-V1078 HydrophobicContact CG2-CG1 3.63Å
1027D85.4Confident84.7Confident143 Ų14349.6 Ų49.677%0.76526%0.264SS*.G310 helixtrans-73.2-22.4-179.2-59.6-40.3000113S1025 M1029S1025-D1027 PolarHBondContact O-N 3.42Å; D1027-M1029 VanDerWaalsContact C-N 3.26Å; D1027-M1029 PolarHBondContact O-N 3.46Å
1028E86.4Confident85.8Confident90 Ų9049.6 Ų49.642%0.42127%0.265SS..G310 helixtrans-82.2-4174.8-70.9162.5-124.100113.2P1023 Q1024 S1025 V1026P1023-E1028 WeakPolarHBondContact CA-OE2 3.25Å; P1023-E1028 HydrophobicContact CB-CB 3.86Å; Q1024-E1028 PolarHBondContact N-OE2 3.15Å; S1025-E1028 PolarHBondContact N-OE1 3.25Å; S1025-E1028 PolarHBondContact O-N 2.97Å; S1025-E1028 WeakPolarHBondContact OG-CG 3.39Å; S1025-E1028 PolarHBondContact OG-N 3.5Å; S1025-E1028 PolarHBondContact OG-OE1 3.32Å; V1026-E1028 VanDerWaalsContact C-N 3.31Å; V1026-E1028 PolarHBondContact O-N 3Å
1029M89.1Confident87Confident9 Ų940.7 Ų40.74%0.04422%0.224CC..SBendtrans-83.9154.1174-67-66.5-74.500111.1I1003 K1007 P1023 V1026 D1027 L1037 V1075 V1078I1003-M1029 HydrophobicContact CG2-CE 4.47Å; K1007-M1029 HydrophobicContact CD-CE 4.31Å; K1007-M1029 HydrophobicContact CG-CE 4.48Å; P1023-M1029 HydrophobicContact CB-CG 4.39Å; P1023-M1029 HydrophobicContact CB-SD 3.83Å; P1023-M1029 HydrophobicContact CG-SD 3.51Å; P1023-M1029 VanDerWaalsContact CG-SD 3.51Å; V1026-M1029 WeakPolarHBondContact O-CB 3.49Å; V1026-M1029 PolarHBondContact O-N 3Å; D1027-M1029 VanDerWaalsContact C-N 3.26Å; D1027-M1029 PolarHBondContact O-N 3.46Å; M1029-L1037 HydrophobicContact CE-CD1 3.92Å; M1029-L1037 HydrophobicContact CG-CD1 3.95Å; M1029-V1075 HydrophobicContact CE-CG2 4.02Å; M1029-V1078 HydrophobicContact CG-CG2 3.95Å; M1029-V1078 HydrophobicContact SD-CG2 4.07Å
1030P89.5Confident88.1Confident16 Ų1636.7 Ų36.710%0.10421%0.205CC..  trans-55.7156172.3-25.335.6000112.4E1006 K1007 L1010 L1032 S1033 S1034E1006-P1030 HydrophobicContact CG-CB 3.73Å; E1006-P1030 HydrophobicContact CG-CG 4.39Å; E1006-P1030 WeakPolarHBondContact OE2-CB 3.43Å; K1007-P1030 HydrophobicContact CD-CG 3.95Å; L1010-P1030 HydrophobicContact CD2-CG 3.85Å; P1030-L1032 PolarHBondContact O-N 3.07Å; P1030-S1033 CarbonylContact O-C 3.59Å; P1030-S1033 WeakPolarHBondContact O-CB 3.35Å; P1030-S1033 PolarHBondContact O-N 3.38Å; P1030-S1033 VanDerWaalsContact O-N 3.08Å; P1030-S1034 WeakPolarHBondContact O-CB 3.36Å; P1030-S1034 PolarHBondContact O-N 3.46Å
1031P88.8Confident88.8Confident62 Ų6237.7 Ų37.740%0.40321%0.21SC..Hα-helixtrans-54.9-42.5-166.7-29.436.3000116.3L959 L1035L959-P1031 HydrophobicContact CD1-CB 4.1Å; L959-P1031 HydrophobicContact CD2-CB 3.8Å; P1031-L1035 WeakPolarHBondContact O-CB 3.43Å; P1031-L1035 PolarHBondContact O-N 2.78Å; P1031-L1035 VanDerWaalsContact O-N 3.11Å
1032L91Very high89.2Confident4 Ų439.3 Ų39.32%0.02121%0.209CC..Hα-helixtrans-73.2-40.1178.4-178.769000111.1L955 A956 L959 A1002 E1006 P1030 L1035 L1036L955-L1032 HydrophobicContact CB-CD1 4.04Å; A956-L1032 HydrophobicContact CB-CD2 3.55Å; L959-L1032 HydrophobicContact CD1-CB 3.66Å; L959-L1032 HydrophobicContact CD1-CD1 4.22Å; A1002-L1032 HydrophobicContact CB-CD2 4.12Å; E1006-L1032 WeakPolarHBondContact OE1-CB 3.07Å; E1006-L1032 PolarHBondContact OE1-N 3.23Å; E1006-L1032 VanDerWaalsContact OE2-CB 3.32Å; E1006-L1032 WeakPolarHBondContact OE2-CB 3.37Å; E1006-L1032 PolarHBondContact OE2-N 3.35Å; P1030-L1032 PolarHBondContact O-N 3.07Å; L1032-L1035 HydrophobicContact CD1-CD2 4.38Å; L1032-L1035 WeakPolarHBondContact O-CB 3.47Å; L1032-L1035 PolarHBondContact O-N 2.68Å; L1032-L1036 HydrophobicContact CD1-CD1 4.22Å; L1032-L1036 HydrophobicContact CD1-CG 4.39Å; L1032-L1036 HydrophobicContact CG-CD1 3.95Å; L1032-L1036 HydrophobicContact CG-CG 4.46Å; L1032-L1036 WeakPolarHBondContact O-CG 3.4Å; L1032-L1036 PolarHBondContact O-N 3.27Å
1033S92.7Very high89.4Confident0 Ų037.8 Ų37.80%020%0.202CC..Hα-helixtrans-63.3-43.8177.3-60.90000111.6I1003 E1006 P1030 L1036 L1037I1003-S1033 PolarHBondContact O-OG 3.16Å; E1006-S1033 VanDerWaalsContact OE2-CB 3.32Å; E1006-S1033 WeakPolarHBondContact OE2-CB 3.49Å; E1006-S1033 PolarHBondContact OE2-N 3.07Å; E1006-S1033 PolarHBondContact OE2-OG 3.46Å; P1030-S1033 CarbonylContact O-C 3.59Å; P1030-S1033 WeakPolarHBondContact O-CB 3.35Å; P1030-S1033 PolarHBondContact O-N 3.38Å; P1030-S1033 VanDerWaalsContact O-N 3.08Å; S1033-L1036 PolarHBondContact O-N 3.17Å; S1033-L1037 VanDerWaalsContact O-CB 3.26Å; S1033-L1037 WeakPolarHBondContact O-CB 3.26Å; S1033-L1037 VanDerWaalsContact O-CG 3.23Å; S1033-L1037 WeakPolarHBondContact O-CG 3.42Å; S1033-L1037 PolarHBondContact O-N 2.97Å
1034S91.6Very high89.5Confident21 Ų2141.6 Ų41.615%0.14723%0.227CC..Hα-helixtrans-59.5-48.1174.3-1770000110.7V1026 P1030 S1038V1026-S1034 WeakPolarHBondContact CG1-O 3.5Å; V1026-S1034 WeakPolarHBondContact O-CB 3.5Å; V1026-S1034 PolarHBondContact O-OG 3.05Å; P1030-S1034 WeakPolarHBondContact O-CB 3.36Å; P1030-S1034 PolarHBondContact O-N 3.46Å; S1034-S1038 VanDerWaalsContact O-CB 3.29Å; S1034-S1038 WeakPolarHBondContact O-CB 3.31Å; S1034-S1038 PolarHBondContact O-N 3.48Å
1035L91.7Very high89.7Confident12 Ų1237 Ų376%0.06321%0.21CC..Hα-helixtrans-56.2-56.1175.3178.575000112.1L955 C970 V974 L977 P1031 L1032 L1037 S1038 V1039L955-L1035 HydrophobicContact CD1-CD2 4.3Å; C970-L1035 HydrophobicContact CB-CD1 3.9Å; C970-L1035 HydrophobicContact CB-CD2 3.62Å; C970-L1035 HydrophobicContact CB-CG 4.24Å; C970-L1035 VanDerWaalsContact O-CD1 3.23Å; C970-L1035 WeakPolarHBondContact O-CD1 3.26Å; V974-L1035 HydrophobicContact CG2-CD1 3.23Å; L977-L1035 HydrophobicContact CD1-CD2 4.21Å; P1031-L1035 WeakPolarHBondContact O-CB 3.43Å; P1031-L1035 PolarHBondContact O-N 2.78Å; P1031-L1035 VanDerWaalsContact O-N 3.11Å; L1032-L1035 HydrophobicContact CD1-CD2 4.38Å; L1032-L1035 WeakPolarHBondContact O-CB 3.47Å; L1032-L1035 PolarHBondContact O-N 2.68Å; L1035-L1037 PolarHBondContact O-N 3.41Å; L1035-S1038 WeakPolarHBondContact O-CB 3.39Å; L1035-S1038 PolarHBondContact O-N 2.88Å; L1035-S1038 PolarHBondContact O-OG 3.15Å; L1035-V1039 WeakPolarHBondContact O-CG2 3.22Å; L1035-V1039 PolarHBondContact O-N 3.5Å
1036L93.6Very high89.9Confident4 Ų435.2 Ų35.22%0.02120%0.197CC..Hα-helixtrans-64.8-41.4-174.8-67.7172.3000111.4I952 V999 A1002 I1003 L1032 S1033 S1038 V1039 I1040I952-L1036 HydrophobicContact CD1-CD2 4Å; V999-L1036 HydrophobicContact CG1-CB 4.19Å; V999-L1036 HydrophobicContact CG1-CD1 4.21Å; V999-L1036 HydrophobicContact CG1-CD2 4.34Å; V999-L1036 HydrophobicContact CG1-CG 4.47Å; A1002-L1036 HydrophobicContact CB-CD1 3.99Å; I1003-L1036 HydrophobicContact CD1-CB 3.99Å; I1003-L1036 HydrophobicContact CD1-CD1 4.5Å; I1003-L1036 HydrophobicContact CG1-CB 4.08Å; I1003-L1036 HydrophobicContact CG1-CD1 3.91Å; L1032-L1036 HydrophobicContact CD1-CD1 4.22Å; L1032-L1036 HydrophobicContact CD1-CG 4.39Å; L1032-L1036 HydrophobicContact CG-CD1 3.95Å; L1032-L1036 HydrophobicContact CG-CG 4.46Å; L1032-L1036 WeakPolarHBondContact O-CG 3.4Å; L1032-L1036 PolarHBondContact O-N 3.27Å; S1033-L1036 PolarHBondContact O-N 3.17Å; L1036-S1038 PolarHBondContact O-N 3.12Å; L1036-V1039 WeakPolarHBondContact O-CB 3.22Å; L1036-V1039 PolarHBondContact O-N 3.23Å; L1036-V1039 VanDerWaalsContact O-N 3.16Å; L1036-I1040 WeakPolarHBondContact O-CD1 3.48Å; L1036-I1040 VanDerWaalsContact O-CG1 3.24Å; L1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; L1036-I1040 PolarHBondContact O-N 3.44Å
1037L92.5Very high90.1Very high0 Ų034 Ų340%019%0.19CC..Hα-helixtrans-65.1-38.1174.8-71170.4000112I1003 V1026 M1029 S1033 L1035 V1039 I1040 L1041 F1050 V1075 V1078I1003-L1037 HydrophobicContact CD1-CD2 4.21Å; I1003-L1037 HydrophobicContact CD1-CG 4.22Å; V1026-L1037 HydrophobicContact CG1-CB 4.1Å; M1029-L1037 HydrophobicContact CE-CD1 3.92Å; M1029-L1037 HydrophobicContact CG-CD1 3.95Å; S1033-L1037 VanDerWaalsContact O-CB 3.26Å; S1033-L1037 WeakPolarHBondContact O-CB 3.26Å; S1033-L1037 VanDerWaalsContact O-CG 3.23Å; S1033-L1037 WeakPolarHBondContact O-CG 3.42Å; S1033-L1037 PolarHBondContact O-N 2.97Å; L1035-L1037 PolarHBondContact O-N 3.41Å; L1037-V1039 PolarHBondContact O-N 3.28Å; L1037-I1040 HydrophobicContact CD2-CD1 4.33Å; L1037-I1040 PolarHBondContact O-N 2.83Å; L1037-L1041 VanDerWaalsContact O-CB 3.28Å; L1037-L1041 WeakPolarHBondContact O-CB 3.48Å; L1037-L1041 WeakPolarHBondContact O-CG 3.44Å; L1037-L1041 PolarHBondContact O-N 3.01Å; L1037-F1050 HydrophobicContact CD2-CE1 4.47Å; L1037-V1075 HydrophobicContact CD2-CG1 4.07Å; L1037-V1078 HydrophobicContact CD1-CG1 4.42Å
1038S91.1Very high90.3Very high38 Ų3835 Ų3527%0.26618%0.183SC..Hα-helixtrans-62-26.3174.982.20000113S1034 L1035 L1036 K1042S1034-S1038 VanDerWaalsContact O-CB 3.29Å; S1034-S1038 WeakPolarHBondContact O-CB 3.31Å; S1034-S1038 PolarHBondContact O-N 3.48Å; L1035-S1038 WeakPolarHBondContact O-CB 3.39Å; L1035-S1038 PolarHBondContact O-N 2.88Å; L1035-S1038 PolarHBondContact O-OG 3.15Å; L1036-S1038 PolarHBondContact O-N 3.12Å; S1038-K1042 WeakPolarHBondContact O-CG 3.39Å
1039V91.9Very high90.5Very high1 Ų132 Ų321%0.00617%0.172CC..Hα-helixtrans-81.4-49.1174.5176.20000110.7V974 L977 L981 L1035 L1036 L1037 L1041 K1042V974-V1039 HydrophobicContact CG1-CG2 4.14Å; L977-V1039 HydrophobicContact CB-CG1 4.25Å; L977-V1039 HydrophobicContact CB-CG2 4.15Å; L981-V1039 HydrophobicContact CD1-CG1 3.76Å; L1035-V1039 WeakPolarHBondContact O-CG2 3.22Å; L1035-V1039 PolarHBondContact O-N 3.5Å; L1036-V1039 WeakPolarHBondContact O-CB 3.22Å; L1036-V1039 PolarHBondContact O-N 3.23Å; L1036-V1039 VanDerWaalsContact O-N 3.16Å; L1037-V1039 PolarHBondContact O-N 3.28Å; V1039-L1041 VanDerWaalsContact C-N 3.33Å; V1039-L1041 PolarHBondContact O-N 3.24Å; V1039-K1042 PolarHBondContact O-N 3.31Å
1040I92.9Very high90.7Very high1 Ų131.6 Ų31.61%0.00517%0.17CC..Hα-helixtrans-59.7-43.7-178-66.3159.7000111.4V999 I1003 L1036 L1037 K1042 S1043 I1046 T1047 F1050V999-I1040 HydrophobicContact CG1-CD1 3.73Å; V999-I1040 HydrophobicContact CG1-CG1 4.49Å; I1003-I1040 HydrophobicContact CD1-CD1 4.08Å; L1036-I1040 WeakPolarHBondContact O-CD1 3.48Å; L1036-I1040 VanDerWaalsContact O-CG1 3.24Å; L1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; L1036-I1040 PolarHBondContact O-N 3.44Å; L1037-I1040 HydrophobicContact CD2-CD1 4.33Å; L1037-I1040 PolarHBondContact O-N 2.83Å; I1040-K1042 VanDerWaalsContact C-N 3.27Å; I1040-K1042 PolarHBondContact O-N 3.26Å; I1040-S1043 PolarHBondContact O-N 3.27Å; I1040-I1046 HydrophobicContact CB-CG2 4.44Å; I1040-I1046 HydrophobicContact CG1-CG2 4.42Å; I1040-I1046 HydrophobicContact CG2-CG2 4.31Å; I1040-T1047 PolarHBondContact O-OG1 2.98Å; I1040-F1050 HydrophobicContact CD1-CD1 4.24Å; I1040-F1050 HydrophobicContact CD1-CD2 3.74Å; I1040-F1050 HydrophobicContact CD1-CE1 4.29Å; I1040-F1050 HydrophobicContact CD1-CE2 3.8Å; I1040-F1050 HydrophobicContact CD1-CG 3.96Å; I1040-F1050 HydrophobicContact CD1-CZ 4.08Å; I1040-F1050 HydrophobicContact CG2-CB 3.9Å; I1040-F1050 HydrophobicContact CG2-CD1 4.07Å; I1040-F1050 HydrophobicContact CG2-CG 4.01Å
1041L90.4Very high90.8Very high40 Ų4031 Ų3121%0.20917%0.166CC..THydrogen-bonded Turntrans-74.7-12.3-173.4-67.6176.9000114V1026 L1037 V1039 S1043 T1047 V1078 I1079 T1082V1026-L1041 HydrophobicContact CG2-CD1 3.59Å; L1037-L1041 VanDerWaalsContact O-CB 3.28Å; L1037-L1041 WeakPolarHBondContact O-CB 3.48Å; L1037-L1041 WeakPolarHBondContact O-CG 3.44Å; L1037-L1041 PolarHBondContact O-N 3.01Å; V1039-L1041 VanDerWaalsContact C-N 3.33Å; V1039-L1041 PolarHBondContact O-N 3.24Å; L1041-S1043 VanDerWaalsContact C-N 3.26Å; L1041-S1043 PolarHBondContact O-N 3.07Å; L1041-T1047 HydrophobicContact CD2-CG2 4.32Å; L1041-V1078 HydrophobicContact CD1-CG1 4.46Å; L1041-I1079 HydrophobicContact CD2-CB 4.42Å; L1041-I1079 HydrophobicContact CD2-CG1 4.07Å; L1041-I1079 HydrophobicContact CD2-CG2 4.15Å; L1041-T1082 HydrophobicContact CD1-CG2 3.96Å; L1041-T1082 HydrophobicContact CD2-CG2 3.94Å; L1041-T1082 HydrophobicContact CG-CG2 4.39Å
1042K87.3Confident90.9Very high130 Ų13030.6 Ų30.657%0.56517%0.168SC*.THydrogen-bonded Turntrans-68.9-23.3174.8-78.9174.6-177.9-176.40113.5V974 T978 S1038 V1039 I1040V974-K1042 VanDerWaalsContact CG1-NZ 3.26Å; T978-K1042 HydrophobicContact CG2-CD 4.37Å; S1038-K1042 WeakPolarHBondContact O-CG 3.39Å; V1039-K1042 PolarHBondContact O-N 3.31Å; I1040-K1042 VanDerWaalsContact C-N 3.27Å; I1040-K1042 PolarHBondContact O-N 3.26Å
1043S87.7Confident90.9Very high16 Ų1631 Ų3111%0.11217%0.17CC..  trans-130.3119.7-173.9179.30000111.5Q982 I1040 L1041 S1045 I1046 T1047Q982-S1043 PolarHBondContact OE1-OG 3.25Å; I1040-S1043 PolarHBondContact O-N 3.27Å; L1041-S1043 VanDerWaalsContact C-N 3.26Å; L1041-S1043 PolarHBondContact O-N 3.07Å; S1043-S1045 PolarHBondContact O-N 3.31Å; S1043-S1045 PolarHBondContact OG-OG 2.83Å; S1043-S1045 VanDerWaalsContact OG-OG 3.05Å; S1043-I1046 PolarHBondContact O-N 3.46Å; S1043-T1047 PolarHBondContact O-N 2.88Å; S1043-T1047 PolarHBondContact O-OG1 2.78Å; S1043-T1047 VanDerWaalsContact O-OG1 3.09Å
1044P87.8Confident90.8Very high84 Ų8431 Ų3155%0.54517%0.17SC..Hα-helixtrans-60.2-30.4179.5-25.934.4000114.1R1048P1044-R1048 WeakPolarHBondContact O-CB 3.49Å; P1044-R1048 PolarHBondContact O-N 2.97Å
1045S88Confident90.7Very high37 Ų3730.2 Ų30.226%0.25916%0.164SC..Hα-helixtrans-70.7-43.4176.850.90000111.7S1043 R1048 S1049S1043-S1045 PolarHBondContact O-N 3.31Å; S1043-S1045 PolarHBondContact OG-OG 2.83Å; S1043-S1045 VanDerWaalsContact OG-OG 3.05Å; S1045-R1048 PolarHBondContact O-N 3.46Å; S1045-S1049 PolarHBondContact O-N 3.27Å; S1045-S1049 VanDerWaalsContact O-N 3.12Å; S1045-S1049 PolarHBondContact O-OG 2.62Å
1046I91.2Very high90.5Very high0 Ų032.4 Ų32.40%018%0.181CC..Hα-helixtrans-63.7-44.8176.4-57.8178.8000109.7L981 Q982 Q985 I1040 S1043 R1048 S1049 F1050L981-I1046 HydrophobicContact CB-CD1 3.88Å; L981-I1046 HydrophobicContact CB-CG2 4.35Å; L981-I1046 HydrophobicContact CD1-CG2 4.41Å; Q982-I1046 HydrophobicContact CB-CD1 4.33Å; Q985-I1046 HydrophobicContact CG-CG1 4.02Å; I1040-I1046 HydrophobicContact CB-CG2 4.44Å; I1040-I1046 HydrophobicContact CG1-CG2 4.42Å; I1040-I1046 HydrophobicContact CG2-CG2 4.31Å; S1043-I1046 PolarHBondContact O-N 3.46Å; I1046-R1048 VanDerWaalsContact C-N 3.29Å; I1046-R1048 PolarHBondContact O-N 3.28Å; I1046-S1049 PolarHBondContact O-N 3.32Å; I1046-F1050 WeakPolarHBondContact O-CB 3.43Å; I1046-F1050 PolarHBondContact O-N 3.42Å
1047T91.9Very high90.1Very high6 Ų632.8 Ų32.84%0.03718%0.184CC..Hα-helixtrans-57.4-41.1176-59.50000112.1I1040 L1041 S1043 L1051 I1079I1040-T1047 PolarHBondContact O-OG1 2.98Å; L1041-T1047 HydrophobicContact CD2-CG2 4.32Å; S1043-T1047 PolarHBondContact O-N 2.88Å; S1043-T1047 PolarHBondContact O-OG1 2.78Å; S1043-T1047 VanDerWaalsContact O-OG1 3.09Å; T1047-L1051 HydrophobicContact CG2-CD1 4.16Å; T1047-L1051 WeakPolarHBondContact O-CB 3.31Å; T1047-L1051 WeakPolarHBondContact O-CG 3.33Å; T1047-L1051 PolarHBondContact O-N 3.46Å; T1047-I1079 HydrophobicContact CG2-CG2 4.19Å
1048R90.2Very high89.8Confident164 Ų16432.9 Ų32.962%0.61918%0.184SC*.Hα-helixtrans-66.6-45179-169.6-173.3-56.2121.52.9112P1044 S1045 I1046 L1051 A1052P1044-R1048 WeakPolarHBondContact O-CB 3.49Å; P1044-R1048 PolarHBondContact O-N 2.97Å; S1045-R1048 PolarHBondContact O-N 3.46Å; I1046-R1048 VanDerWaalsContact C-N 3.29Å; I1046-R1048 PolarHBondContact O-N 3.28Å; R1048-L1051 PolarHBondContact O-N 3.14Å; R1048-A1052 PolarHBondContact O-N 3.33Å
1049S90.6Very high89.4Confident27 Ų2737 Ų3719%0.18920%0.199CC..Hα-helixtrans-66.6-39.4178.9-58.50000111.8Q985 S1045 I1046 A1052 E1053Q985-S1049 VanDerWaalsContact OE1-CB 3.29Å; Q985-S1049 PolarHBondContact OE1-OG 3.4Å; S1045-S1049 PolarHBondContact O-N 3.27Å; S1045-S1049 VanDerWaalsContact O-N 3.12Å; S1045-S1049 PolarHBondContact O-OG 2.62Å; I1046-S1049 PolarHBondContact O-N 3.32Å; S1049-A1052 WeakPolarHBondContact O-CB 3.37Å; S1049-A1052 PolarHBondContact O-N 3.27Å; S1049-E1053 PolarHBondContact O-N 3.39Å
1050F93.4Very high88.8Confident0 Ų040.6 Ų40.60%022%0.224CC..Hα-helixtrans-61-46.2171.9179.6-103.6000111.8V999 F1000 I1003 L1037 I1040 I1046 A1052 E1053 V1054 V1075 I1079V999-F1050 HydrophobicContact CG1-CD2 4.49Å; V999-F1050 HydrophobicContact CG1-CE2 4.19Å; F1000-F1050 HydrophobicContact CB-CE2 3.96Å; F1000-F1050 HydrophobicContact CD2-CE2 4.26Å; F1000-F1050 HydrophobicContact CD2-CZ 4.09Å; I1003-F1050 HydrophobicContact CD1-CE2 4.06Å; I1003-F1050 HydrophobicContact CD1-CZ 3.83Å; L1037-F1050 HydrophobicContact CD2-CE1 4.47Å; I1040-F1050 HydrophobicContact CD1-CD1 4.24Å; I1040-F1050 HydrophobicContact CD1-CD2 3.74Å; I1040-F1050 HydrophobicContact CD1-CE1 4.29Å; I1040-F1050 HydrophobicContact CD1-CE2 3.8Å; I1040-F1050 HydrophobicContact CD1-CG 3.96Å; I1040-F1050 HydrophobicContact CD1-CZ 4.08Å; I1040-F1050 HydrophobicContact CG2-CB 3.9Å; I1040-F1050 HydrophobicContact CG2-CD1 4.07Å; I1040-F1050 HydrophobicContact CG2-CG 4.01Å; I1046-F1050 WeakPolarHBondContact O-CB 3.43Å; I1046-F1050 PolarHBondContact O-N 3.42Å; F1050-A1052 VanDerWaalsContact C-N 3.29Å; F1050-A1052 PolarHBondContact O-N 2.99Å; F1050-E1053 WeakPolarHBondContact O-CB 3.37Å; F1050-E1053 PolarHBondContact O-N 2.82Å; F1050-V1054 HydrophobicContact CD1-CG2 4.17Å; F1050-V1054 HydrophobicContact CE1-CG2 3.83Å; F1050-V1054 HydrophobicContact CZ-CG2 4.04Å; F1050-V1054 VanDerWaalsContact O-CG2 3.28Å; F1050-V1054 WeakPolarHBondContact O-CG2 3.27Å; F1050-V1054 PolarHBondContact O-N 2.93Å; F1050-V1075 HydrophobicContact CE1-CG1 3.93Å; F1050-V1075 HydrophobicContact CZ-CG1 4.29Å; F1050-I1079 HydrophobicContact CD1-CD1 4.23Å; F1050-I1079 HydrophobicContact CE1-CD1 4.04Å
1051L91.8Very high87.6Confident4 Ų445.6 Ų45.62%0.02125%0.251CS..Hα-helixtrans-64.2-32.6175.9-74.9170.8000113.1T1047 R1048 V1054 S1055 L1076 I1079 I1089T1047-L1051 HydrophobicContact CG2-CD1 4.16Å; T1047-L1051 WeakPolarHBondContact O-CB 3.31Å; T1047-L1051 WeakPolarHBondContact O-CG 3.33Å; T1047-L1051 PolarHBondContact O-N 3.46Å; R1048-L1051 PolarHBondContact O-N 3.14Å; L1051-V1054 PolarHBondContact O-N 3.08Å; L1051-S1055 PolarHBondContact O-N 3.46Å; L1051-S1055 PolarHBondContact O-OG 3.09Å; L1051-L1076 HydrophobicContact CD2-CD2 3.69Å; L1051-I1079 HydrophobicContact CD1-CG2 4.48Å; L1051-I1079 HydrophobicContact CD2-CD1 3.88Å; L1051-I1089 HydrophobicContact CD1-CG1 4.09Å; L1051-I1089 HydrophobicContact CD2-CG1 4.31Å
1052A89.7Confident86.5Confident54 Ų5446.9 Ų46.945%0.44627%0.268SS..Hα-helixtrans-66.4-41.2173.800000111.5R1048 S1049 F1050 S1055 S1056R1048-A1052 PolarHBondContact O-N 3.33Å; S1049-A1052 WeakPolarHBondContact O-CB 3.37Å; S1049-A1052 PolarHBondContact O-N 3.27Å; F1050-A1052 VanDerWaalsContact C-N 3.29Å; F1050-A1052 PolarHBondContact O-N 2.99Å; A1052-S1055 PolarHBondContact O-N 2.66Å; A1052-S1056 PolarHBondContact O-N 3.33Å
1053E91.3Very high86.1Confident12 Ų1241.6 Ų41.66%0.05625%0.245CC..Hα-helixtrans-63.9-42.2173.6-178.860.1-152.300112S993 H996 S997 S1049 F1050 S1055 S1056 S1057S993-E1053 WeakPolarHBondContact CB-OE2 3.42Å; S993-E1053 PolarHBondContact OG-OE2 3.08Å; H996-E1053 HydrophobicContact CB-CB 3.78Å; H996-E1053 HydrophobicContact CB-CG 3.84Å; S997-E1053 VanDerWaalsContact CB-OE1 3.23Å; S997-E1053 WeakPolarHBondContact CB-OE1 3.47Å; S997-E1053 PolarHBondContact OG-OE1 3.34Å; S1049-E1053 PolarHBondContact O-N 3.39Å; F1050-E1053 WeakPolarHBondContact O-CB 3.37Å; F1050-E1053 PolarHBondContact O-N 2.82Å; E1053-S1055 VanDerWaalsContact C-N 3.31Å; E1053-S1055 PolarHBondContact O-N 2.92Å; E1053-S1056 PolarHBondContact O-N 3.48Å; E1053-S1057 WeakPolarHBondContact O-CB 3.47Å; E1053-S1057 PolarHBondContact O-N 3.15Å; E1053-S1057 PolarHBondContact O-OG 3.45Å; E1053-S1057 PolarHBondContact OE1-OG 3.02Å
1054V90.8Very high85.4Confident1 Ų145 Ų451%0.00626%0.262CS..Hα-helixtrans-56.8-46.4174173.90000110.5F1000 F1050 L1051 L1058 V1072 A1092F1000-V1054 HydrophobicContact CD2-CG2 3.69Å; F1000-V1054 HydrophobicContact CE2-CB 4.27Å; F1000-V1054 HydrophobicContact CE2-CG1 4.17Å; F1000-V1054 HydrophobicContact CE2-CG2 3.67Å; F1000-V1054 HydrophobicContact CZ-CG1 4.47Å; F1000-V1054 HydrophobicContact CZ-CG2 4.5Å; F1050-V1054 HydrophobicContact CD1-CG2 4.17Å; F1050-V1054 HydrophobicContact CE1-CG2 3.83Å; F1050-V1054 HydrophobicContact CZ-CG2 4.04Å; F1050-V1054 VanDerWaalsContact O-CG2 3.28Å; F1050-V1054 WeakPolarHBondContact O-CG2 3.27Å; F1050-V1054 PolarHBondContact O-N 2.93Å; L1051-V1054 PolarHBondContact O-N 3.08Å; V1054-L1058 HydrophobicContact CG1-CD1 4.09Å; V1054-L1058 WeakPolarHBondContact O-CD1 3.4Å; V1054-L1058 VanDerWaalsContact O-CG 3.28Å; V1054-L1058 WeakPolarHBondContact O-CG 3.39Å; V1054-L1058 PolarHBondContact O-N 3.32Å; V1054-V1072 HydrophobicContact CG1-CG1 4.04Å; V1054-A1092 HydrophobicContact CG1-CB 4.07Å
1055S88.1Confident85.2Confident4 Ų442.5 Ų42.53%0.02825%0.247CC..Hα-helixtrans-63.3-45.4175.4-67.20000112.3L1051 A1052 E1053 S1057 L1058 E1059L1051-S1055 PolarHBondContact O-N 3.46Å; L1051-S1055 PolarHBondContact O-OG 3.09Å; A1052-S1055 PolarHBondContact O-N 2.66Å; E1053-S1055 VanDerWaalsContact C-N 3.31Å; E1053-S1055 PolarHBondContact O-N 2.92Å; S1055-S1057 VanDerWaalsContact C-N 3.35Å; S1055-S1057 PolarHBondContact O-N 3.48Å; S1055-L1058 PolarHBondContact O-N 3.46Å; S1055-E1059 WeakPolarHBondContact O-CG 3.49Å; S1055-E1059 PolarHBondContact O-N 3.39Å
1056S87.7Confident85.1Confident58 Ų5842 Ų4241%0.40624%0.241SC..Hα-helixtrans-61.9-40.7180-169.50000112.6A1052 E1053 L1058 E1059 S1060A1052-S1056 PolarHBondContact O-N 3.33Å; E1053-S1056 PolarHBondContact O-N 3.48Å; S1056-L1058 VanDerWaalsContact C-N 3.31Å; S1056-L1058 PolarHBondContact O-N 3.3Å; S1056-E1059 PolarHBondContact O-N 3.27Å; S1056-S1060 PolarHBondContact O-N 2.89Å
1057S86.4Confident84.8Confident12 Ų1242.6 Ų42.68%0.08425%0.245CC..Hα-helixtrans-67.9-30.8177.7-69.90000112.9F1000 E1053 S1055 S1060F1000-S1057 VanDerWaalsContact CE1-CB 3.46Å; E1053-S1057 WeakPolarHBondContact O-CB 3.47Å; E1053-S1057 PolarHBondContact O-N 3.15Å; E1053-S1057 PolarHBondContact O-OG 3.45Å; E1053-S1057 PolarHBondContact OE1-OG 3.02Å; S1055-S1057 VanDerWaalsContact C-N 3.35Å; S1055-S1057 PolarHBondContact O-N 3.48Å; S1057-S1060 PolarHBondContact O-OG 2.91Å
1058L85Confident84.6Confident1 Ų143.6 Ų43.61%0.00525%0.25CC..Hα-helixtrans-77.4-28.2174.3-70.8164.4000112.2V1054 S1055 S1056 S1060 L1063 L1069 V1072 V1096 H1099V1054-L1058 HydrophobicContact CG1-CD1 4.09Å; V1054-L1058 WeakPolarHBondContact O-CD1 3.4Å; V1054-L1058 VanDerWaalsContact O-CG 3.28Å; V1054-L1058 WeakPolarHBondContact O-CG 3.39Å; V1054-L1058 PolarHBondContact O-N 3.32Å; S1055-L1058 PolarHBondContact O-N 3.46Å; S1056-L1058 VanDerWaalsContact C-N 3.31Å; S1056-L1058 PolarHBondContact O-N 3.3Å; L1058-S1060 VanDerWaalsContact C-N 3.34Å; L1058-L1063 HydrophobicContact CD2-CD1 4.07Å; L1058-L1069 HydrophobicContact CD2-CD2 4.14Å; L1058-V1072 HydrophobicContact CD1-CG1 4.22Å; L1058-V1096 HydrophobicContact CD1-CG2 3.58Å; L1058-V1096 HydrophobicContact CD2-CG2 3.96Å; L1058-V1096 HydrophobicContact CG-CG2 4.45Å; L1058-H1099 PolarHBondContact O-CE1 3.42Å; L1058-H1099 PolarHBondContact O-NE2 3.45Å
1059E83.7Confident84.5Confident126 Ų12635.8 Ų35.859%0.58922%0.22SC*.Hα-helixtrans-80.1-17177.5-73169.6-165.700112.8S1055 S1056S1055-E1059 WeakPolarHBondContact O-CG 3.49Å; S1055-E1059 PolarHBondContact O-N 3.39Å; S1056-E1059 PolarHBondContact O-N 3.27Å
1060S79.5Confident84.3Confident76 Ų7634.5 Ų34.553%0.53121%0.211SC..THydrogen-bonded Turntrans-92.413.5-179.469.90000114.6S1056 S1057 L1058 A1062S1056-S1060 PolarHBondContact O-N 2.89Å; S1057-S1060 PolarHBondContact O-OG 2.91Å; L1058-S1060 VanDerWaalsContact C-N 3.34Å; S1060-A1062 PolarHBondContact O-N 3.27Å
1061D68.1Low84.1Confident106 Ų10634.5 Ų34.557%0.56721%0.211SC*.THydrogen-bonded Turntrans4929.1-174.4-61.6-20.6000113.7L1063 H1099D1061-L1063 VanDerWaalsContact C-N 3.28Å; D1061-L1063 PolarHBondContact O-N 2.98Å; D1061-H1099 IonicContact OD1-NE2 2.74Å; D1061-H1099 PolarHBondContact OD1-NE2 2.86Å
1062A66.8Low84.2Confident67 Ų6734.3 Ų34.355%0.55421%0.21SC*.  trans-80.4-10.3-177.900000112.9S1060S1060-A1062 PolarHBondContact O-N 3.27Å
1063L77.6Confident84.2Confident18 Ų1831.8 Ų31.89%0.09419%0.189CC..  trans-132.593.4-172.6-63.7177.8000110.8F1000 I1004 L1058 D1061 E1068 V1072F1000-L1063 HydrophobicContact CE1-CD1 3.79Å; F1000-L1063 HydrophobicContact CZ-CD1 3.65Å; I1004-L1063 HydrophobicContact CG2-CD2 4.31Å; L1058-L1063 HydrophobicContact CD2-CD1 4.07Å; D1061-L1063 VanDerWaalsContact C-N 3.28Å; D1061-L1063 PolarHBondContact O-N 2.98Å; L1063-E1068 HydrophobicContact CB-CB 4.39Å; L1063-E1068 HydrophobicContact CD2-CB 4.11Å; L1063-E1068 HydrophobicContact CD2-CG 4.14Å; L1063-V1072 HydrophobicContact CD1-CG2 3.87Å
1064D73.7Confident84.2Confident87 Ų8731.3 Ų31.347%0.46519%0.187SC..  trans-110-14.6-174.8-72.1-22000114.1H1103D1064-H1103 PolarHBondContact O-CE1 3.04Å; D1064-H1103 PolarHBondContact O-NE2 3.04Å
1065S84.4Confident84.3Confident33 Ų3331.3 Ų31.323%0.23119%0.187CC..SBendtrans-82.1143.9-177.975.90000112.5S1067 E1068 L1069S1065-S1067 PolarHBondContact O-N 3.13Å; S1065-S1067 VanDerWaalsContact O-N 3.16Å; S1065-S1067 PolarHBondContact OG-OG 2.93Å; S1065-S1067 VanDerWaalsContact OG-OG 3.12Å; S1065-E1068 VanDerWaalsContact CB-OE2 3.26Å; S1065-E1068 WeakPolarHBondContact CB-OE2 3.32Å; S1065-E1068 PolarHBondContact N-OE2 3.46Å; S1065-E1068 WeakPolarHBondContact O-CB 3.35Å; S1065-E1068 PolarHBondContact O-N 3.35Å; S1065-E1068 WeakPolarHBondContact OG-CB 3.38Å; S1065-E1068 WeakPolarHBondContact OG-CG 3.42Å; S1065-E1068 PolarHBondContact OG-N 2.86Å; S1065-E1068 PolarHBondContact OG-OE2 2.87Å; S1065-L1069 PolarHBondContact O-N 3.19Å
1066L84.3Confident84.5Confident25 Ų2531.1 Ų31.113%0.13119%0.186CC..Hα-helixtrans-53.4-37.2174.3-178.962.6000112.6E1068 A1070 L1100 Q1114 M1117 Y1118L1066-E1068 VanDerWaalsContact C-N 3.35Å; L1066-E1068 PolarHBondContact O-N 2.76Å; L1066-A1070 VanDerWaalsContact O-CB 3.28Å; L1066-A1070 WeakPolarHBondContact O-CB 3.29Å; L1066-A1070 PolarHBondContact O-N 2.98Å; L1066-L1100 HydrophobicContact CD1-CD1 3.81Å; L1066-Q1114 HydrophobicContact CD2-CB 4.39Å; L1066-Q1114 WeakPolarHBondContact CD2-O 3.3Å; L1066-M1117 HydrophobicContact CG-SD 4.42Å; L1066-Y1118 HydrophobicContact CD1-CD2 3.88Å
1067S85.4Confident84.5Confident13 Ų1328.8 Ų28.89%0.09117%0.17CC..Hα-helixtrans-67.7-29.9176.747.50000114L1011 Q1012 S1065 A1071L1011-S1067 WeakPolarHBondContact CD1-O 3.36Å; Q1012-S1067 PolarHBondContact NE2-OG 3.06Å; Q1012-S1067 VanDerWaalsContact NE2-OG 3.15Å; S1065-S1067 PolarHBondContact O-N 3.13Å; S1065-S1067 VanDerWaalsContact O-N 3.16Å; S1065-S1067 PolarHBondContact OG-OG 2.93Å; S1065-S1067 VanDerWaalsContact OG-OG 3.12Å; S1067-A1071 WeakPolarHBondContact O-CB 3.42Å; S1067-A1071 PolarHBondContact O-N 3.35Å; S1067-A1071 VanDerWaalsContact O-N 3.11Å
1068E87.1Confident84.7Confident28 Ų2828.3 Ų28.313%0.13117%0.166CC..Hα-helixtrans-76.4-44.6175.6-76.7156.4168.300111.2I1004 R1008 L1063 S1065 L1066 A1070 A1071 V1072I1004-E1068 HydrophobicContact CG2-CB 4.45Å; I1004-E1068 HydrophobicContact CG2-CG 4.15Å; R1008-E1068 HydrophobicContact CG-CG 4.21Å; R1008-E1068 IonicContact CZ-OE1 2.68Å; R1008-E1068 IonicContact NH1-OE1 2.83Å; R1008-E1068 PolarHBondContact NH1-OE1 3.37Å; L1063-E1068 HydrophobicContact CB-CB 4.39Å; L1063-E1068 HydrophobicContact CD2-CB 4.11Å; L1063-E1068 HydrophobicContact CD2-CG 4.14Å; S1065-E1068 VanDerWaalsContact CB-OE2 3.26Å; S1065-E1068 WeakPolarHBondContact CB-OE2 3.32Å; S1065-E1068 PolarHBondContact N-OE2 3.46Å; S1065-E1068 WeakPolarHBondContact O-CB 3.35Å; S1065-E1068 PolarHBondContact O-N 3.35Å; S1065-E1068 WeakPolarHBondContact OG-CB 3.38Å; S1065-E1068 WeakPolarHBondContact OG-CG 3.42Å; S1065-E1068 PolarHBondContact OG-N 2.86Å; S1065-E1068 PolarHBondContact OG-OE2 2.87Å; L1066-E1068 VanDerWaalsContact C-N 3.35Å; L1066-E1068 PolarHBondContact O-N 2.76Å; E1068-A1070 VanDerWaalsContact C-N 3.3Å; E1068-A1070 PolarHBondContact O-N 2.99Å; E1068-A1071 WeakPolarHBondContact O-CB 3.35Å; E1068-A1071 PolarHBondContact O-N 3.17Å; E1068-A1071 VanDerWaalsContact O-N 3.12Å; E1068-V1072 WeakPolarHBondContact O-CG2 3.31Å; E1068-V1072 PolarHBondContact O-N 3.05Å
1069L88Confident85Confident0 Ų028.2 Ų28.20%017%0.166CC..Hα-helixtrans-61-41.3175.3-62.5176.9000111.2L1058 S1065 V1072 L1073 V1096 H1099 L1100L1058-L1069 HydrophobicContact CD2-CD2 4.14Å; S1065-L1069 PolarHBondContact O-N 3.19Å; L1069-V1072 PolarHBondContact O-N 3Å; L1069-L1073 WeakPolarHBondContact O-CG 3.37Å; L1069-L1073 PolarHBondContact O-N 3.26Å; L1069-V1096 HydrophobicContact CD2-CG1 4.43Å; L1069-H1099 HydrophobicContact CD1-CB 3.91Å; L1069-H1099 HydrophobicContact CD2-CB 3.92Å; L1069-L1100 HydrophobicContact CD1-CD1 4.23Å
1070A87.4Confident85.2Confident0 Ų024.6 Ų24.60%015%0.148CC..Hα-helixtrans-62.6-41.217300000112.3L1011 L1066 E1068 L1073 H1074 M1117 S1121L1011-A1070 HydrophobicContact CD1-CB 3.83Å; L1066-A1070 VanDerWaalsContact O-CB 3.28Å; L1066-A1070 WeakPolarHBondContact O-CB 3.29Å; L1066-A1070 PolarHBondContact O-N 2.98Å; E1068-A1070 VanDerWaalsContact C-N 3.3Å; E1068-A1070 PolarHBondContact O-N 2.99Å; A1070-L1073 PolarHBondContact O-N 3Å; A1070-H1074 PolarHBondContact O-CD2 3.21Å; A1070-H1074 VanDerWaalsContact O-CD2 3.23Å; A1070-H1074 VanDerWaalsContact O-CG 3.32Å; A1070-H1074 PolarHBondContact O-N 3.18Å; A1070-M1117 HydrophobicContact CB-CG 3.86Å; A1070-M1117 HydrophobicContact CB-SD 4.08Å; A1070-S1121 WeakPolarHBondContact CB-OG 3.23Å
1071A90.1Very high85.5Confident0 Ų026.6 Ų26.60%015%0.149CC..Hα-helixtrans-62.4-42.4175.100000112.3I1004 K1007 L1011 S1067 E1068 H1074 V1075I1004-A1071 HydrophobicContact CD1-CB 4.03Å; I1004-A1071 HydrophobicContact CG2-CB 4.38Å; K1007-A1071 HydrophobicContact CB-CB 3.87Å; K1007-A1071 HydrophobicContact CG-CB 3.81Å; L1011-A1071 HydrophobicContact CD1-CB 4.17Å; S1067-A1071 WeakPolarHBondContact O-CB 3.42Å; S1067-A1071 PolarHBondContact O-N 3.35Å; S1067-A1071 VanDerWaalsContact O-N 3.11Å; E1068-A1071 WeakPolarHBondContact O-CB 3.35Å; E1068-A1071 PolarHBondContact O-N 3.17Å; E1068-A1071 VanDerWaalsContact O-N 3.12Å; A1071-H1074 PolarHBondContact O-N 2.64Å; A1071-V1075 WeakPolarHBondContact O-CG2 3.33Å; A1071-V1075 PolarHBondContact O-N 2.75Å; A1071-V1075 VanDerWaalsContact O-N 3.08Å
1072V91.9Very high86Confident0 Ų024.1 Ų24.10%014%0.138CC..Hα-helixtrans-61.6-45.2174.9173.60000110.9F1000 I1004 V1054 L1058 L1063 E1068 L1069 H1074 V1075 L1076 V1096F1000-V1072 HydrophobicContact CE2-CG2 4.21Å; F1000-V1072 HydrophobicContact CZ-CG2 3.95Å; I1004-V1072 HydrophobicContact CD1-CB 4.38Å; I1004-V1072 HydrophobicContact CD1-CG2 3.6Å; I1004-V1072 HydrophobicContact CG1-CG2 4.34Å; V1054-V1072 HydrophobicContact CG1-CG1 4.04Å; L1058-V1072 HydrophobicContact CD1-CG1 4.22Å; L1063-V1072 HydrophobicContact CD1-CG2 3.87Å; E1068-V1072 WeakPolarHBondContact O-CG2 3.31Å; E1068-V1072 PolarHBondContact O-N 3.05Å; L1069-V1072 PolarHBondContact O-N 3Å; V1072-H1074 VanDerWaalsContact C-N 3.3Å; V1072-H1074 PolarHBondContact O-N 3.05Å; V1072-V1075 WeakPolarHBondContact O-CB 3.45Å; V1072-V1075 PolarHBondContact O-N 3.21Å; V1072-V1075 VanDerWaalsContact O-N 3.15Å; V1072-L1076 HydrophobicContact CG1-CD1 4.16Å; V1072-L1076 HydrophobicContact CG1-CG 4.39Å; V1072-L1076 WeakPolarHBondContact O-CG 3.49Å; V1072-L1076 PolarHBondContact O-N 3.19Å; V1072-V1096 HydrophobicContact CG1-CG2 3.79Å
1073L90.4Very high86.4Confident0 Ų023 Ų230%013%0.132CC..Hα-helixtrans-62.2-37.1177.7-73167.6000112.5L1069 A1070 L1076 A1077 V1096 S1121 T1124 L1125 L1128L1069-L1073 WeakPolarHBondContact O-CG 3.37Å; L1069-L1073 PolarHBondContact O-N 3.26Å; A1070-L1073 PolarHBondContact O-N 3Å; L1073-L1076 PolarHBondContact O-N 2.83Å; L1073-A1077 VanDerWaalsContact O-CB 3.32Å; L1073-A1077 WeakPolarHBondContact O-CB 3.45Å; L1073-A1077 PolarHBondContact O-N 2.83Å; L1073-V1096 HydrophobicContact CD1-CG1 4.04Å; L1073-V1096 HydrophobicContact CD2-CG1 3.95Å; L1073-V1096 HydrophobicContact CG-CG1 3.92Å; L1073-S1121 WeakPolarHBondContact CD1-O 3.5Å; L1073-T1124 HydrophobicContact CB-CG2 4.2Å; L1073-L1125 HydrophobicContact CD1-CB 4.44Å; L1073-L1125 HydrophobicContact CD2-CB 3.98Å; L1073-L1125 HydrophobicContact CD2-CD1 4.06Å; L1073-L1128 HydrophobicContact CD2-CD1 3.85Å
1074H91.8Very high86.2Confident2 Ų228 Ų281%0.00916%0.155CC..Hα-helixtrans-64.8-39.6174.5-74.3-163.1000111.8K1007 V1021 P1023 A1070 A1071 V1072 A1077 V1078K1007-H1074 WeakPolarHBondContact CE-ND1 3.37Å; V1021-H1074 PolarHBondContact O-CE1 3.25Å; P1023-H1074 VanDerWaalsContact CD-CG 3.47Å; P1023-H1074 HydrophobicContact CG-CB 3.69Å; A1070-H1074 PolarHBondContact O-CD2 3.21Å; A1070-H1074 VanDerWaalsContact O-CD2 3.23Å; A1070-H1074 VanDerWaalsContact O-CG 3.32Å; A1070-H1074 PolarHBondContact O-N 3.18Å; A1071-H1074 PolarHBondContact O-N 2.64Å; V1072-H1074 VanDerWaalsContact C-N 3.3Å; V1072-H1074 PolarHBondContact O-N 3.05Å; H1074-A1077 PolarHBondContact O-N 2.89Å; H1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; H1074-V1078 PolarHBondContact O-N 2.87Å
1075V92.3Very high86.5Confident2 Ų225.6 Ų25.61%0.01215%0.145CC..Hα-helixtrans-63-48173.11720000111.1I1003 I1004 M1029 L1037 F1050 A1071 V1072 A1077 V1078 I1079I1003-V1075 HydrophobicContact CG2-CG2 3.44Å; I1003-V1075 VanDerWaalsContact CG2-CG2 3.44Å; I1004-V1075 HydrophobicContact CD1-CG2 4.35Å; M1029-V1075 HydrophobicContact CE-CG2 4.02Å; L1037-V1075 HydrophobicContact CD2-CG1 4.07Å; F1050-V1075 HydrophobicContact CE1-CG1 3.93Å; F1050-V1075 HydrophobicContact CZ-CG1 4.29Å; A1071-V1075 WeakPolarHBondContact O-CG2 3.33Å; A1071-V1075 PolarHBondContact O-N 2.75Å; A1071-V1075 VanDerWaalsContact O-N 3.08Å; V1072-V1075 WeakPolarHBondContact O-CB 3.45Å; V1072-V1075 PolarHBondContact O-N 3.21Å; V1072-V1075 VanDerWaalsContact O-N 3.15Å; V1075-A1077 VanDerWaalsContact C-N 3.3Å; V1075-A1077 PolarHBondContact O-N 3.37Å; V1075-V1078 PolarHBondContact O-N 3.45Å; V1075-I1079 HydrophobicContact CG1-CD1 3.85Å; V1075-I1079 HydrophobicContact CG1-CG1 4.48Å; V1075-I1079 WeakPolarHBondContact O-CG1 3.21Å; V1075-I1079 PolarHBondContact O-N 3.4Å
1076L91.8Very high86.5Confident0 Ų029.5 Ų29.50%016%0.158CC..Hα-helixtrans-62.7-36.2178.6-66.4178000112.3L1051 V1072 L1073 I1079 K1080 A1092 L1128L1051-L1076 HydrophobicContact CD2-CD2 3.69Å; V1072-L1076 HydrophobicContact CG1-CD1 4.16Å; V1072-L1076 HydrophobicContact CG1-CG 4.39Å; V1072-L1076 WeakPolarHBondContact O-CG 3.49Å; V1072-L1076 PolarHBondContact O-N 3.19Å; L1073-L1076 PolarHBondContact O-N 2.83Å; L1076-I1079 PolarHBondContact O-N 3.32Å; L1076-K1080 WeakPolarHBondContact O-CB 3.4Å; L1076-K1080 PolarHBondContact O-N 2.94Å; L1076-A1092 HydrophobicContact CD1-CB 3.95Å; L1076-A1092 HydrophobicContact CD2-CB 3.97Å; L1076-L1128 HydrophobicContact CB-CD1 3.7Å; L1076-L1128 HydrophobicContact CB-CD2 4.18Å; L1076-L1128 HydrophobicContact CD1-CD1 4.38Å
1077A89.7Confident86.4Confident8 Ų831 Ų317%0.06618%0.18CC..Hα-helixtrans-62.5-41.7175.500000112.1I1022 L1073 H1074 V1075 K1080 Q1081 T1124I1022-A1077 HydrophobicContact CG2-CB 3.95Å; L1073-A1077 VanDerWaalsContact O-CB 3.32Å; L1073-A1077 WeakPolarHBondContact O-CB 3.45Å; L1073-A1077 PolarHBondContact O-N 2.83Å; H1074-A1077 PolarHBondContact O-N 2.89Å; V1075-A1077 VanDerWaalsContact C-N 3.3Å; V1075-A1077 PolarHBondContact O-N 3.37Å; A1077-K1080 WeakPolarHBondContact O-CB 3.4Å; A1077-K1080 PolarHBondContact O-N 3.29Å; A1077-Q1081 WeakPolarHBondContact O-CG 3.4Å; A1077-T1124 HydrophobicContact CB-CG2 4.04Å
1078V90.4Very high86.4Confident2 Ų231.5 Ų31.51%0.01219%0.186CC..Hα-helixtrans-67.4-43.3175.51740000111.2P1023 V1026 M1029 L1037 L1041 H1074 V1075 K1080 Q1081P1023-V1078 HydrophobicContact CB-CG2 3.79Å; P1023-V1078 HydrophobicContact CG-CG2 3.87Å; V1026-V1078 HydrophobicContact CB-CG1 4.41Å; V1026-V1078 HydrophobicContact CG2-CG1 3.63Å; M1029-V1078 HydrophobicContact CG-CG2 3.95Å; M1029-V1078 HydrophobicContact SD-CG2 4.07Å; L1037-V1078 HydrophobicContact CD1-CG1 4.42Å; L1041-V1078 HydrophobicContact CD1-CG1 4.46Å; H1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; H1074-V1078 PolarHBondContact O-N 2.87Å; V1075-V1078 PolarHBondContact O-N 3.45Å; V1078-K1080 VanDerWaalsContact C-N 3.31Å; V1078-K1080 PolarHBondContact O-N 3.39Å; V1078-Q1081 PolarHBondContact O-N 3.02Å
1079I89.8Confident86.4Confident0 Ų030.1 Ų30.10%018%0.18CC..Hα-helixtrans-63-39178.5-60.8169.8000110.8L1041 T1047 F1050 L1051 V1075 L1076 Q1081 T1082 I1089L1041-I1079 HydrophobicContact CD2-CB 4.42Å; L1041-I1079 HydrophobicContact CD2-CG1 4.07Å; L1041-I1079 HydrophobicContact CD2-CG2 4.15Å; T1047-I1079 HydrophobicContact CG2-CG2 4.19Å; F1050-I1079 HydrophobicContact CD1-CD1 4.23Å; F1050-I1079 HydrophobicContact CE1-CD1 4.04Å; L1051-I1079 HydrophobicContact CD1-CG2 4.48Å; L1051-I1079 HydrophobicContact CD2-CD1 3.88Å; V1075-I1079 HydrophobicContact CG1-CD1 3.85Å; V1075-I1079 HydrophobicContact CG1-CG1 4.48Å; V1075-I1079 WeakPolarHBondContact O-CG1 3.21Å; V1075-I1079 PolarHBondContact O-N 3.4Å; L1076-I1079 PolarHBondContact O-N 3.32Å; I1079-Q1081 PolarHBondContact O-N 3.24Å; I1079-T1082 WeakPolarHBondContact O-CB 3.41Å; I1079-T1082 PolarHBondContact O-N 3.12Å; I1079-T1082 VanDerWaalsContact O-N 3.11Å; I1079-T1082 PolarHBondContact O-OG1 3.41Å; I1079-I1089 HydrophobicContact CG2-CD1 3.92Å; I1079-I1089 HydrophobicContact CG2-CG1 4.2Å
1080K88.2Confident86.4Confident50 Ų5035.1 Ų35.122%0.21720%0.202CC..Hα-helixtrans-52.8-39.3177.3175.8-175.2174.2174.20112.7L1076 A1077 V1078 T1082 G1083 A1127 L1128 F1131L1076-K1080 WeakPolarHBondContact O-CB 3.4Å; L1076-K1080 PolarHBondContact O-N 2.94Å; A1077-K1080 WeakPolarHBondContact O-CB 3.4Å; A1077-K1080 PolarHBondContact O-N 3.29Å; V1078-K1080 VanDerWaalsContact C-N 3.31Å; V1078-K1080 PolarHBondContact O-N 3.39Å; K1080-T1082 PolarHBondContact O-N 3.38Å; K1080-T1082 VanDerWaalsContact O-N 3.15Å; K1080-G1083 PolarHBondContact O-N 3.27Å; K1080-A1127 PolarHBondContact NZ-O 2.89Å; K1080-L1128 HydrophobicContact CB-CD2 3.94Å; K1080-L1128 HydrophobicContact CD-CD2 3.8Å; K1080-L1128 HydrophobicContact CG-CD2 4.34Å; K1080-F1131 HydrophobicContact CB-CE1 4.39Å; K1080-F1131 HydrophobicContact CD-CB 4.22Å; K1080-F1131 HydrophobicContact CD-CD1 4.47Å; K1080-F1131 HydrophobicContact CD-CD2 4.04Å; K1080-F1131 HydrophobicContact CD-CE2 4.49Å; K1080-F1131 HydrophobicContact CD-CG 4Å; K1080-F1131 VanDerWaalsContact CE-CD2 3.4Å; K1080-F1131 HydrophobicContact CG-CB 4.48Å; K1080-F1131 HydrophobicContact CG-CD1 3.86Å; K1080-F1131 HydrophobicContact CG-CD2 3.69Å; K1080-F1131 HydrophobicContact CG-CE1 3.86Å; K1080-F1131 HydrophobicContact CG-CE2 3.68Å; K1080-F1131 HydrophobicContact CG-CG 3.75Å; K1080-F1131 HydrophobicContact CG-CZ 3.76Å; K1080-F1131 WeakPolarHBondContact O-CZ 3.33Å
1081Q85.3Confident86.4Confident118 Ų11842.9 Ų42.955%0.55123%0.231SC*.THydrogen-bonded Turntrans-66.4-17.6-175.4-59.9-69.1-2.600113Q1024 A1077 V1078 I1079 G1083Q1024-Q1081 WeakPolarHBondContact O-CG 3.09Å; A1077-Q1081 WeakPolarHBondContact O-CG 3.4Å; V1078-Q1081 PolarHBondContact O-N 3.02Å; I1079-Q1081 PolarHBondContact O-N 3.24Å; Q1081-G1083 VanDerWaalsContact C-N 3.28Å; Q1081-G1083 PolarHBondContact O-N 3.32Å
1082T79.3Confident86.3Confident53 Ų5342.9 Ų42.933%0.32523%0.231SC..THydrogen-bonded Turntrans-74.9-13.5174.3700000113.9L1041 I1079 K1080 H1084L1041-T1082 HydrophobicContact CD1-CG2 3.96Å; L1041-T1082 HydrophobicContact CD2-CG2 3.94Å; L1041-T1082 HydrophobicContact CG-CG2 4.39Å; I1079-T1082 WeakPolarHBondContact O-CB 3.41Å; I1079-T1082 PolarHBondContact O-N 3.12Å; I1079-T1082 VanDerWaalsContact O-N 3.11Å; I1079-T1082 PolarHBondContact O-OG1 3.41Å; K1080-T1082 PolarHBondContact O-N 3.38Å; K1080-T1082 VanDerWaalsContact O-N 3.15Å; T1082-H1084 PolarHBondContact O-CE1 3.39Å; T1082-H1084 PolarHBondContact O-N 3.38Å; T1082-H1084 PolarHBondContact O-ND1 3.2Å
1083G75Confident86.2Confident43 Ų4342.9 Ų42.944%0.44323%0.231SC..  trans76.7-2.7179.600000116K1080 Q1081K1080-G1083 PolarHBondContact O-N 3.27Å; Q1081-G1083 VanDerWaalsContact C-N 3.28Å; Q1081-G1083 PolarHBondContact O-N 3.32Å
1084H74.7Confident86Confident125 Ų12545.6 Ų45.658%0.57925%0.248SC*.  trans-107168.1-176.3-59.991.8000112.1T1082 K1086T1082-H1084 PolarHBondContact O-CE1 3.39Å; T1082-H1084 PolarHBondContact O-N 3.38Å; T1082-H1084 PolarHBondContact O-ND1 3.2Å; H1084-K1086 PolarHBondContact O-N 3.44Å
1085S79.6Confident85.8Confident35 Ų3545.9 Ų45.925%0.24525%0.25CC..  trans6228.5172-57.60000117.3G1087 G1088 I1089S1085-G1087 VanDerWaalsContact C-N 3.29Å; S1085-G1087 PolarHBondContact O-N 3.49Å; S1085-G1087 VanDerWaalsContact O-N 3.12Å; S1085-G1088 PolarHBondContact O-N 3.15Å; S1085-I1089 PolarHBondContact O-N 3.39Å; S1085-I1089 VanDerWaalsContact O-N 3.15Å
1086K83.2Confident85.6Confident115 Ų11545.8 Ų45.850%0.525%0.249SC..Hα-helixtrans-44.2-47.5179.6-63.5-167.2171.4-156.50114.7H1084 G1088 I1089 K1090 F1131H1084-K1086 PolarHBondContact O-N 3.44Å; K1086-G1088 PolarHBondContact O-N 3.09Å; K1086-I1089 PolarHBondContact O-N 3.2Å; K1086-K1090 WeakPolarHBondContact O-CB 3.43Å; K1086-K1090 PolarHBondContact O-N 2.68Å; K1086-F1131 HydrophobicContact CB-CE1 4.41Å; K1086-F1131 HydrophobicContact CG-CD1 4.2Å; K1086-F1131 HydrophobicContact CG-CE1 3.7Å; K1086-F1131 HydrophobicContact CG-CZ 4.13Å; K1086-F1131 PolarHBondContact NZ-O 3.06Å
1087G83.4Confident85.3Confident57 Ų5748.7 Ų48.759%0.58826%0.263SS*.Hα-helixtrans-64.2-36.7-178.300000114.1S1085 R1091S1085-G1087 VanDerWaalsContact C-N 3.29Å; S1085-G1087 PolarHBondContact O-N 3.49Å; S1085-G1087 VanDerWaalsContact O-N 3.12Å; G1087-R1091 PolarHBondContact O-N 3.16Å; G1087-R1091 VanDerWaalsContact O-N 3.14Å
1088G84.9Confident85Confident23 Ų2354.2 Ų54.224%0.23729%0.287CS..Hα-helixtrans-72.8-41.4177.300000112.1S1085 K1086 K1090 R1091 A1092S1085-G1088 PolarHBondContact O-N 3.15Å; K1086-G1088 PolarHBondContact O-N 3.09Å; G1088-K1090 PolarHBondContact O-N 3.24Å; G1088-R1091 PolarHBondContact O-N 3.18Å; G1088-A1092 PolarHBondContact O-N 2.99Å
1089I88.3Confident84.6Confident0 Ų054.6 Ų54.60%029%0.289CS..Hα-helixtrans-61.4-45.8176.1-63.1167.2000110.5L1051 I1079 S1085 K1086 R1091 A1092 A1093 L1128 F1131L1051-I1089 HydrophobicContact CD1-CG1 4.09Å; L1051-I1089 HydrophobicContact CD2-CG1 4.31Å; I1079-I1089 HydrophobicContact CG2-CD1 3.92Å; I1079-I1089 HydrophobicContact CG2-CG1 4.2Å; S1085-I1089 PolarHBondContact O-N 3.39Å; S1085-I1089 VanDerWaalsContact O-N 3.15Å; K1086-I1089 PolarHBondContact O-N 3.2Å; I1089-R1091 PolarHBondContact O-N 3.47Å; I1089-A1092 PolarHBondContact O-N 2.91Å; I1089-A1093 VanDerWaalsContact O-CB 3.3Å; I1089-A1093 WeakPolarHBondContact O-CB 3.49Å; I1089-A1093 PolarHBondContact O-N 3.5Å; I1089-L1128 HydrophobicContact CG2-CD2 3.69Å; I1089-F1131 HydrophobicContact CD1-CD1 4.33Å; I1089-F1131 HydrophobicContact CD1-CE1 3.84Å
1090K87.8Confident84.3Confident105 Ų10554.8 Ų54.846%0.45729%0.29SS..Hα-helixtrans-63.1-40.8178.5-171.7169.7-176.4168.20112.1K1086 G1088 A1093 V1094K1086-K1090 WeakPolarHBondContact O-CB 3.43Å; K1086-K1090 PolarHBondContact O-N 2.68Å; G1088-K1090 PolarHBondContact O-N 3.24Å; K1090-A1093 PolarHBondContact O-N 3.46Å; K1090-V1094 WeakPolarHBondContact O-CG2 3.3Å; K1090-V1094 PolarHBondContact O-N 2.9Å
1091R86.9Confident83.8Confident163 Ų16358.2 Ų58.262%0.61531%0.306SS*.Hα-helixtrans-60.4-52.2175.8-173.6-175.5-61.7177.1-2111.4G1087 G1088 I1089 A1093 V1094 S1095G1087-R1091 PolarHBondContact O-N 3.16Å; G1087-R1091 VanDerWaalsContact O-N 3.14Å; G1088-R1091 PolarHBondContact O-N 3.18Å; I1089-R1091 PolarHBondContact O-N 3.47Å; R1091-A1093 VanDerWaalsContact C-N 3.32Å; R1091-A1093 PolarHBondContact O-N 2.87Å; R1091-V1094 PolarHBondContact O-N 3.26Å; R1091-S1095 PolarHBondContact O-N 3.48Å; R1091-S1095 VanDerWaalsContact O-N 3.14Å; R1091-S1095 PolarHBondContact O-OG 3.33Å
1092A88.2Confident83.3Confident0 Ų059.1 Ų59.10%031%0.31CS..Hα-helixtrans-60.5-40.6177.500000112.3V1054 L1076 G1088 I1089 V1094 S1095 V1096V1054-A1092 HydrophobicContact CG1-CB 4.07Å; L1076-A1092 HydrophobicContact CD1-CB 3.95Å; L1076-A1092 HydrophobicContact CD2-CB 3.97Å; G1088-A1092 PolarHBondContact O-N 2.99Å; I1089-A1092 PolarHBondContact O-N 2.91Å; A1092-V1094 VanDerWaalsContact C-N 3.35Å; A1092-V1094 PolarHBondContact O-N 3.08Å; A1092-S1095 PolarHBondContact O-N 3.23Å; A1092-V1096 WeakPolarHBondContact O-CG2 3.38Å; A1092-V1096 PolarHBondContact O-N 2.86Å
1093A88.5Confident82.9Confident0 Ų058.7 Ų58.70%031%0.305CS..Hα-helixtrans-61.3-40.5176.100000112.5I1089 K1090 R1091 V1096 Q1097 L1125 L1128 L1129I1089-A1093 VanDerWaalsContact O-CB 3.3Å; I1089-A1093 WeakPolarHBondContact O-CB 3.49Å; I1089-A1093 PolarHBondContact O-N 3.5Å; K1090-A1093 PolarHBondContact O-N 3.46Å; R1091-A1093 VanDerWaalsContact C-N 3.32Å; R1091-A1093 PolarHBondContact O-N 2.87Å; A1093-V1096 PolarHBondContact O-N 3.27Å; A1093-Q1097 WeakPolarHBondContact O-CB 3.43Å; A1093-Q1097 PolarHBondContact O-N 2.91Å; A1093-L1125 HydrophobicContact CB-CD1 4.01Å; A1093-L1125 WeakPolarHBondContact O-CD1 3.35Å; A1093-L1128 HydrophobicContact CB-CB 4.18Å; A1093-L1129 HydrophobicContact CB-CD2 3.9Å; A1093-L1129 HydrophobicContact CB-CG 4.37Å
1094V87.9Confident82.3Confident57 Ų5758.6 Ų58.635%0.34530%0.3SS..Hα-helixtrans-63.6-41.1174.9171.40000111.3K1090 R1091 A1092 Q1097 Q1098 L1129K1090-V1094 WeakPolarHBondContact O-CG2 3.3Å; K1090-V1094 PolarHBondContact O-N 2.9Å; R1091-V1094 PolarHBondContact O-N 3.26Å; A1092-V1094 VanDerWaalsContact C-N 3.35Å; A1092-V1094 PolarHBondContact O-N 3.08Å; V1094-Q1097 WeakPolarHBondContact O-CB 3.48Å; V1094-Q1097 PolarHBondContact O-N 3.18Å; V1094-Q1098 PolarHBondContact O-N 3.47Å; V1094-L1129 HydrophobicContact CG2-CD2 3.79Å
1095S86.2Confident81.5Confident7 Ų755.7 Ų55.75%0.04930%0.304CS..Hα-helixtrans-64.1-41.8175.6-51.10000111.9R1091 A1092 Q1097 Q1098 H1099R1091-S1095 PolarHBondContact O-N 3.48Å; R1091-S1095 VanDerWaalsContact O-N 3.14Å; R1091-S1095 PolarHBondContact O-OG 3.33Å; A1092-S1095 PolarHBondContact O-N 3.23Å; S1095-Q1097 VanDerWaalsContact C-N 3.31Å; S1095-Q1097 PolarHBondContact O-N 3.45Å; S1095-Q1098 PolarHBondContact O-N 3.4Å; S1095-H1099 PolarHBondContact O-ND1 3.23Å
1096V87.7Confident80.2Confident0 Ų058.1 Ų58.10%032%0.32CS..Hα-helixtrans-62.2-38.9173.2175.70000111.3L1058 L1069 V1072 L1073 A1092 A1093 Q1098 H1099 L1100L1058-V1096 HydrophobicContact CD1-CG2 3.58Å; L1058-V1096 HydrophobicContact CD2-CG2 3.96Å; L1058-V1096 HydrophobicContact CG-CG2 4.45Å; L1069-V1096 HydrophobicContact CD2-CG1 4.43Å; V1072-V1096 HydrophobicContact CG1-CG2 3.79Å; L1073-V1096 HydrophobicContact CD1-CG1 4.04Å; L1073-V1096 HydrophobicContact CD2-CG1 3.95Å; L1073-V1096 HydrophobicContact CG-CG1 3.92Å; A1092-V1096 WeakPolarHBondContact O-CG2 3.38Å; A1092-V1096 PolarHBondContact O-N 2.86Å; A1093-V1096 PolarHBondContact O-N 3.27Å; V1096-Q1098 VanDerWaalsContact C-N 3.3Å; V1096-Q1098 PolarHBondContact O-N 3.41Å; V1096-H1099 PolarHBondContact O-N 3.07Å; V1096-L1100 WeakPolarHBondContact O-CB 3.5Å; V1096-L1100 PolarHBondContact O-N 3.33Å
1097Q86.8Confident78.7Confident62 Ų6253.8 Ų53.829%0.2930%0.304SS..Hα-helixtrans-56.9-44.2178.2-173.2178.128.600111.3A1093 V1094 S1095 H1099 L1100 H1101 L1125A1093-Q1097 WeakPolarHBondContact O-CB 3.43Å; A1093-Q1097 PolarHBondContact O-N 2.91Å; V1094-Q1097 WeakPolarHBondContact O-CB 3.48Å; V1094-Q1097 PolarHBondContact O-N 3.18Å; S1095-Q1097 VanDerWaalsContact C-N 3.31Å; S1095-Q1097 PolarHBondContact O-N 3.45Å; Q1097-H1099 VanDerWaalsContact C-N 3.31Å; Q1097-H1099 PolarHBondContact O-N 2.96Å; Q1097-L1100 PolarHBondContact O-N 3.03Å; Q1097-H1101 WeakPolarHBondContact CG-CE1 3.3Å; Q1097-H1101 PolarHBondContact O-N 3Å; Q1097-H1101 PolarHBondContact O-ND1 2.85Å; Q1097-L1125 HydrophobicContact CB-CD1 4.32Å; Q1097-L1125 HydrophobicContact CB-CD2 3.89Å; Q1097-L1125 HydrophobicContact CG-CD2 4.06Å
1098Q82.9Confident77.2Confident123 Ų12356.5 Ų56.558%0.57531%0.309SS*.Hα-helixtrans-60.5-39.3-179.9-68.5171.9-16.100112.6V1094 S1095 V1096V1094-Q1098 PolarHBondContact O-N 3.47Å; S1095-Q1098 PolarHBondContact O-N 3.4Å; V1096-Q1098 VanDerWaalsContact C-N 3.3Å; V1096-Q1098 PolarHBondContact O-N 3.41Å
1099H82.8Confident75.5Confident11 Ų1163.2 Ų63.25%0.05134%0.339CS..Hα-helixtrans-77.9-40.3179.2-67.376.3000112.3L1058 D1061 L1069 S1095 V1096 Q1097 H1101 Q1102L1058-H1099 PolarHBondContact O-CE1 3.42Å; L1058-H1099 PolarHBondContact O-NE2 3.45Å; D1061-H1099 IonicContact OD1-NE2 2.74Å; D1061-H1099 PolarHBondContact OD1-NE2 2.86Å; L1069-H1099 HydrophobicContact CD1-CB 3.91Å; L1069-H1099 HydrophobicContact CD2-CB 3.92Å; S1095-H1099 PolarHBondContact O-ND1 3.23Å; V1096-H1099 PolarHBondContact O-N 3.07Å; Q1097-H1099 VanDerWaalsContact C-N 3.31Å; Q1097-H1099 PolarHBondContact O-N 2.96Å; H1099-H1101 VanDerWaalsContact C-N 3.27Å; H1099-H1101 PolarHBondContact O-N 3.25Å; H1099-Q1102 WeakPolarHBondContact O-CB 3.31Å; H1099-Q1102 PolarHBondContact O-N 3.15Å; H1099-Q1102 VanDerWaalsContact O-N 3.11Å
1100L83.4Confident74Confident3 Ų364.8 Ų64.82%0.01635%0.35CS..Hα-helixtrans-64.6-31-177.8-165.667.9000112.4L1066 L1069 V1096 Q1097 Q1102 H1103 Y1118 V1122 L1125L1066-L1100 HydrophobicContact CD1-CD1 3.81Å; L1069-L1100 HydrophobicContact CD1-CD1 4.23Å; V1096-L1100 WeakPolarHBondContact O-CB 3.5Å; V1096-L1100 PolarHBondContact O-N 3.33Å; Q1097-L1100 PolarHBondContact O-N 3.03Å; L1100-Q1102 PolarHBondContact O-N 2.68Å; L1100-H1103 PolarHBondContact O-N 3.35Å; L1100-H1103 VanDerWaalsContact O-N 3.15Å; L1100-Y1118 HydrophobicContact CD1-CD2 4.1Å; L1100-Y1118 HydrophobicContact CD1-CE2 4.07Å; L1100-Y1118 HydrophobicContact CG-CD2 4.5Å; L1100-Y1118 HydrophobicContact CG-CE2 4.01Å; L1100-V1122 HydrophobicContact CD2-CG2 3.83Å; L1100-L1125 HydrophobicContact CD2-CD2 3.82Å
1101H77.6Confident72.9Confident122 Ų12269.4 Ų69.457%0.56537%0.365SS*.G310 helixtrans-63.7-27.1175.8-79.677.2000113.2Q1097 H1099 H1103 A1104Q1097-H1101 WeakPolarHBondContact CG-CE1 3.3Å; Q1097-H1101 PolarHBondContact O-N 3Å; Q1097-H1101 PolarHBondContact O-ND1 2.85Å; H1099-H1101 VanDerWaalsContact C-N 3.27Å; H1099-H1101 PolarHBondContact O-N 3.25Å; H1101-H1103 PolarHBondContact O-N 3.14Å; H1101-A1104 VanDerWaalsContact O-CB 3.29Å; H1101-A1104 WeakPolarHBondContact O-CB 3.47Å; H1101-A1104 PolarHBondContact O-N 3.3Å
1102Q74.5Confident72.1Confident137 Ų13768.7 Ų68.764%0.6437%0.368SS*.G310 helixtrans-70.7-23.7177.5-56.9179.29.400111.9H1099 L1100H1099-Q1102 WeakPolarHBondContact O-CB 3.31Å; H1099-Q1102 PolarHBondContact O-N 3.15Å; H1099-Q1102 VanDerWaalsContact O-N 3.11Å; L1100-Q1102 PolarHBondContact O-N 2.68Å
1103H71.4Confident71.2Confident44 Ų4470 Ų7020%0.20438%0.377CS..G310 helixtrans-88-4.8177.3-71.4-82.7000114D1064 L1100 H1101 G1105 C1106 Y1118D1064-H1103 PolarHBondContact O-CE1 3.04Å; D1064-H1103 PolarHBondContact O-NE2 3.04Å; L1100-H1103 PolarHBondContact O-N 3.35Å; L1100-H1103 VanDerWaalsContact O-N 3.15Å; H1101-H1103 PolarHBondContact O-N 3.14Å; H1103-G1105 VanDerWaalsContact C-N 3.25Å; H1103-G1105 PolarHBondContact O-N 3.43Å; H1103-C1106 PolarHBondContact O-N 3.06Å; H1103-Y1118 HydrophobicContact CB-CD2 4.38Å; H1103-Y1118 HydrophobicContact CB-CE2 4.17Å
1104A62.4Low70.5Confident42 Ų4274.4 Ų74.435%0.34740%0.397SS..THydrogen-bonded Turntrans-59.6-35-179.800000112.9H1101 Y1118H1101-A1104 VanDerWaalsContact O-CB 3.29Å; H1101-A1104 WeakPolarHBondContact O-CB 3.47Å; H1101-A1104 PolarHBondContact O-N 3.3Å; A1104-Y1118 WeakPolarHBondContact CA-OH 3.46Å; A1104-Y1118 WeakPolarHBondContact CB-OH 3.38Å
1105G56.4Low70Confident64 Ų6478.5 Ų78.566%0.6641%0.406SS*.THydrogen-bonded Turntrans-78.3-22.7178.800000114.8H1103H1103-G1105 VanDerWaalsContact C-N 3.25Å; H1103-G1105 PolarHBondContact O-N 3.43Å
1106C52.9Low69.7Low86 Ų8680.4 Ų80.458%0.58142%0.418SS*.G310 helixtrans-82.6-16-179.8-71.90000113.7H1103 V1108 S1110H1103-C1106 PolarHBondContact O-N 3.06Å; C1106-V1108 PolarHBondContact O-N 2.92Å; C1106-S1110 WeakPolarHBondContact O-CB 3.4Å
1107S50.7Low69.5Low23 Ų2381.1 Ų81.116%0.16142%0.421CS..G310 helixtrans-71.1-15.8-175.582.30000114.4S1110S1107-S1110 PolarHBondContact O-OG 3.27Å
1108V52.3Low69.4Low114 Ų11479.7 Ų79.769%0.69141%0.414SS*.G310 helixtrans-75.5-27.9-174.9-171.60000112.5C1106C1106-V1108 PolarHBondContact O-N 2.92Å
1109D49.2Very low69.4Low164 Ų16478.1 Ų78.188%0.87741%0.409SS*.SBendtrans-116.712.2-178.6-78.2-28.3000113.9
1110S58.1Low69.5Low34 Ų3478.4 Ų78.424%0.23841%0.412CS..SBendtrans-93.8158.5-172.971.20000113.9C1106 S1107C1106-S1110 WeakPolarHBondContact O-CB 3.4Å; S1107-S1110 PolarHBondContact O-OG 3.27Å
1111R64.1Low69.7Low202 Ų20278.4 Ų78.476%0.76241%0.412SS*.  trans-56.3145.7175.7-69.2-178.6-178.7179.20.6110.4T1113 Q1114 R1115R1111-T1113 PolarHBondContact O-N 3.01Å; R1111-Q1114 WeakPolarHBondContact O-CB 3.5Å; R1111-Q1114 PolarHBondContact O-N 3.03Å; R1111-R1115 PolarHBondContact O-N 3.32Å
1112E70.1Confident70.1Confident147 Ų14774.7 Ų74.769%0.68740%0.398SS*.Hα-helixtrans-49.3-35.8-177.3-168.4172.4-16700113.8P1017 R1115 V1116P1017-E1112 HydrophobicContact CG-CG 4.04Å; E1112-R1115 PolarHBondContact O-N 3.04Å; E1112-V1116 PolarHBondContact O-N 3.38Å; E1112-V1116 VanDerWaalsContact O-N 3.15Å
1113T68.9Low70.6Confident29 Ų2975.6 Ų75.618%0.17840%0.4CS..Hα-helixtrans-68.2-33.8175.448.50000114.4P1017 R1111 M1117P1017-T1113 HydrophobicContact CG-CG2 4.34Å; R1111-T1113 PolarHBondContact O-N 3.01Å; T1113-M1117 WeakPolarHBondContact O-CB 3.42Å; T1113-M1117 PolarHBondContact O-N 3.34Å
1114Q74.8Confident71.4Confident91 Ų9173.8 Ų73.843%0.42539%0.392SS..Hα-helixtrans-70.8-36.7175.9-69.9179.8-45.200111.2L1066 R1111 M1117 Y1118L1066-Q1114 HydrophobicContact CD2-CB 4.39Å; L1066-Q1114 WeakPolarHBondContact CD2-O 3.3Å; R1111-Q1114 WeakPolarHBondContact O-CB 3.5Å; R1111-Q1114 PolarHBondContact O-N 3.03Å; Q1114-M1117 PolarHBondContact O-N 3.04Å; Q1114-Y1118 PolarHBondContact O-N 3.26Å
1115R77.1Confident72.6Confident143 Ų14372 Ų7254%0.5438%0.377SS..Hα-helixtrans-64-46.6174.8-169.9175-178.7169.62.6111.8R1111 E1112 M1117 Y1118 D1119R1111-R1115 PolarHBondContact O-N 3.32Å; E1112-R1115 PolarHBondContact O-N 3.04Å; R1115-M1117 VanDerWaalsContact C-N 3.33Å; R1115-M1117 PolarHBondContact O-N 3.49Å; R1115-Y1118 WeakPolarHBondContact O-CB 3.16Å; R1115-Y1118 PolarHBondContact O-N 3.46Å; R1115-D1119 PolarHBondContact O-N 3.24Å
1116V80.6Confident74Confident48 Ų4872.6 Ų72.629%0.29137%0.365SS..Hα-helixtrans-65.4-35.7176.3172.70000112.3P1017 V1020 E1112 D1119 S1120P1017-V1116 HydrophobicContact CB-CB 4.21Å; P1017-V1116 HydrophobicContact CB-CG1 4.27Å; P1017-V1116 HydrophobicContact CB-CG2 3.83Å; V1020-V1116 HydrophobicContact CB-CG1 4.3Å; V1020-V1116 HydrophobicContact CG2-CG1 4.27Å; E1112-V1116 PolarHBondContact O-N 3.38Å; E1112-V1116 VanDerWaalsContact O-N 3.15Å; V1116-D1119 PolarHBondContact O-N 3.35Å; V1116-S1120 VanDerWaalsContact O-CB 3.25Å; V1116-S1120 WeakPolarHBondContact O-CB 3.23Å; V1116-S1120 PolarHBondContact O-N 3.02Å
1117M82.3Confident75.5Confident14 Ų1470.6 Ų70.67%0.06936%0.355CS..Hα-helixtrans-64.8-39.9173.7-170.2-180-58.500112.4L1011 L1066 A1070 T1113 Q1114 R1115 S1121L1011-M1117 HydrophobicContact CB-CE 3.95Å; L1011-M1117 HydrophobicContact CB-SD 4.49Å; L1011-M1117 HydrophobicContact CD2-CE 4.39Å; L1066-M1117 HydrophobicContact CG-SD 4.42Å; A1070-M1117 HydrophobicContact CB-CG 3.86Å; A1070-M1117 HydrophobicContact CB-SD 4.08Å; T1113-M1117 WeakPolarHBondContact O-CB 3.42Å; T1113-M1117 PolarHBondContact O-N 3.34Å; Q1114-M1117 PolarHBondContact O-N 3.04Å; R1115-M1117 VanDerWaalsContact C-N 3.33Å; R1115-M1117 PolarHBondContact O-N 3.49Å; M1117-S1121 VanDerWaalsContact O-CB 3.27Å; M1117-S1121 WeakPolarHBondContact O-CB 3.29Å; M1117-S1121 PolarHBondContact O-N 3.12Å; M1117-S1121 PolarHBondContact O-OG 2.8Å
1118Y84.9Confident77.3Confident33 Ų3369.6 Ų69.613%0.12935%0.348CS..Hα-helixtrans-63.6-50174.3-178-93.9000111.4L1066 L1100 H1103 A1104 Q1114 R1115 S1120 S1121 V1122L1066-Y1118 HydrophobicContact CD1-CD2 3.88Å; L1100-Y1118 HydrophobicContact CD1-CD2 4.1Å; L1100-Y1118 HydrophobicContact CD1-CE2 4.07Å; L1100-Y1118 HydrophobicContact CG-CD2 4.5Å; L1100-Y1118 HydrophobicContact CG-CE2 4.01Å; H1103-Y1118 HydrophobicContact CB-CD2 4.38Å; H1103-Y1118 HydrophobicContact CB-CE2 4.17Å; A1104-Y1118 WeakPolarHBondContact CA-OH 3.46Å; A1104-Y1118 WeakPolarHBondContact CB-OH 3.38Å; Q1114-Y1118 PolarHBondContact O-N 3.26Å; R1115-Y1118 WeakPolarHBondContact O-CB 3.16Å; R1115-Y1118 PolarHBondContact O-N 3.46Å; Y1118-S1120 VanDerWaalsContact C-N 3.34Å; Y1118-S1120 PolarHBondContact O-N 3.1Å; Y1118-S1121 WeakPolarHBondContact O-CB 3.47Å; Y1118-S1121 PolarHBondContact O-N 3.19Å; Y1118-S1121 VanDerWaalsContact O-N 3.13Å; Y1118-V1122 HydrophobicContact CD1-CG2 4.14Å; Y1118-V1122 HydrophobicContact CE1-CG2 3.74Å; Y1118-V1122 HydrophobicContact CE2-CG2 4.44Å; Y1118-V1122 WeakPolarHBondContact O-CG2 3.4Å; Y1118-V1122 PolarHBondContact O-N 3.46Å
1119D82.9Confident78.9Confident89 Ų8965.7 Ų65.748%0.47632%0.322SS..Hα-helixtrans-62.4-41-179.7-70-21.9000112.1R1115 V1116 V1122 K1123R1115-D1119 PolarHBondContact O-N 3.24Å; V1116-D1119 PolarHBondContact O-N 3.35Å; D1119-V1122 PolarHBondContact O-N 3.12Å; D1119-K1123 WeakPolarHBondContact O-CB 3.42Å; D1119-K1123 PolarHBondContact O-N 3.07Å
1120S85Confident80.4Confident18 Ų1865.8 Ų65.813%0.12632%0.317CS..Hα-helixtrans-63.5-40.7174-174.40000112.2V1116 Y1118 K1123 T1124V1116-S1120 VanDerWaalsContact O-CB 3.25Å; V1116-S1120 WeakPolarHBondContact O-CB 3.23Å; V1116-S1120 PolarHBondContact O-N 3.02Å; Y1118-S1120 VanDerWaalsContact C-N 3.34Å; Y1118-S1120 PolarHBondContact O-N 3.1Å; S1120-K1123 PolarHBondContact O-N 3.42Å; S1120-T1124 WeakPolarHBondContact O-CB 3.19Å; S1120-T1124 PolarHBondContact O-N 2.93Å; S1120-T1124 PolarHBondContact O-OG1 2.88Å
1121S86.9Confident81Confident2 Ų267 Ų671%0.01432%0.319CS..Hα-helixtrans-64.1-45.1176.4-63.90000111.6A1070 L1073 M1117 Y1118 K1123 T1124 L1125A1070-S1121 WeakPolarHBondContact CB-OG 3.23Å; L1073-S1121 WeakPolarHBondContact CD1-O 3.5Å; M1117-S1121 VanDerWaalsContact O-CB 3.27Å; M1117-S1121 WeakPolarHBondContact O-CB 3.29Å; M1117-S1121 PolarHBondContact O-N 3.12Å; M1117-S1121 PolarHBondContact O-OG 2.8Å; Y1118-S1121 WeakPolarHBondContact O-CB 3.47Å; Y1118-S1121 PolarHBondContact O-N 3.19Å; Y1118-S1121 VanDerWaalsContact O-N 3.13Å; S1121-K1123 PolarHBondContact O-N 2.86Å; S1121-T1124 PolarHBondContact O-N 2.74Å; S1121-L1125 WeakPolarHBondContact O-CB 3.43Å; S1121-L1125 PolarHBondContact O-N 2.68Å
1122V86.6Confident81.9Confident44 Ų4460.3 Ų60.327%0.26730%0.296SS..Hα-helixtrans-61.7-43.8176172.40000111.1L1100 Y1118 D1119 T1124 L1125 N1126L1100-V1122 HydrophobicContact CD2-CG2 3.83Å; Y1118-V1122 HydrophobicContact CD1-CG2 4.14Å; Y1118-V1122 HydrophobicContact CE1-CG2 3.74Å; Y1118-V1122 HydrophobicContact CE2-CG2 4.44Å; Y1118-V1122 WeakPolarHBondContact O-CG2 3.4Å; Y1118-V1122 PolarHBondContact O-N 3.46Å; D1119-V1122 PolarHBondContact O-N 3.12Å; V1122-T1124 PolarHBondContact O-N 3.05Å; V1122-L1125 PolarHBondContact O-N 2.92Å; V1122-N1126 PolarHBondContact O-N 3.2Å; V1122-N1126 PolarHBondContact O-ND2 3Å
1123K86.2Confident82.5Confident156 Ų15655.7 Ų55.768%0.67828%0.276SS*.Hα-helixtrans-62-44.4177.2-172.5177.9179.7-1790112D1119 S1120 S1121 A1127D1119-K1123 WeakPolarHBondContact O-CB 3.42Å; D1119-K1123 PolarHBondContact O-N 3.07Å; S1120-K1123 PolarHBondContact O-N 3.42Å; S1121-K1123 PolarHBondContact O-N 2.86Å; K1123-A1127 PolarHBondContact O-N 3.34Å; K1123-A1127 VanDerWaalsContact O-N 3.13Å
1124T86.3Confident83.2Confident7 Ų757.2 Ų57.24%0.04328%0.281CS..Hα-helixtrans-65.5-44.1178-54.60000111.4I1022 L1073 A1077 S1120 S1121 V1122 A1127 L1128I1022-T1124 WeakPolarHBondContact CD1-OG1 3.34Å; I1022-T1124 WeakPolarHBondContact CG1-OG1 3.46Å; I1022-T1124 HydrophobicContact CG2-CG2 4.25Å; L1073-T1124 HydrophobicContact CB-CG2 4.2Å; A1077-T1124 HydrophobicContact CB-CG2 4.04Å; S1120-T1124 WeakPolarHBondContact O-CB 3.19Å; S1120-T1124 PolarHBondContact O-N 2.93Å; S1120-T1124 PolarHBondContact O-OG1 2.88Å; S1121-T1124 PolarHBondContact O-N 2.74Å; V1122-T1124 PolarHBondContact O-N 3.05Å; T1124-A1127 PolarHBondContact O-N 3.03Å; T1124-L1128 HydrophobicContact CG2-CD1 4.03Å; T1124-L1128 WeakPolarHBondContact O-CG 3.45Å; T1124-L1128 PolarHBondContact O-N 2.9Å
1125L88.3Confident83.7Confident5 Ų555.2 Ų55.23%0.02627%0.273CS..Hα-helixtrans-59.2-48.2177.4175.863.4000111.6L1073 A1093 Q1097 L1100 S1121 V1122 A1127 L1128 L1129L1073-L1125 HydrophobicContact CD1-CB 4.44Å; L1073-L1125 HydrophobicContact CD2-CB 3.98Å; L1073-L1125 HydrophobicContact CD2-CD1 4.06Å; A1093-L1125 HydrophobicContact CB-CD1 4.01Å; A1093-L1125 WeakPolarHBondContact O-CD1 3.35Å; Q1097-L1125 HydrophobicContact CB-CD1 4.32Å; Q1097-L1125 HydrophobicContact CB-CD2 3.89Å; Q1097-L1125 HydrophobicContact CG-CD2 4.06Å; L1100-L1125 HydrophobicContact CD2-CD2 3.82Å; S1121-L1125 WeakPolarHBondContact O-CB 3.43Å; S1121-L1125 PolarHBondContact O-N 2.68Å; V1122-L1125 PolarHBondContact O-N 2.92Å; L1125-A1127 VanDerWaalsContact C-N 3.31Å; L1125-A1127 PolarHBondContact O-N 2.93Å; L1125-L1128 PolarHBondContact O-N 3.15Å; L1125-L1128 VanDerWaalsContact O-N 3.07Å; L1125-L1129 HydrophobicContact CD1-CD1 4.2Å; L1125-L1129 HydrophobicContact CD1-CG 4.26Å; L1125-L1129 HydrophobicContact CG-CD1 4.12Å; L1125-L1129 WeakPolarHBondContact O-CG 3.45Å; L1125-L1129 PolarHBondContact O-N 3.13Å
1126N86.6Confident84.1Confident75 Ų7549.7 Ų49.740%0.40126%0.256SS..Hα-helixtrans-59.6-43.1176.4-72.7-26.8000111.3V1122 L1128 L1129 H1130V1122-N1126 PolarHBondContact O-N 3.2Å; V1122-N1126 PolarHBondContact O-ND2 3Å; N1126-L1128 VanDerWaalsContact C-N 3.26Å; N1126-L1128 PolarHBondContact O-N 2.98Å; N1126-L1129 PolarHBondContact O-N 2.88Å; N1126-H1130 PolarHBondContact O-CD2 3.17Å; N1126-H1130 PolarHBondContact O-N 3.29Å; N1126-H1130 VanDerWaalsContact O-N 3.16Å
1127A84.9Confident84.4Confident45 Ų4549.8 Ų49.837%0.37225%0.254SS..Hα-helixtrans-64.1-28.2176.400000113.5K1080 K1123 T1124 L1125K1080-A1127 PolarHBondContact NZ-O 2.89Å; K1123-A1127 PolarHBondContact O-N 3.34Å; K1123-A1127 VanDerWaalsContact O-N 3.13Å; T1124-A1127 PolarHBondContact O-N 3.03Å; L1125-A1127 VanDerWaalsContact C-N 3.31Å; L1125-A1127 PolarHBondContact O-N 2.93Å
1128L87.1Confident84.5Confident2 Ų252.4 Ų52.41%0.0127%0.267CS..Hα-helixtrans-80.7-35.1175.9-72.7164.5000112.4L1073 L1076 K1080 I1089 A1093 T1124 L1125 N1126 H1130 F1131L1073-L1128 HydrophobicContact CD2-CD1 3.85Å; L1076-L1128 HydrophobicContact CB-CD1 3.7Å; L1076-L1128 HydrophobicContact CB-CD2 4.18Å; L1076-L1128 HydrophobicContact CD1-CD1 4.38Å; K1080-L1128 HydrophobicContact CB-CD2 3.94Å; K1080-L1128 HydrophobicContact CD-CD2 3.8Å; K1080-L1128 HydrophobicContact CG-CD2 4.34Å; I1089-L1128 HydrophobicContact CG2-CD2 3.69Å; A1093-L1128 HydrophobicContact CB-CB 4.18Å; T1124-L1128 HydrophobicContact CG2-CD1 4.03Å; T1124-L1128 WeakPolarHBondContact O-CG 3.45Å; T1124-L1128 PolarHBondContact O-N 2.9Å; L1125-L1128 PolarHBondContact O-N 3.15Å; L1125-L1128 VanDerWaalsContact O-N 3.07Å; N1126-L1128 VanDerWaalsContact C-N 3.26Å; N1126-L1128 PolarHBondContact O-N 2.98Å; L1128-H1130 VanDerWaalsContact C-N 3.29Å; L1128-H1130 PolarHBondContact O-N 2.95Å; L1128-F1131 WeakPolarHBondContact O-CB 3.38Å; L1128-F1131 PolarHBondContact O-N 3.12Å
1129L85.6Confident84.5Confident31 Ų3153.8 Ų53.816%0.16228%0.277CS..Hα-helixtrans-69.8-26.9176.3-69.7172.5000112.8A1093 V1094 L1125 N1126A1093-L1129 HydrophobicContact CB-CD2 3.9Å; A1093-L1129 HydrophobicContact CB-CG 4.37Å; V1094-L1129 HydrophobicContact CG2-CD2 3.79Å; L1125-L1129 HydrophobicContact CD1-CD1 4.2Å; L1125-L1129 HydrophobicContact CD1-CG 4.26Å; L1125-L1129 HydrophobicContact CG-CD1 4.12Å; L1125-L1129 WeakPolarHBondContact O-CG 3.45Å; L1125-L1129 PolarHBondContact O-N 3.13Å; N1126-L1129 PolarHBondContact O-N 2.88Å
1130H82Confident84.6Confident166 Ų16650.9 Ų50.977%0.76926%0.261SS*.THydrogen-bonded Turntrans-87.9-2.8175-70.2-59.6000114.7N1126 L1128N1126-H1130 PolarHBondContact O-CD2 3.17Å; N1126-H1130 PolarHBondContact O-N 3.29Å; N1126-H1130 VanDerWaalsContact O-N 3.16Å; L1128-H1130 VanDerWaalsContact C-N 3.29Å; L1128-H1130 PolarHBondContact O-N 2.95Å
1131F70.3Confident84.6Confident60 Ų6053.9 Ų53.926%0.26327%0.273SS..  trans-81.20176.3179.7-116.1000112.6K1080 K1086 I1089 L1128K1080-F1131 HydrophobicContact CB-CE1 4.39Å; K1080-F1131 HydrophobicContact CD-CB 4.22Å; K1080-F1131 HydrophobicContact CD-CD1 4.47Å; K1080-F1131 HydrophobicContact CD-CD2 4.04Å; K1080-F1131 HydrophobicContact CD-CE2 4.49Å; K1080-F1131 HydrophobicContact CD-CG 4Å; K1080-F1131 VanDerWaalsContact CE-CD2 3.4Å; K1080-F1131 HydrophobicContact CG-CB 4.48Å; K1080-F1131 HydrophobicContact CG-CD1 3.86Å; K1080-F1131 HydrophobicContact CG-CD2 3.69Å; K1080-F1131 HydrophobicContact CG-CE1 3.86Å; K1080-F1131 HydrophobicContact CG-CE2 3.68Å; K1080-F1131 HydrophobicContact CG-CG 3.75Å; K1080-F1131 HydrophobicContact CG-CZ 3.76Å; K1080-F1131 WeakPolarHBondContact O-CZ 3.33Å; K1086-F1131 HydrophobicContact CB-CE1 4.41Å; K1086-F1131 HydrophobicContact CG-CD1 4.2Å; K1086-F1131 HydrophobicContact CG-CE1 3.7Å; K1086-F1131 HydrophobicContact CG-CZ 4.13Å; K1086-F1131 PolarHBondContact NZ-O 3.06Å; I1089-F1131 HydrophobicContact CD1-CD1 4.33Å; I1089-F1131 HydrophobicContact CD1-CE1 3.84Å; L1128-F1131 WeakPolarHBondContact O-CB 3.38Å; L1128-F1131 PolarHBondContact O-N 3.12Å

Retrieved 1,131 of 1,131 residues in 741.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).