A0A087YKQ0_POEFO Loading...

Fignl1 interacting regulator of recombination and mitosis

AlphaFold DB , UniProt , Accession A0A087YKQ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 921 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
1M52.6Low66.5Low108 Ų10879 Ų7953%0.53242%0.421SS..  0143.70-68.2-151.5-157.300109.7N5 L9 D43 I47M1-N5 HydrophobicContact CB-CB 4.37Å; M1-N5 HydrophobicContact SD-CB 4.26Å; M1-L9 HydrophobicContact CE-CD1 3.96Å; M1-L9 HydrophobicContact SD-CD1 3.94Å; M1-D43 HydrophobicContact CE-CB 3.48Å; M1-D43 VanDerWaalsContact CE-CB 3.48Å; M1-I47 HydrophobicContact CE-CD1 3.78Å; M1-I47 HydrophobicContact CE-CG1 4.46Å
2S50.8Low68Low56 Ų5672.4 Ų72.439%0.39239%0.386SS..  trans-75.3155.8168.7550000110.8T4 N5 T6S2-T4 PolarHBondContact O-N 2.62Å; S2-T4 VanDerWaalsContact O-N 3.15Å; S2-N5 WeakPolarHBondContact O-CB 3.47Å; S2-N5 PolarHBondContact O-N 3.04Å; S2-N5 PolarHBondContact OG-ND2 3.32Å; S2-N5 VanDerWaalsContact OG-ND2 3.16Å; S2-N5 PolarHBondContact OG-OD1 3.32Å; S2-T6 PolarHBondContact O-N 3.02Å; S2-T6 PolarHBondContact O-OG1 3.25Å
3Q52.6Low69.2Low184 Ų18472.5 Ų72.586%0.8639%0.391SS*.Hα-helixtrans-54.4-31.7178.9-89178.1-22.600113.8N5 T6 S7Q3-N5 VanDerWaalsContact C-N 3.35Å; Q3-T6 PolarHBondContact O-OG1 3.08Å; Q3-S7 PolarHBondContact O-N 2.93Å
4T58Low70.3Confident101 Ų10179 Ų7962%0.6242%0.417SS*.Hα-helixtrans-70-26.6176.611.20000113.8S2 S7S2-T4 PolarHBondContact O-N 2.62Å; S2-T4 VanDerWaalsContact O-N 3.15Å; T4-S7 PolarHBondContact O-OG 3.26Å
5N63.4Low71.5Confident43 Ų4377 Ų7723%0.2340%0.402CS..Hα-helixtrans-79.3-33.7178.9-65.2-7.9000111M1 S2 Q3 L9 L34M1-N5 HydrophobicContact CB-CB 4.37Å; M1-N5 HydrophobicContact SD-CB 4.26Å; S2-N5 WeakPolarHBondContact O-CB 3.47Å; S2-N5 PolarHBondContact O-N 3.04Å; S2-N5 PolarHBondContact OG-ND2 3.32Å; S2-N5 VanDerWaalsContact OG-ND2 3.16Å; S2-N5 PolarHBondContact OG-OD1 3.32Å; Q3-N5 VanDerWaalsContact C-N 3.35Å; N5-L9 WeakPolarHBondContact O-CG 3.26Å; N5-L9 PolarHBondContact O-N 3.16Å; N5-L34 HydrophobicContact CB-CD2 3.89Å; N5-L34 VanDerWaalsContact CG-CD2 3.47Å; N5-L34 WeakPolarHBondContact ND2-CD2 3.3Å
6T64.4Low72.4Confident50 Ų5076.1 Ų76.131%0.30740%0.404SS..Hα-helixtrans-70.2-38176.3-3.80000112.2S2 Q3 L8 L9 E10S2-T6 PolarHBondContact O-N 3.02Å; S2-T6 PolarHBondContact O-OG1 3.25Å; Q3-T6 PolarHBondContact O-OG1 3.08Å; T6-L8 PolarHBondContact O-N 2.93Å; T6-L9 PolarHBondContact O-N 3Å; T6-E10 PolarHBondContact O-N 3.49Å
7S69.8Low73.2Confident62 Ų6280.4 Ų80.443%0.43442%0.421SS..Hα-helixtrans-63.9-40.2176.8650000112.2Q3 T4 L9 E10 E11Q3-S7 PolarHBondContact O-N 2.93Å; T4-S7 PolarHBondContact O-OG 3.26Å; S7-L9 PolarHBondContact O-N 2.97Å; S7-E10 PolarHBondContact O-N 3.46Å; S7-E11 WeakPolarHBondContact O-CB 3.5Å; S7-E11 PolarHBondContact O-N 3.15Å
8L78.3Confident73.7Confident36 Ų3683.6 Ų83.619%0.18843%0.434CS..Hα-helixtrans-60.7-44.2176.5-173108.9000111.6T6 E10 E11 V12 L31 L34T6-L8 PolarHBondContact O-N 2.93Å; L8-E10 VanDerWaalsContact C-N 3.33Å; L8-E10 PolarHBondContact O-N 3.2Å; L8-E11 PolarHBondContact O-N 3.44Å; L8-V12 HydrophobicContact CG-CG2 4.38Å; L8-V12 WeakPolarHBondContact O-CB 3.26Å; L8-V12 WeakPolarHBondContact O-CG2 3.41Å; L8-V12 PolarHBondContact O-N 3.29Å; L8-L31 HydrophobicContact CD2-CD2 3.99Å; L8-L34 HydrophobicContact CD2-CD1 4.05Å
9L81.3Confident74.4Confident1 Ų181.7 Ų81.71%0.00543%0.426CS..Hα-helixtrans-69.1-28.5-179.8-65.1171.1000113.2M1 N5 T6 S7 V13 L31 I47 I50M1-L9 HydrophobicContact CE-CD1 3.96Å; M1-L9 HydrophobicContact SD-CD1 3.94Å; N5-L9 WeakPolarHBondContact O-CG 3.26Å; N5-L9 PolarHBondContact O-N 3.16Å; T6-L9 PolarHBondContact O-N 3Å; S7-L9 PolarHBondContact O-N 2.97Å; L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.39Å; L9-L31 HydrophobicContact CD2-CD2 3.63Å; L9-I47 HydrophobicContact CD1-CD1 4.46Å; L9-I47 HydrophobicContact CD1-CG1 3.95Å; L9-I47 HydrophobicContact CD2-CG1 3.86Å; L9-I50 HydrophobicContact CB-CD1 4.14Å; L9-I50 HydrophobicContact CD2-CD1 3.66Å; L9-I50 HydrophobicContact CG-CD1 4.47Å
10E79.3Confident75Confident117 Ų11777.7 Ų77.755%0.54741%0.405SS..Hα-helixtrans-78.9-36.4175.7-72.1178-178.100112.2T6 S7 L8 R46T6-E10 PolarHBondContact O-N 3.49Å; S7-E10 PolarHBondContact O-N 3.46Å; L8-E10 VanDerWaalsContact C-N 3.33Å; L8-E10 PolarHBondContact O-N 3.2Å; E10-R46 VanDerWaalsContact CG-NH2 3.26Å
11E81.4Confident75.5Confident111 Ų11182.1 Ų82.152%0.51942%0.417SS..Hα-helixtrans-66.3-48.5177.1-163.4-172.2159.700111.4S7 L8 V13 Q14 W15S7-E11 WeakPolarHBondContact O-CB 3.5Å; S7-E11 PolarHBondContact O-N 3.15Å; L8-E11 PolarHBondContact O-N 3.44Å; E11-V13 VanDerWaalsContact C-N 3.3Å; E11-V13 PolarHBondContact O-N 3.37Å; E11-Q14 PolarHBondContact O-N 3.15Å; E11-W15 HydrophobicContact CG-CZ2 4.48Å; E11-W15 PolarHBondContact O-NE1 3.08Å
12V84.4Confident77.1Confident0 Ų084.1 Ų84.10%043%0.425CS..Hα-helixtrans-62.5-33.1-175.7167.70000113.2L8 Q14 W15 V27 I50 F55L8-V12 HydrophobicContact CG-CG2 4.38Å; L8-V12 WeakPolarHBondContact O-CB 3.26Å; L8-V12 WeakPolarHBondContact O-CG2 3.41Å; L8-V12 PolarHBondContact O-N 3.29Å; V12-Q14 PolarHBondContact O-N 3.41Å; V12-W15 HydrophobicContact CB-CD2 4.45Å; V12-W15 HydrophobicContact CB-CE3 4.49Å; V12-W15 HydrophobicContact CG1-CE3 4.42Å; V12-W15 HydrophobicContact CG2-CD2 4.25Å; V12-W15 HydrophobicContact CG2-CE3 4.11Å; V12-W15 HydrophobicContact CG2-CH2 3.87Å; V12-W15 HydrophobicContact CG2-CZ2 3.97Å; V12-W15 HydrophobicContact CG2-CZ3 3.93Å; V12-W15 WeakPolarHBondContact O-CB 3.47Å; V12-W15 PolarHBondContact O-N 3.29Å; V12-V27 HydrophobicContact CG2-CG1 4.24Å; V12-I50 HydrophobicContact CG1-CG2 3.54Å; V12-F55 HydrophobicContact CG1-CE2 3.41Å; V12-F55 VanDerWaalsContact CG1-CE2 3.41Å; V12-F55 HydrophobicContact CG1-CZ 3.62Å
13V83.4Confident78.9Confident74 Ų7485.3 Ų85.345%0.44842%0.424SS..THydrogen-bonded Turntrans-67.5-21.4178.4172.40000112L9 E11 I50L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.39Å; E11-V13 VanDerWaalsContact C-N 3.3Å; E11-V13 PolarHBondContact O-N 3.37Å; V13-I50 HydrophobicContact CG2-CD1 3.77Å; V13-I50 HydrophobicContact CG2-CG1 3.76Å
14Q84.6Confident80.6Confident163 Ų16377.1 Ų77.176%0.76239%0.386SS*.THydrogen-bonded Turntrans-92.1-0178.5-62.2-68.7-27.400113E11 V12E11-Q14 PolarHBondContact O-N 3.15Å; V12-Q14 PolarHBondContact O-N 3.41Å
15W88.1Confident81.9Confident49 Ų4979.2 Ų79.219%0.18639%0.387CS..  trans-75.1150.2-175.7-72.12.9000112.8E11 V12 T19 E23 V27 M54 F55E11-W15 HydrophobicContact CG-CZ2 4.48Å; E11-W15 PolarHBondContact O-NE1 3.08Å; V12-W15 HydrophobicContact CB-CD2 4.45Å; V12-W15 HydrophobicContact CB-CE3 4.49Å; V12-W15 HydrophobicContact CG1-CE3 4.42Å; V12-W15 HydrophobicContact CG2-CD2 4.25Å; V12-W15 HydrophobicContact CG2-CE3 4.11Å; V12-W15 HydrophobicContact CG2-CH2 3.87Å; V12-W15 HydrophobicContact CG2-CZ2 3.97Å; V12-W15 HydrophobicContact CG2-CZ3 3.93Å; V12-W15 WeakPolarHBondContact O-CB 3.47Å; V12-W15 PolarHBondContact O-N 3.29Å; W15-T19 HydrophobicContact CB-CG2 4.25Å; W15-T19 HydrophobicContact CD2-CG2 3.89Å; W15-T19 HydrophobicContact CE3-CG2 4.12Å; W15-T19 HydrophobicContact CG-CG2 3.96Å; W15-E23 HydrophobicContact CH2-CB 4.1Å; W15-E23 HydrophobicContact CH2-CG 4.17Å; W15-E23 HydrophobicContact CZ3-CB 3.66Å; W15-E23 HydrophobicContact CZ3-CG 4.1Å; W15-V27 HydrophobicContact CH2-CG2 3.76Å; W15-V27 HydrophobicContact CZ3-CG2 3.9Å; W15-M54 WeakPolarHBondContact O-CE 3.42Å; W15-F55 HydrophobicContact CE3-CZ 4.31Å; W15-F55 HydrophobicContact CZ3-CZ 4.19Å
16S86.1Confident83.1Confident62 Ų6279.6 Ų79.643%0.43439%0.393SS..  trans-79.5159.117176.90000111E18 T19 C20S16-E18 PolarHBondContact O-N 2.95Å; S16-T19 WeakPolarHBondContact O-CB 3.2Å; S16-T19 PolarHBondContact O-N 3.49Å; S16-T19 PolarHBondContact OG-N 2.7Å; S16-T19 PolarHBondContact OG-OG1 3.1Å; S16-C20 PolarHBondContact O-N 2.94Å
17Q85.9Confident84.2Confident150 Ų15077.5 Ų77.570%0.70138%0.38SS*.Hα-helixtrans-54.9-37.1175-75.8-172.5-14.400112.6T19 R21 H58Q17-T19 VanDerWaalsContact C-N 3.35Å; Q17-T19 PolarHBondContact O-N 3.25Å; Q17-R21 WeakPolarHBondContact O-CB 3.49Å; Q17-R21 PolarHBondContact O-N 3.01Å; Q17-H58 PolarHBondContact O-NE2 2.89Å
18E83.3Confident85.1Confident138 Ų13874.7 Ų74.765%0.64536%0.36SS*.Hα-helixtrans-62.9-42.5176.1-131.597.2-148.200111.6S16 R21 Q22S16-E18 PolarHBondContact O-N 2.95Å; E18-R21 PolarHBondContact O-N 3.01Å; E18-Q22 WeakPolarHBondContact O-CG 3.37Å; E18-Q22 PolarHBondContact O-N 3.01Å; E18-Q22 VanDerWaalsContact O-N 3.08Å
19T86.1Confident85.6Confident48 Ų4876.5 Ų76.529%0.29437%0.374SS..Hα-helixtrans-67.9-44.5179.8-46.90000111W15 S16 Q17 R21 Q22 E23W15-T19 HydrophobicContact CB-CG2 4.25Å; W15-T19 HydrophobicContact CD2-CG2 3.89Å; W15-T19 HydrophobicContact CE3-CG2 4.12Å; W15-T19 HydrophobicContact CG-CG2 3.96Å; S16-T19 WeakPolarHBondContact O-CB 3.2Å; S16-T19 PolarHBondContact O-N 3.49Å; S16-T19 PolarHBondContact OG-N 2.7Å; S16-T19 PolarHBondContact OG-OG1 3.1Å; Q17-T19 VanDerWaalsContact C-N 3.35Å; Q17-T19 PolarHBondContact O-N 3.25Å; T19-R21 VanDerWaalsContact C-N 3.29Å; T19-R21 PolarHBondContact O-N 2.95Å; T19-Q22 PolarHBondContact O-N 3.39Å; T19-E23 PolarHBondContact O-N 3.12Å
20C86.5Confident85.9Confident0 Ų082 Ų820%040%0.398CS..Hα-helixtrans-60.6-38.7175.8-69.30000112.2S16 L24 M54 F55S16-C20 PolarHBondContact O-N 2.94Å; C20-L24 PolarHBondContact O-N 3.24Å; C20-L24 VanDerWaalsContact O-N 3.1Å; C20-M54 WeakPolarHBondContact CB-O 3.41Å; C20-F55 HydrophobicContact CB-CD1 4.46Å; C20-F55 HydrophobicContact CB-CE1 4.33Å
21R85.9Confident86.3Confident172 Ų17276.4 Ų76.465%0.64937%0.372SS*.Hα-helixtrans-66.9-40.9176-171.9179.3-177.9-178.82.5112.7Q17 E18 T19 H58Q17-R21 WeakPolarHBondContact O-CB 3.49Å; Q17-R21 PolarHBondContact O-N 3.01Å; E18-R21 PolarHBondContact O-N 3.01Å; T19-R21 VanDerWaalsContact C-N 3.29Å; T19-R21 PolarHBondContact O-N 2.95Å; R21-H58 HydrophobicContact CB-CB 4.39Å; R21-H58 HydrophobicContact CG-CB 4.36Å
22Q86.3Confident86.6Confident149 Ų14971.7 Ų71.770%0.69635%0.35SS*.Hα-helixtrans-69.2-41.6179.7-73.7176.23.200112.3E18 T19E18-Q22 WeakPolarHBondContact O-CG 3.37Å; E18-Q22 PolarHBondContact O-N 3.01Å; E18-Q22 VanDerWaalsContact O-N 3.08Å; T19-Q22 PolarHBondContact O-N 3.39Å
23E88.6Confident86.8Confident82 Ų8274.5 Ų74.538%0.38337%0.37SS..Hα-helixtrans-89.92-176.7-68.3-61.4153.800113.8W15 T19 K25 S26 V27W15-E23 HydrophobicContact CH2-CB 4.1Å; W15-E23 HydrophobicContact CH2-CG 4.17Å; W15-E23 HydrophobicContact CZ3-CB 3.66Å; W15-E23 HydrophobicContact CZ3-CG 4.1Å; T19-E23 PolarHBondContact O-N 3.12Å; E23-K25 PolarHBondContact O-N 2.89Å; E23-S26 PolarHBondContact O-N 3.23Å; E23-S26 PolarHBondContact O-OG 2.94Å; E23-S26 VanDerWaalsContact O-OG 3.08Å; E23-S26 PolarHBondContact OE2-OG 3.05Å; E23-V27 HydrophobicContact CB-CG2 3.99Å; E23-V27 WeakPolarHBondContact O-CB 3.09Å; E23-V27 PolarHBondContact O-N 3.11Å
24L87.4Confident87Confident11 Ų1171.8 Ų71.86%0.05835%0.353CS..Hα-helixtrans-48.4-52.8-176.5-179.567.7000112.4C20 S26 L28 F55 H58 I59C20-L24 PolarHBondContact O-N 3.24Å; C20-L24 VanDerWaalsContact O-N 3.1Å; L24-S26 VanDerWaalsContact C-N 3.28Å; L24-S26 PolarHBondContact O-N 3.36Å; L24-L28 HydrophobicContact CD1-CB 4.26Å; L24-L28 HydrophobicContact CD1-CD2 4.2Å; L24-L28 WeakPolarHBondContact O-CB 3.25Å; L24-L28 PolarHBondContact O-N 2.68Å; L24-F55 HydrophobicContact CD1-CB 3.83Å; L24-F55 HydrophobicContact CD1-CD1 3.72Å; L24-F55 HydrophobicContact CD1-CG 4.24Å; L24-H58 HydrophobicContact CD2-CB 4.3Å; L24-I59 HydrophobicContact CD1-CD1 4.4Å; L24-I59 HydrophobicContact CD1-CG1 3.95Å; L24-I59 HydrophobicContact CD2-CG1 4.12Å
25K86.4Confident87.2Confident146 Ų14664 Ų6464%0.63532%0.316SS*.Hα-helixtrans-68.3-25-176.6-64.2-165.3175.2-161.40113.5E23 P29E23-K25 PolarHBondContact O-N 2.89Å; K25-P29 WeakPolarHBondContact O-CD 3.48Å
26S86.8Confident87.1Confident51 Ų5169.7 Ų69.736%0.35734%0.339SS..Hα-helixtrans-90.7-32.4-177.283.90000112.2E23 L24 K30E23-S26 PolarHBondContact O-N 3.23Å; E23-S26 PolarHBondContact O-OG 2.94Å; E23-S26 VanDerWaalsContact O-OG 3.08Å; E23-S26 PolarHBondContact OE2-OG 3.05Å; L24-S26 VanDerWaalsContact C-N 3.28Å; L24-S26 PolarHBondContact O-N 3.36Å; S26-K30 WeakPolarHBondContact O-CE 3.43Å
27V88.7Confident87Confident5 Ų572.9 Ų72.93%0.0335%0.347CS..Hα-helixtrans-101.6-37.4-171.9177.70000112.9V12 W15 E23 K30 L31 F55V12-V27 HydrophobicContact CG2-CG1 4.24Å; W15-V27 HydrophobicContact CH2-CG2 3.76Å; W15-V27 HydrophobicContact CZ3-CG2 3.9Å; E23-V27 HydrophobicContact CB-CG2 3.99Å; E23-V27 WeakPolarHBondContact O-CB 3.09Å; E23-V27 PolarHBondContact O-N 3.11Å; V27-K30 WeakPolarHBondContact O-CB 3.2Å; V27-K30 PolarHBondContact O-N 3.3Å; V27-L31 HydrophobicContact CG1-CD1 3.72Å; V27-L31 HydrophobicContact CG1-CG 3.84Å; V27-L31 PolarHBondContact O-N 2.95Å; V27-F55 HydrophobicContact CB-CE1 4.21Å; V27-F55 HydrophobicContact CB-CZ 4.22Å; V27-F55 HydrophobicContact CG1-CE1 4.17Å; V27-F55 HydrophobicContact CG1-CE2 4.39Å; V27-F55 HydrophobicContact CG1-CZ 3.68Å
28L88.3Confident87Confident4 Ų466.1 Ų66.12%0.02132%0.317CS..Hα-helixtrans-56.3-44.9-178-17870.1000112.7L24 K30 L31 T32 I51 F55 I59 E67L24-L28 HydrophobicContact CD1-CB 4.26Å; L24-L28 HydrophobicContact CD1-CD2 4.2Å; L24-L28 WeakPolarHBondContact O-CB 3.25Å; L24-L28 PolarHBondContact O-N 2.68Å; L28-K30 VanDerWaalsContact C-N 3.3Å; L28-K30 PolarHBondContact O-N 3.35Å; L28-L31 PolarHBondContact O-N 2.83Å; L28-T32 PolarHBondContact O-N 3.4Å; L28-T32 PolarHBondContact O-OG1 2.8Å; L28-I51 HydrophobicContact CD1-CG2 3.95Å; L28-F55 HydrophobicContact CD1-CB 4.29Å; L28-I59 HydrophobicContact CD2-CD1 3.68Å; L28-E67 HydrophobicContact CD2-CB 4.35Å
29P88.7Confident86.8Confident74 Ų7464.1 Ų64.148%0.48132%0.324SS..Hα-helixtrans-61.3-36176.2-23.935.4000113.5K25 T32 S33K25-P29 WeakPolarHBondContact O-CD 3.48Å; P29-T32 VanDerWaalsContact CA-OG1 3.26Å; P29-T32 WeakPolarHBondContact CA-OG1 3.09Å; P29-T32 PolarHBondContact O-N 3.48Å; P29-T32 PolarHBondContact O-OG1 3.48Å; P29-S33 PolarHBondContact O-N 3.47Å
30K88.2Confident86.6Confident116 Ų11664.8 Ų64.850%0.50433%0.328SS..Hα-helixtrans-68.1-44.1176.9-62.8175.8-174.7167.80110.5S26 V27 L28 T32 S33 L34S26-K30 WeakPolarHBondContact O-CE 3.43Å; V27-K30 WeakPolarHBondContact O-CB 3.2Å; V27-K30 PolarHBondContact O-N 3.3Å; L28-K30 VanDerWaalsContact C-N 3.3Å; L28-K30 PolarHBondContact O-N 3.35Å; K30-T32 VanDerWaalsContact C-N 3.34Å; K30-T32 PolarHBondContact O-N 3.36Å; K30-S33 PolarHBondContact O-N 3Å; K30-L34 WeakPolarHBondContact O-CB 3.5Å; K30-L34 VanDerWaalsContact O-CG 3.26Å; K30-L34 WeakPolarHBondContact O-CG 3.46Å; K30-L34 PolarHBondContact O-N 3.38Å
31L87.4Confident86.5Confident0 Ų067.2 Ų67.20%034%0.337CS..Hα-helixtrans-64-37.7175.8-68.2176.3000111.9L8 L9 V27 L28 L34 H35 I47 I50 I51 F55L8-L31 HydrophobicContact CD2-CD2 3.99Å; L9-L31 HydrophobicContact CD2-CD2 3.63Å; V27-L31 HydrophobicContact CG1-CD1 3.72Å; V27-L31 HydrophobicContact CG1-CG 3.84Å; V27-L31 PolarHBondContact O-N 2.95Å; L28-L31 PolarHBondContact O-N 2.83Å; L31-L34 PolarHBondContact O-N 3.04Å; L31-H35 VanDerWaalsContact O-CB 3.3Å; L31-H35 WeakPolarHBondContact O-CB 3.43Å; L31-H35 PolarHBondContact O-N 3.45Å; L31-I47 HydrophobicContact CB-CG2 4.49Å; L31-I47 WeakPolarHBondContact O-CG2 3.41Å; L31-I50 HydrophobicContact CD1-CG2 4Å; L31-I51 HydrophobicContact CB-CD1 3.97Å; L31-I51 HydrophobicContact CB-CG1 3.88Å; L31-I51 HydrophobicContact CD1-CG1 4.18Å; L31-F55 HydrophobicContact CD1-CD2 3.68Å; L31-F55 HydrophobicContact CD1-CE2 3.29Å; L31-F55 HydrophobicContact CD1-CZ 3.92Å
32T88.1Confident86.5Confident12 Ų1263.6 Ų63.67%0.07433%0.331CS..Hα-helixtrans-66-41.1174.69.90000112.1L28 P29 K30 H35 Y36 K71 I72L28-T32 PolarHBondContact O-N 3.4Å; L28-T32 PolarHBondContact O-OG1 2.8Å; P29-T32 VanDerWaalsContact CA-OG1 3.26Å; P29-T32 WeakPolarHBondContact CA-OG1 3.09Å; P29-T32 PolarHBondContact O-N 3.48Å; P29-T32 PolarHBondContact O-OG1 3.48Å; K30-T32 VanDerWaalsContact C-N 3.34Å; K30-T32 PolarHBondContact O-N 3.36Å; T32-H35 PolarHBondContact O-N 3.43Å; T32-Y36 WeakPolarHBondContact O-CB 3.47Å; T32-Y36 PolarHBondContact O-N 3.45Å; T32-K71 HydrophobicContact CG2-CB 3.48Å; T32-K71 VanDerWaalsContact CG2-CB 3.48Å; T32-K71 HydrophobicContact CG2-CD 4.11Å; T32-K71 HydrophobicContact CG2-CG 4.44Å; T32-I72 HydrophobicContact CG2-CG2 3.37Å
33S87.9Confident86.4Confident58 Ų5858.9 Ų58.941%0.40631%0.31SS..Hα-helixtrans-61.3-46.2173.4-161.50000111.5P29 K30 H35 Y36 E37P29-S33 PolarHBondContact O-N 3.47Å; K30-S33 PolarHBondContact O-N 3Å; S33-H35 VanDerWaalsContact C-N 3.33Å; S33-H35 PolarHBondContact O-N 3.5Å; S33-Y36 PolarHBondContact O-N 3.32Å; S33-E37 WeakPolarHBondContact O-CB 3.46Å; S33-E37 WeakPolarHBondContact O-CG 3.45Å; S33-E37 PolarHBondContact O-N 3.34Å; S33-E37 PolarHBondContact OG-OE1 3.15Å
34L87.6Confident86.4Confident17 Ų1755 Ų559%0.08929%0.292CS..Hα-helixtrans-62.7-39.7177.1-69.9173.4000112.1N5 L8 K30 L31 Y36 E37 A38 I47N5-L34 HydrophobicContact CB-CD2 3.89Å; N5-L34 VanDerWaalsContact CG-CD2 3.47Å; N5-L34 WeakPolarHBondContact ND2-CD2 3.3Å; L8-L34 HydrophobicContact CD2-CD1 4.05Å; K30-L34 WeakPolarHBondContact O-CB 3.5Å; K30-L34 VanDerWaalsContact O-CG 3.26Å; K30-L34 WeakPolarHBondContact O-CG 3.46Å; K30-L34 PolarHBondContact O-N 3.38Å; L31-L34 PolarHBondContact O-N 3.04Å; L34-Y36 VanDerWaalsContact C-N 3.33Å; L34-E37 PolarHBondContact O-N 3.09Å; L34-A38 PolarHBondContact O-N 3.18Å; L34-I47 HydrophobicContact CB-CD1 3.92Å
35H87.9Confident86.5Confident0 Ų054.8 Ų54.80%029%0.291CS..Hα-helixtrans-62.8-42175.2-176.9-103.7000111.1L31 T32 S33 A38 C44 I47 I51 I72 K75L31-H35 VanDerWaalsContact O-CB 3.3Å; L31-H35 WeakPolarHBondContact O-CB 3.43Å; L31-H35 PolarHBondContact O-N 3.45Å; T32-H35 PolarHBondContact O-N 3.43Å; S33-H35 VanDerWaalsContact C-N 3.33Å; S33-H35 PolarHBondContact O-N 3.5Å; H35-A38 WeakPolarHBondContact O-CB 3.13Å; H35-A38 PolarHBondContact O-N 3.49Å; H35-C44 PolarHBondContact CD2-O 3.11Å; H35-C44 VanDerWaalsContact CD2-SG 3.55Å; H35-C44 PolarHBondContact NE2-SG 3.17Å; H35-I47 HydrophobicContact CB-CG2 3.79Å; H35-I51 HydrophobicContact CB-CD1 4.37Å; H35-I72 PolarHBondContact CE1-O 2.95Å; H35-I72 VanDerWaalsContact CE1-O 3.31Å; H35-K75 VanDerWaalsContact CE1-CG 3.48Å; H35-K75 WeakPolarHBondContact CE1-CG 3.48Å; H35-K75 WeakPolarHBondContact O-CE 3.37Å
36Y86.4Confident86.6Confident169 Ų16952.2 Ų52.266%0.66328%0.277SS*.Hα-helixtrans-66.2-42.3178-170.5-97.9000112.4T32 S33 L34 A38 K75T32-Y36 WeakPolarHBondContact O-CB 3.47Å; T32-Y36 PolarHBondContact O-N 3.45Å; S33-Y36 PolarHBondContact O-N 3.32Å; L34-Y36 VanDerWaalsContact C-N 3.33Å; Y36-A38 VanDerWaalsContact C-N 3.33Å; Y36-A38 PolarHBondContact O-N 3.22Å; Y36-K75 WeakPolarHBondContact O-CE 3.37Å; Y36-K75 PolarHBondContact O-NZ 2.98Å
37E85.4Confident86.8Confident128 Ų12849.8 Ų49.860%0.59826%0.26SS*.Hα-helixtrans-78.1-10.8179.7-70.3172.9-157.300114.4S33 L34 A39S33-E37 WeakPolarHBondContact O-CB 3.46Å; S33-E37 WeakPolarHBondContact O-CG 3.45Å; S33-E37 PolarHBondContact O-N 3.34Å; S33-E37 PolarHBondContact OG-OE1 3.15Å; L34-E37 PolarHBondContact O-N 3.09Å; E37-A39 PolarHBondContact O-N 2.65Å
38A85Confident86.9Confident9 Ų949.6 Ų49.67%0.07426%0.259CS..  trans-58.2124.4-18000000111.4L34 H35 Y36 D43 C44 I47 K75L34-A38 PolarHBondContact O-N 3.18Å; H35-A38 WeakPolarHBondContact O-CB 3.13Å; H35-A38 PolarHBondContact O-N 3.49Å; Y36-A38 VanDerWaalsContact C-N 3.33Å; Y36-A38 PolarHBondContact O-N 3.22Å; A38-D43 HydrophobicContact CB-CB 4.28Å; A38-C44 HydrophobicContact CB-CB 3.92Å; A38-I47 HydrophobicContact CB-CD1 4.42Å; A38-K75 PolarHBondContact O-NZ 3.39Å; A38-K75 VanDerWaalsContact O-NZ 3.11Å
39A78.7Confident87Confident96 Ų9652 Ų5279%0.79327%0.27SS*.  trans-91.9-26.7-17800000113.1E37E37-A39 PolarHBondContact O-N 2.65Å
40T82.7Confident87.1Confident61 Ų6148.9 Ų48.937%0.37425%0.249SC..SBendtrans-109.9150.6178.775.70000111N42 D43 C44T40-N42 VanDerWaalsContact C-N 3.29Å; T40-N42 PolarHBondContact O-N 3.26Å; T40-D43 PolarHBondContact O-N 3.08Å; T40-D43 WeakPolarHBondContact OG1-CB 3.34Å; T40-D43 PolarHBondContact OG1-N 3.06Å; T40-D43 PolarHBondContact OG1-OD2 2.84Å; T40-C44 WeakPolarHBondContact O-CB 3.48Å; T40-C44 PolarHBondContact O-N 3.27Å; T40-C44 VanDerWaalsContact O-N 3.08Å
41W85Confident87.3Confident51 Ų5143.4 Ų43.419%0.19323%0.225CC..Hα-helixtrans-64.1-34.217537.7-85.4000112.3C44 L45 M79 M83 N107 I108 A111W41-C44 PolarHBondContact O-N 3.12Å; W41-L45 HydrophobicContact CE3-CD1 4.35Å; W41-L45 VanDerWaalsContact O-CB 3.26Å; W41-L45 WeakPolarHBondContact O-CB 3.42Å; W41-L45 VanDerWaalsContact O-CG 3.25Å; W41-L45 WeakPolarHBondContact O-CG 3.3Å; W41-L45 PolarHBondContact O-N 3.37Å; W41-M79 VanDerWaalsContact CA-SD 3.56Å; W41-M79 HydrophobicContact CB-CE 3.35Å; W41-M79 HydrophobicContact CB-CG 4.07Å; W41-M79 HydrophobicContact CB-SD 3.84Å; W41-M79 HydrophobicContact CG-CE 4.06Å; W41-M83 HydrophobicContact CB-CG 4.25Å; W41-M83 HydrophobicContact CB-SD 4.04Å; W41-M83 HydrophobicContact CG-CG 4.36Å; W41-M83 HydrophobicContact CG-SD 4.37Å; W41-N107 HydrophobicContact CH2-CB 4.05Å; W41-I108 HydrophobicContact CZ2-CG1 4.37Å; W41-A111 HydrophobicContact CD2-CB 4.32Å; W41-A111 HydrophobicContact CE3-CB 3.42Å; W41-A111 VanDerWaalsContact CE3-CB 3.42Å; W41-A111 HydrophobicContact CZ3-CB 3.55Å
42N84.3Confident87.5Confident96 Ų9643.4 Ų43.451%0.51323%0.225SC..Hα-helixtrans-61.6-46.2177.4-83.6-33000112T40 R46T40-N42 VanDerWaalsContact C-N 3.29Å; T40-N42 PolarHBondContact O-N 3.26Å; N42-R46 WeakPolarHBondContact O-CB 3.42Å; N42-R46 PolarHBondContact O-N 2.8Å
43D85.4Confident87.7Confident51 Ų5147.6 Ų47.627%0.27324%0.244SC..Hα-helixtrans-64.7-45.1177.3-69.2-30.2000111.2M1 A38 T40 L45 R46 I47M1-D43 HydrophobicContact CE-CB 3.48Å; M1-D43 VanDerWaalsContact CE-CB 3.48Å; A38-D43 HydrophobicContact CB-CB 4.28Å; T40-D43 PolarHBondContact O-N 3.08Å; T40-D43 WeakPolarHBondContact OG1-CB 3.34Å; T40-D43 PolarHBondContact OG1-N 3.06Å; T40-D43 PolarHBondContact OG1-OD2 2.84Å; D43-L45 PolarHBondContact O-N 3.45Å; D43-R46 PolarHBondContact O-N 2.93Å; D43-I47 WeakPolarHBondContact O-CD1 3.42Å; D43-I47 VanDerWaalsContact O-CG1 3.26Å; D43-I47 WeakPolarHBondContact O-CG1 3.29Å; D43-I47 PolarHBondContact O-N 2.9Å
44C87.4Confident87.8Confident1 Ų146.9 Ų46.91%0.00723%0.234CC..Hα-helixtrans-60.4-46.5178.5-160.40000111.4H35 A38 T40 W41 I47 L48 M79H35-C44 PolarHBondContact CD2-O 3.11Å; H35-C44 VanDerWaalsContact CD2-SG 3.55Å; H35-C44 PolarHBondContact NE2-SG 3.17Å; A38-C44 HydrophobicContact CB-CB 3.92Å; T40-C44 WeakPolarHBondContact O-CB 3.48Å; T40-C44 PolarHBondContact O-N 3.27Å; T40-C44 VanDerWaalsContact O-N 3.08Å; W41-C44 PolarHBondContact O-N 3.12Å; C44-I47 PolarHBondContact O-N 3.4Å; C44-L48 VanDerWaalsContact O-CB 3.31Å; C44-L48 WeakPolarHBondContact O-CB 3.48Å; C44-L48 PolarHBondContact O-N 3.22Å; C44-M79 HydrophobicContact CB-CG 4.28Å; C44-M79 HydrophobicContact CB-SD 4.11Å
45L89.4Confident88Confident5 Ų546 Ų463%0.02623%0.23CC..Hα-helixtrans-65.2-41.3178.6-78.9169.4000112.6W41 D43 I47 L48 K49 A111 Q114 L115W41-L45 HydrophobicContact CE3-CD1 4.35Å; W41-L45 VanDerWaalsContact O-CB 3.26Å; W41-L45 WeakPolarHBondContact O-CB 3.42Å; W41-L45 VanDerWaalsContact O-CG 3.25Å; W41-L45 WeakPolarHBondContact O-CG 3.3Å; W41-L45 PolarHBondContact O-N 3.37Å; D43-L45 PolarHBondContact O-N 3.45Å; L45-I47 VanDerWaalsContact C-N 3.35Å; L45-L48 PolarHBondContact O-N 3.27Å; L45-K49 WeakPolarHBondContact O-CB 3.36Å; L45-K49 PolarHBondContact O-N 3.08Å; L45-A111 HydrophobicContact CD1-CB 3.6Å; L45-Q114 HydrophobicContact CD2-CB 4.44Å; L45-L115 HydrophobicContact CD2-CB 3.83Å; L45-L115 HydrophobicContact CD2-CD1 3.55Å; L45-L115 HydrophobicContact CD2-CG 4.32Å
46R88.9Confident88.2Confident93 Ų9346.1 Ų46.135%0.35123%0.23SC..Hα-helixtrans-60.7-46.1176.4-178.5179.2171.6-177.9-1.9110.9E10 N42 D43 I50E10-R46 VanDerWaalsContact CG-NH2 3.26Å; N42-R46 WeakPolarHBondContact O-CB 3.42Å; N42-R46 PolarHBondContact O-N 2.8Å; D43-R46 PolarHBondContact O-N 2.93Å; R46-I50 HydrophobicContact CG-CD1 4.31Å; R46-I50 WeakPolarHBondContact O-CG1 3.46Å; R46-I50 PolarHBondContact O-N 2.97Å; R46-I50 VanDerWaalsContact O-N 3.17Å
47I90.6Very high88.4Confident0 Ų041.1 Ų41.10%022%0.219CC..Hα-helixtrans-67.5-43.5178.6-61.8162.3000110.6M1 L9 L31 L34 H35 A38 D43 C44 L45 K49 I50 I51M1-I47 HydrophobicContact CE-CD1 3.78Å; M1-I47 HydrophobicContact CE-CG1 4.46Å; L9-I47 HydrophobicContact CD1-CD1 4.46Å; L9-I47 HydrophobicContact CD1-CG1 3.95Å; L9-I47 HydrophobicContact CD2-CG1 3.86Å; L31-I47 HydrophobicContact CB-CG2 4.49Å; L31-I47 WeakPolarHBondContact O-CG2 3.41Å; L34-I47 HydrophobicContact CB-CD1 3.92Å; H35-I47 HydrophobicContact CB-CG2 3.79Å; A38-I47 HydrophobicContact CB-CD1 4.42Å; D43-I47 WeakPolarHBondContact O-CD1 3.42Å; D43-I47 VanDerWaalsContact O-CG1 3.26Å; D43-I47 WeakPolarHBondContact O-CG1 3.29Å; D43-I47 PolarHBondContact O-N 2.9Å; C44-I47 PolarHBondContact O-N 3.4Å; L45-I47 VanDerWaalsContact C-N 3.35Å; I47-K49 VanDerWaalsContact C-N 3.34Å; I47-K49 PolarHBondContact O-N 3.29Å; I47-I50 PolarHBondContact O-N 3.34Å; I47-I51 HydrophobicContact CG2-CD1 3.92Å; I47-I51 HydrophobicContact CG2-CG1 4.39Å; I47-I51 WeakPolarHBondContact O-CG1 3.43Å; I47-I51 PolarHBondContact O-N 3.43Å
48L92Very high88.6Confident1 Ų137.1 Ų37.11%0.00520%0.2CC..Hα-helixtrans-58.8-46178.3-175.865.7000111.2C44 L45 I50 I51 T52 I72 A76 L115 A118C44-L48 VanDerWaalsContact O-CB 3.31Å; C44-L48 WeakPolarHBondContact O-CB 3.48Å; C44-L48 PolarHBondContact O-N 3.22Å; L45-L48 PolarHBondContact O-N 3.27Å; L48-I50 VanDerWaalsContact C-N 3.35Å; L48-I50 PolarHBondContact O-N 3.07Å; L48-I51 PolarHBondContact O-N 3.22Å; L48-I51 VanDerWaalsContact O-N 3.16Å; L48-T52 HydrophobicContact CD1-CG2 4.19Å; L48-T52 HydrophobicContact CG-CG2 4.33Å; L48-T52 WeakPolarHBondContact O-CG2 3.48Å; L48-T52 PolarHBondContact O-N 3.05Å; L48-T52 PolarHBondContact O-OG1 3.22Å; L48-T52 VanDerWaalsContact O-OG1 3.05Å; L48-I72 HydrophobicContact CD1-CB 4.36Å; L48-I72 HydrophobicContact CD1-CD1 4.05Å; L48-A76 HydrophobicContact CD2-CB 4.29Å; L48-L115 HydrophobicContact CD2-CD1 3.54Å; L48-A118 HydrophobicContact CD2-CB 3.8Å; L48-A118 HydrophobicContact CG-CB 4.07Å
49K90.7Very high88.9Confident55 Ų5536.9 Ų36.924%0.23920%0.197CC..Hα-helixtrans-57.7-45.3175.3-86.1-177167.6175.60112.5L45 I47 I51 T52 E53 Q114L45-K49 WeakPolarHBondContact O-CB 3.36Å; L45-K49 PolarHBondContact O-N 3.08Å; I47-K49 VanDerWaalsContact C-N 3.34Å; I47-K49 PolarHBondContact O-N 3.29Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 3.5Å; K49-T52 WeakPolarHBondContact CA-OG1 3.41Å; K49-T52 PolarHBondContact O-N 2.94Å; K49-T52 PolarHBondContact O-OG1 2.89Å; K49-E53 VanDerWaalsContact O-CB 3.26Å; K49-E53 WeakPolarHBondContact O-CB 3.39Å; K49-E53 WeakPolarHBondContact O-CG 3.47Å; K49-E53 PolarHBondContact O-N 2.68Å; K49-Q114 VanDerWaalsContact NZ-OE1 3.15Å
50I90.2Very high89.4Confident8 Ų833.7 Ų33.74%0.04117%0.174CC..Hα-helixtrans-59.1-46176.4-69.9164.7000110.4L9 V12 V13 L31 R46 I47 L48 M54 F55L9-I50 HydrophobicContact CB-CD1 4.14Å; L9-I50 HydrophobicContact CD2-CD1 3.66Å; L9-I50 HydrophobicContact CG-CD1 4.47Å; V12-I50 HydrophobicContact CG1-CG2 3.54Å; V13-I50 HydrophobicContact CG2-CD1 3.77Å; V13-I50 HydrophobicContact CG2-CG1 3.76Å; L31-I50 HydrophobicContact CD1-CG2 4Å; R46-I50 HydrophobicContact CG-CD1 4.31Å; R46-I50 WeakPolarHBondContact O-CG1 3.46Å; R46-I50 PolarHBondContact O-N 2.97Å; R46-I50 VanDerWaalsContact O-N 3.17Å; I47-I50 PolarHBondContact O-N 3.34Å; L48-I50 VanDerWaalsContact C-N 3.35Å; L48-I50 PolarHBondContact O-N 3.07Å; I50-M54 VanDerWaalsContact O-CB 3.26Å; I50-M54 WeakPolarHBondContact O-CB 3.34Å; I50-M54 PolarHBondContact O-N 2.95Å; I50-F55 HydrophobicContact CG2-CD2 4.29Å; I50-F55 HydrophobicContact CG2-CE2 3.91Å
51I92Very high89.6Confident0 Ų031.7 Ų31.70%016%0.161CC..Iπ-helixtrans-61.8-48.6177.9-65.1170.1000110.7L28 L31 H35 I47 L48 K49 F55 L56 I72L28-I51 HydrophobicContact CD1-CG2 3.95Å; L31-I51 HydrophobicContact CB-CD1 3.97Å; L31-I51 HydrophobicContact CB-CG1 3.88Å; L31-I51 HydrophobicContact CD1-CG1 4.18Å; H35-I51 HydrophobicContact CB-CD1 4.37Å; I47-I51 HydrophobicContact CG2-CD1 3.92Å; I47-I51 HydrophobicContact CG2-CG1 4.39Å; I47-I51 WeakPolarHBondContact O-CG1 3.43Å; I47-I51 PolarHBondContact O-N 3.43Å; L48-I51 PolarHBondContact O-N 3.22Å; L48-I51 VanDerWaalsContact O-N 3.16Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 3.5Å; I51-F55 PolarHBondContact O-N 3.28Å; I51-L56 PolarHBondContact O-N 2.67Å; I51-I72 HydrophobicContact CD1-CG2 3.98Å; I51-I72 HydrophobicContact CG2-CD1 4.04Å; I51-I72 HydrophobicContact CG2-CG2 4.48Å
52T92.3Very high89.7Confident1 Ų134.2 Ų34.21%0.00619%0.186CC..Iπ-helixtrans-73.2-34-174.954.70000114L48 K49 L56 A118 I121L48-T52 HydrophobicContact CD1-CG2 4.19Å; L48-T52 HydrophobicContact CG-CG2 4.33Å; L48-T52 WeakPolarHBondContact O-CG2 3.48Å; L48-T52 PolarHBondContact O-N 3.05Å; L48-T52 PolarHBondContact O-OG1 3.22Å; L48-T52 VanDerWaalsContact O-OG1 3.05Å; K49-T52 WeakPolarHBondContact CA-OG1 3.41Å; K49-T52 PolarHBondContact O-N 2.94Å; K49-T52 PolarHBondContact O-OG1 2.89Å; T52-L56 WeakPolarHBondContact O-CB 3.08Å; T52-A118 HydrophobicContact CG2-CB 4.43Å; T52-I121 WeakPolarHBondContact O-CG2 3.36Å
53E90.8Very high89.9Confident100 Ų10032.9 Ų32.947%0.46718%0.177SC..Iπ-helixtrans-90.5-38.7-176.1-67174.7-167.200112.4K49 I121K49-E53 VanDerWaalsContact O-CB 3.26Å; K49-E53 WeakPolarHBondContact O-CB 3.39Å; K49-E53 WeakPolarHBondContact O-CG 3.47Å; K49-E53 PolarHBondContact O-N 2.68Å; E53-I121 HydrophobicContact CG-CD1 3.84Å
54M90.3Very high90.3Very high42 Ų4230.4 Ų30.421%0.20716%0.164CC..Iπ-helixtrans-98.8-34.7-171.5-55.8-63.1-67.200113.6W15 C20 I50 H58W15-M54 WeakPolarHBondContact O-CE 3.42Å; C20-M54 WeakPolarHBondContact CB-O 3.41Å; I50-M54 VanDerWaalsContact O-CB 3.26Å; I50-M54 WeakPolarHBondContact O-CB 3.34Å; I50-M54 PolarHBondContact O-N 2.95Å; M54-H58 PolarHBondContact O-CD2 3.15Å; M54-H58 PolarHBondContact O-NE2 3.09Å
55F91.4Very high90.5Very high0 Ų031.3 Ų31.30%017%0.168CC..Iπ-helixtrans-108.6-40.5-172.1-66.7-82.8000113.7V12 W15 C20 L24 V27 L28 L31 I50 I51 P57 H58V12-F55 HydrophobicContact CG1-CE2 3.41Å; V12-F55 VanDerWaalsContact CG1-CE2 3.41Å; V12-F55 HydrophobicContact CG1-CZ 3.62Å; W15-F55 HydrophobicContact CE3-CZ 4.31Å; W15-F55 HydrophobicContact CZ3-CZ 4.19Å; C20-F55 HydrophobicContact CB-CD1 4.46Å; C20-F55 HydrophobicContact CB-CE1 4.33Å; L24-F55 HydrophobicContact CD1-CB 3.83Å; L24-F55 HydrophobicContact CD1-CD1 3.72Å; L24-F55 HydrophobicContact CD1-CG 4.24Å; V27-F55 HydrophobicContact CB-CE1 4.21Å; V27-F55 HydrophobicContact CB-CZ 4.22Å; V27-F55 HydrophobicContact CG1-CE1 4.17Å; V27-F55 HydrophobicContact CG1-CE2 4.39Å; V27-F55 HydrophobicContact CG1-CZ 3.68Å; L28-F55 HydrophobicContact CD1-CB 4.29Å; L31-F55 HydrophobicContact CD1-CD2 3.68Å; L31-F55 HydrophobicContact CD1-CE2 3.29Å; L31-F55 HydrophobicContact CD1-CZ 3.92Å; I50-F55 HydrophobicContact CG2-CD2 4.29Å; I50-F55 HydrophobicContact CG2-CE2 3.91Å; I51-F55 PolarHBondContact O-N 3.28Å; F55-P57 VanDerWaalsContact C-N 3.32Å; F55-H58 WeakPolarHBondContact O-CB 3.38Å; F55-H58 PolarHBondContact O-N 2.95Å
56L92.6Very high90.6Very high1 Ų136.6 Ų36.61%0.00520%0.196CC..G310 helixtrans-50.9-42.2-179.4-176.172.8000113.7I51 T52 H58 I59 L64 F69 I121 C122 H125I51-L56 PolarHBondContact O-N 2.67Å; T52-L56 WeakPolarHBondContact O-CB 3.08Å; L56-H58 PolarHBondContact O-N 3.11Å; L56-I59 PolarHBondContact O-N 3.2Å; L56-I59 VanDerWaalsContact O-N 3.08Å; L56-L64 HydrophobicContact CD1-CD1 3.67Å; L56-F69 HydrophobicContact CD1-CE1 3.83Å; L56-F69 HydrophobicContact CD1-CZ 4.35Å; L56-I121 HydrophobicContact CD2-CG2 4.18Å; L56-C122 HydrophobicContact CD2-CB 4.47Å; L56-H125 HydrophobicContact CD2-CB 3.72Å; L56-H125 HydrophobicContact CG-CB 4.02Å; L56-H125 PolarHBondContact O-CE1 3.26Å; L56-H125 PolarHBondContact O-NE2 3.01Å
57P91.4Very high90.5Very high64 Ų6434.9 Ų34.942%0.41619%0.192SC..G310 helixtrans-59.3-15.6178.2-24.836.1000114.9F55F55-P57 VanDerWaalsContact C-N 3.32Å
58H90.3Very high90.6Very high44 Ų4434.9 Ų34.920%0.20419%0.192CC..G310 helixtrans-102.9-2.4-177.3-55.3-48.9000113.6Q17 R21 L24 M54 F55 L56Q17-H58 PolarHBondContact O-NE2 2.89Å; R21-H58 HydrophobicContact CB-CB 4.39Å; R21-H58 HydrophobicContact CG-CB 4.36Å; L24-H58 HydrophobicContact CD2-CB 4.3Å; M54-H58 PolarHBondContact O-CD2 3.15Å; M54-H58 PolarHBondContact O-NE2 3.09Å; F55-H58 WeakPolarHBondContact O-CB 3.38Å; F55-H58 PolarHBondContact O-N 2.95Å; L56-H58 PolarHBondContact O-N 3.11Å
59I90.8Very high90.8Very high4 Ų434.9 Ų34.92%0.02119%0.192CC..  trans-92.8127.5179.3-54.2175000109.4L24 L28 L56 E63 L64 C68 H125L24-I59 HydrophobicContact CD1-CD1 4.4Å; L24-I59 HydrophobicContact CD1-CG1 3.95Å; L24-I59 HydrophobicContact CD2-CG1 4.12Å; L28-I59 HydrophobicContact CD2-CD1 3.68Å; L56-I59 PolarHBondContact O-N 3.2Å; L56-I59 VanDerWaalsContact O-N 3.08Å; I59-E63 HydrophobicContact CG2-CB 4.19Å; I59-L64 HydrophobicContact CB-CD1 4.04Å; I59-L64 HydrophobicContact CG2-CB 4.44Å; I59-L64 HydrophobicContact CG2-CD1 3.76Å; I59-C68 HydrophobicContact CD1-CB 3.8Å; I59-H125 PolarHBondContact O-NE2 2.91Å; I59-H125 VanDerWaalsContact O-NE2 3.07Å
60G88.6Confident90.9Very high29 Ų2934.4 Ų34.430%0.29920%0.196SC..  trans-76.7159.1176.200000112.9S62 E63 L64G60-S62 VanDerWaalsContact C-N 3.31Å; G60-S62 PolarHBondContact O-N 3.2Å; G60-E63 PolarHBondContact O-N 2.89Å; G60-E63 VanDerWaalsContact O-N 3.15Å; G60-L64 PolarHBondContact O-N 3.2Å
61L87.7Confident91Very high19 Ų1938.8 Ų38.810%0.09922%0.215CC..Hα-helixtrans-55.8-41.2-175.9-177.963.1000113.2E63 L64 F129 L133 A137 I138L61-E63 VanDerWaalsContact C-N 3.3Å; L61-E63 PolarHBondContact O-N 3.47Å; L61-L64 HydrophobicContact CD1-CD2 4.49Å; L61-L64 WeakPolarHBondContact O-CB 3.34Å; L61-L64 PolarHBondContact O-N 2.96Å; L61-F129 HydrophobicContact CB-CD1 4.36Å; L61-F129 HydrophobicContact CB-CD2 4.33Å; L61-F129 HydrophobicContact CB-CE1 4.29Å; L61-F129 HydrophobicContact CB-CE2 4.28Å; L61-F129 HydrophobicContact CB-CG 4.39Å; L61-F129 HydrophobicContact CB-CZ 4.25Å; L61-F129 HydrophobicContact CD1-CD2 4.14Å; L61-F129 HydrophobicContact CD1-CE2 4.34Å; L61-L133 HydrophobicContact CD1-CD2 3.99Å; L61-L133 HydrophobicContact CD2-CD2 4.03Å; L61-A137 HydrophobicContact CD1-CB 4.11Å; L61-A137 HydrophobicContact CG-CB 4.14Å; L61-I138 HydrophobicContact CD1-CG2 4.28Å
62S86.3Confident91.1Very high104 Ų10438.8 Ų38.873%0.72722%0.215SC*.Hα-helixtrans-69.2-23.7-178.458.60000114.6G60G60-S62 VanDerWaalsContact C-N 3.31Å; G60-S62 PolarHBondContact O-N 3.2Å
63E89.7Confident91.2Very high68 Ų6838.8 Ų38.832%0.31821%0.214SC..Hα-helixtrans-98.7-6.8-179.1-65.6176.5167.200111.3I59 G60 L61 E67I59-E63 HydrophobicContact CG2-CB 4.19Å; G60-E63 PolarHBondContact O-N 2.89Å; G60-E63 VanDerWaalsContact O-N 3.15Å; L61-E63 VanDerWaalsContact C-N 3.3Å; L61-E63 PolarHBondContact O-N 3.47Å; E63-E67 HydrophobicContact CB-CG 4.11Å; E63-E67 WeakPolarHBondContact O-CB 3.44Å; E63-E67 WeakPolarHBondContact O-CG 3.26Å; E63-E67 PolarHBondContact O-N 3.41Å
64L91.8Very high91.4Very high0 Ų036.9 Ų36.90%021%0.211CC..Hα-helixtrans-68-45.6-165.5-163.565.5000113.3L56 I59 G60 L61 C68 F69 V126 F129 I138L56-L64 HydrophobicContact CD1-CD1 3.67Å; I59-L64 HydrophobicContact CB-CD1 4.04Å; I59-L64 HydrophobicContact CG2-CB 4.44Å; I59-L64 HydrophobicContact CG2-CD1 3.76Å; G60-L64 PolarHBondContact O-N 3.2Å; L61-L64 HydrophobicContact CD1-CD2 4.49Å; L61-L64 WeakPolarHBondContact O-CB 3.34Å; L61-L64 PolarHBondContact O-N 2.96Å; L64-C68 WeakPolarHBondContact O-CB 3.36Å; L64-C68 PolarHBondContact O-N 3.01Å; L64-F69 HydrophobicContact CD1-CE1 4.28Å; L64-F69 HydrophobicContact CD1-CE2 4.37Å; L64-F69 HydrophobicContact CD1-CZ 4.09Å; L64-F69 HydrophobicContact CD2-CD2 4.03Å; L64-F69 HydrophobicContact CD2-CE2 3.29Å; L64-F69 HydrophobicContact CD2-CZ 3.59Å; L64-F69 HydrophobicContact CG-CD1 4.5Å; L64-F69 HydrophobicContact CG-CD2 3.84Å; L64-F69 HydrophobicContact CG-CE1 4.25Å; L64-F69 HydrophobicContact CG-CE2 3.53Å; L64-F69 HydrophobicContact CG-CG 4.32Å; L64-F69 HydrophobicContact CG-CZ 3.77Å; L64-F69 PolarHBondContact O-N 3.3Å; L64-V126 HydrophobicContact CD2-CG2 3.62Å; L64-F129 HydrophobicContact CD2-CE2 4.5Å; L64-I138 HydrophobicContact CD2-CG2 4.23Å
65E93.3Very high91.5Very high19 Ų1937.1 Ų37.19%0.08921%0.211CC..Iπ-helixtrans-66.6-52.5179.1-172.860.3-157.500111.3F69 S70 A137 I138 R139 S140E65-F69 PolarHBondContact O-N 2.81Å; E65-S70 VanDerWaalsContact O-CB 3.25Å; E65-S70 WeakPolarHBondContact O-CB 3.39Å; E65-S70 PolarHBondContact O-N 2.54Å; E65-S70 PolarHBondContact O-OG 2.95Å; E65-A137 WeakPolarHBondContact CB-O 3.42Å; E65-I138 WeakPolarHBondContact OE2-CA 3.38Å; E65-R139 HydrophobicContact CG-CB 4.47Å; E65-R139 PolarHBondContact OE2-N 3.48Å; E65-R139 VanDerWaalsContact OE2-N 3.11Å; E65-S140 WeakPolarHBondContact OE1-CB 3.33Å; E65-S140 PolarHBondContact OE1-N 3.36Å; E65-S140 PolarHBondContact OE1-OG 2.89Å; E65-S140 PolarHBondContact OE2-N 3.45Å
66D90.1Very high91.6Very high117 Ų11737.1 Ų37.163%0.62621%0.211SC*.Iπ-helixtrans-73.1-40.7-173-71.5-25.9000113.3K71D66-K71 WeakPolarHBondContact O-CE 3.34Å; D66-K71 PolarHBondContact O-NZ 3.02Å
67E88.6Confident91.7Very high57 Ų5737.4 Ų37.427%0.26621%0.212SC..Iπ-helixtrans-85.2-27.9-176.3-60.4-158.5163.200112.6L28 E63L28-E67 HydrophobicContact CD2-CB 4.35Å; E63-E67 HydrophobicContact CB-CG 4.11Å; E63-E67 WeakPolarHBondContact O-CB 3.44Å; E63-E67 WeakPolarHBondContact O-CG 3.26Å; E63-E67 PolarHBondContact O-N 3.41Å
68C92.8Very high91.8Very high0 Ų036.4 Ų36.40%021%0.209CC..Iπ-helixtrans-127.8-70.4-169.1-1660000114.1I59 L64 S70 K71 I72I59-C68 HydrophobicContact CD1-CB 3.8Å; L64-C68 WeakPolarHBondContact O-CB 3.36Å; L64-C68 PolarHBondContact O-N 3.01Å; C68-S70 PolarHBondContact O-N 3.2Å; C68-K71 PolarHBondContact O-N 3.28Å; C68-K71 VanDerWaalsContact O-N 3.11Å; C68-I72 WeakPolarHBondContact O-CG1 3.24Å; C68-I72 PolarHBondContact O-N 3.01Å; C68-I72 VanDerWaalsContact SG-CD1 3.54Å
69F94.9Very high91.9Very high0 Ų035 Ų350%020%0.203CC..Iπ-helixtrans-64.2-45.2-163.9-73.7-13.4000114.3L56 L64 E65 K71 I72 L73 C122 V126 I138 L141L56-F69 HydrophobicContact CD1-CE1 3.83Å; L56-F69 HydrophobicContact CD1-CZ 4.35Å; L64-F69 HydrophobicContact CD1-CE1 4.28Å; L64-F69 HydrophobicContact CD1-CE2 4.37Å; L64-F69 HydrophobicContact CD1-CZ 4.09Å; L64-F69 HydrophobicContact CD2-CD2 4.03Å; L64-F69 HydrophobicContact CD2-CE2 3.29Å; L64-F69 HydrophobicContact CD2-CZ 3.59Å; L64-F69 HydrophobicContact CG-CD1 4.5Å; L64-F69 HydrophobicContact CG-CD2 3.84Å; L64-F69 HydrophobicContact CG-CE1 4.25Å; L64-F69 HydrophobicContact CG-CE2 3.53Å; L64-F69 HydrophobicContact CG-CG 4.32Å; L64-F69 HydrophobicContact CG-CZ 3.77Å; L64-F69 PolarHBondContact O-N 3.3Å; E65-F69 PolarHBondContact O-N 2.81Å; F69-K71 PolarHBondContact O-N 3.05Å; F69-K71 VanDerWaalsContact O-N 3.12Å; F69-I72 PolarHBondContact O-N 3.25Å; F69-L73 HydrophobicContact CB-CD1 3.72Å; F69-L73 HydrophobicContact CB-CG 4.2Å; F69-L73 HydrophobicContact CD1-CD1 4.06Å; F69-L73 HydrophobicContact CD1-CG 4.31Å; F69-L73 HydrophobicContact CD2-CD1 4.44Å; F69-L73 HydrophobicContact CG-CD1 3.84Å; F69-L73 HydrophobicContact CG-CG 4.44Å; F69-L73 WeakPolarHBondContact O-CB 3.48Å; F69-L73 WeakPolarHBondContact O-CG 3.47Å; F69-L73 PolarHBondContact O-N 3.01Å; F69-C122 HydrophobicContact CE1-CB 3.83Å; F69-C122 HydrophobicContact CZ-CB 4.02Å; F69-V126 HydrophobicContact CE2-CG2 3.62Å; F69-V126 HydrophobicContact CZ-CG2 3.8Å; F69-I138 HydrophobicContact CD2-CG2 4.5Å; F69-I138 HydrophobicContact CE2-CG2 4.18Å; F69-L141 HydrophobicContact CD2-CB 3.96Å; F69-L141 HydrophobicContact CD2-CD1 4.48Å; F69-L141 HydrophobicContact CE2-CB 4.09Å; F69-L141 HydrophobicContact CE2-CD1 4.12Å; F69-L141 HydrophobicContact CE2-CD2 3.87Å; F69-L141 HydrophobicContact CE2-CG 4.26Å; F69-L141 HydrophobicContact CZ-CD1 4.16Å; F69-L141 HydrophobicContact CZ-CD2 4.34Å
70S93.5Very high92.1Very high46 Ų4634.8 Ų34.832%0.32220%0.202SC..Hα-helixtrans-59.7-23.7177.362.30000113.2E65 C68 P74 S140E65-S70 VanDerWaalsContact O-CB 3.25Å; E65-S70 WeakPolarHBondContact O-CB 3.39Å; E65-S70 PolarHBondContact O-N 2.54Å; E65-S70 PolarHBondContact O-OG 2.95Å; C68-S70 PolarHBondContact O-N 3.2Å; S70-P74 WeakPolarHBondContact O-CD 3.26Å; S70-P74 WeakPolarHBondContact O-CG 3.45Å; S70-S140 WeakPolarHBondContact CA-OG 3.43Å
71K91.8Very high92.4Very high100 Ų10035 Ų3544%0.43520%0.197SC..Hα-helixtrans-94.5-39.6-178.4-61.1175.4-173.5153.40113.1T32 D66 C68 F69T32-K71 HydrophobicContact CG2-CB 3.48Å; T32-K71 VanDerWaalsContact CG2-CB 3.48Å; T32-K71 HydrophobicContact CG2-CD 4.11Å; T32-K71 HydrophobicContact CG2-CG 4.44Å; D66-K71 WeakPolarHBondContact O-CE 3.34Å; D66-K71 PolarHBondContact O-NZ 3.02Å; C68-K71 PolarHBondContact O-N 3.28Å; C68-K71 VanDerWaalsContact O-N 3.11Å; F69-K71 PolarHBondContact O-N 3.05Å; F69-K71 VanDerWaalsContact O-N 3.12Å
72I94.1Very high92.6Very high0 Ų038.6 Ų38.60%022%0.216CC..Hα-helixtrans-91.6-39-174.169.3174.9000113.3T32 H35 L48 I51 C68 F69 K75 A76T32-I72 HydrophobicContact CG2-CG2 3.37Å; H35-I72 PolarHBondContact CE1-O 2.95Å; H35-I72 VanDerWaalsContact CE1-O 3.31Å; L48-I72 HydrophobicContact CD1-CB 4.36Å; L48-I72 HydrophobicContact CD1-CD1 4.05Å; I51-I72 HydrophobicContact CD1-CG2 3.98Å; I51-I72 HydrophobicContact CG2-CD1 4.04Å; I51-I72 HydrophobicContact CG2-CG2 4.48Å; C68-I72 WeakPolarHBondContact O-CG1 3.24Å; C68-I72 PolarHBondContact O-N 3.01Å; C68-I72 VanDerWaalsContact SG-CD1 3.54Å; F69-I72 PolarHBondContact O-N 3.25Å; I72-K75 PolarHBondContact O-N 3.11Å; I72-A76 PolarHBondContact O-N 3.3Å
73L94.9Very high93Very high0 Ų033.8 Ų33.80%018%0.182CC..Hα-helixtrans-70.3-42-169.7-60.2180000113.1F69 K75 A76 V77 L119 L141 C144F69-L73 HydrophobicContact CB-CD1 3.72Å; F69-L73 HydrophobicContact CB-CG 4.2Å; F69-L73 HydrophobicContact CD1-CD1 4.06Å; F69-L73 HydrophobicContact CD1-CG 4.31Å; F69-L73 HydrophobicContact CD2-CD1 4.44Å; F69-L73 HydrophobicContact CG-CD1 3.84Å; F69-L73 HydrophobicContact CG-CG 4.44Å; F69-L73 WeakPolarHBondContact O-CB 3.48Å; F69-L73 WeakPolarHBondContact O-CG 3.47Å; F69-L73 PolarHBondContact O-N 3.01Å; L73-K75 VanDerWaalsContact C-N 3.27Å; L73-K75 PolarHBondContact O-N 3.03Å; L73-A76 WeakPolarHBondContact O-CB 3.37Å; L73-A76 PolarHBondContact O-N 3.39Å; L73-A76 VanDerWaalsContact O-N 3.11Å; L73-V77 WeakPolarHBondContact O-CG2 3.49Å; L73-V77 PolarHBondContact O-N 3.31Å; L73-L119 HydrophobicContact CD2-CD2 3.61Å; L73-L141 HydrophobicContact CD1-CB 3.98Å; L73-L141 HydrophobicContact CD1-CD1 3.73Å; L73-L141 HydrophobicContact CD1-CG 4.49Å; L73-C144 HydrophobicContact CB-CB 3.85Å; L73-C144 HydrophobicContact CD1-CB 4.47Å
74P94.6Very high93.2Very high61 Ų6131.8 Ų31.840%0.39617%0.173SC..Hα-helixtrans-60.1-37.3176.7-26.436.8000112.8S70 V77 A78S70-P74 WeakPolarHBondContact O-CD 3.26Å; S70-P74 WeakPolarHBondContact O-CG 3.45Å; P74-V77 PolarHBondContact O-N 2.96Å; P74-A78 PolarHBondContact O-N 3.28Å
75K92.5Very high93.3Very high46 Ų4638.2 Ų38.220%0.220%0.201CC..Hα-helixtrans-69.2-38.9175.4177.969.7-177-157.60111.6H35 Y36 A38 I72 L73 V77 A78 M79H35-K75 VanDerWaalsContact CE1-CG 3.48Å; H35-K75 WeakPolarHBondContact CE1-CG 3.48Å; H35-K75 WeakPolarHBondContact O-CE 3.37Å; Y36-K75 WeakPolarHBondContact O-CE 3.37Å; Y36-K75 PolarHBondContact O-NZ 2.98Å; A38-K75 PolarHBondContact O-NZ 3.39Å; A38-K75 VanDerWaalsContact O-NZ 3.11Å; I72-K75 PolarHBondContact O-N 3.11Å; L73-K75 VanDerWaalsContact C-N 3.27Å; L73-K75 PolarHBondContact O-N 3.03Å; K75-V77 VanDerWaalsContact C-N 3.34Å; K75-V77 PolarHBondContact O-N 3.43Å; K75-A78 PolarHBondContact O-N 3Å; K75-M79 WeakPolarHBondContact O-CB 3.38Å; K75-M79 PolarHBondContact O-N 3.16Å
76A93.4Very high93.2Very high0 Ų040.2 Ų40.20%021%0.21CC..Hα-helixtrans-60.3-43.5173.700000111.6L48 I72 L73 M79 F80 L115L48-A76 HydrophobicContact CD2-CB 4.29Å; I72-A76 PolarHBondContact O-N 3.3Å; L73-A76 WeakPolarHBondContact O-CB 3.37Å; L73-A76 PolarHBondContact O-N 3.39Å; L73-A76 VanDerWaalsContact O-N 3.11Å; A76-M79 WeakPolarHBondContact O-CB 3.42Å; A76-M79 PolarHBondContact O-N 2.86Å; A76-F80 PolarHBondContact O-N 3.43Å; A76-L115 HydrophobicContact CB-CD1 4.19Å
77V94.7Very high93.3Very high7 Ų734.7 Ų34.74%0.04218%0.18CC..Hα-helixtrans-60.5-47.7173.9173.50000111.4L73 P74 K75 M79 F80 D81 C144 K147 V148L73-V77 WeakPolarHBondContact O-CG2 3.49Å; L73-V77 PolarHBondContact O-N 3.31Å; P74-V77 PolarHBondContact O-N 2.96Å; K75-V77 VanDerWaalsContact C-N 3.34Å; K75-V77 PolarHBondContact O-N 3.43Å; V77-M79 VanDerWaalsContact C-N 3.26Å; V77-M79 PolarHBondContact O-N 3.2Å; V77-F80 WeakPolarHBondContact O-CB 3.23Å; V77-F80 PolarHBondContact O-N 3.29Å; V77-D81 VanDerWaalsContact O-CG 3.24Å; V77-D81 PolarHBondContact O-N 2.99Å; V77-C144 HydrophobicContact CG2-CB 3.57Å; V77-K147 HydrophobicContact CG1-CD 3.6Å; V77-K147 VanDerWaalsContact CG1-CE 3.45Å; V77-K147 HydrophobicContact CG1-CG 4.11Å; V77-V148 HydrophobicContact CG2-CG2 4.04Å
78A93.5Very high93.3Very high43 Ų4336.6 Ų36.636%0.35519%0.191SC..Hα-helixtrans-61.2-36.4177.800000112.1P74 K75 D81 N82P74-A78 PolarHBondContact O-N 3.28Å; K75-A78 PolarHBondContact O-N 3Å; A78-D81 PolarHBondContact O-N 3.24Å; A78-N82 VanDerWaalsContact O-CG 3.29Å; A78-N82 PolarHBondContact O-N 3.05Å; A78-N82 PolarHBondContact O-ND2 3.08Å
79M91.9Very high93.2Very high14 Ų1441.5 Ų41.57%0.06922%0.217CC..Hα-helixtrans-66.5-43.3175.3-166.469.3-112.600111.8W41 C44 K75 A76 V77 D81 N82 M83W41-M79 VanDerWaalsContact CA-SD 3.56Å; W41-M79 HydrophobicContact CB-CE 3.35Å; W41-M79 HydrophobicContact CB-CG 4.07Å; W41-M79 HydrophobicContact CB-SD 3.84Å; W41-M79 HydrophobicContact CG-CE 4.06Å; C44-M79 HydrophobicContact CB-CG 4.28Å; C44-M79 HydrophobicContact CB-SD 4.11Å; K75-M79 WeakPolarHBondContact O-CB 3.38Å; K75-M79 PolarHBondContact O-N 3.16Å; A76-M79 WeakPolarHBondContact O-CB 3.42Å; A76-M79 PolarHBondContact O-N 2.86Å; V77-M79 VanDerWaalsContact C-N 3.26Å; V77-M79 PolarHBondContact O-N 3.2Å; M79-D81 VanDerWaalsContact C-N 3.29Å; M79-D81 PolarHBondContact O-N 3.45Å; M79-N82 HydrophobicContact CE-CB 4.03Å; M79-N82 PolarHBondContact O-N 3.39Å; M79-M83 HydrophobicContact CE-CG 4.3Å; M79-M83 HydrophobicContact CG-CE 4.4Å; M79-M83 WeakPolarHBondContact O-CG 3.48Å; M79-M83 PolarHBondContact O-N 3.49Å
80F95.2Very high92.8Very high0 Ų044.2 Ų44.20%023%0.23CC..Hα-helixtrans-58.2-43.8173.6-168-91000111.7A76 V77 N82 M83 M84 M112 L115 I116 V148 K151 T152A76-F80 PolarHBondContact O-N 3.43Å; V77-F80 WeakPolarHBondContact O-CB 3.23Å; V77-F80 PolarHBondContact O-N 3.29Å; F80-N82 VanDerWaalsContact C-N 3.32Å; F80-N82 PolarHBondContact O-N 3.49Å; F80-M83 HydrophobicContact CD2-CE 4.35Å; F80-M83 PolarHBondContact O-N 2.9Å; F80-M84 HydrophobicContact CD1-CG 3.97Å; F80-M84 HydrophobicContact CE1-CG 3.64Å; F80-M84 HydrophobicContact CE1-SD 4.36Å; F80-M84 HydrophobicContact CZ-CG 4.34Å; F80-M84 PolarHBondContact O-N 3.44Å; F80-M112 HydrophobicContact CD2-CB 4.47Å; F80-M112 HydrophobicContact CD2-CE 4.16Å; F80-M112 HydrophobicContact CD2-CG 4.27Å; F80-M112 HydrophobicContact CE1-CE 3.85Å; F80-M112 HydrophobicContact CE2-CB 3.98Å; F80-M112 HydrophobicContact CE2-CE 3.35Å; F80-M112 HydrophobicContact CE2-CG 4.04Å; F80-M112 HydrophobicContact CZ-CE 3.15Å; F80-L115 HydrophobicContact CB-CD2 3.64Å; F80-L115 HydrophobicContact CD2-CD2 3.65Å; F80-L115 HydrophobicContact CG-CD2 4.11Å; F80-I116 HydrophobicContact CE2-CD1 4.43Å; F80-V148 HydrophobicContact CB-CG2 4.41Å; F80-V148 HydrophobicContact CD1-CG1 4.38Å; F80-V148 HydrophobicContact CD2-CG1 3.95Å; F80-V148 HydrophobicContact CE1-CG1 4.36Å; F80-V148 HydrophobicContact CE2-CG1 3.88Å; F80-V148 HydrophobicContact CG-CG1 4.18Å; F80-V148 HydrophobicContact CG-CG2 4.37Å; F80-V148 HydrophobicContact CZ-CG1 4.1Å; F80-K151 HydrophobicContact CD1-CB 4.35Å; F80-K151 HydrophobicContact CE1-CB 3.75Å; F80-T152 WeakPolarHBondContact CZ-OG1 3.41Å
81D94.6Very high92.5Very high35 Ų3542.5 Ų42.519%0.18722%0.217CC..Hα-helixtrans-61.8-40.1178.2-69.6-8.7000112V77 A78 M79 K85 K147 K151V77-D81 VanDerWaalsContact O-CG 3.24Å; V77-D81 PolarHBondContact O-N 2.99Å; A78-D81 PolarHBondContact O-N 3.24Å; M79-D81 VanDerWaalsContact C-N 3.29Å; M79-D81 PolarHBondContact O-N 3.45Å; D81-K85 WeakPolarHBondContact O-CB 2.99Å; D81-K85 PolarHBondContact O-N 3.4Å; D81-K147 WeakPolarHBondContact OD2-CE 3.44Å; D81-K147 IonicContact OD2-NZ 3.53Å; D81-K147 PolarHBondContact OD2-NZ 2.86Å; D81-K151 WeakPolarHBondContact OD1-CD 3.16Å; D81-K151 VanDerWaalsContact OD1-CE 3.32Å; D81-K151 WeakPolarHBondContact OD1-CE 3.47Å; D81-K151 IonicContact OD1-NZ 3.01Å; D81-K151 PolarHBondContact OD1-NZ 2.96Å; D81-K151 IonicContact OD2-NZ 3.73Å; D81-K151 PolarHBondContact OD2-NZ 3.39Å
82N93.3Very high91.9Very high94 Ų9440.2 Ų40.250%0.50322%0.222SC..Hα-helixtrans-67.2-41.9175.3-71-22000112.2A78 M79 F80 K85 E86A78-N82 VanDerWaalsContact O-CG 3.29Å; A78-N82 PolarHBondContact O-N 3.05Å; A78-N82 PolarHBondContact O-ND2 3.08Å; M79-N82 HydrophobicContact CE-CB 4.03Å; M79-N82 PolarHBondContact O-N 3.39Å; F80-N82 VanDerWaalsContact C-N 3.32Å; F80-N82 PolarHBondContact O-N 3.49Å; N82-K85 PolarHBondContact O-N 3.38Å; N82-E86 PolarHBondContact O-N 3.45Å
83M94.5Very high91.3Very high2 Ų246.5 Ų46.51%0.0125%0.251CS..Hα-helixtrans-61.2-45.4175-74-172.4-6800111.5W41 M79 F80 K85 E86 I87 I108 A111 M112 L115W41-M83 HydrophobicContact CB-CG 4.25Å; W41-M83 HydrophobicContact CB-SD 4.04Å; W41-M83 HydrophobicContact CG-CG 4.36Å; W41-M83 HydrophobicContact CG-SD 4.37Å; M79-M83 HydrophobicContact CE-CG 4.3Å; M79-M83 HydrophobicContact CG-CE 4.4Å; M79-M83 WeakPolarHBondContact O-CG 3.48Å; M79-M83 PolarHBondContact O-N 3.49Å; F80-M83 HydrophobicContact CD2-CE 4.35Å; F80-M83 PolarHBondContact O-N 2.9Å; M83-K85 PolarHBondContact O-N 3.22Å; M83-E86 PolarHBondContact O-N 3.49Å; M83-I87 WeakPolarHBondContact O-CG1 3.37Å; M83-I87 PolarHBondContact O-N 3.39Å; M83-I108 HydrophobicContact CB-CG2 3.68Å; M83-I108 HydrophobicContact CG-CG2 4.04Å; M83-I108 HydrophobicContact SD-CG2 4.45Å; M83-A111 HydrophobicContact SD-CB 3.77Å; M83-M112 HydrophobicContact CB-CG 4.01Å; M83-M112 HydrophobicContact CB-SD 4.31Å; M83-M112 HydrophobicContact CE-CG 3.82Å; M83-M112 HydrophobicContact SD-CG 3.9Å; M83-L115 HydrophobicContact CE-CB 4.49Å; M83-L115 HydrophobicContact CE-CD2 4.08Å
84M93.5Very high90.7Very high27 Ų2746.5 Ų46.513%0.13325%0.251CS..Hα-helixtrans-58.9-45.7174.4-81.8-62.4-63.300112.2F80 E86 I87 M88 M112 H155F80-M84 HydrophobicContact CD1-CG 3.97Å; F80-M84 HydrophobicContact CE1-CG 3.64Å; F80-M84 HydrophobicContact CE1-SD 4.36Å; F80-M84 HydrophobicContact CZ-CG 4.34Å; F80-M84 PolarHBondContact O-N 3.44Å; M84-E86 VanDerWaalsContact C-N 3.31Å; M84-E86 PolarHBondContact O-N 3.22Å; M84-I87 PolarHBondContact O-N 2.81Å; M84-M88 WeakPolarHBondContact O-CG 3.23Å; M84-M88 PolarHBondContact O-N 3.43Å; M84-M112 HydrophobicContact CG-CE 3.79Å; M84-M112 HydrophobicContact SD-CE 3.35Å; M84-M112 WeakPolarHBondContact SD-CE 3.38Å; M84-M112 HydrophobicContact SD-SD 4.37Å; M84-H155 HydrophobicContact CE-CB 3.63Å; M84-H155 HydrophobicContact SD-CB 4.06Å
85K93.1Very high89.9Confident135 Ų13545.5 Ų45.559%0.58725%0.246SC*.Hα-helixtrans-61.2-41.3177.9-172-179.2-179.6-177.20111.8D81 N82 M83 M88 N89D81-K85 WeakPolarHBondContact O-CB 2.99Å; D81-K85 PolarHBondContact O-N 3.4Å; N82-K85 PolarHBondContact O-N 3.38Å; M83-K85 PolarHBondContact O-N 3.22Å; K85-M88 PolarHBondContact O-N 3.39Å; K85-N89 PolarHBondContact O-N 3.45Å; K85-N89 PolarHBondContact O-ND2 2.88Å
86E92Very high89Confident61 Ų6148.1 Ų48.129%0.28527%0.27SS..Hα-helixtrans-64.8-41.7177.7-167.460-152.100111.7N82 M83 M84 M88 N89 Q90 F104 I108N82-E86 PolarHBondContact O-N 3.45Å; M83-E86 PolarHBondContact O-N 3.49Å; M84-E86 VanDerWaalsContact C-N 3.31Å; M84-E86 PolarHBondContact O-N 3.22Å; E86-M88 PolarHBondContact O-N 3.4Å; E86-N89 PolarHBondContact O-N 3.44Å; E86-Q90 HydrophobicContact CG-CG 4.37Å; E86-Q90 WeakPolarHBondContact O-CB 3.35Å; E86-Q90 VanDerWaalsContact O-CG 3.22Å; E86-Q90 WeakPolarHBondContact O-CG 3.4Å; E86-Q90 PolarHBondContact O-N 3Å; E86-Q90 VanDerWaalsContact O-N 3.17Å; E86-Q90 VanDerWaalsContact OE1-CG 3.24Å; E86-Q90 WeakPolarHBondContact OE1-CG 3.4Å; E86-Q90 PolarHBondContact OE1-NE2 3.16Å; E86-F104 HydrophobicContact CG-CE1 3.77Å; E86-F104 HydrophobicContact CG-CZ 3.84Å; E86-I108 HydrophobicContact CB-CD1 4.06Å; E86-I108 HydrophobicContact CG-CD1 3.7Å
87I91.6Very high88.2Confident0 Ų056.6 Ų56.60%031%0.309CS..Hα-helixtrans-56-53.9171.9-69.4169.7000109.8M83 M84 N89 Q90 V91 L105 I108 L109 M112M83-I87 WeakPolarHBondContact O-CG1 3.37Å; M83-I87 PolarHBondContact O-N 3.39Å; M84-I87 PolarHBondContact O-N 2.81Å; I87-N89 VanDerWaalsContact C-N 3.28Å; I87-N89 PolarHBondContact O-N 3.09Å; I87-Q90 PolarHBondContact O-N 2.97Å; I87-Q90 VanDerWaalsContact O-N 3.16Å; I87-V91 VanDerWaalsContact O-CB 3.3Å; I87-V91 WeakPolarHBondContact O-CB 3.44Å; I87-V91 PolarHBondContact O-N 3.05Å; I87-L105 HydrophobicContact CB-CD2 4.38Å; I87-L105 HydrophobicContact CG1-CD2 4.13Å; I87-L105 HydrophobicContact CG2-CD2 4.44Å; I87-I108 HydrophobicContact CD1-CB 4.49Å; I87-I108 HydrophobicContact CD1-CG2 3.78Å; I87-I108 HydrophobicContact CG1-CB 4.3Å; I87-I108 HydrophobicContact CG1-CD1 4.48Å; I87-I108 HydrophobicContact CG1-CG2 3.79Å; I87-L109 HydrophobicContact CD1-CD2 3.77Å; I87-L109 HydrophobicContact CD1-CG 4.23Å; I87-M112 HydrophobicContact CD1-SD 3.53Å; I87-M112 VanDerWaalsContact CD1-SD 3.53Å
88M89.8Confident87.6Confident97 Ų9759 Ų5948%0.47832%0.322SS..Hα-helixtrans-61.2-34.4-175.4-66.7-56.7-63.400113.4M84 K85 E86 V162M84-M88 WeakPolarHBondContact O-CG 3.23Å; M84-M88 PolarHBondContact O-N 3.43Å; K85-M88 PolarHBondContact O-N 3.39Å; E86-M88 PolarHBondContact O-N 3.4Å; M88-V162 HydrophobicContact CE-CG2 4.23Å; M88-V162 HydrophobicContact SD-CG1 3.93Å; M88-V162 HydrophobicContact SD-CG2 4.15Å
89N89.8Confident87.1Confident103 Ų10361.8 Ų61.855%0.55134%0.335SS*.Hα-helixtrans-71.1-36.3178.1-70.4-18.2000112.8K85 E86 I87K85-N89 PolarHBondContact O-N 3.45Å; K85-N89 PolarHBondContact O-ND2 2.88Å; E86-N89 PolarHBondContact O-N 3.44Å; I87-N89 VanDerWaalsContact C-N 3.28Å; I87-N89 PolarHBondContact O-N 3.09Å
90Q87.4Confident86.8Confident58 Ų5868.8 Ų68.827%0.27137%0.368SS..Hα-helixtrans-99.6-19.3-168.1-62.8-70.33.400113.2E86 I87 G92 E93 L101 F104 L105E86-Q90 HydrophobicContact CG-CG 4.37Å; E86-Q90 WeakPolarHBondContact O-CB 3.35Å; E86-Q90 VanDerWaalsContact O-CG 3.22Å; E86-Q90 WeakPolarHBondContact O-CG 3.4Å; E86-Q90 PolarHBondContact O-N 3Å; E86-Q90 VanDerWaalsContact O-N 3.17Å; E86-Q90 VanDerWaalsContact OE1-CG 3.24Å; E86-Q90 WeakPolarHBondContact OE1-CG 3.4Å; E86-Q90 PolarHBondContact OE1-NE2 3.16Å; I87-Q90 PolarHBondContact O-N 2.97Å; I87-Q90 VanDerWaalsContact O-N 3.16Å; Q90-G92 VanDerWaalsContact C-N 3.26Å; Q90-G92 PolarHBondContact O-N 3.2Å; Q90-E93 PolarHBondContact O-N 3.13Å; Q90-L101 HydrophobicContact CB-CD1 4.09Å; Q90-F104 HydrophobicContact CG-CE1 4.36Å; Q90-L105 HydrophobicContact CB-CD2 4.24Å
91V85.8Confident86.4Confident9 Ų969.6 Ų69.66%0.05537%0.372CS..G310 helixtrans-65.3-26.6-171.789.10000113.7I87 E93 L94 L105 V162 Y163I87-V91 VanDerWaalsContact O-CB 3.3Å; I87-V91 WeakPolarHBondContact O-CB 3.44Å; I87-V91 PolarHBondContact O-N 3.05Å; V91-E93 PolarHBondContact O-N 3.43Å; V91-L94 HydrophobicContact CG2-CD2 4.44Å; V91-L94 WeakPolarHBondContact O-CB 3.33Å; V91-L94 PolarHBondContact O-N 2.89Å; V91-L94 VanDerWaalsContact O-N 3.16Å; V91-L105 HydrophobicContact CG2-CD1 4.45Å; V91-V162 HydrophobicContact CB-CG1 4.47Å; V91-V162 HydrophobicContact CG1-CG1 3.87Å; V91-V162 VanDerWaalsContact CG1-O 3.23Å; V91-V162 WeakPolarHBondContact CG1-O 3.42Å; V91-V162 HydrophobicContact CG2-CG1 4.22Å; V91-Y163 HydrophobicContact CG2-CD1 3.3Å; V91-Y163 HydrophobicContact CG2-CE1 3.31Å; V91-Y163 HydrophobicContact CG2-CG 4.12Å
92G80.3Confident86Confident52 Ų5269 Ų6954%0.53637%0.37SS..G310 helixtrans-60.6-34.7-179.300000113.1Q90 L94 R166Q90-G92 VanDerWaalsContact C-N 3.26Å; Q90-G92 PolarHBondContact O-N 3.2Å; G92-L94 VanDerWaalsContact C-N 3.34Å; G92-R166 PolarHBondContact O-NH1 3.39Å; G92-R166 PolarHBondContact O-NH2 2.89Å
93E81.3Confident85.8Confident132 Ų13266.8 Ų66.862%0.61737%0.365SS*.G310 helixtrans-86.2-2.8-178.6-60.1-173.7-178.700113.6Q90 V91 S95 L101Q90-E93 PolarHBondContact O-N 3.13Å; V91-E93 PolarHBondContact O-N 3.43Å; E93-S95 PolarHBondContact O-N 3.43Å; E93-L101 HydrophobicContact CB-CD2 3.72Å
94L81.2Confident85.6Confident0 Ų070 Ų700%038%0.379CS..  trans-58128.2-178.2179.461.8000110.6V91 G92 C102 L105 Y163 R166 L169V91-L94 HydrophobicContact CG2-CD2 4.44Å; V91-L94 WeakPolarHBondContact O-CB 3.33Å; V91-L94 PolarHBondContact O-N 2.89Å; V91-L94 VanDerWaalsContact O-N 3.16Å; G92-L94 VanDerWaalsContact C-N 3.34Å; L94-C102 HydrophobicContact CD1-CB 4.12Å; L94-L105 HydrophobicContact CB-CD1 4.36Å; L94-L105 HydrophobicContact CD1-CD1 3.98Å; L94-L105 HydrophobicContact CD2-CD1 4.42Å; L94-L105 HydrophobicContact CG-CD1 4.48Å; L94-Y163 HydrophobicContact CD2-CD1 3.83Å; L94-Y163 HydrophobicContact CD2-CE1 4.44Å; L94-R166 HydrophobicContact CD2-CB 4.11Å; L94-R166 HydrophobicContact CG-CB 4.46Å; L94-R166 WeakPolarHBondContact O-CD 3.41Å; L94-R166 VanDerWaalsContact O-CZ 3.27Å; L94-R166 PolarHBondContact O-NE 2.87Å; L94-R166 PolarHBondContact O-NH1 3.37Å; L94-L169 HydrophobicContact CD1-CD1 4.02Å; L94-L169 HydrophobicContact CD2-CD1 4.25Å; L94-L169 HydrophobicContact CG-CD1 4Å
95S78.1Confident85.5Confident41 Ų4168.7 Ų68.729%0.28737%0.373SS..  trans-147.7161.3172.4760000110.5E93 Q97 N98E93-S95 PolarHBondContact O-N 3.43Å; S95-Q97 PolarHBondContact O-N 3.43Å; S95-Q97 VanDerWaalsContact O-N 3.13Å; S95-Q97 PolarHBondContact OG-N 3.49Å; S95-N98 PolarHBondContact O-N 3.07Å; S95-N98 VanDerWaalsContact O-N 3.15Å; S95-N98 PolarHBondContact OG-N 3.15Å
96S73.9Confident85.5Confident101 Ų10165.9 Ų65.971%0.70636%0.358SS*.THydrogen-bonded Turntrans-62.8-16.1174.654.30000113.2
97Q76.3Confident85.5Confident177 Ų17767.3 Ų67.383%0.82737%0.368SS*.THydrogen-bonded Turntrans-91.5-22.8178.7-62.4177.8-6.300112.4S95 T99S95-Q97 PolarHBondContact O-N 3.43Å; S95-Q97 VanDerWaalsContact O-N 3.13Å; S95-Q97 PolarHBondContact OG-N 3.49Å; Q97-T99 PolarHBondContact O-N 3.02Å
98N82.1Confident85.6Confident57 Ų5767.3 Ų67.331%0.30537%0.368SS..  trans-94.275.9-179.3-165.2-13.7000111S95 E100 L101 C102S95-N98 PolarHBondContact O-N 3.07Å; S95-N98 VanDerWaalsContact O-N 3.15Å; S95-N98 PolarHBondContact OG-N 3.15Å; N98-E100 VanDerWaalsContact C-N 3.33Å; N98-E100 PolarHBondContact O-N 2.82Å; N98-L101 HydrophobicContact CB-CB 4.2Å; N98-L101 WeakPolarHBondContact ND2-CB 3.43Å; N98-L101 PolarHBondContact O-N 3.17Å; N98-L101 VanDerWaalsContact OD1-CB 3.29Å; N98-L101 WeakPolarHBondContact OD1-CB 3.37Å; N98-L101 PolarHBondContact OD1-N 3.05Å; N98-C102 WeakPolarHBondContact O-CB 3.26Å; N98-C102 PolarHBondContact O-N 2.85Å
99T83.3Confident85.8Confident102 Ų10262.7 Ų62.763%0.62635%0.345SS*.Hα-helixtrans-65.8-32.4-176.351.40000113.1Q97 A103Q97-T99 PolarHBondContact O-N 3.02Å; T99-A103 WeakPolarHBondContact O-CB 3.32Å; T99-A103 PolarHBondContact O-N 3.1Å
100E86.6Confident86Confident162 Ų16261.6 Ų61.676%0.75734%0.337SS*.Hα-helixtrans-67.7-47.3177.5-67.3-175.3174.900111.7N98 C102 A103 F104N98-E100 VanDerWaalsContact C-N 3.33Å; N98-E100 PolarHBondContact O-N 2.82Å; E100-C102 VanDerWaalsContact C-N 3.32Å; E100-C102 PolarHBondContact O-N 3.22Å; E100-A103 PolarHBondContact O-N 3.39Å; E100-F104 WeakPolarHBondContact O-CB 3.45Å; E100-F104 PolarHBondContact O-N 2.9Å
101L87Confident86.3Confident16 Ų1659 Ų598%0.08433%0.325CS..Hα-helixtrans-63.9-39.5175.5-17564.5000111.7Q90 E93 N98 F104 L105Q90-L101 HydrophobicContact CB-CD1 4.09Å; E93-L101 HydrophobicContact CB-CD2 3.72Å; N98-L101 HydrophobicContact CB-CB 4.2Å; N98-L101 WeakPolarHBondContact ND2-CB 3.43Å; N98-L101 PolarHBondContact O-N 3.17Å; N98-L101 VanDerWaalsContact OD1-CB 3.29Å; N98-L101 WeakPolarHBondContact OD1-CB 3.37Å; N98-L101 PolarHBondContact OD1-N 3.05Å; L101-F104 HydrophobicContact CD1-CD1 4.49Å; L101-F104 PolarHBondContact O-N 3.3Å; L101-L105 HydrophobicContact CG-CD1 4.25Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 3.17Å
102C86.4Confident86.8Confident22 Ų2258.6 Ų58.615%0.14932%0.323CS..Hα-helixtrans-60.8-47.7174.3-173.90000111.1L94 N98 E100 F104 L105 R106L94-C102 HydrophobicContact CD1-CB 4.12Å; N98-C102 WeakPolarHBondContact O-CB 3.26Å; N98-C102 PolarHBondContact O-N 2.85Å; E100-C102 VanDerWaalsContact C-N 3.32Å; E100-C102 PolarHBondContact O-N 3.22Å; C102-F104 VanDerWaalsContact C-N 3.32Å; C102-F104 PolarHBondContact O-N 3.43Å; C102-L105 PolarHBondContact O-N 3.4Å; C102-R106 WeakPolarHBondContact O-CB 3.44Å; C102-R106 WeakPolarHBondContact O-CG 3.5Å; C102-R106 PolarHBondContact O-N 3.21Å
103A88.7Confident87.5Confident48 Ų4857.1 Ų57.140%0.39730%0.303SS..Hα-helixtrans-61.6-40.3175.800000111.9T99 E100 R106 N107T99-A103 WeakPolarHBondContact O-CB 3.32Å; T99-A103 PolarHBondContact O-N 3.1Å; E100-A103 PolarHBondContact O-N 3.39Å; A103-R106 PolarHBondContact O-N 3.35Å; A103-N107 WeakPolarHBondContact O-CB 3.44Å; A103-N107 PolarHBondContact O-N 2.85Å; A103-N107 PolarHBondContact O-ND2 3.26Å
104F89.8Confident88.1Confident70 Ų7054 Ų5431%0.30729%0.289SS..Hα-helixtrans-61.9-49.8176.5179.1-109000112.4E86 Q90 E100 L101 C102 R106 N107 I108E86-F104 HydrophobicContact CG-CE1 3.77Å; E86-F104 HydrophobicContact CG-CZ 3.84Å; Q90-F104 HydrophobicContact CG-CE1 4.36Å; E100-F104 WeakPolarHBondContact O-CB 3.45Å; E100-F104 PolarHBondContact O-N 2.9Å; L101-F104 HydrophobicContact CD1-CD1 4.49Å; L101-F104 PolarHBondContact O-N 3.3Å; C102-F104 VanDerWaalsContact C-N 3.32Å; C102-F104 PolarHBondContact O-N 3.43Å; F104-R106 PolarHBondContact O-N 2.94Å; F104-N107 WeakPolarHBondContact O-CB 3.47Å; F104-N107 PolarHBondContact O-N 2.61Å; F104-N107 VanDerWaalsContact O-N 3.16Å; F104-I108 HydrophobicContact CD1-CD1 3.95Å; F104-I108 HydrophobicContact CE1-CD1 3.46Å; F104-I108 VanDerWaalsContact CE1-CD1 3.46Å; F104-I108 HydrophobicContact CE1-CG1 4.49Å; F104-I108 HydrophobicContact CE2-CD1 4.31Å; F104-I108 HydrophobicContact CZ-CD1 3.67Å; F104-I108 HydrophobicContact CZ-CG1 4.41Å; F104-I108 WeakPolarHBondContact O-CG1 3.25Å; F104-I108 PolarHBondContact O-N 3.04Å
105L90.6Very high88.8Confident0 Ų054.1 Ų54.10%029%0.289CS..Hα-helixtrans-64.4-39.1177.7-72.7170.3000112.2I87 Q90 V91 L94 L101 C102 N107 I108 L109I87-L105 HydrophobicContact CB-CD2 4.38Å; I87-L105 HydrophobicContact CG1-CD2 4.13Å; I87-L105 HydrophobicContact CG2-CD2 4.44Å; Q90-L105 HydrophobicContact CB-CD2 4.24Å; V91-L105 HydrophobicContact CG2-CD1 4.45Å; L94-L105 HydrophobicContact CB-CD1 4.36Å; L94-L105 HydrophobicContact CD1-CD1 3.98Å; L94-L105 HydrophobicContact CD2-CD1 4.42Å; L94-L105 HydrophobicContact CG-CD1 4.48Å; L101-L105 HydrophobicContact CG-CD1 4.25Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 3.17Å; C102-L105 PolarHBondContact O-N 3.4Å; L105-N107 VanDerWaalsContact C-N 3.32Å; L105-N107 PolarHBondContact O-N 2.95Å; L105-I108 PolarHBondContact O-N 3.43Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 2.98Å
106R92.9Very high89.6Confident75 Ų7552.2 Ų52.228%0.28328%0.276SS..Hα-helixtrans-61.4-40.7172.8-72.3-179.27177.67.4111.5C102 A103 F104 L109 Q110 L169 V170 D172 L173C102-R106 WeakPolarHBondContact O-CB 3.44Å; C102-R106 WeakPolarHBondContact O-CG 3.5Å; C102-R106 PolarHBondContact O-N 3.21Å; A103-R106 PolarHBondContact O-N 3.35Å; F104-R106 PolarHBondContact O-N 2.94Å; R106-L109 PolarHBondContact O-N 2.96Å; R106-Q110 WeakPolarHBondContact O-CB 3.38Å; R106-Q110 PolarHBondContact O-N 2.97Å; R106-L169 PolarHBondContact NH1-O 3.27Å; R106-V170 HydrophobicContact CG-CG1 4.07Å; R106-D172 IonicContact CZ-OD1 2.9Å; R106-D172 IonicContact CZ-OD2 2.8Å; R106-D172 IonicContact NH1-OD1 2.67Å; R106-D172 PolarHBondContact NH1-OD1 2.98Å; R106-D172 IonicContact NH1-OD2 2.68Å; R106-D172 IonicContact NH2-OD1 3.08Å; R106-D172 IonicContact NH2-OD2 3.58Å; R106-D172 PolarHBondContact NH2-OD2 2.84Å; R106-L173 HydrophobicContact CB-CD1 3.62Å; R106-L173 HydrophobicContact CG-CD1 3.77Å; R106-L173 WeakPolarHBondContact O-CD1 3.31Å
107N93.2Very high90.6Very high91 Ų9150 Ų5049%0.48726%0.256SS..Hα-helixtrans-63.9-40.3175.6-72-22.2000112.2W41 A103 F104 L105 Q110 A111W41-N107 HydrophobicContact CH2-CB 4.05Å; A103-N107 WeakPolarHBondContact O-CB 3.44Å; A103-N107 PolarHBondContact O-N 2.85Å; A103-N107 PolarHBondContact O-ND2 3.26Å; F104-N107 WeakPolarHBondContact O-CB 3.47Å; F104-N107 PolarHBondContact O-N 2.61Å; F104-N107 VanDerWaalsContact O-N 3.16Å; L105-N107 VanDerWaalsContact C-N 3.32Å; L105-N107 PolarHBondContact O-N 2.95Å; N107-Q110 PolarHBondContact O-N 3.28Å; N107-A111 VanDerWaalsContact O-CB 3.32Å; N107-A111 WeakPolarHBondContact O-CB 3.11Å; N107-A111 PolarHBondContact O-N 3.44Å
108I93.4Very high91.4Very high1 Ų141.7 Ų41.71%0.00522%0.217CC..Hα-helixtrans-64.6-46.6175.8-62.9168.7000110.8W41 M83 E86 I87 F104 L105 Q110 A111 M112W41-I108 HydrophobicContact CZ2-CG1 4.37Å; M83-I108 HydrophobicContact CB-CG2 3.68Å; M83-I108 HydrophobicContact CG-CG2 4.04Å; M83-I108 HydrophobicContact SD-CG2 4.45Å; E86-I108 HydrophobicContact CB-CD1 4.06Å; E86-I108 HydrophobicContact CG-CD1 3.7Å; I87-I108 HydrophobicContact CD1-CB 4.49Å; I87-I108 HydrophobicContact CD1-CG2 3.78Å; I87-I108 HydrophobicContact CG1-CB 4.3Å; I87-I108 HydrophobicContact CG1-CD1 4.48Å; I87-I108 HydrophobicContact CG1-CG2 3.79Å; F104-I108 HydrophobicContact CD1-CD1 3.95Å; F104-I108 HydrophobicContact CE1-CD1 3.46Å; F104-I108 VanDerWaalsContact CE1-CD1 3.46Å; F104-I108 HydrophobicContact CE1-CG1 4.49Å; F104-I108 HydrophobicContact CE2-CD1 4.31Å; F104-I108 HydrophobicContact CZ-CD1 3.67Å; F104-I108 HydrophobicContact CZ-CG1 4.41Å; F104-I108 WeakPolarHBondContact O-CG1 3.25Å; F104-I108 PolarHBondContact O-N 3.04Å; L105-I108 PolarHBondContact O-N 3.43Å; I108-Q110 VanDerWaalsContact C-N 3.3Å; I108-Q110 PolarHBondContact O-N 3.44Å; I108-A111 WeakPolarHBondContact O-CB 3.32Å; I108-A111 PolarHBondContact O-N 3.39Å; I108-A111 VanDerWaalsContact O-N 3.12Å; I108-M112 HydrophobicContact CG2-CG 4.48Å; I108-M112 HydrophobicContact CG2-SD 4.2Å; I108-M112 WeakPolarHBondContact O-CG 3.24Å; I108-M112 PolarHBondContact O-N 2.9Å
109L94Very high92.1Very high0 Ų039.1 Ų39.10%020%0.204CC..Hα-helixtrans-60.6-41.6177.6-72.3171.6000111.6I87 L105 R106 A111 M112 V113 V170 L173 L174 L177I87-L109 HydrophobicContact CD1-CD2 3.77Å; I87-L109 HydrophobicContact CD1-CG 4.23Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 2.98Å; R106-L109 PolarHBondContact O-N 2.96Å; L109-A111 VanDerWaalsContact C-N 3.33Å; L109-A111 PolarHBondContact O-N 3.32Å; L109-M112 HydrophobicContact CD2-SD 4.29Å; L109-M112 WeakPolarHBondContact O-CB 3.46Å; L109-M112 PolarHBondContact O-N 3.16Å; L109-V113 WeakPolarHBondContact O-CG2 3.21Å; L109-V113 PolarHBondContact O-N 2.84Å; L109-V170 HydrophobicContact CD1-CB 3.7Å; L109-V170 HydrophobicContact CD1-CG1 3.92Å; L109-V170 HydrophobicContact CD1-CG2 4.39Å; L109-L173 HydrophobicContact CB-CB 4.01Å; L109-L173 HydrophobicContact CB-CD1 4.06Å; L109-L173 HydrophobicContact CD1-CB 4.16Å; L109-L173 HydrophobicContact CD1-CD1 4.45Å; L109-L174 HydrophobicContact CD1-CD2 4.44Å; L109-L174 HydrophobicContact CD1-CG 4.41Å; L109-L174 HydrophobicContact CD2-CD2 3.88Å; L109-L177 HydrophobicContact CD2-CD2 4.42Å
110Q94.3Very high92.7Very high80 Ų8034.5 Ų34.537%0.37418%0.176SC..Hα-helixtrans-63.2-39.4174.8-172.264.454.400112R106 N107 I108 M112 V113 Q114 L173R106-Q110 WeakPolarHBondContact O-CB 3.38Å; R106-Q110 PolarHBondContact O-N 2.97Å; N107-Q110 PolarHBondContact O-N 3.28Å; I108-Q110 VanDerWaalsContact C-N 3.3Å; I108-Q110 PolarHBondContact O-N 3.44Å; Q110-M112 VanDerWaalsContact C-N 3.34Å; Q110-V113 WeakPolarHBondContact O-CB 3.36Å; Q110-V113 PolarHBondContact O-N 2.95Å; Q110-Q114 WeakPolarHBondContact O-CG 3.45Å; Q110-Q114 PolarHBondContact O-N 3.26Å; Q110-L173 VanDerWaalsContact OE1-CD2 3.31Å
111A93.4Very high93.1Very high4 Ų428 Ų283%0.03315%0.146CC..Hα-helixtrans-63.7-39.4175.400000111.9W41 L45 M83 N107 I108 L109 Q114 L115W41-A111 HydrophobicContact CD2-CB 4.32Å; W41-A111 HydrophobicContact CE3-CB 3.42Å; W41-A111 VanDerWaalsContact CE3-CB 3.42Å; W41-A111 HydrophobicContact CZ3-CB 3.55Å; L45-A111 HydrophobicContact CD1-CB 3.6Å; M83-A111 HydrophobicContact SD-CB 3.77Å; N107-A111 VanDerWaalsContact O-CB 3.32Å; N107-A111 WeakPolarHBondContact O-CB 3.11Å; N107-A111 PolarHBondContact O-N 3.44Å; I108-A111 WeakPolarHBondContact O-CB 3.32Å; I108-A111 PolarHBondContact O-N 3.39Å; I108-A111 VanDerWaalsContact O-N 3.12Å; L109-A111 VanDerWaalsContact C-N 3.33Å; L109-A111 PolarHBondContact O-N 3.32Å; A111-Q114 PolarHBondContact O-N 3.37Å; A111-L115 PolarHBondContact O-N 3.14Å
112M96.2Very high93.5Very high0 Ų027.2 Ų27.20%014%0.142CC..Hα-helixtrans-63.5-41.8173.6-67.917073.300112.1F80 M83 M84 I87 I108 L109 Q110 Q114 L115 I116 L177F80-M112 HydrophobicContact CD2-CB 4.47Å; F80-M112 HydrophobicContact CD2-CE 4.16Å; F80-M112 HydrophobicContact CD2-CG 4.27Å; F80-M112 HydrophobicContact CE1-CE 3.85Å; F80-M112 HydrophobicContact CE2-CB 3.98Å; F80-M112 HydrophobicContact CE2-CE 3.35Å; F80-M112 HydrophobicContact CE2-CG 4.04Å; F80-M112 HydrophobicContact CZ-CE 3.15Å; M83-M112 HydrophobicContact CB-CG 4.01Å; M83-M112 HydrophobicContact CB-SD 4.31Å; M83-M112 HydrophobicContact CE-CG 3.82Å; M83-M112 HydrophobicContact SD-CG 3.9Å; M84-M112 HydrophobicContact CG-CE 3.79Å; M84-M112 HydrophobicContact SD-CE 3.35Å; M84-M112 WeakPolarHBondContact SD-CE 3.38Å; M84-M112 HydrophobicContact SD-SD 4.37Å; I87-M112 HydrophobicContact CD1-SD 3.53Å; I87-M112 VanDerWaalsContact CD1-SD 3.53Å; I108-M112 HydrophobicContact CG2-CG 4.48Å; I108-M112 HydrophobicContact CG2-SD 4.2Å; I108-M112 WeakPolarHBondContact O-CG 3.24Å; I108-M112 PolarHBondContact O-N 2.9Å; L109-M112 HydrophobicContact CD2-SD 4.29Å; L109-M112 WeakPolarHBondContact O-CB 3.46Å; L109-M112 PolarHBondContact O-N 3.16Å; Q110-M112 VanDerWaalsContact C-N 3.34Å; M112-Q114 VanDerWaalsContact C-N 3.34Å; M112-Q114 PolarHBondContact O-N 2.66Å; M112-L115 WeakPolarHBondContact O-CB 3.36Å; M112-L115 PolarHBondContact O-N 3.12Å; M112-I116 WeakPolarHBondContact O-CG1 3.4Å; M112-I116 PolarHBondContact O-N 3.21Å; M112-L177 HydrophobicContact CB-CD1 3.72Å; M112-L177 HydrophobicContact CE-CD2 4.16Å
113V94.8Very high93.9Very high21 Ų2126.2 Ų26.213%0.12714%0.135CC..Hα-helixtrans-58.6-46.2173.5173.80000110.7L109 Q110 L115 I116 D117 L177 E180L109-V113 WeakPolarHBondContact O-CG2 3.21Å; L109-V113 PolarHBondContact O-N 2.84Å; Q110-V113 WeakPolarHBondContact O-CB 3.36Å; Q110-V113 PolarHBondContact O-N 2.95Å; V113-L115 VanDerWaalsContact C-N 3.3Å; V113-L115 PolarHBondContact O-N 2.89Å; V113-I116 PolarHBondContact O-N 3.31Å; V113-D117 PolarHBondContact O-N 3.29Å; V113-L177 HydrophobicContact CB-CD1 4.5Å; V113-L177 HydrophobicContact CG2-CB 3.97Å; V113-L177 HydrophobicContact CG2-CD1 3.74Å; V113-E180 HydrophobicContact CG1-CG 3.99Å
114Q93.6Very high94.2Very high67 Ų6730.7 Ų30.731%0.31314%0.142SC..Hα-helixtrans-64.5-33.5178-68.4-175.221.200113L45 K49 Q110 A111 M112 A118L45-Q114 HydrophobicContact CD2-CB 4.44Å; K49-Q114 VanDerWaalsContact NZ-OE1 3.15Å; Q110-Q114 WeakPolarHBondContact O-CG 3.45Å; Q110-Q114 PolarHBondContact O-N 3.26Å; A111-Q114 PolarHBondContact O-N 3.37Å; M112-Q114 VanDerWaalsContact C-N 3.34Å; M112-Q114 PolarHBondContact O-N 2.66Å; Q114-A118 PolarHBondContact O-N 3.1Å
115L95.2Very high94.4Very high2 Ų228.4 Ų28.41%0.0113%0.132CC..Hα-helixtrans-64.5-46.5173.9-165.778.8000111.1L45 L48 A76 F80 M83 A111 M112 V113 D117 A118 L119L45-L115 HydrophobicContact CD2-CB 3.83Å; L45-L115 HydrophobicContact CD2-CD1 3.55Å; L45-L115 HydrophobicContact CD2-CG 4.32Å; L48-L115 HydrophobicContact CD2-CD1 3.54Å; A76-L115 HydrophobicContact CB-CD1 4.19Å; F80-L115 HydrophobicContact CB-CD2 3.64Å; F80-L115 HydrophobicContact CD2-CD2 3.65Å; F80-L115 HydrophobicContact CG-CD2 4.11Å; M83-L115 HydrophobicContact CE-CB 4.49Å; M83-L115 HydrophobicContact CE-CD2 4.08Å; A111-L115 PolarHBondContact O-N 3.14Å; M112-L115 WeakPolarHBondContact O-CB 3.36Å; M112-L115 PolarHBondContact O-N 3.12Å; V113-L115 VanDerWaalsContact C-N 3.3Å; V113-L115 PolarHBondContact O-N 2.89Å; L115-D117 VanDerWaalsContact C-N 3.29Å; L115-D117 PolarHBondContact O-N 3.29Å; L115-A118 PolarHBondContact O-N 3.28Å; L115-L119 WeakPolarHBondContact O-CG 3.5Å; L115-L119 PolarHBondContact O-N 2.86Å
116I96.4Very high94.5Very high0 Ų028.4 Ų28.40%013%0.132CC..Hα-helixtrans-62.9-37.8178.9-68179.2000111F80 M112 V113 L119 S120 V148 T152 L177 E180 A181 L184F80-I116 HydrophobicContact CE2-CD1 4.43Å; M112-I116 WeakPolarHBondContact O-CG1 3.4Å; M112-I116 PolarHBondContact O-N 3.21Å; V113-I116 PolarHBondContact O-N 3.31Å; I116-L119 PolarHBondContact O-N 3.31Å; I116-S120 PolarHBondContact O-N 3.35Å; I116-S120 PolarHBondContact O-OG 3.07Å; I116-V148 HydrophobicContact CG1-CG1 4.18Å; I116-T152 HydrophobicContact CD1-CG2 4.06Å; I116-L177 HydrophobicContact CD1-CD1 3.58Å; I116-L177 HydrophobicContact CD1-CG 4.29Å; I116-E180 HydrophobicContact CB-CB 4.47Å; I116-E180 HydrophobicContact CG2-CB 3.73Å; I116-A181 HydrophobicContact CD1-CB 4.25Å; I116-L184 HydrophobicContact CG2-CB 4.12Å; I116-L184 HydrophobicContact CG2-CD2 3.79Å
117D93.9Very high94.4Very high55 Ų5525.6 Ų25.629%0.29413%0.126SC..Hα-helixtrans-63.4-45173.9-178.643.8000111.8V113 L115 L119 S120 I121V113-D117 PolarHBondContact O-N 3.29Å; L115-D117 VanDerWaalsContact C-N 3.29Å; L115-D117 PolarHBondContact O-N 3.29Å; D117-L119 VanDerWaalsContact C-N 3.33Å; D117-L119 PolarHBondContact O-N 3.33Å; D117-S120 CarbonylContact O-C 3.44Å; D117-S120 WeakPolarHBondContact O-CA 3.47Å; D117-S120 VanDerWaalsContact O-CB 3.26Å; D117-S120 WeakPolarHBondContact O-CB 3.38Å; D117-S120 PolarHBondContact O-N 3.17Å; D117-I121 PolarHBondContact O-N 3.28Å
118A93.7Very high94.3Very high2 Ų224.8 Ų24.82%0.01713%0.128CC..Hα-helixtrans-59.8-41.5174.400000112.4L48 T52 Q114 L115 S120 I121 C122L48-A118 HydrophobicContact CD2-CB 3.8Å; L48-A118 HydrophobicContact CG-CB 4.07Å; T52-A118 HydrophobicContact CG2-CB 4.43Å; Q114-A118 PolarHBondContact O-N 3.1Å; L115-A118 PolarHBondContact O-N 3.28Å; A118-S120 VanDerWaalsContact C-N 3.28Å; A118-S120 PolarHBondContact O-N 2.66Å; A118-I121 WeakPolarHBondContact O-CB 3.42Å; A118-I121 PolarHBondContact O-N 2.82Å; A118-C122 PolarHBondContact O-N 2.95Å
119L96.3Very high94.1Very high3 Ų326.8 Ų26.82%0.01614%0.137CC..Hα-helixtrans-64.1-33.6172.9-65.2176000112.1L73 L115 I116 D117 I121 C122 V123 I145 V148 L184L73-L119 HydrophobicContact CD2-CD2 3.61Å; L115-L119 WeakPolarHBondContact O-CG 3.5Å; L115-L119 PolarHBondContact O-N 2.86Å; I116-L119 PolarHBondContact O-N 3.31Å; D117-L119 VanDerWaalsContact C-N 3.33Å; D117-L119 PolarHBondContact O-N 3.33Å; L119-I121 VanDerWaalsContact C-N 3.3Å; L119-I121 PolarHBondContact O-N 2.96Å; L119-C122 WeakPolarHBondContact O-CB 3.41Å; L119-C122 PolarHBondContact O-N 3.3Å; L119-V123 PolarHBondContact O-N 3.42Å; L119-V123 VanDerWaalsContact O-N 3.12Å; L119-I145 HydrophobicContact CB-CG1 4.46Å; L119-V148 HydrophobicContact CD1-CB 4.3Å; L119-V148 HydrophobicContact CD1-CG1 4.15Å; L119-V148 HydrophobicContact CD1-CG2 4.07Å; L119-L184 HydrophobicContact CB-CD1 4.32Å; L119-L184 HydrophobicContact CB-CD2 3.94Å; L119-L184 HydrophobicContact CD1-CD2 4.4Å
120S95.9Very high93.4Very high6 Ų636.5 Ų36.54%0.04218%0.182CC..Hα-helixtrans-67.2-31.6175.2-57.80000112.1I116 D117 A118 R124I116-S120 PolarHBondContact O-N 3.35Å; I116-S120 PolarHBondContact O-OG 3.07Å; D117-S120 CarbonylContact O-C 3.44Å; D117-S120 WeakPolarHBondContact O-CA 3.47Å; D117-S120 VanDerWaalsContact O-CB 3.26Å; D117-S120 WeakPolarHBondContact O-CB 3.38Å; D117-S120 PolarHBondContact O-N 3.17Å; A118-S120 VanDerWaalsContact C-N 3.28Å; A118-S120 PolarHBondContact O-N 2.66Å; S120-R124 WeakPolarHBondContact O-CB 3.37Å; S120-R124 WeakPolarHBondContact O-CG 3.4Å; S120-R124 PolarHBondContact O-N 3.45Å; S120-R124 PolarHBondContact O-NE 3.02Å
121I94.9Very high92.3Very high25 Ų2539.5 Ų39.513%0.12820%0.196CC..Hα-helixtrans-64.4-43.8170.5-60.5167.3000110T52 E53 L56 D117 A118 L119 V123 R124 H125T52-I121 WeakPolarHBondContact O-CG2 3.36Å; E53-I121 HydrophobicContact CG-CD1 3.84Å; L56-I121 HydrophobicContact CD2-CG2 4.18Å; D117-I121 PolarHBondContact O-N 3.28Å; A118-I121 WeakPolarHBondContact O-CB 3.42Å; A118-I121 PolarHBondContact O-N 2.82Å; L119-I121 VanDerWaalsContact C-N 3.3Å; L119-I121 PolarHBondContact O-N 2.96Å; I121-V123 PolarHBondContact O-N 3.13Å; I121-R124 PolarHBondContact O-N 3.2Å; I121-H125 PolarHBondContact O-N 3.41Å
122C95.6Very high91.3Very high0 Ų042.3 Ų42.30%023%0.225CC..Hα-helixtrans-55.8-47.8175.8-61.40000112.4L56 F69 A118 L119 H125 V126 L141L56-C122 HydrophobicContact CD2-CB 4.47Å; F69-C122 HydrophobicContact CE1-CB 3.83Å; F69-C122 HydrophobicContact CZ-CB 4.02Å; A118-C122 PolarHBondContact O-N 2.95Å; L119-C122 WeakPolarHBondContact O-CB 3.41Å; L119-C122 PolarHBondContact O-N 3.3Å; C122-H125 PolarHBondContact O-N 2.93Å; C122-V126 PolarHBondContact O-N 3.4Å; C122-L141 HydrophobicContact CB-CD1 3.86Å
123V95.7Very high90.7Very high0 Ų042.5 Ų42.50%023%0.226CC..Hα-helixtrans-66-42.1178.8179.10000111.9L119 I121 H125 V126 G127 L141 I145 L184 S187 L188 V191L119-V123 PolarHBondContact O-N 3.42Å; L119-V123 VanDerWaalsContact O-N 3.12Å; I121-V123 PolarHBondContact O-N 3.13Å; V123-H125 VanDerWaalsContact C-N 3.31Å; V123-H125 PolarHBondContact O-N 2.87Å; V123-V126 PolarHBondContact O-N 3.35Å; V123-G127 PolarHBondContact O-N 3.2Å; V123-L141 HydrophobicContact CG2-CD1 4.44Å; V123-L141 HydrophobicContact CG2-CD2 4.48Å; V123-I145 HydrophobicContact CG2-CD1 3.21Å; V123-L184 HydrophobicContact CB-CD1 4.45Å; V123-L184 HydrophobicContact CG2-CD1 3.73Å; V123-S187 VanDerWaalsContact CG1-C 3.46Å; V123-S187 WeakPolarHBondContact CG1-O 3.4Å; V123-L188 HydrophobicContact CG1-CB 4.49Å; V123-L188 HydrophobicContact CG2-CD1 4.5Å; V123-V191 HydrophobicContact CG1-CB 4.47Å; V123-V191 HydrophobicContact CG1-CG2 3.75Å
124R94Very high90.2Very high142 Ų14243.9 Ų43.954%0.53624%0.236SC..Hα-helixtrans-62.7-38.3177.6-79.9-176.2-72.9146.2-13.3112.3S120 I121 G127 S128S120-R124 WeakPolarHBondContact O-CB 3.37Å; S120-R124 WeakPolarHBondContact O-CG 3.4Å; S120-R124 PolarHBondContact O-N 3.45Å; S120-R124 PolarHBondContact O-NE 3.02Å; I121-R124 PolarHBondContact O-N 3.2Å; R124-G127 CarbonylContact O-C 3.49Å; R124-G127 PolarHBondContact O-N 3.28Å; R124-S128 PolarHBondContact O-N 3.22Å
125H94.1Very high89.8Confident22 Ų2240.8 Ų40.810%0.10222%0.222CC..Hα-helixtrans-61.8-50.2175.5-174.361.7000111.2L56 I59 I121 C122 V123 G127 S128 F129L56-H125 HydrophobicContact CD2-CB 3.72Å; L56-H125 HydrophobicContact CG-CB 4.02Å; L56-H125 PolarHBondContact O-CE1 3.26Å; L56-H125 PolarHBondContact O-NE2 3.01Å; I59-H125 PolarHBondContact O-NE2 2.91Å; I59-H125 VanDerWaalsContact O-NE2 3.07Å; I121-H125 PolarHBondContact O-N 3.41Å; C122-H125 PolarHBondContact O-N 2.93Å; V123-H125 VanDerWaalsContact C-N 3.31Å; V123-H125 PolarHBondContact O-N 2.87Å; H125-G127 VanDerWaalsContact C-N 3.27Å; H125-G127 PolarHBondContact O-N 2.95Å; H125-S128 WeakPolarHBondContact O-CB 3.34Å; H125-S128 PolarHBondContact O-N 3.41Å; H125-S128 PolarHBondContact O-OG 3.47Å; H125-F129 AromaticContact CD2-CE2 3.91Å; H125-F129 AromaticContact CE1-CZ 3.93Å; H125-F129 AromaticContact NE2-CE2 3.75Å; H125-F129 AromaticContact NE2-CZ 3.5Å
126V93.5Very high89.4Confident0 Ų043.5 Ų43.50%024%0.236CC..Hα-helixtrans-58.5-42.2174.6177.60000111.4L64 F69 C122 V123 S128 F129 L133 I138 L141 V191L64-V126 HydrophobicContact CD2-CG2 3.62Å; F69-V126 HydrophobicContact CE2-CG2 3.62Å; F69-V126 HydrophobicContact CZ-CG2 3.8Å; C122-V126 PolarHBondContact O-N 3.4Å; V123-V126 PolarHBondContact O-N 3.35Å; V126-S128 PolarHBondContact O-N 2.81Å; V126-F129 WeakPolarHBondContact O-CD2 3.49Å; V126-F129 PolarHBondContact O-N 3.16Å; V126-L133 HydrophobicContact CG1-CD1 4.14Å; V126-L133 HydrophobicContact CG1-CD2 3.89Å; V126-I138 HydrophobicContact CG1-CD1 4.15Å; V126-I138 HydrophobicContact CG1-CG2 3.99Å; V126-I138 HydrophobicContact CG2-CG2 3.9Å; V126-L141 HydrophobicContact CB-CD2 4.37Å; V126-L141 HydrophobicContact CG2-CD2 3.75Å; V126-V191 HydrophobicContact CB-CG1 4.38Å; V126-V191 HydrophobicContact CG1-CG1 3.59Å
127G90.8Very high88.9Confident16 Ų1644.4 Ų44.417%0.16524%0.244CC..THydrogen-bonded Turntrans-67.4-10.4177.900000115V123 R124 H125 R194V123-G127 PolarHBondContact O-N 3.2Å; R124-G127 CarbonylContact O-C 3.49Å; R124-G127 PolarHBondContact O-N 3.28Å; H125-G127 VanDerWaalsContact C-N 3.27Å; H125-G127 PolarHBondContact O-N 2.95Å; G127-R194 PolarHBondContact O-NH1 2.97Å; G127-R194 PolarHBondContact O-NH2 2.9Å
128S91.3Very high88.8Confident75 Ų7541.8 Ų41.852%0.52423%0.23SC..THydrogen-bonded Turntrans-85.9-16.7178.577.10000113.7R124 H125 V126R124-S128 PolarHBondContact O-N 3.22Å; H125-S128 WeakPolarHBondContact O-CB 3.34Å; H125-S128 PolarHBondContact O-N 3.41Å; H125-S128 PolarHBondContact O-OG 3.47Å; V126-S128 PolarHBondContact O-N 2.81Å
129F89.2Confident88.7Confident43 Ų4344.6 Ų44.619%0.18924%0.24CC..  trans-72.2132.8175.1-62.8-72.2000110.5L61 L64 H125 V126L61-F129 HydrophobicContact CB-CD1 4.36Å; L61-F129 HydrophobicContact CB-CD2 4.33Å; L61-F129 HydrophobicContact CB-CE1 4.29Å; L61-F129 HydrophobicContact CB-CE2 4.28Å; L61-F129 HydrophobicContact CB-CG 4.39Å; L61-F129 HydrophobicContact CB-CZ 4.25Å; L61-F129 HydrophobicContact CD1-CD2 4.14Å; L61-F129 HydrophobicContact CD1-CE2 4.34Å; L64-F129 HydrophobicContact CD2-CE2 4.5Å; H125-F129 AromaticContact CD2-CE2 3.91Å; H125-F129 AromaticContact CE1-CZ 3.93Å; H125-F129 AromaticContact NE2-CE2 3.75Å; H125-F129 AromaticContact NE2-CZ 3.5Å; V126-F129 WeakPolarHBondContact O-CD2 3.49Å; V126-F129 PolarHBondContact O-N 3.16Å
130E77.8Confident88.6Confident204 Ų20445.7 Ų45.795%0.95325%0.248SC*.  trans-85.3-16.2175.8-64.5-168.9166.500112.8
131E72.1Confident88.6Confident143 Ų14345.4 Ų45.467%0.66825%0.246SC*.SBendtrans-71.2158.3-179.5-65.5177.4178.100112.4L133E131-L133 PolarHBondContact O-N 2.95Å
132G72.4Confident88.5Confident63 Ų6344.2 Ų44.265%0.64924%0.24SC*.PPolyproline II helixtrans-60.7120.3174.800000110.9C134G132-C134 PolarHBondContact O-N 3.3Å
133L83.7Confident88.5Confident4 Ų447.6 Ų47.62%0.02126%0.26CS..BIsolated β-bridgetrans-76.9124.3-178.5-67.6173.6000110.5L61 V126 E131 V191 R194 I195L61-L133 HydrophobicContact CD1-CD2 3.99Å; L61-L133 HydrophobicContact CD2-CD2 4.03Å; V126-L133 HydrophobicContact CG1-CD1 4.14Å; V126-L133 HydrophobicContact CG1-CD2 3.89Å; E131-L133 PolarHBondContact O-N 2.95Å; L133-V191 HydrophobicContact CD1-CG1 3.87Å; L133-R194 HydrophobicContact CD1-CB 4.06Å; L133-I195 HydrophobicContact CB-CG1 4.09Å; L133-I195 WeakPolarHBondContact O-CA 3.36Å
134C83.7Confident88.5Confident50 Ų5048.3 Ų48.334%0.33827%0.265SS..PPolyproline II helixtrans-94.6141.4168.4-179.40000110G132 A137 E205G132-C134 PolarHBondContact O-N 3.3Å; C134-A137 PolarHBondContact O-N 2.87Å; C134-E205 PolarHBondContact SG-OE1 3.21Å; C134-E205 VanDerWaalsContact SG-OE1 3.37Å
135L85.5Confident88.6Confident2 Ų241.5 Ų41.51%0.0124%0.24CC..SBendtrans-69.4-34.2-178.3-171.260.5000111.8A137 I138 R139 P142 I195 D208 I209L135-A137 VanDerWaalsContact C-N 3.25Å; L135-A137 PolarHBondContact O-N 3.37Å; L135-I138 CarbonylContact O-C 3.38Å; L135-I138 PolarHBondContact O-N 3.43Å; L135-I138 VanDerWaalsContact O-N 3.09Å; L135-R139 WeakPolarHBondContact O-CA 3.46Å; L135-R139 PolarHBondContact O-N 3.19Å; L135-P142 HydrophobicContact CD1-CG 4.25Å; L135-I195 HydrophobicContact CB-CG2 4.33Å; L135-I195 HydrophobicContact CD1-CD1 3.74Å; L135-D208 HydrophobicContact CD2-CB 3.44Å; L135-D208 VanDerWaalsContact CD2-CB 3.44Å; L135-D208 HydrophobicContact CG-CB 4.18Å; L135-I209 HydrophobicContact CD2-CB 4.28Å
136D85.8Confident88.8Confident58 Ų5840.6 Ų40.631%0.3124%0.235SC..G310 helixtrans-58.3-36.8176-75-31.2000112.5I138 R139 E205D136-I138 PolarHBondContact O-N 3.12Å; D136-I138 VanDerWaalsContact O-N 3.15Å; D136-R139 IonicContact OD1-CZ 3.2Å; D136-R139 IonicContact OD1-NH1 3.39Å; D136-R139 PolarHBondContact OD1-NH1 2.75Å; D136-R139 IonicContact OD1-NH2 2.72Å; D136-R139 PolarHBondContact OD1-NH2 2.88Å; D136-E205 WeakPolarHBondContact OD1-CG 3.21Å
137A87.9Confident88.9Confident19 Ų1944.3 Ų44.316%0.15725%0.252CS..G310 helixtrans-70.5-8.8-179.400000113.8L61 E65 C134 L135L61-A137 HydrophobicContact CD1-CB 4.11Å; L61-A137 HydrophobicContact CG-CB 4.14Å; E65-A137 WeakPolarHBondContact CB-O 3.42Å; C134-A137 PolarHBondContact O-N 2.87Å; L135-A137 VanDerWaalsContact C-N 3.25Å; L135-A137 PolarHBondContact O-N 3.37Å
138I91.8Very high89.2Confident0 Ų043.6 Ų43.60%024%0.244CC..G310 helixtrans-141.923.1-178.961.3171.3000112.8L61 L64 E65 F69 V126 L135 D136 S140 L141 P142 V191 I195L61-I138 HydrophobicContact CD1-CG2 4.28Å; L64-I138 HydrophobicContact CD2-CG2 4.23Å; E65-I138 WeakPolarHBondContact OE2-CA 3.38Å; F69-I138 HydrophobicContact CD2-CG2 4.5Å; F69-I138 HydrophobicContact CE2-CG2 4.18Å; V126-I138 HydrophobicContact CG1-CD1 4.15Å; V126-I138 HydrophobicContact CG1-CG2 3.99Å; V126-I138 HydrophobicContact CG2-CG2 3.9Å; L135-I138 CarbonylContact O-C 3.38Å; L135-I138 PolarHBondContact O-N 3.43Å; L135-I138 VanDerWaalsContact O-N 3.09Å; D136-I138 PolarHBondContact O-N 3.12Å; D136-I138 VanDerWaalsContact O-N 3.15Å; I138-S140 VanDerWaalsContact C-N 3.28Å; I138-S140 PolarHBondContact O-N 3.18Å; I138-S140 VanDerWaalsContact O-N 3.13Å; I138-L141 HydrophobicContact CB-CB 4.3Å; I138-L141 HydrophobicContact CB-CD2 4.5Å; I138-L141 WeakPolarHBondContact O-CB 3.5Å; I138-L141 PolarHBondContact O-N 3.24Å; I138-P142 WeakPolarHBondContact O-CD 3.48Å; I138-V191 HydrophobicContact CD1-CG1 4.27Å; I138-I195 HydrophobicContact CD1-CD1 4.1Å
139R91.2Very high89.5Confident62 Ų6240 Ų4023%0.23422%0.219CC..THydrogen-bonded Turntrans-49.8-42.8-169.8-176.6174.5-113.7126.524.3113.6E65 L135 D136 L141 E204 D208E65-R139 HydrophobicContact CG-CB 4.47Å; E65-R139 PolarHBondContact OE2-N 3.48Å; E65-R139 VanDerWaalsContact OE2-N 3.11Å; L135-R139 WeakPolarHBondContact O-CA 3.46Å; L135-R139 PolarHBondContact O-N 3.19Å; D136-R139 IonicContact OD1-CZ 3.2Å; D136-R139 IonicContact OD1-NH1 3.39Å; D136-R139 PolarHBondContact OD1-NH1 2.75Å; D136-R139 IonicContact OD1-NH2 2.72Å; D136-R139 PolarHBondContact OD1-NH2 2.88Å; R139-L141 VanDerWaalsContact C-N 3.32Å; R139-L141 PolarHBondContact O-N 3Å; R139-E204 IonicContact CZ-OE2 2.84Å; R139-E204 IonicContact NH1-OE2 3.65Å; R139-E204 PolarHBondContact NH1-OE2 2.98Å; R139-E204 IonicContact NH2-OE2 3.49Å; R139-D208 IonicContact CZ-OD2 2.61Å; R139-D208 IonicContact NE-OD1 3.82Å; R139-D208 IonicContact NE-OD2 3.77Å; R139-D208 PolarHBondContact NE-OD2 2.99Å; R139-D208 IonicContact NH2-OD2 2.66Å; R139-D208 PolarHBondContact NH2-OD2 3.29Å
140S93.5Very high89.8Confident25 Ų2542 Ų4218%0.17523%0.225CC..Hα-helixtrans-71.9-24.5-179.8-66.40000113.7E65 S70 I138 C144E65-S140 WeakPolarHBondContact OE1-CB 3.33Å; E65-S140 PolarHBondContact OE1-N 3.36Å; E65-S140 PolarHBondContact OE1-OG 2.89Å; E65-S140 PolarHBondContact OE2-N 3.45Å; S70-S140 WeakPolarHBondContact CA-OG 3.43Å; I138-S140 VanDerWaalsContact C-N 3.28Å; I138-S140 PolarHBondContact O-N 3.18Å; I138-S140 VanDerWaalsContact O-N 3.13Å; S140-C144 VanDerWaalsContact O-CB 3.23Å; S140-C144 WeakPolarHBondContact O-CB 3.45Å; S140-C144 PolarHBondContact O-N 3.42Å; S140-C144 PolarHBondContact O-SG 2.99Å
141L95.1Very high90.7Very high0 Ų035.1 Ų35.10%019%0.192CC..Hα-helixtrans-68.3-56.7-169.2-179.678.1000113.2F69 L73 C122 V123 V126 I138 R139 T143 C144 I145F69-L141 HydrophobicContact CD2-CB 3.96Å; F69-L141 HydrophobicContact CD2-CD1 4.48Å; F69-L141 HydrophobicContact CE2-CB 4.09Å; F69-L141 HydrophobicContact CE2-CD1 4.12Å; F69-L141 HydrophobicContact CE2-CD2 3.87Å; F69-L141 HydrophobicContact CE2-CG 4.26Å; F69-L141 HydrophobicContact CZ-CD1 4.16Å; F69-L141 HydrophobicContact CZ-CD2 4.34Å; L73-L141 HydrophobicContact CD1-CB 3.98Å; L73-L141 HydrophobicContact CD1-CD1 3.73Å; L73-L141 HydrophobicContact CD1-CG 4.49Å; C122-L141 HydrophobicContact CB-CD1 3.86Å; V123-L141 HydrophobicContact CG2-CD1 4.44Å; V123-L141 HydrophobicContact CG2-CD2 4.48Å; V126-L141 HydrophobicContact CB-CD2 4.37Å; V126-L141 HydrophobicContact CG2-CD2 3.75Å; I138-L141 HydrophobicContact CB-CB 4.3Å; I138-L141 HydrophobicContact CB-CD2 4.5Å; I138-L141 WeakPolarHBondContact O-CB 3.5Å; I138-L141 PolarHBondContact O-N 3.24Å; R139-L141 VanDerWaalsContact C-N 3.32Å; R139-L141 PolarHBondContact O-N 3Å; L141-T143 PolarHBondContact O-N 2.81Å; L141-C144 PolarHBondContact O-N 2.94Å; L141-I145 HydrophobicContact CD1-CD1 3.42Å; L141-I145 VanDerWaalsContact CD1-CD1 3.42Å; L141-I145 HydrophobicContact CD1-CG1 4.28Å; L141-I145 HydrophobicContact CG-CD1 3.81Å; L141-I145 WeakPolarHBondContact O-CB 3.33Å; L141-I145 WeakPolarHBondContact O-CG1 3.24Å; L141-I145 PolarHBondContact O-N 3.17Å
142P94.7Very high91.9Very high1 Ų128.3 Ų28.31%0.00616%0.16CC..Hα-helixtrans-57.6-47.6177.2-2434.1000112L135 I138 C144 I145 L146 L192 V212L135-P142 HydrophobicContact CD1-CG 4.25Å; I138-P142 WeakPolarHBondContact O-CD 3.48Å; P142-C144 PolarHBondContact O-N 3.29Å; P142-I145 PolarHBondContact O-N 2.87Å; P142-L146 HydrophobicContact CB-CD1 4.47Å; P142-L146 VanDerWaalsContact O-CB 3.28Å; P142-L146 WeakPolarHBondContact O-CB 3.48Å; P142-L146 WeakPolarHBondContact O-CD1 3.24Å; P142-L146 WeakPolarHBondContact O-CG 3.33Å; P142-L146 PolarHBondContact O-N 3.5Å; P142-L192 HydrophobicContact CB-CD2 4.1Å; P142-L192 HydrophobicContact CG-CD2 3.77Å; P142-V212 HydrophobicContact CB-CG2 3.72Å
143T93.6Very high93Very high70 Ų7025.3 Ų25.343%0.42913%0.129SC..Hα-helixtrans-60.8-46-176.2-54.60000112.1L141 K147L141-T143 PolarHBondContact O-N 2.81Å; T143-K147 WeakPolarHBondContact O-CB 3.16Å; T143-K147 PolarHBondContact O-N 3.09Å
144C96Very high93.6Very high15 Ų1528.3 Ų28.310%0.10114%0.143CC..Hα-helixtrans-68-44.9179.3-70.60000112.1L73 V77 S140 L141 P142 K147 V148L73-C144 HydrophobicContact CB-CB 3.85Å; L73-C144 HydrophobicContact CD1-CB 4.47Å; V77-C144 HydrophobicContact CG2-CB 3.57Å; S140-C144 VanDerWaalsContact O-CB 3.23Å; S140-C144 WeakPolarHBondContact O-CB 3.45Å; S140-C144 PolarHBondContact O-N 3.42Å; S140-C144 PolarHBondContact O-SG 2.99Å; L141-C144 PolarHBondContact O-N 2.94Å; P142-C144 PolarHBondContact O-N 3.29Å; C144-K147 PolarHBondContact O-N 3.38Å; C144-V148 WeakPolarHBondContact O-CG2 3.28Å; C144-V148 PolarHBondContact O-N 3.36Å; C144-V148 VanDerWaalsContact O-N 3.1Å
145I97.3Very high94.1Very high0 Ų026.1 Ų26.10%013%0.128CC..Hα-helixtrans-67.5-45.8-178.2-69.5172.8000110.9L119 V123 L141 P142 K147 V148 L149 L184 L188L119-I145 HydrophobicContact CB-CG1 4.46Å; V123-I145 HydrophobicContact CG2-CD1 3.21Å; L141-I145 HydrophobicContact CD1-CD1 3.42Å; L141-I145 VanDerWaalsContact CD1-CD1 3.42Å; L141-I145 HydrophobicContact CD1-CG1 4.28Å; L141-I145 HydrophobicContact CG-CD1 3.81Å; L141-I145 WeakPolarHBondContact O-CB 3.33Å; L141-I145 WeakPolarHBondContact O-CG1 3.24Å; L141-I145 PolarHBondContact O-N 3.17Å; P142-I145 PolarHBondContact O-N 2.87Å; I145-K147 PolarHBondContact O-N 3.18Å; I145-V148 PolarHBondContact O-N 2.97Å; I145-V148 VanDerWaalsContact O-N 3.09Å; I145-L149 HydrophobicContact CG2-CD1 3.64Å; I145-L149 HydrophobicContact CG2-CG 3.92Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.29Å; I145-L149 WeakPolarHBondContact O-CG 3.4Å; I145-L149 PolarHBondContact O-N 3.23Å; I145-L184 HydrophobicContact CD1-CD1 4.18Å; I145-L184 HydrophobicContact CG2-CD1 4.13Å; I145-L184 HydrophobicContact CG2-CD2 3.81Å; I145-L184 HydrophobicContact CG2-CG 3.8Å; I145-L188 HydrophobicContact CB-CD2 4.03Å; I145-L188 HydrophobicContact CD1-CD1 4.46Å; I145-L188 HydrophobicContact CG2-CD2 3.65Å
146L97.1Very high94.5Very high2 Ų226.6 Ų26.61%0.0113%0.132CC..Hα-helixtrans-59.9-37.1178.5-68.5169.1000111.2P142 L149 R150 L188 V212 L216 I219P142-L146 HydrophobicContact CB-CD1 4.47Å; P142-L146 VanDerWaalsContact O-CB 3.28Å; P142-L146 WeakPolarHBondContact O-CB 3.48Å; P142-L146 WeakPolarHBondContact O-CD1 3.24Å; P142-L146 WeakPolarHBondContact O-CG 3.33Å; P142-L146 PolarHBondContact O-N 3.5Å; L146-L149 HydrophobicContact CD2-CD1 4.44Å; L146-L149 PolarHBondContact O-N 3.05Å; L146-R150 VanDerWaalsContact O-CB 3.24Å; L146-R150 WeakPolarHBondContact O-CB 3.4Å; L146-R150 PolarHBondContact O-N 3.43Å; L146-L188 HydrophobicContact CD2-CD2 3.89Å; L146-L188 HydrophobicContact CG-CD2 3.92Å; L146-V212 HydrophobicContact CD1-CB 4.33Å; L146-V212 HydrophobicContact CD1-CG1 4.05Å; L146-V212 HydrophobicContact CD1-CG2 4.18Å; L146-L216 HydrophobicContact CD2-CD2 3.61Å; L146-L216 HydrophobicContact CD2-CG 4.21Å; L146-I219 HydrophobicContact CB-CD1 4.41Å; L146-I219 HydrophobicContact CD2-CD1 3.78Å
147K96.4Very high94.8Very high79 Ų7927.5 Ų27.534%0.34313%0.133SC..Hα-helixtrans-64.4-42.8173.9-177.4171.3164.4-165.80112.7V77 D81 T143 C144 I145 K151V77-K147 HydrophobicContact CG1-CD 3.6Å; V77-K147 VanDerWaalsContact CG1-CE 3.45Å; V77-K147 HydrophobicContact CG1-CG 4.11Å; D81-K147 WeakPolarHBondContact OD2-CE 3.44Å; D81-K147 IonicContact OD2-NZ 3.53Å; D81-K147 PolarHBondContact OD2-NZ 2.86Å; T143-K147 WeakPolarHBondContact O-CB 3.16Å; T143-K147 PolarHBondContact O-N 3.09Å; C144-K147 PolarHBondContact O-N 3.38Å; I145-K147 PolarHBondContact O-N 3.18Å; K147-K151 WeakPolarHBondContact O-CG 3.29Å; K147-K151 PolarHBondContact O-N 2.97Å
148V97.1Very high95Very high1 Ų129 Ų291%0.00614%0.138CC..Hα-helixtrans-64.2-50.3175.3171.80000110.2V77 F80 I116 L119 C144 I145 R150 K151 T152V77-V148 HydrophobicContact CG2-CG2 4.04Å; F80-V148 HydrophobicContact CB-CG2 4.41Å; F80-V148 HydrophobicContact CD1-CG1 4.38Å; F80-V148 HydrophobicContact CD2-CG1 3.95Å; F80-V148 HydrophobicContact CE1-CG1 4.36Å; F80-V148 HydrophobicContact CE2-CG1 3.88Å; F80-V148 HydrophobicContact CG-CG1 4.18Å; F80-V148 HydrophobicContact CG-CG2 4.37Å; F80-V148 HydrophobicContact CZ-CG1 4.1Å; I116-V148 HydrophobicContact CG1-CG1 4.18Å; L119-V148 HydrophobicContact CD1-CB 4.3Å; L119-V148 HydrophobicContact CD1-CG1 4.15Å; L119-V148 HydrophobicContact CD1-CG2 4.07Å; C144-V148 WeakPolarHBondContact O-CG2 3.28Å; C144-V148 PolarHBondContact O-N 3.36Å; C144-V148 VanDerWaalsContact O-N 3.1Å; I145-V148 PolarHBondContact O-N 2.97Å; I145-V148 VanDerWaalsContact O-N 3.09Å; V148-R150 VanDerWaalsContact C-N 3.34Å; V148-R150 PolarHBondContact O-N 3.16Å; V148-K151 PolarHBondContact O-N 3.37Å; V148-K151 VanDerWaalsContact O-N 3.16Å; V148-T152 PolarHBondContact O-N 3.25Å; V148-T152 PolarHBondContact O-OG1 3.05Å
149L97.3Very high94.9Very high0 Ų029.8 Ų29.80%014%0.144CC..Hα-helixtrans-55.5-47.5178.2-70.7175000111.9I145 L146 K151 T152 F153 A181 L184 Q185 I219I145-L149 HydrophobicContact CG2-CD1 3.64Å; I145-L149 HydrophobicContact CG2-CG 3.92Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.29Å; I145-L149 WeakPolarHBondContact O-CG 3.4Å; I145-L149 PolarHBondContact O-N 3.23Å; L146-L149 HydrophobicContact CD2-CD1 4.44Å; L146-L149 PolarHBondContact O-N 3.05Å; L149-K151 VanDerWaalsContact C-N 3.32Å; L149-K151 PolarHBondContact O-N 3.22Å; L149-T152 PolarHBondContact O-N 3.47Å; L149-F153 HydrophobicContact CB-CD2 4.33Å; L149-F153 HydrophobicContact CB-CE2 3.97Å; L149-F153 HydrophobicContact CD2-CE2 4.23Å; L149-F153 HydrophobicContact CD2-CZ 4.24Å; L149-F153 WeakPolarHBondContact O-CD2 3.5Å; L149-F153 WeakPolarHBondContact O-CG 3.37Å; L149-F153 PolarHBondContact O-N 3.24Å; L149-A181 HydrophobicContact CD2-CB 3.87Å; L149-A181 WeakPolarHBondContact CD2-O 3.43Å; L149-L184 HydrophobicContact CD2-CB 4.29Å; L149-L184 HydrophobicContact CD2-CD2 4.13Å; L149-L184 HydrophobicContact CD2-CG 4.24Å; L149-Q185 HydrophobicContact CD1-CB 3.64Å; L149-Q185 HydrophobicContact CD1-CG 3.94Å; L149-Q185 HydrophobicContact CD2-CB 4.2Å; L149-I219 HydrophobicContact CB-CD1 4.21Å
150R96.8Very high94.7Very high84 Ų8434 Ų3432%0.31717%0.166SC..Hα-helixtrans-54.2-48.5177.3-168.3-177.772.4-165.91.4111.5L146 V148 Q154 D218 I219 I222L146-R150 VanDerWaalsContact O-CB 3.24Å; L146-R150 WeakPolarHBondContact O-CB 3.4Å; L146-R150 PolarHBondContact O-N 3.43Å; V148-R150 VanDerWaalsContact C-N 3.34Å; V148-R150 PolarHBondContact O-N 3.16Å; R150-Q154 WeakPolarHBondContact O-CB 3.42Å; R150-Q154 PolarHBondContact O-N 3.23Å; R150-D218 IonicContact NH1-OD2 3.47Å; R150-D218 PolarHBondContact NH1-OD2 3.47Å; R150-I219 HydrophobicContact CB-CD1 4.48Å; R150-I219 HydrophobicContact CB-CG1 3.92Å; R150-I219 HydrophobicContact CG-CG1 4.18Å; R150-I222 HydrophobicContact CB-CD1 4.45Å; R150-I222 HydrophobicContact CG-CD1 3.27Å
151K96Very high94.5Very high59 Ų5939 Ų3926%0.25719%0.189SC..Hα-helixtrans-69.6-38.1179.6-70.8-174.4175.2-166.60112.6F80 D81 K147 V148 L149 Q154 H155F80-K151 HydrophobicContact CD1-CB 4.35Å; F80-K151 HydrophobicContact CE1-CB 3.75Å; D81-K151 WeakPolarHBondContact OD1-CD 3.16Å; D81-K151 VanDerWaalsContact OD1-CE 3.32Å; D81-K151 WeakPolarHBondContact OD1-CE 3.47Å; D81-K151 IonicContact OD1-NZ 3.01Å; D81-K151 PolarHBondContact OD1-NZ 2.96Å; D81-K151 IonicContact OD2-NZ 3.73Å; D81-K151 PolarHBondContact OD2-NZ 3.39Å; K147-K151 WeakPolarHBondContact O-CG 3.29Å; K147-K151 PolarHBondContact O-N 2.97Å; V148-K151 PolarHBondContact O-N 3.37Å; V148-K151 VanDerWaalsContact O-N 3.16Å; L149-K151 VanDerWaalsContact C-N 3.32Å; L149-K151 PolarHBondContact O-N 3.22Å; K151-Q154 PolarHBondContact O-N 3.39Å; K151-H155 WeakPolarHBondContact O-CB 3.35Å; K151-H155 PolarHBondContact O-N 3.02Å
152T96.4Very high94.2Very high0 Ų040 Ų400%020%0.196CC..Hα-helixtrans-61.5-51.1175.4-57.50000111.2F80 I116 V148 L149 Q154 H155 C156 L177 A181F80-T152 WeakPolarHBondContact CZ-OG1 3.41Å; I116-T152 HydrophobicContact CD1-CG2 4.06Å; V148-T152 PolarHBondContact O-N 3.25Å; V148-T152 PolarHBondContact O-OG1 3.05Å; L149-T152 PolarHBondContact O-N 3.47Å; T152-Q154 VanDerWaalsContact C-N 3.32Å; T152-Q154 PolarHBondContact O-N 3.12Å; T152-H155 WeakPolarHBondContact O-CB 3.35Å; T152-H155 PolarHBondContact O-N 3.28Å; T152-C156 PolarHBondContact O-N 3.3Å; T152-C156 PolarHBondContact O-SG 2.91Å; T152-L177 HydrophobicContact CG2-CD1 4.39Å; T152-L177 HydrophobicContact CG2-CD2 3.86Å; T152-L177 HydrophobicContact CG2-CG 3.67Å; T152-A181 HydrophobicContact CG2-CB 3.67Å
153F96.7Very high93.9Very high0 Ų040 Ų400%020%0.195CC..Hα-helixtrans-65.4-36179.7-64-45.1000112.4L149 C156 K157 F178 A181 Q185 I219 I222 I223 L226 L230L149-F153 HydrophobicContact CB-CD2 4.33Å; L149-F153 HydrophobicContact CB-CE2 3.97Å; L149-F153 HydrophobicContact CD2-CE2 4.23Å; L149-F153 HydrophobicContact CD2-CZ 4.24Å; L149-F153 WeakPolarHBondContact O-CD2 3.5Å; L149-F153 WeakPolarHBondContact O-CG 3.37Å; L149-F153 PolarHBondContact O-N 3.24Å; F153-C156 PolarHBondContact O-N 2.9Å; F153-K157 WeakPolarHBondContact O-CB 3.35Å; F153-K157 PolarHBondContact O-N 3.27Å; F153-F178 AromaticContact CD1-CD2 3.91Å; F153-F178 HydrophobicContact CD1-CD2 3.91Å; F153-F178 AromaticContact CD1-CE2 3.81Å; F153-F178 HydrophobicContact CD1-CE2 3.81Å; F153-F178 HydrophobicContact CE1-CD2 4.03Å; F153-F178 AromaticContact CE1-CE2 3.87Å; F153-F178 HydrophobicContact CE1-CE2 3.87Å; F153-A181 HydrophobicContact CD1-CB 4.48Å; F153-A181 HydrophobicContact CE1-CB 3.75Å; F153-A181 HydrophobicContact CZ-CB 4Å; F153-Q185 VanDerWaalsContact CZ-OE1 3.27Å; F153-I219 HydrophobicContact CD2-CG2 3.98Å; F153-I219 HydrophobicContact CE2-CG2 4.24Å; F153-I222 HydrophobicContact CB-CG2 4.02Å; F153-I223 HydrophobicContact CB-CG2 3.96Å; F153-I223 HydrophobicContact CD1-CG2 4.47Å; F153-I223 HydrophobicContact CD2-CG2 3.86Å; F153-I223 HydrophobicContact CE2-CG2 4.48Å; F153-I223 HydrophobicContact CG-CG2 3.86Å; F153-L226 HydrophobicContact CB-CD2 4.39Å; F153-L226 HydrophobicContact CD1-CD2 4.48Å; F153-L230 HydrophobicContact CD1-CD2 4.36Å; F153-L230 HydrophobicContact CE1-CD2 3.87Å; F153-L230 HydrophobicContact CE2-CD2 4.46Å; F153-L230 HydrophobicContact CZ-CD2 3.93Å
154Q95.2Very high93.3Very high68 Ų6840.6 Ų40.632%0.31820%0.201SC..Hα-helixtrans-60.8-47.2173.7-171.264.251.500111.1R150 K151 T152 C156 K157 D158 I222R150-Q154 WeakPolarHBondContact O-CB 3.42Å; R150-Q154 PolarHBondContact O-N 3.23Å; K151-Q154 PolarHBondContact O-N 3.39Å; T152-Q154 VanDerWaalsContact C-N 3.32Å; T152-Q154 PolarHBondContact O-N 3.12Å; Q154-C156 VanDerWaalsContact C-N 3.32Å; Q154-C156 PolarHBondContact O-N 2.91Å; Q154-K157 PolarHBondContact O-N 3.47Å; Q154-D158 PolarHBondContact NE2-OD1 3.01Å; Q154-D158 VanDerWaalsContact NE2-OD1 3.1Å; Q154-D158 PolarHBondContact NE2-OD2 3.29Å; Q154-D158 PolarHBondContact O-N 3.48Å; Q154-I222 HydrophobicContact CB-CD1 4.33Å; Q154-I222 HydrophobicContact CB-CG2 4.11Å; Q154-I222 VanDerWaalsContact OE1-CG1 3.29Å
155H94.1Very high92.5Very high3 Ų343.5 Ų43.51%0.01423%0.234CC..Hα-helixtrans-60.2-42.7176.8-170.357.2000112.3M84 K151 T152 S159 Y163M84-H155 HydrophobicContact CE-CB 3.63Å; M84-H155 HydrophobicContact SD-CB 4.06Å; K151-H155 WeakPolarHBondContact O-CB 3.35Å; K151-H155 PolarHBondContact O-N 3.02Å; T152-H155 WeakPolarHBondContact O-CB 3.35Å; T152-H155 PolarHBondContact O-N 3.28Å; H155-S159 WeakPolarHBondContact O-CA 3.49Å; H155-S159 WeakPolarHBondContact O-CB 3.49Å; H155-S159 PolarHBondContact O-N 3.49Å; H155-Y163 AromaticContact CE1-CE2 3.75Å; H155-Y163 AromaticContact CE1-CZ 3.95Å; H155-Y163 PolarHBondContact CE1-OH 3Å; H155-Y163 AromaticContact NE2-CE2 3.68Å; H155-Y163 AromaticContact NE2-CZ 3.78Å; H155-Y163 PolarHBondContact NE2-OH 3.31Å
156C93.7Very high91.9Very high13 Ų1347.1 Ų47.19%0.08825%0.248CC..Hα-helixtrans-62.6-42.3176.1-67.80000111.8T152 F153 Q154 S159 F178 L226T152-C156 PolarHBondContact O-N 3.3Å; T152-C156 PolarHBondContact O-SG 2.91Å; F153-C156 PolarHBondContact O-N 2.9Å; Q154-C156 VanDerWaalsContact C-N 3.32Å; Q154-C156 PolarHBondContact O-N 2.91Å; C156-S159 WeakPolarHBondContact O-CB 3.47Å; C156-S159 PolarHBondContact O-N 3.27Å; C156-S159 PolarHBondContact O-OG 3.02Å; C156-F178 HydrophobicContact CB-CD2 4.24Å; C156-L226 HydrophobicContact CB-CD2 4.45Å
157K92.1Very high91.5Very high76 Ų7649.1 Ų49.133%0.3326%0.259SS..Hα-helixtrans-65.1-44.9177.8176.2161.5178.2169.10112.6F153 Q154 S159 I222 S224 L226F153-K157 WeakPolarHBondContact O-CB 3.35Å; F153-K157 PolarHBondContact O-N 3.27Å; Q154-K157 PolarHBondContact O-N 3.47Å; K157-S159 PolarHBondContact O-N 2.92Å; K157-I222 HydrophobicContact CD-CG2 4.44Å; K157-I222 WeakPolarHBondContact CD-O 3.38Å; K157-I222 WeakPolarHBondContact CE-O 3.37Å; K157-I222 PolarHBondContact NZ-O 3.18Å; K157-S224 PolarHBondContact NZ-O 3.47Å; K157-S224 VanDerWaalsContact NZ-O 3.08Å; K157-S224 PolarHBondContact NZ-OG 3.46Å; K157-L226 HydrophobicContact CB-CD1 4.43Å
158D92.2Very high91.1Very high52 Ų5250.1 Ų50.128%0.27828%0.276SS..Hα-helixtrans-82.7-1.1-177.5-60.6-20.4000112.6Q154 E160 I161 V162Q154-D158 PolarHBondContact NE2-OD1 3.01Å; Q154-D158 VanDerWaalsContact NE2-OD1 3.1Å; Q154-D158 PolarHBondContact NE2-OD2 3.29Å; Q154-D158 PolarHBondContact O-N 3.48Å; D158-E160 VanDerWaalsContact C-N 3.29Å; D158-E160 PolarHBondContact O-N 3.26Å; D158-I161 CarbonylContact O-C 3.56Å; D158-I161 WeakPolarHBondContact O-CA 3.32Å; D158-I161 WeakPolarHBondContact O-CB 3.37Å; D158-I161 PolarHBondContact O-N 3.4Å; D158-V162 HydrophobicContact CB-CG2 3.89Å; D158-V162 VanDerWaalsContact O-CG2 3.32Å; D158-V162 WeakPolarHBondContact O-CG2 3.41Å; D158-V162 PolarHBondContact O-N 3.31Å
159S90.9Very high90.6Very high16 Ų1652.3 Ų52.311%0.11229%0.287CS..Hα-helixtrans-56.6-37-170.662.50000113.8H155 C156 K157 I161 V162 Y163H155-S159 WeakPolarHBondContact O-CA 3.49Å; H155-S159 WeakPolarHBondContact O-CB 3.49Å; H155-S159 PolarHBondContact O-N 3.49Å; C156-S159 WeakPolarHBondContact O-CB 3.47Å; C156-S159 PolarHBondContact O-N 3.27Å; C156-S159 PolarHBondContact O-OG 3.02Å; K157-S159 PolarHBondContact O-N 2.92Å; S159-I161 VanDerWaalsContact C-N 3.28Å; S159-I161 PolarHBondContact O-N 3.16Å; S159-V162 PolarHBondContact O-N 3.17Å; S159-Y163 VanDerWaalsContact O-CD2 3.25Å; S159-Y163 WeakPolarHBondContact O-CD2 3.41Å; S159-Y163 PolarHBondContact O-N 3.23Å
160E87.3Confident90.3Very high150 Ų15052.3 Ų52.370%0.70129%0.287SS*.Hα-helixtrans-60.3-40.2175.4-68.9-169.8166.500112.3D158 C164 L167D158-E160 VanDerWaalsContact C-N 3.29Å; D158-E160 PolarHBondContact O-N 3.26Å; E160-C164 PolarHBondContact O-N 2.85Å; E160-L167 HydrophobicContact CG-CD2 4.28Å
161I88.3Confident90Very high130 Ų13050.2 Ų50.267%0.66729%0.287SS*.Hα-helixtrans-76.2-46.4179-58172.9000110.1D158 S159 Y163 C164D158-I161 CarbonylContact O-C 3.56Å; D158-I161 WeakPolarHBondContact O-CA 3.32Å; D158-I161 WeakPolarHBondContact O-CB 3.37Å; D158-I161 PolarHBondContact O-N 3.4Å; S159-I161 VanDerWaalsContact C-N 3.28Å; S159-I161 PolarHBondContact O-N 3.16Å; I161-Y163 VanDerWaalsContact C-N 3.33Å; I161-Y163 PolarHBondContact O-N 2.84Å; I161-C164 PolarHBondContact O-N 3.04Å; I161-C164 PolarHBondContact O-SG 3.24Å
162V88.5Confident89.8Confident21 Ų2151.3 Ų51.313%0.12730%0.296CS..Hα-helixtrans-61.6-41.9-176.41730000111.2M88 V91 D158 S159M88-V162 HydrophobicContact CE-CG2 4.23Å; M88-V162 HydrophobicContact SD-CG1 3.93Å; M88-V162 HydrophobicContact SD-CG2 4.15Å; V91-V162 HydrophobicContact CB-CG1 4.47Å; V91-V162 HydrophobicContact CG1-CG1 3.87Å; V91-V162 VanDerWaalsContact CG1-O 3.23Å; V91-V162 WeakPolarHBondContact CG1-O 3.42Å; V91-V162 HydrophobicContact CG2-CG1 4.22Å; D158-V162 HydrophobicContact CB-CG2 3.89Å; D158-V162 VanDerWaalsContact O-CG2 3.32Å; D158-V162 WeakPolarHBondContact O-CG2 3.41Å; D158-V162 PolarHBondContact O-N 3.31Å; S159-V162 PolarHBondContact O-N 3.17Å
163Y88.9Confident89.7Confident0 Ų052 Ų520%030%0.3CS..Hα-helixtrans-93.8-4-177.3-63.8-85.1000113.7V91 L94 H155 S159 I161 G165 R166 L167 V170 L174V91-Y163 HydrophobicContact CG2-CD1 3.3Å; V91-Y163 HydrophobicContact CG2-CE1 3.31Å; V91-Y163 HydrophobicContact CG2-CG 4.12Å; L94-Y163 HydrophobicContact CD2-CD1 3.83Å; L94-Y163 HydrophobicContact CD2-CE1 4.44Å; H155-Y163 AromaticContact CE1-CE2 3.75Å; H155-Y163 AromaticContact CE1-CZ 3.95Å; H155-Y163 PolarHBondContact CE1-OH 3Å; H155-Y163 AromaticContact NE2-CE2 3.68Å; H155-Y163 AromaticContact NE2-CZ 3.78Å; H155-Y163 PolarHBondContact NE2-OH 3.31Å; S159-Y163 VanDerWaalsContact O-CD2 3.25Å; S159-Y163 WeakPolarHBondContact O-CD2 3.41Å; S159-Y163 PolarHBondContact O-N 3.23Å; I161-Y163 VanDerWaalsContact C-N 3.33Å; I161-Y163 PolarHBondContact O-N 2.84Å; Y163-G165 PolarHBondContact O-N 3.03Å; Y163-R166 WeakPolarHBondContact O-CA 3.3Å; Y163-R166 VanDerWaalsContact O-CB 3.23Å; Y163-R166 WeakPolarHBondContact O-CB 3.22Å; Y163-R166 PolarHBondContact O-N 3Å; Y163-R166 PolarHBondContact O-NE 3.05Å; Y163-L167 HydrophobicContact CD2-CD1 3.96Å; Y163-L167 HydrophobicContact CG-CD1 4.35Å; Y163-V170 HydrophobicContact CD1-CG2 3.68Å; Y163-V170 HydrophobicContact CD2-CG2 4.36Å; Y163-V170 HydrophobicContact CE1-CG1 4.47Å; Y163-V170 HydrophobicContact CE1-CG2 3.55Å; Y163-V170 HydrophobicContact CE2-CG2 4.27Å; Y163-V170 HydrophobicContact CG-CG2 4.11Å; Y163-L174 HydrophobicContact CD2-CD1 4.12Å; Y163-L174 HydrophobicContact CE2-CD1 3.73Å; Y163-L174 HydrophobicContact CE2-CD2 4.32Å
164C81.6Confident89.5Confident83 Ų8352.5 Ų52.556%0.56130%0.302SS*.THydrogen-bonded Turntrans39.867.4172.4-80.40000114.5E160 I161 R166E160-C164 PolarHBondContact O-N 2.85Å; I161-C164 PolarHBondContact O-N 3.04Å; I161-C164 PolarHBondContact O-SG 3.24Å; C164-R166 PolarHBondContact O-N 3.31Å; C164-R166 VanDerWaalsContact O-N 3.16Å
165G79.5Confident89.4Confident77 Ų7756.3 Ų56.379%0.79432%0.32SS*.THydrogen-bonded Turntrans73.8-1.3179.200000115.5Y163Y163-G165 PolarHBondContact O-N 3.03Å
166R84.9Confident89.4Confident75 Ų7557.5 Ų57.528%0.28333%0.333SS..  trans-106.113.8178.2-57166.2-87.4-163.12.1112.8G92 L94 Y163 C164 S168 L169G92-R166 PolarHBondContact O-NH1 3.39Å; G92-R166 PolarHBondContact O-NH2 2.89Å; L94-R166 HydrophobicContact CD2-CB 4.11Å; L94-R166 HydrophobicContact CG-CB 4.46Å; L94-R166 WeakPolarHBondContact O-CD 3.41Å; L94-R166 VanDerWaalsContact O-CZ 3.27Å; L94-R166 PolarHBondContact O-NE 2.87Å; L94-R166 PolarHBondContact O-NH1 3.37Å; Y163-R166 WeakPolarHBondContact O-CA 3.3Å; Y163-R166 VanDerWaalsContact O-CB 3.23Å; Y163-R166 WeakPolarHBondContact O-CB 3.22Å; Y163-R166 PolarHBondContact O-N 3Å; Y163-R166 PolarHBondContact O-NE 3.05Å; C164-R166 PolarHBondContact O-N 3.31Å; C164-R166 VanDerWaalsContact O-N 3.16Å; R166-S168 PolarHBondContact O-N 2.93Å; R166-L169 HydrophobicContact CB-CD1 4.25Å; R166-L169 WeakPolarHBondContact O-CB 3.38Å; R166-L169 PolarHBondContact O-N 3.37Å
167L87.3Confident89.5Confident45 Ų4556.9 Ų56.924%0.23633%0.329CS..G310 helixtrans-55.7-35.5-179-177.466.3000112.6E160 Y163 L169 V170 A171 L174E160-L167 HydrophobicContact CG-CD2 4.28Å; Y163-L167 HydrophobicContact CD2-CD1 3.96Å; Y163-L167 HydrophobicContact CG-CD1 4.35Å; L167-L169 PolarHBondContact O-N 3.43Å; L167-V170 PolarHBondContact O-N 3.1Å; L167-A171 HydrophobicContact CG-CB 4.43Å; L167-A171 WeakPolarHBondContact O-CB 3.43Å; L167-A171 PolarHBondContact O-N 2.73Å; L167-L174 HydrophobicContact CD1-CD1 3.4Å
168S88.1Confident89.7Confident100 Ų10055.4 Ų55.470%0.69932%0.323SS*.G310 helixtrans-57.5-21.6-179.555.70000114.2R166 V170R166-S168 PolarHBondContact O-N 2.93Å; S168-V170 VanDerWaalsContact C-N 3.29Å; S168-V170 PolarHBondContact O-N 3.26Å
169L88.1Confident89.8Confident47 Ų4759.8 Ų59.825%0.24634%0.339CS..G310 helixtrans-73.7-18.7177.7-59.8178.8000113.6L94 R106 R166 L167L94-L169 HydrophobicContact CD1-CD1 4.02Å; L94-L169 HydrophobicContact CD2-CD1 4.25Å; L94-L169 HydrophobicContact CG-CD1 4Å; R106-L169 PolarHBondContact NH1-O 3.27Å; R166-L169 HydrophobicContact CB-CD1 4.25Å; R166-L169 WeakPolarHBondContact O-CB 3.38Å; R166-L169 PolarHBondContact O-N 3.37Å; L167-L169 PolarHBondContact O-N 3.43Å
170V90Very high90.1Very high0 Ų061.7 Ų61.70%035%0.346CS..THydrogen-bonded Turntrans-137.11.5-174.2-65.10000113.9R106 L109 Y163 L167 S168 D172 L173 L174R106-V170 HydrophobicContact CG-CG1 4.07Å; L109-V170 HydrophobicContact CD1-CB 3.7Å; L109-V170 HydrophobicContact CD1-CG1 3.92Å; L109-V170 HydrophobicContact CD1-CG2 4.39Å; Y163-V170 HydrophobicContact CD1-CG2 3.68Å; Y163-V170 HydrophobicContact CD2-CG2 4.36Å; Y163-V170 HydrophobicContact CE1-CG1 4.47Å; Y163-V170 HydrophobicContact CE1-CG2 3.55Å; Y163-V170 HydrophobicContact CE2-CG2 4.27Å; Y163-V170 HydrophobicContact CG-CG2 4.11Å; L167-V170 PolarHBondContact O-N 3.1Å; S168-V170 VanDerWaalsContact C-N 3.29Å; S168-V170 PolarHBondContact O-N 3.26Å; V170-D172 VanDerWaalsContact C-N 3.27Å; V170-D172 PolarHBondContact O-N 3.28Å; V170-L173 PolarHBondContact O-N 2.78Å; V170-L173 VanDerWaalsContact O-N 3.1Å; V170-L174 HydrophobicContact CG2-CD1 3.83Å; V170-L174 HydrophobicContact CG2-CG 4.41Å; V170-L174 PolarHBondContact O-N 3.02Å
171A90.3Very high90.5Very high39 Ų3954.6 Ų54.632%0.32231%0.313SS..Hα-helixtrans-57.9-36.8-173.200000113.2L167 L174 Q175L167-A171 HydrophobicContact CG-CB 4.43Å; L167-A171 WeakPolarHBondContact O-CB 3.43Å; L167-A171 PolarHBondContact O-N 2.73Å; A171-L174 PolarHBondContact O-N 3.08Å; A171-Q175 WeakPolarHBondContact O-CB 3.27Å; A171-Q175 PolarHBondContact O-N 3.12Å
172D92.9Very high90.9Very high82 Ų8251.8 Ų51.844%0.43930%0.295SS..Hα-helixtrans-61.2-43.8176.761.7-48.5000112.1R106 V170 G176R106-D172 IonicContact CZ-OD1 2.9Å; R106-D172 IonicContact CZ-OD2 2.8Å; R106-D172 IonicContact NH1-OD1 2.67Å; R106-D172 PolarHBondContact NH1-OD1 2.98Å; R106-D172 IonicContact NH1-OD2 2.68Å; R106-D172 IonicContact NH2-OD1 3.08Å; R106-D172 IonicContact NH2-OD2 3.58Å; R106-D172 PolarHBondContact NH2-OD2 2.84Å; V170-D172 VanDerWaalsContact C-N 3.27Å; V170-D172 PolarHBondContact O-N 3.28Å; D172-G176 PolarHBondContact O-N 3.27Å
173L93.4Very high91.2Very high16 Ų1653.3 Ų53.38%0.08431%0.306CS..Hα-helixtrans-73.5-36.5178.7-66176.2000112.2R106 L109 Q110 V170 Q175 G176 L177R106-L173 HydrophobicContact CB-CD1 3.62Å; R106-L173 HydrophobicContact CG-CD1 3.77Å; R106-L173 WeakPolarHBondContact O-CD1 3.31Å; L109-L173 HydrophobicContact CB-CB 4.01Å; L109-L173 HydrophobicContact CB-CD1 4.06Å; L109-L173 HydrophobicContact CD1-CB 4.16Å; L109-L173 HydrophobicContact CD1-CD1 4.45Å; Q110-L173 VanDerWaalsContact OE1-CD2 3.31Å; V170-L173 PolarHBondContact O-N 2.78Å; V170-L173 VanDerWaalsContact O-N 3.1Å; L173-Q175 VanDerWaalsContact C-N 3.35Å; L173-G176 PolarHBondContact O-N 3.3Å; L173-L177 WeakPolarHBondContact O-CB 3.28Å; L173-L177 PolarHBondContact O-N 3.07Å
174L93.4Very high91.6Very high10 Ų1053.3 Ų53.35%0.05231%0.306CS..Hα-helixtrans-65.3-39.5173.9-71.8170.4000111.7L109 Y163 L167 V170 A171 L177 F178L109-L174 HydrophobicContact CD1-CD2 4.44Å; L109-L174 HydrophobicContact CD1-CG 4.41Å; L109-L174 HydrophobicContact CD2-CD2 3.88Å; Y163-L174 HydrophobicContact CD2-CD1 4.12Å; Y163-L174 HydrophobicContact CE2-CD1 3.73Å; Y163-L174 HydrophobicContact CE2-CD2 4.32Å; L167-L174 HydrophobicContact CD1-CD1 3.4Å; V170-L174 HydrophobicContact CG2-CD1 3.83Å; V170-L174 HydrophobicContact CG2-CG 4.41Å; V170-L174 PolarHBondContact O-N 3.02Å; A171-L174 PolarHBondContact O-N 3.08Å; L174-L177 PolarHBondContact O-N 3.47Å; L174-F178 WeakPolarHBondContact O-CB 3.31Å; L174-F178 PolarHBondContact O-N 3.25Å
175Q92.8Very high92.3Very high147 Ų14749.5 Ų49.569%0.68728%0.28SS*.Hα-helixtrans-64.6-41.2173.5-17217811.700111.4A171 L173 F178 K179A171-Q175 WeakPolarHBondContact O-CB 3.27Å; A171-Q175 PolarHBondContact O-N 3.12Å; L173-Q175 VanDerWaalsContact C-N 3.35Å; Q175-F178 PolarHBondContact O-N 3.44Å; Q175-K179 WeakPolarHBondContact O-CB 3.43Å; Q175-K179 PolarHBondContact O-N 3.45Å
176G93.9Very high93.1Very high28 Ų2851.4 Ų51.429%0.28927%0.267SS..Hα-helixtrans-59.8-47.2172.300000112.3D172 L173 F178 K179 E180D172-G176 PolarHBondContact O-N 3.27Å; L173-G176 PolarHBondContact O-N 3.3Å; G176-F178 PolarHBondContact O-N 3.08Å; G176-K179 PolarHBondContact O-N 2.8Å; G176-E180 PolarHBondContact O-N 2.83Å
177L95.3Very high93.6Very high0 Ų049.1 Ų49.10%026%0.262CS..Hα-helixtrans-59.9-44.9177.8-170.673.3000112L109 M112 V113 I116 T152 L173 L174 A181L109-L177 HydrophobicContact CD2-CD2 4.42Å; M112-L177 HydrophobicContact CB-CD1 3.72Å; M112-L177 HydrophobicContact CE-CD2 4.16Å; V113-L177 HydrophobicContact CB-CD1 4.5Å; V113-L177 HydrophobicContact CG2-CB 3.97Å; V113-L177 HydrophobicContact CG2-CD1 3.74Å; I116-L177 HydrophobicContact CD1-CD1 3.58Å; I116-L177 HydrophobicContact CD1-CG 4.29Å; T152-L177 HydrophobicContact CG2-CD1 4.39Å; T152-L177 HydrophobicContact CG2-CD2 3.86Å; T152-L177 HydrophobicContact CG2-CG 3.67Å; L173-L177 WeakPolarHBondContact O-CB 3.28Å; L173-L177 PolarHBondContact O-N 3.07Å; L174-L177 PolarHBondContact O-N 3.47Å; L177-A181 VanDerWaalsContact O-CB 3.32Å; L177-A181 WeakPolarHBondContact O-CB 3.35Å; L177-A181 PolarHBondContact O-N 3.48Å
178F95.6Very high94Very high46 Ų4647 Ų4720%0.20225%0.251CS..Hα-helixtrans-61.7-43.6175.9-179.2-96.9000111.9F153 C156 L174 Q175 G176 A181 Y182 L226 D227 L230F153-F178 AromaticContact CD1-CD2 3.91Å; F153-F178 HydrophobicContact CD1-CD2 3.91Å; F153-F178 AromaticContact CD1-CE2 3.81Å; F153-F178 HydrophobicContact CD1-CE2 3.81Å; F153-F178 HydrophobicContact CE1-CD2 4.03Å; F153-F178 AromaticContact CE1-CE2 3.87Å; F153-F178 HydrophobicContact CE1-CE2 3.87Å; C156-F178 HydrophobicContact CB-CD2 4.24Å; L174-F178 WeakPolarHBondContact O-CB 3.31Å; L174-F178 PolarHBondContact O-N 3.25Å; Q175-F178 PolarHBondContact O-N 3.44Å; G176-F178 PolarHBondContact O-N 3.08Å; F178-A181 PolarHBondContact O-N 3.16Å; F178-Y182 WeakPolarHBondContact O-CB 3.47Å; F178-Y182 PolarHBondContact O-N 3.4Å; F178-L226 HydrophobicContact CD2-CD2 4.2Å; F178-L226 HydrophobicContact CE2-CD2 3.58Å; F178-L226 HydrophobicContact CE2-CG 3.98Å; F178-D227 HydrophobicContact CZ-CB 4.01Å; F178-L230 HydrophobicContact CE2-CD2 4.09Å; F178-L230 HydrophobicContact CZ-CD2 3.95Å
179K95.4Very high94.4Very high143 Ų14343.2 Ų43.262%0.62222%0.223SC*.Hα-helixtrans-63.8-44.7-179.7-173.3-174175.7-167.60112.1Q175 G176 Y182 S183Q175-K179 WeakPolarHBondContact O-CB 3.43Å; Q175-K179 PolarHBondContact O-N 3.45Å; G176-K179 PolarHBondContact O-N 2.8Å; K179-Y182 PolarHBondContact O-N 3.07Å; K179-S183 PolarHBondContact O-N 3.36Å
180E96.3Very high94.7Very high57 Ų5745.5 Ų45.527%0.26623%0.232SC..Hα-helixtrans-67.3-40176.9-67.3-49.4137.100111.5V113 I116 G176 Y182 S183 L184V113-E180 HydrophobicContact CG1-CG 3.99Å; I116-E180 HydrophobicContact CB-CB 4.47Å; I116-E180 HydrophobicContact CG2-CB 3.73Å; G176-E180 PolarHBondContact O-N 2.83Å; E180-Y182 PolarHBondContact O-N 3.31Å; E180-S183 PolarHBondContact O-N 2.99Å; E180-L184 WeakPolarHBondContact O-CB 3.35Å; E180-L184 PolarHBondContact O-N 3.29Å
181A96.7Very high94.8Very high0 Ų045.7 Ų45.70%023%0.233CC..Hα-helixtrans-61.7-42.5173.900000112.2I116 L149 T152 F153 L177 F178 S183 L184 Q185I116-A181 HydrophobicContact CD1-CB 4.25Å; L149-A181 HydrophobicContact CD2-CB 3.87Å; L149-A181 WeakPolarHBondContact CD2-O 3.43Å; T152-A181 HydrophobicContact CG2-CB 3.67Å; F153-A181 HydrophobicContact CD1-CB 4.48Å; F153-A181 HydrophobicContact CE1-CB 3.75Å; F153-A181 HydrophobicContact CZ-CB 4Å; L177-A181 VanDerWaalsContact O-CB 3.32Å; L177-A181 WeakPolarHBondContact O-CB 3.35Å; L177-A181 PolarHBondContact O-N 3.48Å; F178-A181 PolarHBondContact O-N 3.16Å; A181-S183 PolarHBondContact O-N 3.12Å; A181-L184 PolarHBondContact O-N 2.89Å; A181-Q185 WeakPolarHBondContact O-CB 3.48Å; A181-Q185 PolarHBondContact O-N 3.08Å
182Y95.6Very high95Very high72 Ų7243.9 Ų43.928%0.28222%0.218SC..Hα-helixtrans-60.8-44.5175.5-178.7-95000111.9F178 K179 E180 Q185 K186 L230F178-Y182 WeakPolarHBondContact O-CB 3.47Å; F178-Y182 PolarHBondContact O-N 3.4Å; K179-Y182 PolarHBondContact O-N 3.07Å; E180-Y182 PolarHBondContact O-N 3.31Å; Y182-Q185 PolarHBondContact O-N 2.9Å; Y182-K186 WeakPolarHBondContact O-CB 3.2Å; Y182-K186 PolarHBondContact O-N 3.38Å; Y182-L230 HydrophobicContact CD2-CB 3.95Å; Y182-L230 HydrophobicContact CD2-CD1 3.58Å; Y182-L230 HydrophobicContact CD2-CD2 4.03Å; Y182-L230 HydrophobicContact CD2-CG 3.99Å; Y182-L230 HydrophobicContact CE2-CB 3.66Å; Y182-L230 HydrophobicContact CE2-CD1 3.64Å; Y182-L230 HydrophobicContact CE2-CG 4.07Å
183S96Very high95Very high53 Ų5342.6 Ų42.637%0.37121%0.211SC..Hα-helixtrans-64-44.6177-1720000112.3K179 E180 A181 K186 S187K179-S183 PolarHBondContact O-N 3.36Å; E180-S183 PolarHBondContact O-N 2.99Å; A181-S183 PolarHBondContact O-N 3.12Å; S183-K186 PolarHBondContact O-N 3.21Å; S183-S187 PolarHBondContact O-N 2.87Å; S183-S187 PolarHBondContact O-OG 3.1Å
184L97.3Very high94.8Very high0 Ų047.5 Ų47.50%023%0.229CC..Hα-helixtrans-60.6-48.1176.3175.557.9000111.1I116 L119 V123 I145 L149 E180 A181 K186 S187 L188I116-L184 HydrophobicContact CG2-CB 4.12Å; I116-L184 HydrophobicContact CG2-CD2 3.79Å; L119-L184 HydrophobicContact CB-CD1 4.32Å; L119-L184 HydrophobicContact CB-CD2 3.94Å; L119-L184 HydrophobicContact CD1-CD2 4.4Å; V123-L184 HydrophobicContact CB-CD1 4.45Å; V123-L184 HydrophobicContact CG2-CD1 3.73Å; I145-L184 HydrophobicContact CD1-CD1 4.18Å; I145-L184 HydrophobicContact CG2-CD1 4.13Å; I145-L184 HydrophobicContact CG2-CD2 3.81Å; I145-L184 HydrophobicContact CG2-CG 3.8Å; L149-L184 HydrophobicContact CD2-CB 4.29Å; L149-L184 HydrophobicContact CD2-CD2 4.13Å; L149-L184 HydrophobicContact CD2-CG 4.24Å; E180-L184 WeakPolarHBondContact O-CB 3.35Å; E180-L184 PolarHBondContact O-N 3.29Å; A181-L184 PolarHBondContact O-N 2.89Å; L184-K186 PolarHBondContact O-N 3.45Å; L184-S187 PolarHBondContact O-N 3.17Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 PolarHBondContact O-N 3.05Å
185Q96.5Very high94.7Very high3 Ų347.1 Ų47.11%0.01423%0.227CC..Hα-helixtrans-58.6-50.3177.3-174.1-179.9-1000110.8L149 F153 A181 Y182 S187 L188 L189 T234L149-Q185 HydrophobicContact CD1-CB 3.64Å; L149-Q185 HydrophobicContact CD1-CG 3.94Å; L149-Q185 HydrophobicContact CD2-CB 4.2Å; F153-Q185 VanDerWaalsContact CZ-OE1 3.27Å; A181-Q185 WeakPolarHBondContact O-CB 3.48Å; A181-Q185 PolarHBondContact O-N 3.08Å; Y182-Q185 PolarHBondContact O-N 2.9Å; Q185-S187 VanDerWaalsContact C-N 3.29Å; Q185-S187 PolarHBondContact O-N 2.74Å; Q185-L188 WeakPolarHBondContact O-CB 3.21Å; Q185-L188 PolarHBondContact O-N 3.48Å; Q185-L188 VanDerWaalsContact O-N 3.08Å; Q185-L189 HydrophobicContact CG-CD1 4.38Å; Q185-L189 HydrophobicContact CG-CG 4.25Å; Q185-L189 VanDerWaalsContact O-CG 3.32Å; Q185-L189 WeakPolarHBondContact O-CG 3.36Å; Q185-L189 PolarHBondContact O-N 3.34Å; Q185-T234 PolarHBondContact NE2-OG1 3.24Å
186K95.7Very high94.2Very high117 Ų11744.1 Ų44.151%0.50922%0.222SC..Hα-helixtrans-54.5-47.9179.4-174.2-172.1175.5-157.70111.4Y182 S183 L184 L188 L189 E190Y182-K186 WeakPolarHBondContact O-CB 3.2Å; Y182-K186 PolarHBondContact O-N 3.38Å; S183-K186 PolarHBondContact O-N 3.21Å; L184-K186 PolarHBondContact O-N 3.45Å; K186-L188 VanDerWaalsContact C-N 3.32Å; K186-L188 PolarHBondContact O-N 3.48Å; K186-L189 PolarHBondContact O-N 3Å; K186-E190 VanDerWaalsContact CE-OE1 3.22Å; K186-E190 WeakPolarHBondContact CE-OE1 3.47Å; K186-E190 IonicContact NZ-OE1 3.27Å; K186-E190 WeakPolarHBondContact O-CG 3.43Å; K186-E190 PolarHBondContact O-N 3.3Å; K186-E190 VanDerWaalsContact O-N 3.07Å
187S95.3Very high93.8Very high27 Ų2744 Ų4419%0.18921%0.214CC..Hα-helixtrans-62.3-40.2178.5-53.50000111.7V123 S183 L184 Q185 E190 V191V123-S187 VanDerWaalsContact CG1-C 3.46Å; V123-S187 WeakPolarHBondContact CG1-O 3.4Å; S183-S187 PolarHBondContact O-N 2.87Å; S183-S187 PolarHBondContact O-OG 3.1Å; L184-S187 PolarHBondContact O-N 3.17Å; Q185-S187 VanDerWaalsContact C-N 3.29Å; Q185-S187 PolarHBondContact O-N 2.74Å; S187-E190 PolarHBondContact O-N 3.44Å; S187-V191 WeakPolarHBondContact O-CG2 3.48Å; S187-V191 PolarHBondContact O-N 2.87Å; S187-V191 VanDerWaalsContact O-N 3.12Å
188L96.1Very high93Very high1 Ų148.5 Ų48.51%0.00524%0.239CC..Hα-helixtrans-64.7-44.1177.1177.566000111.3V123 I145 L146 L184 Q185 K186 E190 V191 L192V123-L188 HydrophobicContact CG1-CB 4.49Å; V123-L188 HydrophobicContact CG2-CD1 4.5Å; I145-L188 HydrophobicContact CB-CD2 4.03Å; I145-L188 HydrophobicContact CD1-CD1 4.46Å; I145-L188 HydrophobicContact CG2-CD2 3.65Å; L146-L188 HydrophobicContact CD2-CD2 3.89Å; L146-L188 HydrophobicContact CG-CD2 3.92Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 PolarHBondContact O-N 3.05Å; Q185-L188 WeakPolarHBondContact O-CB 3.21Å; Q185-L188 PolarHBondContact O-N 3.48Å; Q185-L188 VanDerWaalsContact O-N 3.08Å; K186-L188 VanDerWaalsContact C-N 3.32Å; K186-L188 PolarHBondContact O-N 3.48Å; L188-E190 VanDerWaalsContact C-N 3.29Å; L188-E190 PolarHBondContact O-N 2.99Å; L188-V191 PolarHBondContact O-N 3.32Å; L188-V191 VanDerWaalsContact O-N 3.16Å; L188-L192 HydrophobicContact CD1-CD1 4.31Å; L188-L192 HydrophobicContact CD1-CG 4.2Å; L188-L192 HydrophobicContact CD2-CD1 4.39Å; L188-L192 HydrophobicContact CG-CD1 3.93Å; L188-L192 HydrophobicContact CG-CG 4.26Å; L188-L192 WeakPolarHBondContact O-CB 3.42Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 3.48Å
189L95.9Very high92.1Very high20 Ų2052.2 Ų52.211%0.10527%0.27CS..Hα-helixtrans-61.8-38.2177.7-60.3-170.6000111.4Q185 K186 V191 L192 D193 L216 F237Q185-L189 HydrophobicContact CG-CD1 4.38Å; Q185-L189 HydrophobicContact CG-CG 4.25Å; Q185-L189 VanDerWaalsContact O-CG 3.32Å; Q185-L189 WeakPolarHBondContact O-CG 3.36Å; Q185-L189 PolarHBondContact O-N 3.34Å; K186-L189 PolarHBondContact O-N 3Å; L189-V191 VanDerWaalsContact C-N 3.32Å; L189-V191 PolarHBondContact O-N 3Å; L189-L192 HydrophobicContact CD2-CD1 4.39Å; L189-L192 PolarHBondContact O-N 3.4Å; L189-D193 WeakPolarHBondContact O-CB 3.4Å; L189-D193 PolarHBondContact O-N 3.32Å; L189-L216 HydrophobicContact CD2-CD1 4.32Å; L189-L216 HydrophobicContact CD2-CD2 3.89Å; L189-F237 HydrophobicContact CB-CD2 3.98Å; L189-F237 HydrophobicContact CB-CE2 3.98Å; L189-F237 HydrophobicContact CB-CG 4.28Å; L189-F237 HydrophobicContact CB-CZ 4.28Å; L189-F237 HydrophobicContact CD1-CB 4.01Å; L189-F237 HydrophobicContact CD1-CD1 4.38Å; L189-F237 HydrophobicContact CD1-CD2 4.4Å; L189-F237 HydrophobicContact CD1-CG 4Å; L189-F237 HydrophobicContact CD2-CD1 3.61Å; L189-F237 HydrophobicContact CD2-CD2 4.5Å; L189-F237 HydrophobicContact CD2-CE1 3.69Å; L189-F237 HydrophobicContact CD2-CG 4.03Å; L189-F237 HydrophobicContact CD2-CZ 4.2Å; L189-F237 HydrophobicContact CG-CD1 4.37Å; L189-F237 HydrophobicContact CG-CD2 4.5Å; L189-F237 HydrophobicContact CG-CG 4.3Å; L189-F237 WeakPolarHBondContact O-CE2 3.42Å
190E93.8Very high91.3Very high95 Ų9549.8 Ų49.844%0.44427%0.272SS..Hα-helixtrans-65.5-32.3175.3-71.8172.9-172.400113.2K186 S187 L188 R194K186-E190 VanDerWaalsContact CE-OE1 3.22Å; K186-E190 WeakPolarHBondContact CE-OE1 3.47Å; K186-E190 IonicContact NZ-OE1 3.27Å; K186-E190 WeakPolarHBondContact O-CG 3.43Å; K186-E190 PolarHBondContact O-N 3.3Å; K186-E190 VanDerWaalsContact O-N 3.07Å; S187-E190 PolarHBondContact O-N 3.44Å; L188-E190 VanDerWaalsContact C-N 3.29Å; L188-E190 PolarHBondContact O-N 2.99Å; E190-R194 PolarHBondContact O-NE 3.32Å
191V93.6Very high90.6Very high3 Ų348 Ų482%0.01827%0.267CS..Hα-helixtrans-73.2-48.4173169.40000110.7V123 V126 L133 I138 S187 L188 L189 D193 R194V123-V191 HydrophobicContact CG1-CB 4.47Å; V123-V191 HydrophobicContact CG1-CG2 3.75Å; V126-V191 HydrophobicContact CB-CG1 4.38Å; V126-V191 HydrophobicContact CG1-CG1 3.59Å; L133-V191 HydrophobicContact CD1-CG1 3.87Å; I138-V191 HydrophobicContact CD1-CG1 4.27Å; S187-V191 WeakPolarHBondContact O-CG2 3.48Å; S187-V191 PolarHBondContact O-N 2.87Å; S187-V191 VanDerWaalsContact O-N 3.12Å; L188-V191 PolarHBondContact O-N 3.32Å; L188-V191 VanDerWaalsContact O-N 3.16Å; L189-V191 VanDerWaalsContact C-N 3.32Å; L189-V191 PolarHBondContact O-N 3Å; V191-D193 PolarHBondContact O-N 3.49Å; V191-R194 WeakPolarHBondContact O-CB 3.49Å; V191-R194 PolarHBondContact O-N 2.89Å; V191-R194 VanDerWaalsContact O-N 3.1Å
192L93.6Very high90.2Very high1 Ų150.1 Ų50.11%0.00528%0.281CS..Hα-helixtrans-60.4-33178.5-71.8173.3000112.5P142 L188 L189 R194 I195 V212 F237P142-L192 HydrophobicContact CB-CD2 4.1Å; P142-L192 HydrophobicContact CG-CD2 3.77Å; L188-L192 HydrophobicContact CD1-CD1 4.31Å; L188-L192 HydrophobicContact CD1-CG 4.2Å; L188-L192 HydrophobicContact CD2-CD1 4.39Å; L188-L192 HydrophobicContact CG-CD1 3.93Å; L188-L192 HydrophobicContact CG-CG 4.26Å; L188-L192 WeakPolarHBondContact O-CB 3.42Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 3.48Å; L189-L192 HydrophobicContact CD2-CD1 4.39Å; L189-L192 PolarHBondContact O-N 3.4Å; L192-R194 PolarHBondContact O-N 2.86Å; L192-I195 HydrophobicContact CD2-CD1 3.7Å; L192-I195 WeakPolarHBondContact O-CB 3.46Å; L192-I195 PolarHBondContact O-N 2.82Å; L192-V212 HydrophobicContact CD1-CG1 3.82Å; L192-V212 HydrophobicContact CD2-CG1 4.49Å; L192-F237 HydrophobicContact CB-CE1 4.28Å; L192-F237 HydrophobicContact CB-CZ 3.63Å; L192-F237 HydrophobicContact CD1-CE1 4.28Å; L192-F237 HydrophobicContact CD1-CZ 4.41Å
193D92.4Very high89.7Confident55 Ų5553.3 Ų53.329%0.29430%0.303SS..THydrogen-bonded Turntrans-64.7-27.6178.3-153.941.9000113.3L189 V191 F237 K240 Q241 K244L189-D193 WeakPolarHBondContact O-CB 3.4Å; L189-D193 PolarHBondContact O-N 3.32Å; V191-D193 PolarHBondContact O-N 3.49Å; D193-F237 HydrophobicContact CB-CE2 4.02Å; D193-K240 VanDerWaalsContact OD1-CE 3.31Å; D193-K240 WeakPolarHBondContact OD1-CE 3.32Å; D193-K240 IonicContact OD1-NZ 3.77Å; D193-K240 PolarHBondContact OD1-NZ 3.44Å; D193-K240 IonicContact OD2-NZ 3.11Å; D193-K240 PolarHBondContact OD2-NZ 3.04Å; D193-Q241 PolarHBondContact OD1-NE2 3.43Å; D193-Q241 VanDerWaalsContact OD1-NE2 3.1Å; D193-K244 PolarHBondContact O-NZ 3.12Å
194R90.8Very high89.3Confident120 Ų12056.6 Ų56.645%0.45331%0.313SS..THydrogen-bonded Turntrans-83-13.8-179.8-72.6-174.3-100.9176.3-9113.9G127 L133 E190 V191 L192G127-R194 PolarHBondContact O-NH1 2.97Å; G127-R194 PolarHBondContact O-NH2 2.9Å; L133-R194 HydrophobicContact CD1-CB 4.06Å; E190-R194 PolarHBondContact O-NE 3.32Å; V191-R194 WeakPolarHBondContact O-CB 3.49Å; V191-R194 PolarHBondContact O-N 2.89Å; V191-R194 VanDerWaalsContact O-N 3.1Å; L192-R194 PolarHBondContact O-N 2.86Å
195I89.6Confident88.9Confident1 Ų157.8 Ų57.81%0.00532%0.318CS..BIsolated β-bridgetrans-63.9141.2175.4-60179.5000108.9L133 L135 I138 L192 L197 K244 Y245L133-I195 HydrophobicContact CB-CG1 4.09Å; L133-I195 WeakPolarHBondContact O-CA 3.36Å; L135-I195 HydrophobicContact CB-CG2 4.33Å; L135-I195 HydrophobicContact CD1-CD1 3.74Å; I138-I195 HydrophobicContact CD1-CD1 4.1Å; L192-I195 HydrophobicContact CD2-CD1 3.7Å; L192-I195 WeakPolarHBondContact O-CB 3.46Å; L192-I195 PolarHBondContact O-N 2.82Å; I195-L197 HydrophobicContact CG2-CG 4.48Å; I195-K244 PolarHBondContact O-NZ 3.4Å; I195-Y245 PolarHBondContact O-OH 3.27Å
196S83.5Confident88.7Confident85 Ų8558 Ų5859%0.59432%0.32SS*.  trans-126.6115.8174.157.90000109.8
197L85.2Confident88.5Confident24 Ų2455.3 Ų55.313%0.12632%0.316CS..  trans-99.4130.7170-62.4167.8000108.1I195 A201 E205 I209 Y245 L248I195-L197 HydrophobicContact CG2-CG 4.48Å; L197-A201 HydrophobicContact CB-CB 4.3Å; L197-A201 HydrophobicContact CD2-CB 4.11Å; L197-E205 HydrophobicContact CD2-CB 3.98Å; L197-I209 HydrophobicContact CD1-CB 3.96Å; L197-I209 HydrophobicContact CD1-CG1 4.21Å; L197-I209 HydrophobicContact CD1-CG2 3.73Å; L197-Y245 HydrophobicContact CB-CD1 3.94Å; L197-Y245 HydrophobicContact CB-CE1 3.78Å; L197-Y245 HydrophobicContact CD1-CD1 4.16Å; L197-Y245 HydrophobicContact CD1-CD2 4.39Å; L197-Y245 HydrophobicContact CD1-CE1 4.11Å; L197-Y245 HydrophobicContact CD1-CE2 4.3Å; L197-Y245 HydrophobicContact CD1-CG 4.29Å; L197-Y245 HydrophobicContact CG-CD1 4.46Å; L197-Y245 HydrophobicContact CG-CE1 4.1Å; L197-L248 HydrophobicContact CB-CD1 4.03Å
198D78.8Confident88.3Confident96 Ų9655.3 Ų55.351%0.51331%0.314SS..  trans-106.1-179.9174.765.815.5000111.2S200 A201D198-S200 PolarHBondContact O-N 3.1Å; D198-S200 VanDerWaalsContact O-N 3.09Å; D198-S200 WeakPolarHBondContact OD1-CA 3.44Å; D198-S200 PolarHBondContact OD1-N 3.14Å; D198-S200 PolarHBondContact OD1-OG 3.12Å; D198-S200 PolarHBondContact OD2-OG 3.44Å; D198-A201 VanDerWaalsContact O-CB 3.3Å; D198-A201 WeakPolarHBondContact O-CB 3.26Å; D198-A201 PolarHBondContact O-N 2.88Å; D198-A201 VanDerWaalsContact O-N 3.08Å; D198-A201 PolarHBondContact OD1-N 3.5Å
199S75.8Confident88.2Confident123 Ų12355.4 Ų55.486%0.8631%0.314SS*.THydrogen-bonded Turntrans-67.2-5.3179.456.70000114.1
200S78.3Confident88.2Confident93 Ų9355.1 Ų55.165%0.6531%0.313SS*.THydrogen-bonded Turntrans-101.24.6173.940.20000113.5D198D198-S200 PolarHBondContact O-N 3.1Å; D198-S200 VanDerWaalsContact O-N 3.09Å; D198-S200 WeakPolarHBondContact OD1-CA 3.44Å; D198-S200 PolarHBondContact OD1-N 3.14Å; D198-S200 PolarHBondContact OD1-OG 3.12Å; D198-S200 PolarHBondContact OD2-OG 3.44Å
201A83.1Confident88.2Confident20 Ų2052.5 Ų52.517%0.16531%0.308CS..  trans-54.3139.5173.900000111.1L197 D198 V206L197-A201 HydrophobicContact CB-CB 4.3Å; L197-A201 HydrophobicContact CD2-CB 4.11Å; D198-A201 VanDerWaalsContact O-CB 3.3Å; D198-A201 WeakPolarHBondContact O-CB 3.26Å; D198-A201 PolarHBondContact O-N 2.88Å; D198-A201 VanDerWaalsContact O-N 3.08Å; D198-A201 PolarHBondContact OD1-N 3.5Å; A201-V206 HydrophobicContact CB-CG2 4.39Å
202S86.4Confident88.3Confident43 Ų4352.5 Ų52.530%0.30131%0.308SS..  trans-71.2156.3177.865.30000111.9E204 E205 V206S202-E204 PolarHBondContact O-N 3.29Å; S202-E205 PolarHBondContact N-OE2 3.36Å; S202-E205 PolarHBondContact O-N 2.63Å; S202-E205 VanDerWaalsContact O-N 3.12Å; S202-E205 VanDerWaalsContact OG-CG 3.29Å; S202-E205 WeakPolarHBondContact OG-CG 3.49Å; S202-E205 PolarHBondContact OG-N 3.34Å; S202-E205 PolarHBondContact OG-OE2 3.03Å; S202-V206 WeakPolarHBondContact O-CG2 3.17Å; S202-V206 PolarHBondContact O-N 2.87Å
203D86.6Confident88.5Confident139 Ų13952.4 Ų52.474%0.74331%0.307SS*.Hα-helixtrans-57-31.4174.8-70.9-21.5000112S207D203-S207 WeakPolarHBondContact O-CB 3.35Å; D203-S207 PolarHBondContact O-N 3.1Å
204E87.8Confident88.7Confident123 Ų12351 Ų5158%0.57530%0.299SS*.Hα-helixtrans-68.4-44.7176.8-59.1-173.5176.100111.8R139 S202 V206 S207 D208R139-E204 IonicContact CZ-OE2 2.84Å; R139-E204 IonicContact NH1-OE2 3.65Å; R139-E204 PolarHBondContact NH1-OE2 2.98Å; R139-E204 IonicContact NH2-OE2 3.49Å; S202-E204 PolarHBondContact O-N 3.29Å; E204-V206 VanDerWaalsContact C-N 3.32Å; E204-V206 PolarHBondContact O-N 3.21Å; E204-S207 WeakPolarHBondContact O-CB 3.15Å; E204-S207 PolarHBondContact O-N 2.73Å; E204-D208 VanDerWaalsContact O-CG 3.22Å; E204-D208 PolarHBondContact O-N 3.46Å
205E88.6Confident88.9Confident24 Ų2446.9 Ų46.911%0.11229%0.288CS..Hα-helixtrans-63.7-38176.4-71.8170.510700112C134 D136 L197 S202 D208 I209C134-E205 PolarHBondContact SG-OE1 3.21Å; C134-E205 VanDerWaalsContact SG-OE1 3.37Å; D136-E205 WeakPolarHBondContact OD1-CG 3.21Å; L197-E205 HydrophobicContact CD2-CB 3.98Å; S202-E205 PolarHBondContact N-OE2 3.36Å; S202-E205 PolarHBondContact O-N 2.63Å; S202-E205 VanDerWaalsContact O-N 3.12Å; S202-E205 VanDerWaalsContact OG-CG 3.29Å; S202-E205 WeakPolarHBondContact OG-CG 3.49Å; S202-E205 PolarHBondContact OG-N 3.34Å; S202-E205 PolarHBondContact OG-OE2 3.03Å; E205-D208 PolarHBondContact O-N 3.43Å; E205-I209 PolarHBondContact O-N 2.95Å; E205-I209 VanDerWaalsContact O-N 3.09Å
206V91.2Very high89.2Confident8 Ų846.8 Ų46.85%0.04829%0.288CS..Hα-helixtrans-64.2-44.9173.8177.30000110.5A201 S202 E204 D208 I209 V210 L248 V249A201-V206 HydrophobicContact CB-CG2 4.39Å; S202-V206 WeakPolarHBondContact O-CG2 3.17Å; S202-V206 PolarHBondContact O-N 2.87Å; E204-V206 VanDerWaalsContact C-N 3.32Å; E204-V206 PolarHBondContact O-N 3.21Å; V206-D208 VanDerWaalsContact C-N 3.3Å; V206-D208 PolarHBondContact O-N 3.04Å; V206-I209 WeakPolarHBondContact O-CG2 3.35Å; V206-I209 PolarHBondContact O-N 3.03Å; V206-V210 WeakPolarHBondContact O-CB 3.39Å; V206-V210 VanDerWaalsContact O-CG2 3.23Å; V206-V210 WeakPolarHBondContact O-CG2 3.1Å; V206-V210 PolarHBondContact O-N 3.32Å; V206-L248 WeakPolarHBondContact CG1-O 3.5Å; V206-L248 HydrophobicContact CG2-CB 4.35Å; V206-V249 HydrophobicContact CG1-CG1 4.4Å
207S92.4Very high89.9Confident61 Ų6143.4 Ų43.443%0.42726%0.263SS..Hα-helixtrans-61.3-39176.4178.20000112D203 E204 V210 A211D203-S207 WeakPolarHBondContact O-CB 3.35Å; D203-S207 PolarHBondContact O-N 3.1Å; E204-S207 WeakPolarHBondContact O-CB 3.15Å; E204-S207 PolarHBondContact O-N 2.73Å; S207-V210 PolarHBondContact O-N 3.43Å; S207-A211 WeakPolarHBondContact O-CB 3.13Å; S207-A211 PolarHBondContact O-N 3.46Å
208D91.7Very high90.4Very high27 Ų2745.7 Ų45.714%0.14428%0.275CS..Hα-helixtrans-67-43.8178.8-69.4-35.1000112.4L135 R139 E204 E205 V206 V210 A211 V212L135-D208 HydrophobicContact CD2-CB 3.44Å; L135-D208 VanDerWaalsContact CD2-CB 3.44Å; L135-D208 HydrophobicContact CG-CB 4.18Å; R139-D208 IonicContact CZ-OD2 2.61Å; R139-D208 IonicContact NE-OD1 3.82Å; R139-D208 IonicContact NE-OD2 3.77Å; R139-D208 PolarHBondContact NE-OD2 2.99Å; R139-D208 IonicContact NH2-OD2 2.66Å; R139-D208 PolarHBondContact NH2-OD2 3.29Å; E204-D208 VanDerWaalsContact O-CG 3.22Å; E204-D208 PolarHBondContact O-N 3.46Å; E205-D208 PolarHBondContact O-N 3.43Å; V206-D208 VanDerWaalsContact C-N 3.3Å; V206-D208 PolarHBondContact O-N 3.04Å; D208-V210 VanDerWaalsContact C-N 3.29Å; D208-V210 PolarHBondContact O-N 3.01Å; D208-A211 WeakPolarHBondContact O-CB 3.34Å; D208-A211 PolarHBondContact O-N 3.46Å; D208-V212 WeakPolarHBondContact O-CG2 3.45Å; D208-V212 PolarHBondContact O-N 3.24Å
209I93.6Very high91.2Very high3 Ų341.1 Ų41.12%0.01525%0.251CS..Hα-helixtrans-66.8-35.3177.9-167.563.3000111.2L135 L197 E205 V206 V212 I213 Y245 V249L135-I209 HydrophobicContact CD2-CB 4.28Å; L197-I209 HydrophobicContact CD1-CB 3.96Å; L197-I209 HydrophobicContact CD1-CG1 4.21Å; L197-I209 HydrophobicContact CD1-CG2 3.73Å; E205-I209 PolarHBondContact O-N 2.95Å; E205-I209 VanDerWaalsContact O-N 3.09Å; V206-I209 WeakPolarHBondContact O-CG2 3.35Å; V206-I209 PolarHBondContact O-N 3.03Å; I209-V212 HydrophobicContact CD1-CB 4.45Å; I209-V212 WeakPolarHBondContact O-CB 3.49Å; I209-V212 PolarHBondContact O-N 2.92Å; I209-I213 HydrophobicContact CG1-CD1 4.49Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.43Å; I209-Y245 HydrophobicContact CD1-CD2 4.37Å; I209-Y245 HydrophobicContact CD1-CE2 3.97Å; I209-Y245 HydrophobicContact CG1-CD2 3.76Å; I209-Y245 HydrophobicContact CG1-CE2 3.84Å; I209-V249 HydrophobicContact CG2-CG1 3.81Å
210V95.1Very high92.1Very high13 Ų1335.2 Ų35.28%0.07921%0.21CC..Hα-helixtrans-62.2-44.7171.7169.30000110.5V206 S207 D208 V212 I213 H214 V249 Q252 L253V206-V210 WeakPolarHBondContact O-CB 3.39Å; V206-V210 VanDerWaalsContact O-CG2 3.23Å; V206-V210 WeakPolarHBondContact O-CG2 3.1Å; V206-V210 PolarHBondContact O-N 3.32Å; S207-V210 PolarHBondContact O-N 3.43Å; D208-V210 VanDerWaalsContact C-N 3.29Å; D208-V210 PolarHBondContact O-N 3.01Å; V210-V212 VanDerWaalsContact C-N 3.31Å; V210-V212 PolarHBondContact O-N 2.99Å; V210-I213 PolarHBondContact O-N 3.4Å; V210-H214 PolarHBondContact O-CD2 2.86Å; V210-H214 VanDerWaalsContact O-CD2 3.28Å; V210-H214 PolarHBondContact O-N 3.46Å; V210-V249 HydrophobicContact CG2-CB 3.93Å; V210-V249 HydrophobicContact CG2-CG1 3.87Å; V210-Q252 HydrophobicContact CG1-CB 4.32Å; V210-Q252 HydrophobicContact CG2-CB 3.94Å; V210-L253 HydrophobicContact CG2-CD2 4.47Å
211A95.1Very high92.7Very high40 Ų4033.7 Ų33.733%0.33120%0.199SC..Hα-helixtrans-62.5-36.9175.900000112.5S207 D208 S215S207-A211 WeakPolarHBondContact O-CB 3.13Å; S207-A211 PolarHBondContact O-N 3.46Å; D208-A211 WeakPolarHBondContact O-CB 3.34Å; D208-A211 PolarHBondContact O-N 3.46Å; A211-S215 VanDerWaalsContact O-CB 3.24Å; A211-S215 WeakPolarHBondContact O-CB 3.4Å; A211-S215 PolarHBondContact O-N 2.94Å; A211-S215 PolarHBondContact O-OG 3.48Å
212V95.2Very high93.1Very high3 Ų333.4 Ų33.42%0.01819%0.194CC..Hα-helixtrans-63.8-47.4172.9166.90000110.9P142 L146 L192 D208 I209 V210 H214 S215 L216P142-V212 HydrophobicContact CB-CG2 3.72Å; L146-V212 HydrophobicContact CD1-CB 4.33Å; L146-V212 HydrophobicContact CD1-CG1 4.05Å; L146-V212 HydrophobicContact CD1-CG2 4.18Å; L192-V212 HydrophobicContact CD1-CG1 3.82Å; L192-V212 HydrophobicContact CD2-CG1 4.49Å; D208-V212 WeakPolarHBondContact O-CG2 3.45Å; D208-V212 PolarHBondContact O-N 3.24Å; I209-V212 HydrophobicContact CD1-CB 4.45Å; I209-V212 WeakPolarHBondContact O-CB 3.49Å; I209-V212 PolarHBondContact O-N 2.92Å; V210-V212 VanDerWaalsContact C-N 3.31Å; V210-V212 PolarHBondContact O-N 2.99Å; V212-H214 PolarHBondContact O-N 3.41Å; V212-S215 PolarHBondContact O-N 2.89Å; V212-L216 HydrophobicContact CG1-CD1 4.13Å; V212-L216 WeakPolarHBondContact O-CG 3.32Å; V212-L216 PolarHBondContact O-N 3.16Å
213I96.3Very high93.4Very high0 Ų031.3 Ų31.30%018%0.18CC..Hα-helixtrans-59.4-46.6178.3-70.9167.6000110.8I209 V210 L216 L217 L238 Q241 L253I209-I213 HydrophobicContact CG1-CD1 4.49Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.43Å; V210-I213 PolarHBondContact O-N 3.4Å; I213-L216 PolarHBondContact O-N 3.27Å; I213-L217 PolarHBondContact O-N 2.92Å; I213-L238 HydrophobicContact CG2-CD2 4.27Å; I213-L238 HydrophobicContact CG2-CG 4.16Å; I213-Q241 HydrophobicContact CD1-CB 4.31Å; I213-Q241 HydrophobicContact CG1-CB 4.23Å; I213-L253 HydrophobicContact CB-CD2 4.25Å; I213-L253 HydrophobicContact CD1-CD2 4.04Å; I213-L253 HydrophobicContact CG2-CD2 3.75Å
214H96.7Very high93.5Very high26 Ų2625.6 Ų25.612%0.1215%0.151CC..Hα-helixtrans-69.7-34.8178.4-73.9-53.4000113.1V210 V212 L216 L217 D218 H254V210-H214 PolarHBondContact O-CD2 2.86Å; V210-H214 VanDerWaalsContact O-CD2 3.28Å; V210-H214 PolarHBondContact O-N 3.46Å; V212-H214 PolarHBondContact O-N 3.41Å; H214-L216 VanDerWaalsContact C-N 3.3Å; H214-L216 PolarHBondContact O-N 2.9Å; H214-L217 WeakPolarHBondContact O-CB 3.49Å; H214-L217 PolarHBondContact O-N 3.32Å; H214-L217 VanDerWaalsContact O-N 3.17Å; H214-D218 PolarHBondContact O-N 3.43Å; H214-H254 VanDerWaalsContact CE1-CB 3.45Å; H214-H254 WeakPolarHBondContact CE1-CB 3.5Å; H214-H254 AromaticContact CE1-CG 3.72Å; H214-H254 PolarHBondContact CE1-N 3.01Å; H214-H254 AromaticContact CE1-ND1 3.95Å; H214-H254 AromaticContact NE2-CG 3.78Å; H214-H254 PolarHBondContact NE2-N 3.32Å; H214-H254 VanDerWaalsContact NE2-N 3.16Å
215S96.3Very high93.2Very high32 Ų3226.7 Ų26.722%0.22416%0.161CC..Hα-helixtrans-65.1-35.2173-63.60000112.2A211 V212 D218 I219A211-S215 VanDerWaalsContact O-CB 3.24Å; A211-S215 WeakPolarHBondContact O-CB 3.4Å; A211-S215 PolarHBondContact O-N 2.94Å; A211-S215 PolarHBondContact O-OG 3.48Å; V212-S215 PolarHBondContact O-N 2.89Å; S215-D218 WeakPolarHBondContact O-CB 3.38Å; S215-I219 WeakPolarHBondContact O-CG1 3.48Å; S215-I219 PolarHBondContact O-N 3.05Å; S215-I219 VanDerWaalsContact O-N 3.1Å
216L96.6Very high93.1Very high0 Ų028.2 Ų28.20%017%0.17CC..Hα-helixtrans-69.4-35.5172.5-70169.8000111.9L146 L189 V212 I213 H214 I219 C220 T234 F237 L238L146-L216 HydrophobicContact CD2-CD2 3.61Å; L146-L216 HydrophobicContact CD2-CG 4.21Å; L189-L216 HydrophobicContact CD2-CD1 4.32Å; L189-L216 HydrophobicContact CD2-CD2 3.89Å; V212-L216 HydrophobicContact CG1-CD1 4.13Å; V212-L216 WeakPolarHBondContact O-CG 3.32Å; V212-L216 PolarHBondContact O-N 3.16Å; I213-L216 PolarHBondContact O-N 3.27Å; H214-L216 VanDerWaalsContact C-N 3.3Å; H214-L216 PolarHBondContact O-N 2.9Å; L216-I219 PolarHBondContact O-N 3.49Å; L216-C220 PolarHBondContact O-N 3.16Å; L216-C220 PolarHBondContact O-SG 3.3Å; L216-T234 HydrophobicContact CB-CG2 4.46Å; L216-T234 HydrophobicContact CD2-CG2 4.07Å; L216-F237 HydrophobicContact CD1-CD1 3.66Å; L216-F237 HydrophobicContact CD1-CE1 3.85Å; L216-L238 HydrophobicContact CB-CD1 4.18Å
217L96.7Very high93.1Very high14 Ų1430.8 Ų30.87%0.07318%0.183CC..Hα-helixtrans-61.8-45.8173.5-174.763.1000111.2I213 H214 I219 C220 S221 W235 L238 D257 I258I213-L217 PolarHBondContact O-N 2.92Å; H214-L217 WeakPolarHBondContact O-CB 3.49Å; H214-L217 PolarHBondContact O-N 3.32Å; H214-L217 VanDerWaalsContact O-N 3.17Å; L217-I219 VanDerWaalsContact C-N 3.29Å; L217-I219 PolarHBondContact O-N 3.19Å; L217-C220 WeakPolarHBondContact O-CB 3.49Å; L217-C220 PolarHBondContact O-N 3.34Å; L217-C220 VanDerWaalsContact O-N 3.14Å; L217-S221 PolarHBondContact O-N 3.03Å; L217-S221 VanDerWaalsContact O-N 3.12Å; L217-W235 HydrophobicContact CD1-CH2 3.34Å; L217-W235 HydrophobicContact CD1-CZ2 3.9Å; L217-W235 HydrophobicContact CD1-CZ3 4.04Å; L217-L238 HydrophobicContact CB-CD1 3.82Å; L217-L238 HydrophobicContact CD1-CD1 4.1Å; L217-D257 HydrophobicContact CD2-CB 3.89Å; L217-I258 HydrophobicContact CD1-CG1 4.41Å; L217-I258 HydrophobicContact CD2-CG1 3.8Å
218D95.3Very high93Very high71 Ų7130.9 Ų30.938%0.3818%0.178SC..Hα-helixtrans-55.1-47.9173.2-77.1-5.5000110.4R150 H214 S215 C220 S221 I222R150-D218 IonicContact NH1-OD2 3.47Å; R150-D218 PolarHBondContact NH1-OD2 3.47Å; H214-D218 PolarHBondContact O-N 3.43Å; S215-D218 WeakPolarHBondContact O-CB 3.38Å; D218-C220 VanDerWaalsContact C-N 3.35Å; D218-C220 PolarHBondContact O-N 3.06Å; D218-S221 WeakPolarHBondContact O-CB 3.32Å; D218-S221 PolarHBondContact O-N 3.31Å; D218-S221 PolarHBondContact O-OG 2.99Å; D218-I222 WeakPolarHBondContact O-CG1 3.23Å; D218-I222 PolarHBondContact O-N 3.23Å
219I95.6Very high92.9Very high0 Ų032 Ų320%019%0.19CC..Hα-helixtrans-60.5-42.8177.6-70.4169.8000111.2L146 L149 R150 F153 S215 L216 L217 S221 I222 I223 T234L146-I219 HydrophobicContact CB-CD1 4.41Å; L146-I219 HydrophobicContact CD2-CD1 3.78Å; L149-I219 HydrophobicContact CB-CD1 4.21Å; R150-I219 HydrophobicContact CB-CD1 4.48Å; R150-I219 HydrophobicContact CB-CG1 3.92Å; R150-I219 HydrophobicContact CG-CG1 4.18Å; F153-I219 HydrophobicContact CD2-CG2 3.98Å; F153-I219 HydrophobicContact CE2-CG2 4.24Å; S215-I219 WeakPolarHBondContact O-CG1 3.48Å; S215-I219 PolarHBondContact O-N 3.05Å; S215-I219 VanDerWaalsContact O-N 3.1Å; L216-I219 PolarHBondContact O-N 3.49Å; L217-I219 VanDerWaalsContact C-N 3.29Å; L217-I219 PolarHBondContact O-N 3.19Å; I219-S221 VanDerWaalsContact C-N 3.28Å; I219-S221 PolarHBondContact O-N 2.96Å; I219-I222 WeakPolarHBondContact O-CB 3.47Å; I219-I222 PolarHBondContact O-N 3.4Å; I219-I223 HydrophobicContact CG2-CD1 4.07Å; I219-I223 HydrophobicContact CG2-CG2 3.97Å; I219-I223 WeakPolarHBondContact O-CG1 3.45Å; I219-I223 PolarHBondContact O-N 3.45Å; I219-T234 HydrophobicContact CG2-CG2 4.44Å
220C95.2Very high92.9Very high0 Ų032 Ų320%019%0.191CC..Hα-helixtrans-54.8-42.5175.7-780000112.3L216 L217 D218 I222 S224 H231 T234 W235L216-C220 PolarHBondContact O-N 3.16Å; L216-C220 PolarHBondContact O-SG 3.3Å; L217-C220 WeakPolarHBondContact O-CB 3.49Å; L217-C220 PolarHBondContact O-N 3.34Å; L217-C220 VanDerWaalsContact O-N 3.14Å; D218-C220 VanDerWaalsContact C-N 3.35Å; D218-C220 PolarHBondContact O-N 3.06Å; C220-I222 PolarHBondContact O-N 3.39Å; C220-S224 PolarHBondContact O-N 3.3Å; C220-H231 PolarHBondContact O-NE2 2.91Å; C220-T234 VanDerWaalsContact SG-CG2 3.55Å; C220-W235 HydrophobicContact CB-CD2 4.46Å; C220-W235 HydrophobicContact CB-CZ2 4.11Å
221S91.3Very high92.9Very high61 Ų6132 Ų3243%0.42719%0.19SC..Hα-helixtrans-61.4-34.6177.378.60000112.5L217 D218 I219 S224L217-S221 PolarHBondContact O-N 3.03Å; L217-S221 VanDerWaalsContact O-N 3.12Å; D218-S221 WeakPolarHBondContact O-CB 3.32Å; D218-S221 PolarHBondContact O-N 3.31Å; D218-S221 PolarHBondContact O-OG 2.99Å; I219-S221 VanDerWaalsContact C-N 3.28Å; I219-S221 PolarHBondContact O-N 2.96Å; S221-S224 PolarHBondContact O-OG 3.4Å
222I92.3Very high92.8Very high13 Ų1330.9 Ų30.97%0.06718%0.181CC..Hα-helixtrans-78-51-179.6-59.8174.6000110.6R150 F153 Q154 K157 D218 I219 C220 S224R150-I222 HydrophobicContact CB-CD1 4.45Å; R150-I222 HydrophobicContact CG-CD1 3.27Å; F153-I222 HydrophobicContact CB-CG2 4.02Å; Q154-I222 HydrophobicContact CB-CD1 4.33Å; Q154-I222 HydrophobicContact CB-CG2 4.11Å; Q154-I222 VanDerWaalsContact OE1-CG1 3.29Å; K157-I222 HydrophobicContact CD-CG2 4.44Å; K157-I222 WeakPolarHBondContact CD-O 3.38Å; K157-I222 WeakPolarHBondContact CE-O 3.37Å; K157-I222 PolarHBondContact NZ-O 3.18Å; D218-I222 WeakPolarHBondContact O-CG1 3.23Å; D218-I222 PolarHBondContact O-N 3.23Å; I219-I222 WeakPolarHBondContact O-CB 3.47Å; I219-I222 PolarHBondContact O-N 3.4Å; C220-I222 PolarHBondContact O-N 3.39Å; I222-S224 PolarHBondContact O-N 3.05Å; I222-S224 VanDerWaalsContact O-N 3.11Å
223I92.9Very high92.8Very high0 Ų034.6 Ų34.60%020%0.2CC..Hα-helixtrans-72.4-4.5-175.967.1-172.3000113.5F153 I219 N225 L226 L230 H231 T234F153-I223 HydrophobicContact CB-CG2 3.96Å; F153-I223 HydrophobicContact CD1-CG2 4.47Å; F153-I223 HydrophobicContact CD2-CG2 3.86Å; F153-I223 HydrophobicContact CE2-CG2 4.48Å; F153-I223 HydrophobicContact CG-CG2 3.86Å; I219-I223 HydrophobicContact CG2-CD1 4.07Å; I219-I223 HydrophobicContact CG2-CG2 3.97Å; I219-I223 WeakPolarHBondContact O-CG1 3.45Å; I219-I223 PolarHBondContact O-N 3.45Å; I223-N225 PolarHBondContact O-N 2.68Å; I223-L226 HydrophobicContact CG2-CD2 4.48Å; I223-L226 WeakPolarHBondContact O-CB 3.37Å; I223-L226 PolarHBondContact O-N 2.87Å; I223-L230 HydrophobicContact CB-CD2 4.3Å; I223-L230 HydrophobicContact CD1-CG 4.01Å; I223-L230 HydrophobicContact CG2-CD2 3.88Å; I223-L230 HydrophobicContact CG2-CG 4.46Å; I223-H231 HydrophobicContact CD1-CB 4.19Å; I223-H231 HydrophobicContact CG1-CB 4.04Å; I223-T234 HydrophobicContact CD1-CG2 4.27Å; I223-T234 WeakPolarHBondContact CD1-OG1 3.44Å
224S86.9Confident92.8Very high19 Ų1934.6 Ų34.613%0.13320%0.201CC..THydrogen-bonded Turntrans-51.5127.1168.166.20000110.3K157 C220 S221 I222 L226K157-S224 PolarHBondContact NZ-O 3.47Å; K157-S224 VanDerWaalsContact NZ-O 3.08Å; K157-S224 PolarHBondContact NZ-OG 3.46Å; C220-S224 PolarHBondContact O-N 3.3Å; S221-S224 PolarHBondContact O-OG 3.4Å; I222-S224 PolarHBondContact O-N 3.05Å; I222-S224 VanDerWaalsContact O-N 3.11Å; S224-L226 PolarHBondContact O-N 3.26Å; S224-L226 VanDerWaalsContact O-N 3.13Å
225N81.7Confident92.8Very high146 Ų14633.4 Ų33.478%0.78120%0.195SC*.THydrogen-bonded Turntrans62.45.1-175-54.4-29000116.5I223I223-N225 PolarHBondContact O-N 2.68Å
226L87.3Confident92.8Very high56 Ų5638.6 Ų38.629%0.29321%0.214SC..THydrogen-bonded Turntrans-86.6-56.9176-172.764.3000111.6F153 C156 K157 F178 I223 S224F153-L226 HydrophobicContact CB-CD2 4.39Å; F153-L226 HydrophobicContact CD1-CD2 4.48Å; C156-L226 HydrophobicContact CB-CD2 4.45Å; K157-L226 HydrophobicContact CB-CD1 4.43Å; F178-L226 HydrophobicContact CD2-CD2 4.2Å; F178-L226 HydrophobicContact CE2-CD2 3.58Å; F178-L226 HydrophobicContact CE2-CG 3.98Å; I223-L226 HydrophobicContact CG2-CD2 4.48Å; I223-L226 WeakPolarHBondContact O-CB 3.37Å; I223-L226 PolarHBondContact O-N 2.87Å; S224-L226 PolarHBondContact O-N 3.26Å; S224-L226 VanDerWaalsContact O-N 3.13Å
227D90.5Very high92.8Very high61 Ų6139.6 Ų39.633%0.32622%0.218SC..  trans-147.2126.5173.2-179.4-91.2000111.1F178 A229 L230 H231F178-D227 HydrophobicContact CZ-CB 4.01Å; D227-A229 PolarHBondContact O-N 3.3Å; D227-A229 WeakPolarHBondContact OD1-CB 3.17Å; D227-A229 PolarHBondContact OD1-N 2.83Å; D227-L230 HydrophobicContact CB-CB 3.99Å; D227-L230 WeakPolarHBondContact OD1-CB 3.39Å; D227-L230 PolarHBondContact OD1-N 3.17Å; D227-H231 VanDerWaalsContact O-CB 3.29Å; D227-H231 WeakPolarHBondContact O-CB 3.29Å; D227-H231 PolarHBondContact O-N 3.01Å
228I89.9Confident92.8Very high64 Ų6438.9 Ų38.933%0.32821%0.214SC..Hα-helixtrans-65.5-40.9-173.8-65.5174.7000111.7A232 L296 K299 M303I228-A232 WeakPolarHBondContact O-CB 3.27Å; I228-A232 PolarHBondContact O-N 3.29Å; I228-L296 HydrophobicContact CD1-CD1 4.42Å; I228-K299 HydrophobicContact CD1-CB 4.14Å; I228-M303 HydrophobicContact CG2-CG 3.56Å; I228-M303 HydrophobicContact CG2-SD 3.57Å; I228-M303 VanDerWaalsContact CG2-SD 3.57Å
229A91.3Very high92.9Very high49 Ų4936 Ų3641%0.40520%0.199SC..Hα-helixtrans-72.8-43.3-175.400000110.9D227 H231 A232 N233D227-A229 PolarHBondContact O-N 3.3Å; D227-A229 WeakPolarHBondContact OD1-CB 3.17Å; D227-A229 PolarHBondContact OD1-N 2.83Å; A229-H231 VanDerWaalsContact C-N 3.33Å; A229-H231 PolarHBondContact O-N 3.07Å; A229-A232 PolarHBondContact O-N 2.89Å; A229-N233 WeakPolarHBondContact O-CB 3.21Å; A229-N233 VanDerWaalsContact O-CG 3.22Å; A229-N233 PolarHBondContact O-N 3.15Å; A229-N233 PolarHBondContact O-ND2 2.9Å; A229-N233 VanDerWaalsContact O-ND2 3.14Å
230L93.4Very high92.9Very high5 Ų540.7 Ų40.73%0.02622%0.219CC..Hα-helixtrans-57.8-47.6173.5177.553000111.1F153 F178 Y182 I223 D227 N233 T234F153-L230 HydrophobicContact CD1-CD2 4.36Å; F153-L230 HydrophobicContact CE1-CD2 3.87Å; F153-L230 HydrophobicContact CE2-CD2 4.46Å; F153-L230 HydrophobicContact CZ-CD2 3.93Å; F178-L230 HydrophobicContact CE2-CD2 4.09Å; F178-L230 HydrophobicContact CZ-CD2 3.95Å; Y182-L230 HydrophobicContact CD2-CB 3.95Å; Y182-L230 HydrophobicContact CD2-CD1 3.58Å; Y182-L230 HydrophobicContact CD2-CD2 4.03Å; Y182-L230 HydrophobicContact CD2-CG 3.99Å; Y182-L230 HydrophobicContact CE2-CB 3.66Å; Y182-L230 HydrophobicContact CE2-CD1 3.64Å; Y182-L230 HydrophobicContact CE2-CG 4.07Å; I223-L230 HydrophobicContact CB-CD2 4.3Å; I223-L230 HydrophobicContact CD1-CG 4.01Å; I223-L230 HydrophobicContact CG2-CD2 3.88Å; I223-L230 HydrophobicContact CG2-CG 4.46Å; D227-L230 HydrophobicContact CB-CB 3.99Å; D227-L230 WeakPolarHBondContact OD1-CB 3.39Å; D227-L230 PolarHBondContact OD1-N 3.17Å; L230-N233 PolarHBondContact O-N 3.03Å; L230-T234 WeakPolarHBondContact O-CB 3.4Å; L230-T234 PolarHBondContact O-N 3.36Å; L230-T234 PolarHBondContact O-OG1 2.9Å
231H93.8Very high92.9Very high11 Ų1140.8 Ų40.85%0.05122%0.22CC..Hα-helixtrans-62.2-48.5-179.6-168.4-162.8000112.3C220 I223 D227 A229 N233 T234 W235 N265 F307C220-H231 PolarHBondContact O-NE2 2.91Å; I223-H231 HydrophobicContact CD1-CB 4.19Å; I223-H231 HydrophobicContact CG1-CB 4.04Å; D227-H231 VanDerWaalsContact O-CB 3.29Å; D227-H231 WeakPolarHBondContact O-CB 3.29Å; D227-H231 PolarHBondContact O-N 3.01Å; A229-H231 VanDerWaalsContact C-N 3.33Å; A229-H231 PolarHBondContact O-N 3.07Å; H231-N233 PolarHBondContact O-N 3.15Å; H231-T234 PolarHBondContact O-N 2.97Å; H231-W235 AromaticContact CD2-CD1 3.31Å; H231-W235 AromaticContact CD2-NE1 3.54Å; H231-W235 AromaticContact CE1-NE1 3.98Å; H231-W235 AromaticContact NE2-CD1 3.26Å; H231-W235 VanDerWaalsContact NE2-CD1 3.26Å; H231-W235 AromaticContact NE2-NE1 2.99Å; H231-W235 PolarHBondContact NE2-NE1 3.31Å; H231-W235 PolarHBondContact O-N 3.31Å; H231-W235 VanDerWaalsContact O-N 3.09Å; H231-N265 PolarHBondContact CE1-OD1 3.44Å; H231-F307 AromaticContact CE1-CZ 3.58Å; H231-F307 AromaticContact ND1-CZ 3.86Å
232A94Very high93.1Very high18 Ų1837.9 Ų37.915%0.14920%0.199CC..Hα-helixtrans-62-42.9177.700000112.6I228 A229 K236 M303 F306I228-A232 WeakPolarHBondContact O-CB 3.27Å; I228-A232 PolarHBondContact O-N 3.29Å; A229-A232 PolarHBondContact O-N 2.89Å; A232-K236 VanDerWaalsContact O-CB 3.28Å; A232-K236 WeakPolarHBondContact O-CB 3.15Å; A232-K236 PolarHBondContact O-N 2.9Å; A232-M303 HydrophobicContact CB-CE 4.03Å; A232-M303 HydrophobicContact CB-SD 3.95Å; A232-F306 HydrophobicContact CB-CE1 4.45Å; A232-F306 WeakPolarHBondContact O-CZ 3.26Å
233N94.6Very high93.2Very high80 Ų8039.2 Ų39.243%0.42821%0.206SC..Hα-helixtrans-67.5-39.9-179.6-73.7-28.5000112.3A229 L230 H231 K236 F237A229-N233 WeakPolarHBondContact O-CB 3.21Å; A229-N233 VanDerWaalsContact O-CG 3.22Å; A229-N233 PolarHBondContact O-N 3.15Å; A229-N233 PolarHBondContact O-ND2 2.9Å; A229-N233 VanDerWaalsContact O-ND2 3.14Å; L230-N233 PolarHBondContact O-N 3.03Å; H231-N233 PolarHBondContact O-N 3.15Å; N233-K236 PolarHBondContact O-N 3.4Å; N233-F237 WeakPolarHBondContact O-CB 3.28Å; N233-F237 PolarHBondContact O-N 3.5Å
234T95.9Very high93.2Very high1 Ų143.3 Ų43.31%0.00622%0.224CC..Hα-helixtrans-64.4-46.1177.7-51.20000110.6Q185 L216 I219 C220 I223 L230 H231 F237 L238Q185-T234 PolarHBondContact NE2-OG1 3.24Å; L216-T234 HydrophobicContact CB-CG2 4.46Å; L216-T234 HydrophobicContact CD2-CG2 4.07Å; I219-T234 HydrophobicContact CG2-CG2 4.44Å; C220-T234 VanDerWaalsContact SG-CG2 3.55Å; I223-T234 HydrophobicContact CD1-CG2 4.27Å; I223-T234 WeakPolarHBondContact CD1-OG1 3.44Å; L230-T234 WeakPolarHBondContact O-CB 3.4Å; L230-T234 PolarHBondContact O-N 3.36Å; L230-T234 PolarHBondContact O-OG1 2.9Å; H231-T234 PolarHBondContact O-N 2.97Å; T234-F237 PolarHBondContact O-N 2.75Å; T234-L238 WeakPolarHBondContact O-CB 3.23Å; T234-L238 PolarHBondContact O-N 3.27Å
235W96.9Very high93.4Very high0 Ų042.8 Ų42.80%022%0.219CC..Hα-helixtrans-60.5-46.8173.7-92.2113000113L217 C220 H231 F237 L238 I239 I258 S261 L262 N265 F306 F307L217-W235 HydrophobicContact CD1-CH2 3.34Å; L217-W235 HydrophobicContact CD1-CZ2 3.9Å; L217-W235 HydrophobicContact CD1-CZ3 4.04Å; C220-W235 HydrophobicContact CB-CD2 4.46Å; C220-W235 HydrophobicContact CB-CZ2 4.11Å; H231-W235 AromaticContact CD2-CD1 3.31Å; H231-W235 AromaticContact CD2-NE1 3.54Å; H231-W235 AromaticContact CE1-NE1 3.98Å; H231-W235 AromaticContact NE2-CD1 3.26Å; H231-W235 VanDerWaalsContact NE2-CD1 3.26Å; H231-W235 AromaticContact NE2-NE1 2.99Å; H231-W235 PolarHBondContact NE2-NE1 3.31Å; H231-W235 PolarHBondContact O-N 3.31Å; H231-W235 VanDerWaalsContact O-N 3.09Å; W235-F237 PolarHBondContact O-N 2.84Å; W235-L238 HydrophobicContact CE3-CD1 4.28Å; W235-L238 HydrophobicContact CE3-CD2 4.24Å; W235-L238 HydrophobicContact CZ3-CD1 4.16Å; W235-L238 HydrophobicContact CZ3-CD2 4.01Å; W235-L238 PolarHBondContact O-N 3.31Å; W235-I239 HydrophobicContact CE3-CD1 4.29Å; W235-I239 HydrophobicContact CE3-CG1 4.13Å; W235-I239 HydrophobicContact CZ3-CD1 4.26Å; W235-I239 VanDerWaalsContact O-CG1 3.29Å; W235-I239 WeakPolarHBondContact O-CG1 3.49Å; W235-I239 PolarHBondContact O-N 3.19Å; W235-I258 HydrophobicContact CZ3-CG2 4.13Å; W235-S261 WeakPolarHBondContact CZ2-OG 2.96Å; W235-L262 HydrophobicContact CD2-CD2 3.86Å; W235-L262 HydrophobicContact CE3-CD2 3.66Å; W235-L262 HydrophobicContact CE3-CG 4.21Å; W235-L262 HydrophobicContact CH2-CD2 3.82Å; W235-L262 HydrophobicContact CH2-CG 3.64Å; W235-L262 HydrophobicContact CZ2-CD2 4.02Å; W235-L262 HydrophobicContact CZ2-CG 4.19Å; W235-L262 HydrophobicContact CZ3-CD1 4.23Å; W235-L262 HydrophobicContact CZ3-CD2 3.64Å; W235-L262 HydrophobicContact CZ3-CG 3.66Å; W235-N265 PolarHBondContact NE1-ND2 2.97Å; W235-F306 HydrophobicContact CB-CE1 3.74Å; W235-F306 HydrophobicContact CB-CZ 3.73Å; W235-F306 HydrophobicContact CG-CE1 4.34Å; W235-F307 AromaticContact CD1-CE1 3.58Å; W235-F307 HydrophobicContact CG-CE1 4.17Å; W235-F307 AromaticContact NE1-CE1 3.7Å
236K96.1Very high93.9Very high142 Ų14238.4 Ų38.462%0.61719%0.194SC*.Hα-helixtrans-57.9-41178.8-174.2179.4-179.7-177.30111A232 N233 K240 F306A232-K236 VanDerWaalsContact O-CB 3.28Å; A232-K236 WeakPolarHBondContact O-CB 3.15Å; A232-K236 PolarHBondContact O-N 2.9Å; N233-K236 PolarHBondContact O-N 3.4Å; K236-K240 VanDerWaalsContact O-CB 3.23Å; K236-K240 WeakPolarHBondContact O-CB 3.38Å; K236-K240 PolarHBondContact O-N 3.38Å; K236-F306 HydrophobicContact CB-CE2 4.48Å; K236-F306 HydrophobicContact CB-CZ 4.45Å
237F96.6Very high94.2Very high20 Ų2040.5 Ų40.59%0.08821%0.213CC..Hα-helixtrans-69.1-46.9176.8-174.6-90.3000112.3L189 L192 D193 L216 N233 T234 W235 I239 K240 Q241L189-F237 HydrophobicContact CB-CD2 3.98Å; L189-F237 HydrophobicContact CB-CE2 3.98Å; L189-F237 HydrophobicContact CB-CG 4.28Å; L189-F237 HydrophobicContact CB-CZ 4.28Å; L189-F237 HydrophobicContact CD1-CB 4.01Å; L189-F237 HydrophobicContact CD1-CD1 4.38Å; L189-F237 HydrophobicContact CD1-CD2 4.4Å; L189-F237 HydrophobicContact CD1-CG 4Å; L189-F237 HydrophobicContact CD2-CD1 3.61Å; L189-F237 HydrophobicContact CD2-CD2 4.5Å; L189-F237 HydrophobicContact CD2-CE1 3.69Å; L189-F237 HydrophobicContact CD2-CG 4.03Å; L189-F237 HydrophobicContact CD2-CZ 4.2Å; L189-F237 HydrophobicContact CG-CD1 4.37Å; L189-F237 HydrophobicContact CG-CD2 4.5Å; L189-F237 HydrophobicContact CG-CG 4.3Å; L189-F237 WeakPolarHBondContact O-CE2 3.42Å; L192-F237 HydrophobicContact CB-CE1 4.28Å; L192-F237 HydrophobicContact CB-CZ 3.63Å; L192-F237 HydrophobicContact CD1-CE1 4.28Å; L192-F237 HydrophobicContact CD1-CZ 4.41Å; D193-F237 HydrophobicContact CB-CE2 4.02Å; L216-F237 HydrophobicContact CD1-CD1 3.66Å; L216-F237 HydrophobicContact CD1-CE1 3.85Å; N233-F237 WeakPolarHBondContact O-CB 3.28Å; N233-F237 PolarHBondContact O-N 3.5Å; T234-F237 PolarHBondContact O-N 2.75Å; W235-F237 PolarHBondContact O-N 2.84Å; F237-I239 VanDerWaalsContact C-N 3.32Å; F237-I239 PolarHBondContact O-N 3.16Å; F237-K240 WeakPolarHBondContact O-CB 3.4Å; F237-K240 PolarHBondContact O-N 3.25Å; F237-K240 VanDerWaalsContact O-N 3.15Å; F237-Q241 HydrophobicContact CD1-CG 3.83Å; F237-Q241 HydrophobicContact CE1-CG 3.32Å; F237-Q241 HydrophobicContact CE2-CG 4.19Å; F237-Q241 HydrophobicContact CG-CG 4.47Å; F237-Q241 HydrophobicContact CZ-CG 3.53Å; F237-Q241 WeakPolarHBondContact O-CG 3.34Å; F237-Q241 PolarHBondContact O-N 3.02Å
238L96.7Very high94.2Very high0 Ų039.8 Ų39.80%021%0.21CC..Hα-helixtrans-53.4-49.6177.5-178.3162.8000111.5I213 L216 L217 T234 W235 Q241 S242 I258I213-L238 HydrophobicContact CG2-CD2 4.27Å; I213-L238 HydrophobicContact CG2-CG 4.16Å; L216-L238 HydrophobicContact CB-CD1 4.18Å; L217-L238 HydrophobicContact CB-CD1 3.82Å; L217-L238 HydrophobicContact CD1-CD1 4.1Å; T234-L238 WeakPolarHBondContact O-CB 3.23Å; T234-L238 PolarHBondContact O-N 3.27Å; W235-L238 HydrophobicContact CE3-CD1 4.28Å; W235-L238 HydrophobicContact CE3-CD2 4.24Å; W235-L238 HydrophobicContact CZ3-CD1 4.16Å; W235-L238 HydrophobicContact CZ3-CD2 4.01Å; W235-L238 PolarHBondContact O-N 3.31Å; L238-Q241 PolarHBondContact O-N 3.23Å; L238-S242 PolarHBondContact O-N 3.09Å; L238-S242 PolarHBondContact O-OG 2.74Å; L238-I258 HydrophobicContact CD2-CG2 4.49Å
239I96.9Very high94.4Very high10 Ų1036.8 Ų36.85%0.05119%0.194CC..Hα-helixtrans-68-40.7179.9-60.6-71.1000110.5W235 F237 Q241 S242 L243 I258 L262 T310 Y314W235-I239 HydrophobicContact CE3-CD1 4.29Å; W235-I239 HydrophobicContact CE3-CG1 4.13Å; W235-I239 HydrophobicContact CZ3-CD1 4.26Å; W235-I239 VanDerWaalsContact O-CG1 3.29Å; W235-I239 WeakPolarHBondContact O-CG1 3.49Å; W235-I239 PolarHBondContact O-N 3.19Å; F237-I239 VanDerWaalsContact C-N 3.32Å; F237-I239 PolarHBondContact O-N 3.16Å; I239-Q241 PolarHBondContact O-N 2.96Å; I239-S242 PolarHBondContact O-N 2.91Å; I239-L243 HydrophobicContact CG2-CD1 3.93Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.38Å; I239-L243 PolarHBondContact O-N 2.97Å; I239-I258 HydrophobicContact CD1-CG2 4.26Å; I239-L262 HydrophobicContact CD1-CD1 4.28Å; I239-T310 HydrophobicContact CB-CG2 4.42Å; I239-T310 HydrophobicContact CD1-CG2 3.98Å; I239-T310 HydrophobicContact CG1-CG2 3.6Å; I239-T310 HydrophobicContact CG2-CG2 4.36Å; I239-Y314 HydrophobicContact CD1-CD2 3.52Å; I239-Y314 HydrophobicContact CD1-CE2 3.95Å; I239-Y314 HydrophobicContact CD1-CG 4.33Å
240K95.9Very high94.5Very high99 Ų9937 Ų3743%0.4319%0.187SC..Hα-helixtrans-56.8-46.9174.2-175.9-171.7-179.6-169.20111.7D193 K236 F237 L243 K244D193-K240 VanDerWaalsContact OD1-CE 3.31Å; D193-K240 WeakPolarHBondContact OD1-CE 3.32Å; D193-K240 IonicContact OD1-NZ 3.77Å; D193-K240 PolarHBondContact OD1-NZ 3.44Å; D193-K240 IonicContact OD2-NZ 3.11Å; D193-K240 PolarHBondContact OD2-NZ 3.04Å; K236-K240 VanDerWaalsContact O-CB 3.23Å; K236-K240 WeakPolarHBondContact O-CB 3.38Å; K236-K240 PolarHBondContact O-N 3.38Å; F237-K240 WeakPolarHBondContact O-CB 3.4Å; F237-K240 PolarHBondContact O-N 3.25Å; F237-K240 VanDerWaalsContact O-N 3.15Å; K240-L243 PolarHBondContact O-N 3.43Å; K240-K244 VanDerWaalsContact O-CB 3.28Å; K240-K244 WeakPolarHBondContact O-CB 3.44Å; K240-K244 PolarHBondContact O-N 3.37Å
241Q94.7Very high94.4Very high1 Ų144.8 Ų44.81%0.00522%0.223CC..Hα-helixtrans-68.2-39.4179.6-63.5-48.8-44.500112.2D193 I213 F237 L238 I239 L243 K244 Y245D193-Q241 PolarHBondContact OD1-NE2 3.43Å; D193-Q241 VanDerWaalsContact OD1-NE2 3.1Å; I213-Q241 HydrophobicContact CD1-CB 4.31Å; I213-Q241 HydrophobicContact CG1-CB 4.23Å; F237-Q241 HydrophobicContact CD1-CG 3.83Å; F237-Q241 HydrophobicContact CE1-CG 3.32Å; F237-Q241 HydrophobicContact CE2-CG 4.19Å; F237-Q241 HydrophobicContact CG-CG 4.47Å; F237-Q241 HydrophobicContact CZ-CG 3.53Å; F237-Q241 WeakPolarHBondContact O-CG 3.34Å; F237-Q241 PolarHBondContact O-N 3.02Å; L238-Q241 PolarHBondContact O-N 3.23Å; I239-Q241 PolarHBondContact O-N 2.96Å; Q241-L243 PolarHBondContact O-N 3.38Å; Q241-K244 PolarHBondContact O-N 2.82Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.42Å; Q241-Y245 PolarHBondContact O-N 2.93Å; Q241-Y245 VanDerWaalsContact OE1-CE2 3.25Å
242S96Very high94.4Very high0 Ų048.1 Ų48.10%024%0.239CC..Hα-helixtrans-56.8-40.8175.4-55.40000111.4L238 I239 Q246L238-S242 PolarHBondContact O-N 3.09Å; L238-S242 PolarHBondContact O-OG 2.74Å; I239-S242 PolarHBondContact O-N 2.91Å; S242-Q246 WeakPolarHBondContact O-CA 3.22Å; S242-Q246 PolarHBondContact O-N 2.73Å
243L94.4Very high94.5Very high41 Ų4147.7 Ų47.722%0.21523%0.234CC..Hα-helixtrans-79.3-38.7179.1-64.7171.6000113I239 K240 Q241 Y245 Q246 H313 E317 F318I239-L243 HydrophobicContact CG2-CD1 3.93Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.38Å; I239-L243 PolarHBondContact O-N 2.97Å; K240-L243 PolarHBondContact O-N 3.43Å; Q241-L243 PolarHBondContact O-N 3.38Å; L243-Y245 PolarHBondContact O-N 3Å; L243-Q246 WeakPolarHBondContact O-CB 3.26Å; L243-Q246 PolarHBondContact O-N 3.42Å; L243-H313 WeakPolarHBondContact CD1-NE2 3.29Å; L243-E317 HydrophobicContact CD2-CB 3.56Å; L243-E317 HydrophobicContact CD2-CG 3.63Å; L243-F318 HydrophobicContact CD2-CD2 4.49Å; L243-F318 HydrophobicContact CD2-CE2 3.6Å; L243-F318 HydrophobicContact CD2-CZ 4.07Å; L243-F318 HydrophobicContact CG-CE2 4.44Å
244K93.1Very high94.6Very high87 Ų8749.1 Ų49.138%0.37824%0.238SC..Hα-helixtrans-56.6-36.8179-175.9-179.1175.2-168.90111.6D193 I195 K240 Q241D193-K244 PolarHBondContact O-NZ 3.12Å; I195-K244 PolarHBondContact O-NZ 3.4Å; K240-K244 VanDerWaalsContact O-CB 3.28Å; K240-K244 WeakPolarHBondContact O-CB 3.44Å; K240-K244 PolarHBondContact O-N 3.37Å; Q241-K244 PolarHBondContact O-N 2.82Å
245Y92.3Very high94.6Very high7 Ų749.6 Ų49.63%0.02724%0.24CC..THydrogen-bonded Turntrans-113.123-178.6-52.1-59000113.2I195 L197 I209 Q241 L243 S247 L248 V249I195-Y245 PolarHBondContact O-OH 3.27Å; L197-Y245 HydrophobicContact CB-CD1 3.94Å; L197-Y245 HydrophobicContact CB-CE1 3.78Å; L197-Y245 HydrophobicContact CD1-CD1 4.16Å; L197-Y245 HydrophobicContact CD1-CD2 4.39Å; L197-Y245 HydrophobicContact CD1-CE1 4.11Å; L197-Y245 HydrophobicContact CD1-CE2 4.3Å; L197-Y245 HydrophobicContact CD1-CG 4.29Å; L197-Y245 HydrophobicContact CG-CD1 4.46Å; L197-Y245 HydrophobicContact CG-CE1 4.1Å; I209-Y245 HydrophobicContact CD1-CD2 4.37Å; I209-Y245 HydrophobicContact CD1-CE2 3.97Å; I209-Y245 HydrophobicContact CG1-CD2 3.76Å; I209-Y245 HydrophobicContact CG1-CE2 3.84Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.42Å; Q241-Y245 PolarHBondContact O-N 2.93Å; Q241-Y245 VanDerWaalsContact OE1-CE2 3.25Å; L243-Y245 PolarHBondContact O-N 3Å; Y245-S247 PolarHBondContact O-N 2.99Å; Y245-S247 VanDerWaalsContact O-N 3.16Å; Y245-L248 WeakPolarHBondContact O-CB 3.41Å; Y245-L248 PolarHBondContact O-N 3.49Å; Y245-V249 WeakPolarHBondContact O-CG2 3.37Å; Y245-V249 PolarHBondContact O-N 3.43Å; Y245-V249 VanDerWaalsContact O-N 3.12Å
246Q92.6Very high94.5Very high54 Ų5450.2 Ų50.225%0.25225%0.247SC..Hα-helixtrans-42.7-56.2-170.3173.9174.6-2.900113.6S242 L243 L248 V249 E250 E317 F318S242-Q246 WeakPolarHBondContact O-CA 3.22Å; S242-Q246 PolarHBondContact O-N 2.73Å; L243-Q246 WeakPolarHBondContact O-CB 3.26Å; L243-Q246 PolarHBondContact O-N 3.42Å; Q246-L248 PolarHBondContact O-N 2.84Å; Q246-L248 VanDerWaalsContact O-N 3.14Å; Q246-V249 PolarHBondContact O-N 2.96Å; Q246-E250 WeakPolarHBondContact O-CB 3.36Å; Q246-E250 WeakPolarHBondContact O-CG 3.45Å; Q246-E250 PolarHBondContact O-N 3Å; Q246-E317 PolarHBondContact NE2-O 3.08Å; Q246-F318 HydrophobicContact CB-CE1 4.43Å; Q246-F318 HydrophobicContact CB-CZ 4.43Å; Q246-F318 HydrophobicContact CG-CE1 3.77Å; Q246-F318 HydrophobicContact CG-CZ 4.13Å
247S91.8Very high94.4Very high100 Ų10047.4 Ų47.470%0.69924%0.238SC*.Hα-helixtrans-65-18-176.158.90000114.8Y245Y245-S247 PolarHBondContact O-N 2.99Å; Y245-S247 VanDerWaalsContact O-N 3.16Å
248L91.8Very high94.4Very high47 Ų4746.5 Ų46.525%0.24623%0.234CC..Hα-helixtrans-92.5-35.1178.8-61.8174.4000111.6L197 V206 Y245 Q246L197-L248 HydrophobicContact CB-CD1 4.03Å; V206-L248 WeakPolarHBondContact CG1-O 3.5Å; V206-L248 HydrophobicContact CG2-CB 4.35Å; Y245-L248 WeakPolarHBondContact O-CB 3.41Å; Y245-L248 PolarHBondContact O-N 3.49Å; Q246-L248 PolarHBondContact O-N 2.84Å; Q246-L248 VanDerWaalsContact O-N 3.14Å
249V92.8Very high94.4Very high0 Ų046.5 Ų46.50%023%0.234CC..Hα-helixtrans-105.3-15-169.6-55.10000114.2V206 I209 V210 Y245 Q246 E251 Q252 L253V206-V249 HydrophobicContact CG1-CG1 4.4Å; I209-V249 HydrophobicContact CG2-CG1 3.81Å; V210-V249 HydrophobicContact CG2-CB 3.93Å; V210-V249 HydrophobicContact CG2-CG1 3.87Å; Y245-V249 WeakPolarHBondContact O-CG2 3.37Å; Y245-V249 PolarHBondContact O-N 3.43Å; Y245-V249 VanDerWaalsContact O-N 3.12Å; Q246-V249 PolarHBondContact O-N 2.96Å; V249-E251 VanDerWaalsContact C-N 3.26Å; V249-E251 PolarHBondContact O-N 3.4Å; V249-E251 VanDerWaalsContact O-N 3.13Å; V249-Q252 PolarHBondContact O-N 2.86Å; V249-L253 HydrophobicContact CB-CD1 4.33Å; V249-L253 HydrophobicContact CB-CD2 4.49Å; V249-L253 HydrophobicContact CB-CG 4.04Å; V249-L253 HydrophobicContact CG2-CD1 3.6Å; V249-L253 HydrophobicContact CG2-CD2 4.47Å; V249-L253 HydrophobicContact CG2-CG 3.88Å; V249-L253 WeakPolarHBondContact O-CG 3.33Å; V249-L253 PolarHBondContact O-N 2.97Å
250E93.5Very high94.4Very high54 Ų5448.3 Ų48.325%0.25224%0.244SC..THydrogen-bonded Turntrans-57.5-30.4-17162.2-179.4-166.500114.8Q246 H255 F318 F321Q246-E250 WeakPolarHBondContact O-CB 3.36Å; Q246-E250 WeakPolarHBondContact O-CG 3.45Å; Q246-E250 PolarHBondContact O-N 3Å; E250-H255 PolarHBondContact O-NE2 3.02Å; E250-F318 HydrophobicContact CB-CD1 4.3Å; E250-F318 HydrophobicContact CB-CE1 4.11Å; E250-F321 HydrophobicContact CB-CD2 4.46Å; E250-F321 HydrophobicContact CB-CE2 3.66Å; E250-F321 HydrophobicContact CB-CZ 3.83Å; E250-F321 HydrophobicContact CG-CE2 3.94Å; E250-F321 HydrophobicContact CG-CZ 3.77Å; E250-F321 WeakPolarHBondContact O-CE1 3.38Å
251E92.7Very high94.4Very high169 Ų16944.5 Ų44.579%0.7923%0.23SC*.THydrogen-bonded Turntrans-81.3-22.9177.2-62.1-169.7166.800113.4V249 F321V249-E251 VanDerWaalsContact C-N 3.26Å; V249-E251 PolarHBondContact O-N 3.4Å; V249-E251 VanDerWaalsContact O-N 3.13Å; E251-F321 HydrophobicContact CG-CE1 4.37Å; E251-F321 HydrophobicContact CG-CZ 4.38Å
252Q94.2Very high94.4Very high81 Ų8144.5 Ų44.538%0.37923%0.23SC..THydrogen-bonded Turntrans-99.5-21.8-174-60.8-171.428.900113.1V210 V249 H254V210-Q252 HydrophobicContact CG1-CB 4.32Å; V210-Q252 HydrophobicContact CG2-CB 3.94Å; V249-Q252 PolarHBondContact O-N 2.86Å; Q252-H254 PolarHBondContact O-N 3.38Å
253L96Very high94.5Very high8 Ų844.9 Ų44.94%0.04223%0.233CC..SBendtrans-65.2132178.2-74-178.7000111.4V210 I213 V249 H255V210-L253 HydrophobicContact CG2-CD2 4.47Å; I213-L253 HydrophobicContact CB-CD2 4.25Å; I213-L253 HydrophobicContact CD1-CD2 4.04Å; I213-L253 HydrophobicContact CG2-CD2 3.75Å; V249-L253 HydrophobicContact CB-CD1 4.33Å; V249-L253 HydrophobicContact CB-CD2 4.49Å; V249-L253 HydrophobicContact CB-CG 4.04Å; V249-L253 HydrophobicContact CG2-CD1 3.6Å; V249-L253 HydrophobicContact CG2-CD2 4.47Å; V249-L253 HydrophobicContact CG2-CG 3.88Å; V249-L253 WeakPolarHBondContact O-CG 3.33Å; V249-L253 PolarHBondContact O-N 2.97Å; L253-H255 PolarHBondContact O-CD2 2.86Å; L253-H255 VanDerWaalsContact O-CD2 3.28Å; L253-H255 PolarHBondContact O-N 3.33Å
254H95.4Very high94.5Very high111 Ų11147.9 Ų47.951%0.51425%0.249SC..  trans-73.872.1166.9-52.2161.7000111.1H214 Q252 G256 D257 I258H214-H254 VanDerWaalsContact CE1-CB 3.45Å; H214-H254 WeakPolarHBondContact CE1-CB 3.5Å; H214-H254 AromaticContact CE1-CG 3.72Å; H214-H254 PolarHBondContact CE1-N 3.01Å; H214-H254 AromaticContact CE1-ND1 3.95Å; H214-H254 AromaticContact NE2-CG 3.78Å; H214-H254 PolarHBondContact NE2-N 3.32Å; H214-H254 VanDerWaalsContact NE2-N 3.16Å; Q252-H254 PolarHBondContact O-N 3.38Å; H254-G256 PolarHBondContact O-N 3.22Å; H254-G256 VanDerWaalsContact O-N 3.1Å; H254-D257 HydrophobicContact CB-CB 4.25Å; H254-D257 WeakPolarHBondContact CB-OD2 3.43Å; H254-D257 IonicContact CG-OD2 3.6Å; H254-D257 IonicContact ND1-OD2 2.76Å; H254-D257 PolarHBondContact O-N 3.03Å; H254-I258 PolarHBondContact O-N 2.69Å
255H95.5Very high94.7Very high10 Ų1044.4 Ų44.45%0.04624%0.235CC..Hα-helixtrans-53.4-34.3-178.1-69.4-65.2000113.7E250 L253 D257 I258 V259 Y314 F318 F321 L322E250-H255 PolarHBondContact O-NE2 3.02Å; L253-H255 PolarHBondContact O-CD2 2.86Å; L253-H255 VanDerWaalsContact O-CD2 3.28Å; L253-H255 PolarHBondContact O-N 3.33Å; H255-D257 VanDerWaalsContact C-N 3.34Å; H255-D257 PolarHBondContact O-N 3.2Å; H255-I258 PolarHBondContact O-N 2.9Å; H255-V259 WeakPolarHBondContact O-CB 3.46Å; H255-V259 PolarHBondContact O-N 3.11Å; H255-Y314 PolarHBondContact CE1-OH 2.97Å; H255-Y314 AromaticContact ND1-CE1 3.67Å; H255-Y314 AromaticContact ND1-CZ 3.57Å; H255-Y314 PolarHBondContact ND1-OH 3.12Å; H255-F318 AromaticContact CE1-CD1 3.27Å; H255-F318 WeakPolarHBondContact CE1-CD1 3.39Å; H255-F318 AromaticContact CE1-CE1 3.73Å; H255-F318 AromaticContact CE1-CG 3.65Å; H255-F318 AromaticContact ND1-CG 4Å; H255-F318 AromaticContact NE2-CD1 3.99Å; H255-F321 HydrophobicContact CB-CB 4.41Å; H255-F321 WeakPolarHBondContact CD2-CB 3.46Å; H255-F321 AromaticContact CD2-CG 3.66Å; H255-F321 AromaticContact NE2-CD2 3.88Å; H255-F321 AromaticContact NE2-CG 3.68Å; H255-L322 HydrophobicContact CB-CD2 3.81Å
256G94.6Very high94.9Very high14 Ų1444.1 Ų44.114%0.14423%0.233CC..Hα-helixtrans-60.8-41.3176.800000113.3H254 N260 K325H254-G256 PolarHBondContact O-N 3.22Å; H254-G256 VanDerWaalsContact O-N 3.1Å; G256-N260 WeakPolarHBondContact O-CB 3.43Å; G256-N260 PolarHBondContact O-N 3.47Å; G256-N260 PolarHBondContact O-ND2 3.42Å; G256-N260 PolarHBondContact O-OD1 2.9Å; G256-K325 VanDerWaalsContact CA-CE 3.43Å
257D95.4Very high95Very high83 Ų8342.5 Ų42.544%0.44423%0.226SC..Hα-helixtrans-72-40.4-178.2-60.8-20.5000110.7L217 H254 H255 S261L217-D257 HydrophobicContact CD2-CB 3.89Å; H254-D257 HydrophobicContact CB-CB 4.25Å; H254-D257 WeakPolarHBondContact CB-OD2 3.43Å; H254-D257 IonicContact CG-OD2 3.6Å; H254-D257 IonicContact ND1-OD2 2.76Å; H254-D257 PolarHBondContact O-N 3.03Å; H255-D257 VanDerWaalsContact C-N 3.34Å; H255-D257 PolarHBondContact O-N 3.2Å; D257-S261 WeakPolarHBondContact O-CB 3.37Å; D257-S261 PolarHBondContact O-N 3.46Å
258I96.6Very high95.2Very high0 Ų039.8 Ų39.80%021%0.21CC..Hα-helixtrans-61.1-51.1177.7-66.1169.9000110.5L217 W235 L238 I239 H254 H255 S261 L262 Y314L217-I258 HydrophobicContact CD1-CG1 4.41Å; L217-I258 HydrophobicContact CD2-CG1 3.8Å; W235-I258 HydrophobicContact CZ3-CG2 4.13Å; L238-I258 HydrophobicContact CD2-CG2 4.49Å; I239-I258 HydrophobicContact CD1-CG2 4.26Å; H254-I258 PolarHBondContact O-N 2.69Å; H255-I258 PolarHBondContact O-N 2.9Å; I258-S261 PolarHBondContact O-N 2.82Å; I258-L262 HydrophobicContact CG2-CD1 4.34Å; I258-L262 WeakPolarHBondContact O-CG 3.47Å; I258-L262 PolarHBondContact O-N 3.36Å; I258-Y314 HydrophobicContact CB-CE1 4.42Å; I258-Y314 WeakPolarHBondContact CD1-OH 3.48Å; I258-Y314 HydrophobicContact CG2-CD1 4.43Å; I258-Y314 HydrophobicContact CG2-CD2 4.45Å; I258-Y314 HydrophobicContact CG2-CE1 3.97Å; I258-Y314 HydrophobicContact CG2-CE2 3.99Å
259V96.4Very high95.3Very high0 Ų038.1 Ų38.10%020%0.203CC..Hα-helixtrans-68.6-41.5-178.6161.40000112.3H255 S261 L262 S263 L311 Y314 L322 F329H255-V259 WeakPolarHBondContact O-CB 3.46Å; H255-V259 PolarHBondContact O-N 3.11Å; V259-S261 VanDerWaalsContact C-N 3.33Å; V259-L262 PolarHBondContact O-N 2.72Å; V259-S263 WeakPolarHBondContact O-CB 3.29Å; V259-S263 PolarHBondContact O-N 3Å; V259-S263 PolarHBondContact O-OG 3.31Å; V259-L311 HydrophobicContact CB-CD1 4.42Å; V259-L311 HydrophobicContact CG1-CD1 3.94Å; V259-L311 HydrophobicContact CG2-CD1 4.17Å; V259-Y314 HydrophobicContact CG2-CD1 3.65Å; V259-Y314 HydrophobicContact CG2-CE1 3.94Å; V259-L322 HydrophobicContact CB-CD2 4.32Å; V259-L322 HydrophobicContact CG2-CD1 4.09Å; V259-L322 HydrophobicContact CG2-CD2 3.6Å; V259-F329 HydrophobicContact CG1-CD1 4.4Å; V259-F329 HydrophobicContact CG1-CE1 3.31Å; V259-F329 HydrophobicContact CG1-CZ 3.67Å
260N95.8Very high95.4Very high48 Ų4838.2 Ų38.226%0.25720%0.203SC..Hα-helixtrans-61.1-46.1175.8-74.6-7.8000110.1G256 L262 S263 D264G256-N260 WeakPolarHBondContact O-CB 3.43Å; G256-N260 PolarHBondContact O-N 3.47Å; G256-N260 PolarHBondContact O-ND2 3.42Å; G256-N260 PolarHBondContact O-OD1 2.9Å; N260-L262 PolarHBondContact O-N 3.44Å; N260-S263 WeakPolarHBondContact O-CB 3.34Å; N260-S263 PolarHBondContact O-N 2.91Å; N260-S263 VanDerWaalsContact O-N 3.12Å; N260-D264 WeakPolarHBondContact O-CB 3.35Å; N260-D264 PolarHBondContact O-N 3.2Å
261S95.9Very high95.4Very high20 Ų2039.5 Ų39.514%0.1421%0.209CC..Hα-helixtrans-63.2-39.9177.9-169.10000112.9W235 D257 I258 V259 S263 N265W235-S261 WeakPolarHBondContact CZ2-OG 2.96Å; D257-S261 WeakPolarHBondContact O-CB 3.37Å; D257-S261 PolarHBondContact O-N 3.46Å; I258-S261 PolarHBondContact O-N 2.82Å; V259-S261 VanDerWaalsContact C-N 3.33Å; S261-S263 VanDerWaalsContact C-N 3.34Å; S261-N265 VanDerWaalsContact O-CB 3.29Å; S261-N265 WeakPolarHBondContact O-CB 3.47Å; S261-N265 VanDerWaalsContact O-CG 3.28Å; S261-N265 PolarHBondContact O-N 2.89Å; S261-N265 PolarHBondContact O-ND2 3.33Å
262L96.5Very high95.4Very high0 Ų033.2 Ų33.20%018%0.183CC..Hα-helixtrans-61.8-41.8172.5-77.4172000112.1W235 I239 I258 V259 N260 L266 F307 T310 L311W235-L262 HydrophobicContact CD2-CD2 3.86Å; W235-L262 HydrophobicContact CE3-CD2 3.66Å; W235-L262 HydrophobicContact CE3-CG 4.21Å; W235-L262 HydrophobicContact CH2-CD2 3.82Å; W235-L262 HydrophobicContact CH2-CG 3.64Å; W235-L262 HydrophobicContact CZ2-CD2 4.02Å; W235-L262 HydrophobicContact CZ2-CG 4.19Å; W235-L262 HydrophobicContact CZ3-CD1 4.23Å; W235-L262 HydrophobicContact CZ3-CD2 3.64Å; W235-L262 HydrophobicContact CZ3-CG 3.66Å; I239-L262 HydrophobicContact CD1-CD1 4.28Å; I258-L262 HydrophobicContact CG2-CD1 4.34Å; I258-L262 WeakPolarHBondContact O-CG 3.47Å; I258-L262 PolarHBondContact O-N 3.36Å; V259-L262 PolarHBondContact O-N 2.72Å; N260-L262 PolarHBondContact O-N 3.44Å; L262-L266 WeakPolarHBondContact O-CB 3.49Å; L262-L266 PolarHBondContact O-N 2.93Å; L262-F307 HydrophobicContact CD2-CD1 3.94Å; L262-T310 HydrophobicContact CD1-CG2 4.12Å; L262-T310 HydrophobicContact CD2-CG2 3.93Å; L262-L311 HydrophobicContact CB-CD1 4.3Å; L262-L311 HydrophobicContact CD1-CD1 4.36Å
263S96.7Very high95.4Very high9 Ų929.3 Ų29.36%0.06317%0.165CC..Hα-helixtrans-66.1-45.5179.5-55.90000111.3V259 N260 S261 L266 L267V259-S263 WeakPolarHBondContact O-CB 3.29Å; V259-S263 PolarHBondContact O-N 3Å; V259-S263 PolarHBondContact O-OG 3.31Å; N260-S263 WeakPolarHBondContact O-CB 3.34Å; N260-S263 PolarHBondContact O-N 2.91Å; N260-S263 VanDerWaalsContact O-N 3.12Å; S261-S263 VanDerWaalsContact C-N 3.34Å; S263-L266 WeakPolarHBondContact O-CB 3.46Å; S263-L266 PolarHBondContact O-N 3.17Å; S263-L267 WeakPolarHBondContact O-CG 3.42Å; S263-L267 PolarHBondContact O-N 3.42Å
264D95.6Very high95.2Very high103 Ų10329.8 Ų29.855%0.55117%0.169SC*.Hα-helixtrans-63-43.2177-67.7-22.3000111.2N260 L266 L267 A268N260-D264 WeakPolarHBondContact O-CB 3.35Å; N260-D264 PolarHBondContact O-N 3.2Å; D264-L266 PolarHBondContact O-N 2.82Å; D264-L267 PolarHBondContact O-N 3.36Å; D264-A268 VanDerWaalsContact O-CB 3.26Å; D264-A268 WeakPolarHBondContact O-CB 3.34Å; D264-A268 PolarHBondContact O-N 3.02Å
265N95.6Very high95.1Very high15 Ų1530.1 Ų30.18%0.0817%0.17CC..Hα-helixtrans-64.8-37.9176.4-79.5-50000112.6H231 W235 S261 S269 F307H231-N265 PolarHBondContact CE1-OD1 3.44Å; W235-N265 PolarHBondContact NE1-ND2 2.97Å; S261-N265 VanDerWaalsContact O-CB 3.29Å; S261-N265 WeakPolarHBondContact O-CB 3.47Å; S261-N265 VanDerWaalsContact O-CG 3.28Å; S261-N265 PolarHBondContact O-N 2.89Å; S261-N265 PolarHBondContact O-ND2 3.33Å; N265-S269 VanDerWaalsContact O-CB 3.3Å; N265-S269 WeakPolarHBondContact O-CB 3.46Å; N265-S269 PolarHBondContact O-N 3.1Å; N265-S269 PolarHBondContact O-OG 3.24Å; N265-F307 HydrophobicContact CB-CD1 4.08Å; N265-F307 HydrophobicContact CB-CD2 4Å; N265-F307 HydrophobicContact CB-CE1 3.87Å; N265-F307 HydrophobicContact CB-CE2 3.78Å; N265-F307 HydrophobicContact CB-CG 4.16Å; N265-F307 HydrophobicContact CB-CZ 3.72Å
266L96.6Very high94.8Very high0 Ų030.5 Ų30.50%017%0.172CC..Hα-helixtrans-62.9-49.5173.5174.556.8000111.1L262 S263 D264 S269 L270 C304 F307 A308 I336 M365L262-L266 WeakPolarHBondContact O-CB 3.49Å; L262-L266 PolarHBondContact O-N 2.93Å; S263-L266 WeakPolarHBondContact O-CB 3.46Å; S263-L266 PolarHBondContact O-N 3.17Å; D264-L266 PolarHBondContact O-N 2.82Å; L266-S269 PolarHBondContact O-N 3Å; L266-L270 WeakPolarHBondContact O-CB 3.32Å; L266-L270 PolarHBondContact O-N 3.44Å; L266-C304 HydrophobicContact CD1-CB 3.9Å; L266-C304 VanDerWaalsContact CD1-O 3.3Å; L266-C304 WeakPolarHBondContact CD1-O 3.29Å; L266-F307 HydrophobicContact CB-CB 3.93Å; L266-F307 HydrophobicContact CD1-CB 4.39Å; L266-A308 HydrophobicContact CD1-CB 4.19Å; L266-A308 HydrophobicContact CD2-CB 3.99Å; L266-I336 HydrophobicContact CD2-CD1 3.66Å; L266-I336 HydrophobicContact CG-CD1 4.16Å; L266-M365 HydrophobicContact CD2-SD 4.45Å
267L95.9Very high94.6Very high20 Ų2029.9 Ų29.911%0.10517%0.165CC..Hα-helixtrans-63.6-44.7179.1-72.5171.4000111.9S263 D264 S269 L270 H271 L332 Q335 I336S263-L267 WeakPolarHBondContact O-CG 3.42Å; S263-L267 PolarHBondContact O-N 3.42Å; D264-L267 PolarHBondContact O-N 3.36Å; L267-S269 VanDerWaalsContact C-N 3.34Å; L267-S269 PolarHBondContact O-N 3.04Å; L267-L270 PolarHBondContact O-N 3.36Å; L267-H271 PolarHBondContact O-N 3.24Å; L267-H271 PolarHBondContact O-ND1 2.75Å; L267-L332 HydrophobicContact CD1-CD1 3.75Å; L267-L332 HydrophobicContact CD2-CD1 3.86Å; L267-L332 HydrophobicContact CG-CD1 3.6Å; L267-Q335 HydrophobicContact CD2-CB 4.05Å; L267-I336 HydrophobicContact CD2-CG1 3.89Å
268A94.7Very high94.3Very high44 Ų4429.9 Ų29.936%0.36416%0.163SC..Hα-helixtrans-60.6-44.117700000111.6D264 L270 H271 S272D264-A268 VanDerWaalsContact O-CB 3.26Å; D264-A268 WeakPolarHBondContact O-CB 3.34Å; D264-A268 PolarHBondContact O-N 3.02Å; A268-L270 VanDerWaalsContact C-N 3.34Å; A268-L270 PolarHBondContact O-N 2.8Å; A268-H271 PolarHBondContact O-N 2.8Å; A268-S272 WeakPolarHBondContact O-CB 3.46Å; A268-S272 PolarHBondContact O-N 3.34Å
269S94.6Very high93.9Very high12 Ų1235.8 Ų35.88%0.08419%0.191CC..Hα-helixtrans-64.1-39.9176.2-56.90000111.6N265 L266 L267 S272 C273 C304N265-S269 VanDerWaalsContact O-CB 3.3Å; N265-S269 WeakPolarHBondContact O-CB 3.46Å; N265-S269 PolarHBondContact O-N 3.1Å; N265-S269 PolarHBondContact O-OG 3.24Å; L266-S269 PolarHBondContact O-N 3Å; L267-S269 VanDerWaalsContact C-N 3.34Å; L267-S269 PolarHBondContact O-N 3.04Å; S269-S272 PolarHBondContact O-N 3.38Å; S269-C273 PolarHBondContact O-N 3.13Å; S269-C304 WeakPolarHBondContact CB-SG 3.25Å
270L95Very high93.5Very high1 Ų136 Ų361%0.00519%0.191CC..Hα-helixtrans-64.5-47.2176.9176.860.4000111.8L266 L267 A268 S272 C273 V274 I336 F340 L357 V361L266-L270 WeakPolarHBondContact O-CB 3.32Å; L266-L270 PolarHBondContact O-N 3.44Å; L267-L270 PolarHBondContact O-N 3.36Å; A268-L270 VanDerWaalsContact C-N 3.34Å; A268-L270 PolarHBondContact O-N 2.8Å; L270-S272 VanDerWaalsContact C-N 3.33Å; L270-S272 PolarHBondContact O-N 3.39Å; L270-C273 WeakPolarHBondContact O-CB 3.4Å; L270-C273 PolarHBondContact O-N 3.07Å; L270-V274 HydrophobicContact CD1-CG2 4.49Å; L270-V274 WeakPolarHBondContact O-CG2 3.48Å; L270-V274 PolarHBondContact O-N 2.93Å; L270-I336 HydrophobicContact CD2-CB 4.33Å; L270-I336 HydrophobicContact CD2-CG1 4.06Å; L270-I336 HydrophobicContact CD2-CG2 4.2Å; L270-F340 HydrophobicContact CD1-CE2 3.96Å; L270-F340 HydrophobicContact CD1-CZ 3.68Å; L270-F340 HydrophobicContact CD2-CE2 4.11Å; L270-L357 HydrophobicContact CD1-CD1 4.05Å; L270-L357 HydrophobicContact CD1-CD2 3.84Å; L270-L357 HydrophobicContact CD1-CG 4.07Å; L270-V361 HydrophobicContact CD1-CG2 4.32Å
271H93.9Very high93Very high81 Ų8137.6 Ų37.638%0.37520%0.196SC..Hα-helixtrans-59.4-44.9176.2-69.9125.3000111.2L267 A268 C273 V274 E275L267-H271 PolarHBondContact O-N 3.24Å; L267-H271 PolarHBondContact O-ND1 2.75Å; A268-H271 PolarHBondContact O-N 2.8Å; H271-C273 VanDerWaalsContact C-N 3.34Å; H271-C273 PolarHBondContact O-N 3.31Å; H271-V274 WeakPolarHBondContact O-CB 2.88Å; H271-V274 PolarHBondContact O-N 3.34Å; H271-V274 VanDerWaalsContact O-N 3.12Å; H271-E275 WeakPolarHBondContact O-CG 3.26Å; H271-E275 PolarHBondContact O-N 3.45Å
272S93.4Very high92.6Very high37 Ų3744 Ų4426%0.25923%0.228SC..Hα-helixtrans-60.7-41.2176.1-172.30000112.4A268 S269 L270 V274 E275 M276A268-S272 WeakPolarHBondContact O-CB 3.46Å; A268-S272 PolarHBondContact O-N 3.34Å; S269-S272 PolarHBondContact O-N 3.38Å; L270-S272 VanDerWaalsContact C-N 3.33Å; L270-S272 PolarHBondContact O-N 3.39Å; S272-V274 PolarHBondContact O-N 2.62Å; S272-E275 PolarHBondContact O-N 3.37Å; S272-M276 WeakPolarHBondContact O-CB 3.21Å; S272-M276 VanDerWaalsContact O-CE 3.31Å; S272-M276 WeakPolarHBondContact O-CE 3.23Å; S272-M276 WeakPolarHBondContact O-CG 3.47Å; S272-M276 PolarHBondContact O-N 3.15Å; S272-M276 WeakPolarHBondContact OG-CE 3.5Å
273C93.8Very high92Very high0 Ų047 Ų470%025%0.253CS..Hα-helixtrans-60-43.4172.6-84.80000112.8S269 L270 H271 A277 F297 T300 A301 L357S269-C273 PolarHBondContact O-N 3.13Å; L270-C273 WeakPolarHBondContact O-CB 3.4Å; L270-C273 PolarHBondContact O-N 3.07Å; H271-C273 VanDerWaalsContact C-N 3.34Å; H271-C273 PolarHBondContact O-N 3.31Å; C273-A277 VanDerWaalsContact O-CB 3.27Å; C273-A277 WeakPolarHBondContact O-CB 3.4Å; C273-A277 PolarHBondContact O-N 3.28Å; C273-F297 HydrophobicContact CB-CD2 4.17Å; C273-F297 HydrophobicContact CB-CE2 3.9Å; C273-F297 WeakPolarHBondContact O-CD2 3.45Å; C273-F297 WeakPolarHBondContact O-CE2 3.29Å; C273-T300 VanDerWaalsContact SG-C 3.58Å; C273-A301 PolarHBondContact SG-N 3.21Å; C273-L357 HydrophobicContact CB-CD1 3.65Å; C273-L357 HydrophobicContact CB-CD2 4.17Å
274V92.1Very high91.3Very high18 Ų1849.3 Ų49.311%0.10928%0.278CS..Hα-helixtrans-63.6-49.6178.2167.40000110.7L270 H271 S272 M276 A277 E278 P347 L357L270-V274 HydrophobicContact CD1-CG2 4.49Å; L270-V274 WeakPolarHBondContact O-CG2 3.48Å; L270-V274 PolarHBondContact O-N 2.93Å; H271-V274 WeakPolarHBondContact O-CB 2.88Å; H271-V274 PolarHBondContact O-N 3.34Å; H271-V274 VanDerWaalsContact O-N 3.12Å; S272-V274 PolarHBondContact O-N 2.62Å; V274-M276 PolarHBondContact O-N 3.32Å; V274-A277 PolarHBondContact O-N 2.83Å; V274-A277 VanDerWaalsContact O-N 3.13Å; V274-E278 WeakPolarHBondContact O-CG 3.45Å; V274-E278 PolarHBondContact O-N 3.15Å; V274-P347 HydrophobicContact CG1-CB 4.25Å; V274-P347 HydrophobicContact CG1-CG 3.64Å; V274-L357 HydrophobicContact CG2-CD2 4.24Å
275E91.8Very high90.5Very high117 Ų11746.8 Ų46.855%0.54726%0.264SS..Hα-helixtrans-58.9-46.1178.3-71.8175.8178.300111.8H271 S272 A277 E278 Q279H271-E275 WeakPolarHBondContact O-CG 3.26Å; H271-E275 PolarHBondContact O-N 3.45Å; S272-E275 PolarHBondContact O-N 3.37Å; E275-A277 VanDerWaalsContact C-N 3.33Å; E275-A277 PolarHBondContact O-N 3.41Å; E275-E278 PolarHBondContact O-N 3.14Å; E275-Q279 WeakPolarHBondContact O-CG 3.43Å; E275-Q279 PolarHBondContact O-N 3.05Å
276M90.9Very high89.3Confident19 Ų1950.1 Ų50.19%0.09428%0.279CS..Hα-helixtrans-62.4-39.6175.5-76.3-172.7-82.500112.1S272 V274 E278 Q279 I280 L296 F297 T300S272-M276 WeakPolarHBondContact O-CB 3.21Å; S272-M276 VanDerWaalsContact O-CE 3.31Å; S272-M276 WeakPolarHBondContact O-CE 3.23Å; S272-M276 WeakPolarHBondContact O-CG 3.47Å; S272-M276 PolarHBondContact O-N 3.15Å; S272-M276 WeakPolarHBondContact OG-CE 3.5Å; V274-M276 PolarHBondContact O-N 3.32Å; M276-E278 VanDerWaalsContact C-N 3.32Å; M276-E278 PolarHBondContact O-N 3.05Å; M276-Q279 PolarHBondContact O-N 3.13Å; M276-I280 WeakPolarHBondContact O-CB 3.5Å; M276-I280 VanDerWaalsContact O-CG1 3.25Å; M276-I280 WeakPolarHBondContact O-CG1 3.48Å; M276-I280 PolarHBondContact O-N 3.28Å; M276-L296 HydrophobicContact SD-CB 4.21Å; M276-L296 HydrophobicContact SD-CD2 3.86Å; M276-L296 HydrophobicContact SD-CG 3.72Å; M276-F297 HydrophobicContact CB-CB 4.5Å; M276-F297 HydrophobicContact CB-CD2 4.44Å; M276-F297 HydrophobicContact SD-CB 4.47Å; M276-T300 HydrophobicContact CE-CG2 3.89Å; M276-T300 WeakPolarHBondContact CE-OG1 3.4Å
277A90.1Very high88Confident0 Ų059.1 Ų59.10%032%0.322CS..Hα-helixtrans-66-35.9178.300000112C273 V274 E275 K281 F297 L349 L353C273-A277 VanDerWaalsContact O-CB 3.27Å; C273-A277 WeakPolarHBondContact O-CB 3.4Å; C273-A277 PolarHBondContact O-N 3.28Å; V274-A277 PolarHBondContact O-N 2.83Å; V274-A277 VanDerWaalsContact O-N 3.13Å; E275-A277 VanDerWaalsContact C-N 3.33Å; E275-A277 PolarHBondContact O-N 3.41Å; A277-K281 WeakPolarHBondContact O-CB 3.49Å; A277-K281 PolarHBondContact O-N 3.25Å; A277-F297 HydrophobicContact CB-CD2 4.36Å; A277-F297 HydrophobicContact CB-CE2 4.03Å; A277-L349 HydrophobicContact CB-CD1 3.94Å; A277-L349 HydrophobicContact CB-CD2 3.6Å; A277-L349 HydrophobicContact CB-CG 4.33Å; A277-L353 HydrophobicContact CB-CB 4.45Å; A277-L353 HydrophobicContact CB-CD1 3.91Å
278E88.6Confident87Confident84 Ų8461.6 Ų61.639%0.39334%0.337SS..Hα-helixtrans-65.6-42.7171.8-69.4-175.9166.400111.8V274 E275 M276 K281 L282 P347 L349V274-E278 WeakPolarHBondContact O-CG 3.45Å; V274-E278 PolarHBondContact O-N 3.15Å; E275-E278 PolarHBondContact O-N 3.14Å; M276-E278 VanDerWaalsContact C-N 3.32Å; M276-E278 PolarHBondContact O-N 3.05Å; E278-K281 WeakPolarHBondContact O-CB 3.42Å; E278-K281 PolarHBondContact O-N 3.48Å; E278-L282 WeakPolarHBondContact O-CG 3.44Å; E278-L282 PolarHBondContact O-N 3.19Å; E278-P347 WeakPolarHBondContact OE1-CB 3.3Å; E278-L349 HydrophobicContact CG-CD2 3.68Å
279Q88.4Confident85.9Confident124 Ų12463 Ų6358%0.57934%0.342SS*.Hα-helixtrans-62.4-44.8175.4-70.6176-1.600112E275 M276 K281 L282 A283E275-Q279 WeakPolarHBondContact O-CG 3.43Å; E275-Q279 PolarHBondContact O-N 3.05Å; M276-Q279 PolarHBondContact O-N 3.13Å; Q279-K281 VanDerWaalsContact C-N 3.26Å; Q279-K281 PolarHBondContact O-N 3.27Å; Q279-L282 PolarHBondContact O-N 3.22Å; Q279-A283 WeakPolarHBondContact O-CB 3.47Å; Q279-A283 PolarHBondContact O-N 3.19Å
280I87.8Confident84.9Confident3 Ų370.3 Ų70.32%0.01537%0.374CS..Hα-helixtrans-59.8-39.9175-69.9165.2000110.5M276 G284 L285 E293 Y294 F297 L353M276-I280 WeakPolarHBondContact O-CB 3.5Å; M276-I280 VanDerWaalsContact O-CG1 3.25Å; M276-I280 WeakPolarHBondContact O-CG1 3.48Å; M276-I280 PolarHBondContact O-N 3.28Å; I280-G284 PolarHBondContact O-N 3.34Å; I280-L285 HydrophobicContact CG2-CB 4.12Å; I280-L285 PolarHBondContact O-N 3.19Å; I280-E293 HydrophobicContact CD1-CB 4.41Å; I280-E293 HydrophobicContact CG1-CB 4.05Å; I280-Y294 HydrophobicContact CD1-CD2 4.47Å; I280-F297 HydrophobicContact CD1-CB 4.13Å; I280-L353 HydrophobicContact CB-CD1 4.29Å; I280-L353 HydrophobicContact CD1-CD1 4.48Å; I280-L353 HydrophobicContact CG2-CD1 3.97Å
281K86Confident84.4Confident82 Ų8270.9 Ų70.936%0.35738%0.378SS..Hα-helixtrans-62.2-50.5176.1-176.8-171.7179.2-177.70111.2A277 E278 Q279 A283 G284 Q286 S348 P350A277-K281 WeakPolarHBondContact O-CB 3.49Å; A277-K281 PolarHBondContact O-N 3.25Å; E278-K281 WeakPolarHBondContact O-CB 3.42Å; E278-K281 PolarHBondContact O-N 3.48Å; Q279-K281 VanDerWaalsContact C-N 3.26Å; Q279-K281 PolarHBondContact O-N 3.27Å; K281-A283 VanDerWaalsContact C-N 3.33Å; K281-A283 PolarHBondContact O-N 3.39Å; K281-G284 PolarHBondContact O-N 2.89Å; K281-Q286 PolarHBondContact O-NE2 2.62Å; K281-S348 WeakPolarHBondContact CD-O 3.4Å; K281-S348 PolarHBondContact NZ-O 2.98Å; K281-S348 PolarHBondContact NZ-OG 3.48Å; K281-P350 HydrophobicContact CB-CG 4.09Å; K281-P350 HydrophobicContact CG-CG 4.2Å
282L86.3Confident84Confident154 Ų15471.5 Ų71.581%0.80639%0.39SS*.Hα-helixtrans-64.2-36.1-179.4-71.1172.6000112.6E278 Q279 G284E278-L282 WeakPolarHBondContact O-CG 3.44Å; E278-L282 PolarHBondContact O-N 3.19Å; Q279-L282 PolarHBondContact O-N 3.22Å; L282-G284 VanDerWaalsContact C-N 3.27Å; L282-G284 PolarHBondContact O-N 3.2Å
283A84.8Confident83.7Confident65 Ų6573.9 Ų73.954%0.53740%0.397SS..THydrogen-bonded Turntrans-77.7-7.5177.300000113.9Q279 K281 L285Q279-A283 WeakPolarHBondContact O-CB 3.47Å; Q279-A283 PolarHBondContact O-N 3.19Å; K281-A283 VanDerWaalsContact C-N 3.33Å; K281-A283 PolarHBondContact O-N 3.39Å; A283-L285 VanDerWaalsContact C-N 3.28Å; A283-L285 HydrophobicContact CB-CD1 3.84Å; A283-L285 HydrophobicContact CB-CG 3.92Å; A283-L285 PolarHBondContact O-N 3.39Å
284G81.5Confident83.4Confident56 Ų5674.6 Ų74.658%0.57740%0.4SS*.THydrogen-bonded Turntrans69.720.4-177.500000114.4I280 K281 L282 Q286I280-G284 PolarHBondContact O-N 3.34Å; K281-G284 PolarHBondContact O-N 2.89Å; L282-G284 VanDerWaalsContact C-N 3.27Å; L282-G284 PolarHBondContact O-N 3.2Å; G284-Q286 VanDerWaalsContact C-N 3.27Å; G284-Q286 PolarHBondContact O-N 3.48Å
285L78.9Confident83.3Confident50 Ų5078.7 Ų78.726%0.26242%0.416SS..  trans-90.425.7-174.3-65.7172.4000113.6I280 A283 E287 T288I280-L285 HydrophobicContact CG2-CB 4.12Å; I280-L285 PolarHBondContact O-N 3.19Å; A283-L285 VanDerWaalsContact C-N 3.28Å; A283-L285 HydrophobicContact CB-CD1 3.84Å; A283-L285 HydrophobicContact CB-CG 3.92Å; A283-L285 PolarHBondContact O-N 3.39Å; L285-E287 VanDerWaalsContact C-N 3.34Å; L285-E287 PolarHBondContact O-N 3.12Å; L285-T288 WeakPolarHBondContact CA-OG1 3.27Å; L285-T288 PolarHBondContact O-N 2.98Å; L285-T288 PolarHBondContact O-OG1 3.48Å; L285-T288 VanDerWaalsContact O-OG1 3.13Å
286Q70.7Confident83.3Confident86 Ų8677.2 Ų77.240%0.40241%0.411SS..SBendtrans-72.4-27.6-166.9-5916319.700112.9K281 G284 P350K281-Q286 PolarHBondContact O-NE2 2.62Å; G284-Q286 VanDerWaalsContact C-N 3.27Å; G284-Q286 PolarHBondContact O-N 3.48Å; Q286-P350 HydrophobicContact CG-CB 4.44Å; Q286-P350 HydrophobicContact CG-CG 3.91Å
287E68.3Low83.3Confident189 Ų18976.3 Ų76.388%0.88341%0.407SS*.SBendtrans-99.5-9.8-178.6-62-176.8170.200112.9L285 V289L285-E287 VanDerWaalsContact C-N 3.34Å; L285-E287 PolarHBondContact O-N 3.12Å; E287-V289 PolarHBondContact O-N 3.37Å
288T75.1Confident83.4Confident71 Ų7178.9 Ų78.944%0.43642%0.419SS..  trans-93.771.2-177.438.10000111.6L285 Q290 S291L285-T288 WeakPolarHBondContact CA-OG1 3.27Å; L285-T288 PolarHBondContact O-N 2.98Å; L285-T288 PolarHBondContact O-OG1 3.48Å; L285-T288 VanDerWaalsContact O-OG1 3.13Å; T288-Q290 PolarHBondContact O-N 3.42Å; T288-S291 WeakPolarHBondContact O-CB 3.42Å; T288-S291 PolarHBondContact O-N 3.35Å; T288-S291 PolarHBondContact O-OG 2.96Å; T288-S291 VanDerWaalsContact O-OG 3.14Å
289V72Confident83.6Confident75 Ų7580.8 Ų80.846%0.45543%0.426SS..THydrogen-bonded Turntrans-52.2-21.9179.2-179.80000113.8E287 Y294E287-V289 PolarHBondContact O-N 3.37Å; V289-Y294 HydrophobicContact CB-CD1 4.42Å; V289-Y294 HydrophobicContact CB-CE1 4.28Å; V289-Y294 HydrophobicContact CG1-CD1 4.04Å; V289-Y294 HydrophobicContact CG1-CE1 3.75Å; V289-Y294 HydrophobicContact CG2-CE1 4.38Å; V289-Y294 WeakPolarHBondContact O-CD1 3.25Å
290Q74.6Confident83.8Confident164 Ų16475.6 Ų75.677%0.76640%0.402SS*.THydrogen-bonded Turntrans-88.1-4.8179.8-63.3-160.80.500115.3T288 K295T288-Q290 PolarHBondContact O-N 3.42Å; Q290-K295 WeakPolarHBondContact O-CE 3.28Å; Q290-K295 PolarHBondContact O-NZ 2.92Å
291S83.2Confident84.1Confident13 Ų1375.4 Ų75.49%0.09140%0.402CS..SBendtrans-60.9147.4178.868.90000111.3T288 E293 Y294 K295T288-S291 WeakPolarHBondContact O-CB 3.42Å; T288-S291 PolarHBondContact O-N 3.35Å; T288-S291 PolarHBondContact O-OG 2.96Å; T288-S291 VanDerWaalsContact O-OG 3.14Å; S291-E293 WeakPolarHBondContact CB-OE2 3.46Å; S291-E293 PolarHBondContact O-N 3.42Å; S291-Y294 PolarHBondContact O-N 3.28Å; S291-Y294 WeakPolarHBondContact OG-CB 3.4Å; S291-Y294 PolarHBondContact OG-N 2.85Å; S291-K295 PolarHBondContact O-N 3.42Å
292P85.2Confident84.6Confident95 Ų9577.7 Ų77.762%0.61741%0.411SS*.Hα-helixtrans-60.7-35.6179.223.4-30.7000111.9K295 L296P292-K295 PolarHBondContact O-N 3.3Å; P292-L296 WeakPolarHBondContact O-CB 3.27Å; P292-L296 PolarHBondContact O-N 3.41Å
293E87.1Confident85Confident86 Ų8671.2 Ų71.240%0.40238%0.377SS..Hα-helixtrans-63.7-46.7177.2-58.578-170.100111.1I280 S291 K295 L296 F297I280-E293 HydrophobicContact CD1-CB 4.41Å; I280-E293 HydrophobicContact CG1-CB 4.05Å; S291-E293 WeakPolarHBondContact CB-OE2 3.46Å; S291-E293 PolarHBondContact O-N 3.42Å; E293-K295 PolarHBondContact O-N 2.83Å; E293-L296 PolarHBondContact O-N 2.95Å; E293-F297 PolarHBondContact O-N 2.97Å
294Y88.4Confident85.5Confident16 Ų1668.1 Ų68.16%0.06335%0.351CS..Hα-helixtrans-64.4-42.3178.2-164.7-79.3000111.4I280 V289 S291 L296 F297 Q298 L353 E356I280-Y294 HydrophobicContact CD1-CD2 4.47Å; V289-Y294 HydrophobicContact CB-CD1 4.42Å; V289-Y294 HydrophobicContact CB-CE1 4.28Å; V289-Y294 HydrophobicContact CG1-CD1 4.04Å; V289-Y294 HydrophobicContact CG1-CE1 3.75Å; V289-Y294 HydrophobicContact CG2-CE1 4.38Å; V289-Y294 WeakPolarHBondContact O-CD1 3.25Å; S291-Y294 PolarHBondContact O-N 3.28Å; S291-Y294 WeakPolarHBondContact OG-CB 3.4Å; S291-Y294 PolarHBondContact OG-N 2.85Å; Y294-L296 VanDerWaalsContact C-N 3.3Å; Y294-L296 PolarHBondContact O-N 2.68Å; Y294-F297 WeakPolarHBondContact O-CB 3.5Å; Y294-F297 PolarHBondContact O-N 2.9Å; Y294-Q298 HydrophobicContact CD1-CG 3.84Å; Y294-Q298 HydrophobicContact CE1-CG 3.72Å; Y294-Q298 WeakPolarHBondContact O-CG 3.3Å; Y294-Q298 PolarHBondContact O-N 2.99Å; Y294-L353 HydrophobicContact CD2-CD2 3.89Å; Y294-L353 HydrophobicContact CE2-CD2 3.33Å; Y294-L353 HydrophobicContact CE2-CG 4.33Å; Y294-E356 PolarHBondContact OH-OE2 3.1Å
295K90.4Very high86.2Confident104 Ų10469.5 Ų69.545%0.45234%0.339SS..Hα-helixtrans-62.2-37.3175.4-74.2177.6-179.2165.50112.5Q290 S291 P292 E293 Q298 K299Q290-K295 WeakPolarHBondContact O-CE 3.28Å; Q290-K295 PolarHBondContact O-NZ 2.92Å; S291-K295 PolarHBondContact O-N 3.42Å; P292-K295 PolarHBondContact O-N 3.3Å; E293-K295 PolarHBondContact O-N 2.83Å; K295-Q298 PolarHBondContact O-N 3.32Å; K295-K299 WeakPolarHBondContact O-CG 3.49Å; K295-K299 PolarHBondContact O-N 2.98Å
296L90.1Very high87.1Confident86 Ų8669.4 Ų69.445%0.4534%0.337SS..Hα-helixtrans-67.8-42.7175.8-175.561.7000111.2I228 M276 P292 E293 Y294 Q298 K299 T300I228-L296 HydrophobicContact CD1-CD1 4.42Å; M276-L296 HydrophobicContact SD-CB 4.21Å; M276-L296 HydrophobicContact SD-CD2 3.86Å; M276-L296 HydrophobicContact SD-CG 3.72Å; P292-L296 WeakPolarHBondContact O-CB 3.27Å; P292-L296 PolarHBondContact O-N 3.41Å; E293-L296 PolarHBondContact O-N 2.95Å; Y294-L296 VanDerWaalsContact C-N 3.3Å; Y294-L296 PolarHBondContact O-N 2.68Å; L296-Q298 PolarHBondContact O-N 3.47Å; L296-K299 PolarHBondContact O-N 3.49Å; L296-T300 PolarHBondContact O-N 3.5Å; L296-T300 PolarHBondContact O-OG1 3.41Å
297F92.6Very high88.4Confident0 Ų065.3 Ų65.30%032%0.318CS..Hα-helixtrans-55.1-49.4171.4169-91.4000111.4C273 M276 A277 I280 E293 Y294 K299 T300 A301 L353 L357C273-F297 HydrophobicContact CB-CD2 4.17Å; C273-F297 HydrophobicContact CB-CE2 3.9Å; C273-F297 WeakPolarHBondContact O-CD2 3.45Å; C273-F297 WeakPolarHBondContact O-CE2 3.29Å; M276-F297 HydrophobicContact CB-CB 4.5Å; M276-F297 HydrophobicContact CB-CD2 4.44Å; M276-F297 HydrophobicContact SD-CB 4.47Å; A277-F297 HydrophobicContact CB-CD2 4.36Å; A277-F297 HydrophobicContact CB-CE2 4.03Å; I280-F297 HydrophobicContact CD1-CB 4.13Å; E293-F297 PolarHBondContact O-N 2.97Å; Y294-F297 WeakPolarHBondContact O-CB 3.5Å; Y294-F297 PolarHBondContact O-N 2.9Å; F297-K299 PolarHBondContact O-N 3.02Å; F297-T300 PolarHBondContact O-N 3.14Å; F297-T300 VanDerWaalsContact O-N 3.15Å; F297-A301 WeakPolarHBondContact O-CB 3.33Å; F297-A301 PolarHBondContact O-N 3.46Å; F297-L353 HydrophobicContact CD1-CD2 3.74Å; F297-L353 HydrophobicContact CE1-CB 4.47Å; F297-L353 HydrophobicContact CE1-CD2 3.54Å; F297-L353 HydrophobicContact CG-CD2 4.35Å; F297-L353 HydrophobicContact CZ-CB 4.16Å; F297-L353 HydrophobicContact CZ-CD2 3.97Å; F297-L357 HydrophobicContact CZ-CB 4.19Å
298Q91.8Very high89.7Confident53 Ų5356.4 Ų56.425%0.24828%0.276CS..Hα-helixtrans-61.9-40.2179.3-68.6-165.6-4500113.1Y294 K295 L296 T300 K302 E356Y294-Q298 HydrophobicContact CD1-CG 3.84Å; Y294-Q298 HydrophobicContact CE1-CG 3.72Å; Y294-Q298 WeakPolarHBondContact O-CG 3.3Å; Y294-Q298 PolarHBondContact O-N 2.99Å; K295-Q298 PolarHBondContact O-N 3.32Å; L296-Q298 PolarHBondContact O-N 3.47Å; Q298-T300 VanDerWaalsContact C-N 3.32Å; Q298-K302 WeakPolarHBondContact O-CG 3.35Å; Q298-K302 PolarHBondContact O-N 3.39Å; Q298-E356 WeakPolarHBondContact CG-OE1 3.32Å; Q298-E356 PolarHBondContact NE2-OE1 2.71Å; Q298-E356 PolarHBondContact NE2-OE2 3.42Å
299K92.4Very high90.8Very high125 Ų12556.8 Ų56.854%0.54328%0.276SS..Hα-helixtrans-62.6-41.8175.2-75.6177.7179.7-177.70111.1I228 K295 L296 F297 K302 M303I228-K299 HydrophobicContact CD1-CB 4.14Å; K295-K299 WeakPolarHBondContact O-CG 3.49Å; K295-K299 PolarHBondContact O-N 2.98Å; L296-K299 PolarHBondContact O-N 3.49Å; F297-K299 PolarHBondContact O-N 3.02Å; K299-K302 WeakPolarHBondContact O-CB 3.32Å; K299-K302 PolarHBondContact O-N 3.01Å; K299-M303 PolarHBondContact O-N 3.04Å; K299-M303 VanDerWaalsContact O-N 3.15Å
300T93.1Very high92Very high14 Ų1454 Ų549%0.08626%0.259CS..Hα-helixtrans-71.4-38.7179.8-50.60000111.5C273 M276 L296 F297 Q298 K302 M303 C304C273-T300 VanDerWaalsContact SG-C 3.58Å; M276-T300 HydrophobicContact CE-CG2 3.89Å; M276-T300 WeakPolarHBondContact CE-OG1 3.4Å; L296-T300 PolarHBondContact O-N 3.5Å; L296-T300 PolarHBondContact O-OG1 3.41Å; F297-T300 PolarHBondContact O-N 3.14Å; F297-T300 VanDerWaalsContact O-N 3.15Å; Q298-T300 VanDerWaalsContact C-N 3.32Å; T300-K302 VanDerWaalsContact C-N 3.29Å; T300-K302 PolarHBondContact O-N 3.43Å; T300-M303 WeakPolarHBondContact O-CA 3.48Å; T300-M303 VanDerWaalsContact O-CB 3.28Å; T300-M303 WeakPolarHBondContact O-CB 3.41Å; T300-M303 PolarHBondContact O-N 3.28Å; T300-C304 PolarHBondContact O-N 3.48Å; T300-C304 PolarHBondContact O-SG 2.94Å; T300-C304 VanDerWaalsContact O-SG 3.38Å
301A94.4Very high93Very high0 Ų046.2 Ų46.20%022%0.222CC..Hα-helixtrans-61.9-37.4173.800000111.8C273 F297 M303 C304 R305 L357 S360C273-A301 PolarHBondContact SG-N 3.21Å; F297-A301 WeakPolarHBondContact O-CB 3.33Å; F297-A301 PolarHBondContact O-N 3.46Å; A301-M303 VanDerWaalsContact C-N 3.3Å; A301-M303 PolarHBondContact O-N 2.86Å; A301-C304 WeakPolarHBondContact O-CB 3.28Å; A301-C304 PolarHBondContact O-N 3.45Å; A301-R305 PolarHBondContact O-N 3.34Å; A301-R305 VanDerWaalsContact O-N 3.09Å; A301-L357 HydrophobicContact CB-CD1 4.31Å; A301-S360 WeakPolarHBondContact O-CB 3.45Å
302K94.9Very high93.7Very high130 Ų13046.4 Ų46.457%0.56522%0.223SC*.Hα-helixtrans-63.5-34.5171.1-73.3173-176.81780112.4Q298 K299 T300 R305 F306Q298-K302 WeakPolarHBondContact O-CG 3.35Å; Q298-K302 PolarHBondContact O-N 3.39Å; K299-K302 WeakPolarHBondContact O-CB 3.32Å; K299-K302 PolarHBondContact O-N 3.01Å; T300-K302 VanDerWaalsContact C-N 3.29Å; T300-K302 PolarHBondContact O-N 3.43Å; K302-R305 PolarHBondContact O-N 3.32Å; K302-F306 WeakPolarHBondContact O-CB 3.42Å; K302-F306 PolarHBondContact O-N 2.79Å
303M94.8Very high94.2Very high17 Ų1745.8 Ų45.88%0.08421%0.212CC..Hα-helixtrans-66.1-41172.6-70.8-56.9-62.800112I228 A232 K299 T300 A301 R305 F306 F307I228-M303 HydrophobicContact CG2-CG 3.56Å; I228-M303 HydrophobicContact CG2-SD 3.57Å; I228-M303 VanDerWaalsContact CG2-SD 3.57Å; A232-M303 HydrophobicContact CB-CE 4.03Å; A232-M303 HydrophobicContact CB-SD 3.95Å; K299-M303 PolarHBondContact O-N 3.04Å; K299-M303 VanDerWaalsContact O-N 3.15Å; T300-M303 WeakPolarHBondContact O-CA 3.48Å; T300-M303 VanDerWaalsContact O-CB 3.28Å; T300-M303 WeakPolarHBondContact O-CB 3.41Å; T300-M303 PolarHBondContact O-N 3.28Å; A301-M303 VanDerWaalsContact C-N 3.3Å; A301-M303 PolarHBondContact O-N 2.86Å; M303-R305 VanDerWaalsContact C-N 3.31Å; M303-R305 PolarHBondContact O-N 2.97Å; M303-F306 HydrophobicContact CE-CD1 3.9Å; M303-F306 HydrophobicContact CE-CE1 4.44Å; M303-F306 WeakPolarHBondContact O-CB 3.44Å; M303-F306 PolarHBondContact O-N 3.48Å; M303-F306 VanDerWaalsContact O-N 3.14Å; M303-F307 HydrophobicContact CB-CD2 4.42Å; M303-F307 HydrophobicContact CB-CE2 4.11Å; M303-F307 HydrophobicContact CE-CD2 4.38Å; M303-F307 HydrophobicContact CE-CE1 4.12Å; M303-F307 HydrophobicContact CE-CE2 3.49Å; M303-F307 VanDerWaalsContact CE-CE2 3.49Å; M303-F307 HydrophobicContact CE-CZ 3.32Å; M303-F307 WeakPolarHBondContact O-CD2 3.41Å; M303-F307 PolarHBondContact O-N 2.99Å
304C96.4Very high94.7Very high0 Ų041.7 Ų41.70%019%0.193CC..Hα-helixtrans-56.5-47.3172.5-53.60000111.1L266 S269 T300 A301 F306 F307 A308 V361L266-C304 HydrophobicContact CD1-CB 3.9Å; L266-C304 VanDerWaalsContact CD1-O 3.3Å; L266-C304 WeakPolarHBondContact CD1-O 3.29Å; S269-C304 WeakPolarHBondContact CB-SG 3.25Å; T300-C304 PolarHBondContact O-N 3.48Å; T300-C304 PolarHBondContact O-SG 2.94Å; T300-C304 VanDerWaalsContact O-SG 3.38Å; A301-C304 WeakPolarHBondContact O-CB 3.28Å; A301-C304 PolarHBondContact O-N 3.45Å; C304-F306 VanDerWaalsContact C-N 3.33Å; C304-F306 PolarHBondContact O-N 3.01Å; C304-F307 PolarHBondContact O-N 2.82Å; C304-A308 WeakPolarHBondContact O-CB 3.38Å; C304-A308 PolarHBondContact O-N 3.28Å; C304-V361 HydrophobicContact CB-CG2 3.56Å
305R96.8Very high95Very high86 Ų8640.9 Ų40.933%0.32519%0.19SC..Hα-helixtrans-60-43.1176-175179.3-74.5120.5-4.4112.1A301 K302 M303 N309 A359 S360 P364A301-R305 PolarHBondContact O-N 3.34Å; A301-R305 VanDerWaalsContact O-N 3.09Å; K302-R305 PolarHBondContact O-N 3.32Å; M303-R305 VanDerWaalsContact C-N 3.31Å; M303-R305 PolarHBondContact O-N 2.97Å; R305-N309 VanDerWaalsContact O-CB 3.31Å; R305-N309 WeakPolarHBondContact O-CB 3.42Å; R305-N309 PolarHBondContact O-N 3.05Å; R305-N309 PolarHBondContact O-ND2 3.13Å; R305-A359 VanDerWaalsContact NH2-C 3.27Å; R305-A359 PolarHBondContact NH2-O 3.09Å; R305-S360 WeakPolarHBondContact CA-O 3.39Å; R305-S360 VanDerWaalsContact CB-O 3.28Å; R305-S360 WeakPolarHBondContact CB-O 3.38Å; R305-S360 PolarHBondContact NH1-OG 2.98Å; R305-S360 VanDerWaalsContact NH2-CA 3.29Å; R305-S360 PolarHBondContact NH2-OG 3.04Å; R305-S360 VanDerWaalsContact NH2-OG 3.15Å; R305-P364 HydrophobicContact CG-CG 4.21Å
306F96.8Very high95.3Very high47 Ų4741.1 Ų41.121%0.20619%0.19CC..Hα-helixtrans-59.9-51.2177.8168.5-101.3000111.6A232 W235 K236 K302 M303 C304 N309 T310A232-F306 HydrophobicContact CB-CE1 4.45Å; A232-F306 WeakPolarHBondContact O-CZ 3.26Å; W235-F306 HydrophobicContact CB-CE1 3.74Å; W235-F306 HydrophobicContact CB-CZ 3.73Å; W235-F306 HydrophobicContact CG-CE1 4.34Å; K236-F306 HydrophobicContact CB-CE2 4.48Å; K236-F306 HydrophobicContact CB-CZ 4.45Å; K302-F306 WeakPolarHBondContact O-CB 3.42Å; K302-F306 PolarHBondContact O-N 2.79Å; M303-F306 HydrophobicContact CE-CD1 3.9Å; M303-F306 HydrophobicContact CE-CE1 4.44Å; M303-F306 WeakPolarHBondContact O-CB 3.44Å; M303-F306 PolarHBondContact O-N 3.48Å; M303-F306 VanDerWaalsContact O-N 3.14Å; C304-F306 VanDerWaalsContact C-N 3.33Å; C304-F306 PolarHBondContact O-N 3.01Å; F306-N309 PolarHBondContact O-N 3.08Å; F306-T310 VanDerWaalsContact O-CB 3.25Å; F306-T310 WeakPolarHBondContact O-CB 3.36Å; F306-T310 PolarHBondContact O-N 2.98Å; F306-T310 PolarHBondContact O-OG1 3.03Å
307F97.1Very high95.5Very high1 Ų139.6 Ų39.60%0.00418%0.181CC..Hα-helixtrans-64.5-44.1-179.9-67.9-53.3000112.1H231 W235 L262 N265 L266 M303 C304 T310 L311H231-F307 AromaticContact CE1-CZ 3.58Å; H231-F307 AromaticContact ND1-CZ 3.86Å; W235-F307 AromaticContact CD1-CE1 3.58Å; W235-F307 HydrophobicContact CG-CE1 4.17Å; W235-F307 AromaticContact NE1-CE1 3.7Å; L262-F307 HydrophobicContact CD2-CD1 3.94Å; N265-F307 HydrophobicContact CB-CD1 4.08Å; N265-F307 HydrophobicContact CB-CD2 4Å; N265-F307 HydrophobicContact CB-CE1 3.87Å; N265-F307 HydrophobicContact CB-CE2 3.78Å; N265-F307 HydrophobicContact CB-CG 4.16Å; N265-F307 HydrophobicContact CB-CZ 3.72Å; L266-F307 HydrophobicContact CB-CB 3.93Å; L266-F307 HydrophobicContact CD1-CB 4.39Å; M303-F307 HydrophobicContact CB-CD2 4.42Å; M303-F307 HydrophobicContact CB-CE2 4.11Å; M303-F307 HydrophobicContact CE-CD2 4.38Å; M303-F307 HydrophobicContact CE-CE1 4.12Å; M303-F307 HydrophobicContact CE-CE2 3.49Å; M303-F307 VanDerWaalsContact CE-CE2 3.49Å; M303-F307 HydrophobicContact CE-CZ 3.32Å; M303-F307 WeakPolarHBondContact O-CD2 3.41Å; M303-F307 PolarHBondContact O-N 2.99Å; C304-F307 PolarHBondContact O-N 2.82Å; F307-T310 PolarHBondContact O-N 3.39Å; F307-L311 VanDerWaalsContact O-CB 3.3Å; F307-L311 WeakPolarHBondContact O-CB 3.36Å; F307-L311 PolarHBondContact O-N 2.89Å
308A97.3Very high95.6Very high1 Ų139.6 Ų39.61%0.00818%0.181CC..Hα-helixtrans-61.2-48.1177.900000111.6L266 C304 T310 L311 V312 P364L266-A308 HydrophobicContact CD1-CB 4.19Å; L266-A308 HydrophobicContact CD2-CB 3.99Å; C304-A308 WeakPolarHBondContact O-CB 3.38Å; C304-A308 PolarHBondContact O-N 3.28Å; A308-T310 VanDerWaalsContact C-N 3.33Å; A308-T310 PolarHBondContact O-N 2.91Å; A308-L311 WeakPolarHBondContact O-CB 3.36Å; A308-L311 PolarHBondContact O-N 3Å; A308-V312 VanDerWaalsContact O-CG2 3.23Å; A308-V312 WeakPolarHBondContact O-CG2 3.43Å; A308-V312 PolarHBondContact O-N 3.46Å; A308-P364 HydrophobicContact CB-CB 3.55Å; A308-P364 HydrophobicContact CB-CG 4.17Å
309N97.4Very high95.6Very high80 Ų8040.8 Ų40.843%0.42819%0.185SC..Hα-helixtrans-63.9-38.2176.9-76.4-20.6000112.9R305 F306 L311 V312 H313 P364R305-N309 VanDerWaalsContact O-CB 3.31Å; R305-N309 WeakPolarHBondContact O-CB 3.42Å; R305-N309 PolarHBondContact O-N 3.05Å; R305-N309 PolarHBondContact O-ND2 3.13Å; F306-N309 PolarHBondContact O-N 3.08Å; N309-L311 VanDerWaalsContact C-N 3.34Å; N309-V312 PolarHBondContact O-N 3.21Å; N309-H313 WeakPolarHBondContact O-CB 3.27Å; N309-H313 PolarHBondContact O-N 3.18Å; N309-P364 WeakPolarHBondContact OD1-CB 3.46Å; N309-P364 WeakPolarHBondContact OD1-CG 3.36Å
310T96.9Very high95.5Very high16 Ų1643 Ų4310%0.09819%0.191CC..Hα-helixtrans-65.4-41.5177.7-58.80000110.6I239 L262 F306 F307 A308 H313 Y314I239-T310 HydrophobicContact CB-CG2 4.42Å; I239-T310 HydrophobicContact CD1-CG2 3.98Å; I239-T310 HydrophobicContact CG1-CG2 3.6Å; I239-T310 HydrophobicContact CG2-CG2 4.36Å; L262-T310 HydrophobicContact CD1-CG2 4.12Å; L262-T310 HydrophobicContact CD2-CG2 3.93Å; F306-T310 VanDerWaalsContact O-CB 3.25Å; F306-T310 WeakPolarHBondContact O-CB 3.36Å; F306-T310 PolarHBondContact O-N 2.98Å; F306-T310 PolarHBondContact O-OG1 3.03Å; F307-T310 PolarHBondContact O-N 3.39Å; A308-T310 VanDerWaalsContact C-N 3.33Å; A308-T310 PolarHBondContact O-N 2.91Å; T310-H313 PolarHBondContact O-N 3.16Å; T310-Y314 WeakPolarHBondContact O-CB 3.27Å; T310-Y314 PolarHBondContact O-N 3.05Å
311L96.9Very high95.5Very high0 Ų045.9 Ų45.90%020%0.203CC..Hα-helixtrans-62.6-46.3175-17860.8000111.6V259 L262 F307 A308 N309 H313 Y314 I315 F329 L332 F368V259-L311 HydrophobicContact CB-CD1 4.42Å; V259-L311 HydrophobicContact CG1-CD1 3.94Å; V259-L311 HydrophobicContact CG2-CD1 4.17Å; L262-L311 HydrophobicContact CB-CD1 4.3Å; L262-L311 HydrophobicContact CD1-CD1 4.36Å; F307-L311 VanDerWaalsContact O-CB 3.3Å; F307-L311 WeakPolarHBondContact O-CB 3.36Å; F307-L311 PolarHBondContact O-N 2.89Å; A308-L311 WeakPolarHBondContact O-CB 3.36Å; A308-L311 PolarHBondContact O-N 3Å; N309-L311 VanDerWaalsContact C-N 3.34Å; L311-H313 VanDerWaalsContact C-N 3.32Å; L311-H313 PolarHBondContact O-N 3.16Å; L311-Y314 PolarHBondContact O-N 3.06Å; L311-I315 HydrophobicContact CD1-CD1 3.99Å; L311-I315 HydrophobicContact CD1-CG1 4.3Å; L311-I315 HydrophobicContact CG-CD1 3.88Å; L311-I315 WeakPolarHBondContact O-CB 3.44Å; L311-I315 VanDerWaalsContact O-CG1 3.26Å; L311-I315 WeakPolarHBondContact O-CG1 3.49Å; L311-I315 PolarHBondContact O-N 3.23Å; L311-F329 HydrophobicContact CD1-CE1 4.33Å; L311-L332 HydrophobicContact CD2-CD2 3.56Å; L311-F368 HydrophobicContact CD2-CD2 4.06Å; L311-F368 HydrophobicContact CD2-CE2 3.64Å; L311-F368 HydrophobicContact CG-CD2 4.2Å; L311-F368 HydrophobicContact CG-CE2 4Å
312V97.1Very high95.4Very high18 Ų1845.9 Ų45.911%0.10920%0.203CC..Hα-helixtrans-55.5-48.8174.3173.60000110.9A308 N309 I315 K316 A367 F368 Q371A308-V312 VanDerWaalsContact O-CG2 3.23Å; A308-V312 WeakPolarHBondContact O-CG2 3.43Å; A308-V312 PolarHBondContact O-N 3.46Å; N309-V312 PolarHBondContact O-N 3.21Å; V312-I315 PolarHBondContact O-N 3.12Å; V312-K316 PolarHBondContact O-N 3.22Å; V312-A367 HydrophobicContact CG1-CB 4.15Å; V312-A367 HydrophobicContact CG2-CB 4.46Å; V312-F368 HydrophobicContact CG2-CB 3.72Å; V312-Q371 HydrophobicContact CG1-CG 3.92Å
313H96.5Very high95.2Very high81 Ų8141.7 Ų41.738%0.37519%0.189SC..Hα-helixtrans-63.5-44.7-179.7-174.231.7000111.6L243 N309 T310 L311 I315 K316 E317L243-H313 WeakPolarHBondContact CD1-NE2 3.29Å; N309-H313 WeakPolarHBondContact O-CB 3.27Å; N309-H313 PolarHBondContact O-N 3.18Å; T310-H313 PolarHBondContact O-N 3.16Å; L311-H313 VanDerWaalsContact C-N 3.32Å; L311-H313 PolarHBondContact O-N 3.16Å; H313-I315 PolarHBondContact O-N 3.24Å; H313-K316 WeakPolarHBondContact O-CB 3.45Å; H313-K316 PolarHBondContact O-N 3.12Å; H313-E317 IonicContact CE1-OE1 3.12Å; H313-E317 IonicContact ND1-OE1 3.66Å; H313-E317 WeakPolarHBondContact O-CG 3.44Å; H313-E317 PolarHBondContact O-N 2.99Å
314Y96.6Very high94.9Very high0 Ų050 Ų500%022%0.224CC..Hα-helixtrans-63.9-41179.7-162.1-96000112.2I239 H255 I258 V259 T310 L311 K316 E317 F318 L322I239-Y314 HydrophobicContact CD1-CD2 3.52Å; I239-Y314 HydrophobicContact CD1-CE2 3.95Å; I239-Y314 HydrophobicContact CD1-CG 4.33Å; H255-Y314 PolarHBondContact CE1-OH 2.97Å; H255-Y314 AromaticContact ND1-CE1 3.67Å; H255-Y314 AromaticContact ND1-CZ 3.57Å; H255-Y314 PolarHBondContact ND1-OH 3.12Å; I258-Y314 HydrophobicContact CB-CE1 4.42Å; I258-Y314 WeakPolarHBondContact CD1-OH 3.48Å; I258-Y314 HydrophobicContact CG2-CD1 4.43Å; I258-Y314 HydrophobicContact CG2-CD2 4.45Å; I258-Y314 HydrophobicContact CG2-CE1 3.97Å; I258-Y314 HydrophobicContact CG2-CE2 3.99Å; V259-Y314 HydrophobicContact CG2-CD1 3.65Å; V259-Y314 HydrophobicContact CG2-CE1 3.94Å; T310-Y314 WeakPolarHBondContact O-CB 3.27Å; T310-Y314 PolarHBondContact O-N 3.05Å; L311-Y314 PolarHBondContact O-N 3.06Å; Y314-K316 VanDerWaalsContact C-N 3.33Å; Y314-K316 PolarHBondContact O-N 2.88Å; Y314-E317 PolarHBondContact O-N 3.36Å; Y314-F318 HydrophobicContact CD1-CD2 4.06Å; Y314-F318 AromaticContact CD2-CD2 3.69Å; Y314-F318 HydrophobicContact CD2-CD2 3.69Å; Y314-F318 AromaticContact CD2-CE2 3.77Å; Y314-F318 HydrophobicContact CD2-CE2 3.77Å; Y314-F318 HydrophobicContact CE1-CB 4.33Å; Y314-F318 AromaticContact CE1-CD2 3.87Å; Y314-F318 HydrophobicContact CE1-CD2 3.87Å; Y314-F318 HydrophobicContact CE1-CG 4.31Å; Y314-F318 AromaticContact CE2-CD2 3.49Å; Y314-F318 HydrophobicContact CE2-CD2 3.49Å; Y314-F318 VanDerWaalsContact CE2-CD2 3.49Å; Y314-F318 AromaticContact CE2-CE2 3.4Å; Y314-F318 HydrophobicContact CE2-CE2 3.4Å; Y314-F318 VanDerWaalsContact CE2-CE2 3.4Å; Y314-F318 HydrophobicContact CE2-CZ 4.37Å; Y314-F318 AromaticContact CG-CD2 3.98Å; Y314-F318 HydrophobicContact CG-CD2 3.98Å; Y314-F318 AromaticContact CZ-CD2 3.58Å; Y314-F318 AromaticContact CZ-CE2 3.86Å; Y314-F318 PolarHBondContact O-N 3.37Å; Y314-L322 HydrophobicContact CD1-CD1 4.17Å
315I95.8Very high94.8Very high0 Ų052.5 Ų52.50%024%0.235CC..Hα-helixtrans-60.8-44.8175.4-69.4164.6000111L311 V312 H313 E317 K319 L322 F329 F368 Q371 L372L311-I315 HydrophobicContact CD1-CD1 3.99Å; L311-I315 HydrophobicContact CD1-CG1 4.3Å; L311-I315 HydrophobicContact CG-CD1 3.88Å; L311-I315 WeakPolarHBondContact O-CB 3.44Å; L311-I315 VanDerWaalsContact O-CG1 3.26Å; L311-I315 WeakPolarHBondContact O-CG1 3.49Å; L311-I315 PolarHBondContact O-N 3.23Å; V312-I315 PolarHBondContact O-N 3.12Å; H313-I315 PolarHBondContact O-N 3.24Å; I315-E317 VanDerWaalsContact C-N 3.33Å; I315-E317 PolarHBondContact O-N 3.11Å; I315-K319 WeakPolarHBondContact O-CA 3.37Å; I315-K319 VanDerWaalsContact O-CB 3.27Å; I315-K319 WeakPolarHBondContact O-CB 3.26Å; I315-K319 PolarHBondContact O-N 3.15Å; I315-L322 HydrophobicContact CB-CD1 4.3Å; I315-L322 HydrophobicContact CG1-CD1 3.92Å; I315-F329 HydrophobicContact CD1-CD1 4.25Å; I315-F329 HydrophobicContact CD1-CE1 3.7Å; I315-F329 HydrophobicContact CD1-CE2 4.43Å; I315-F329 HydrophobicContact CD1-CZ 3.82Å; I315-F329 HydrophobicContact CG1-CE1 4.18Å; I315-F329 HydrophobicContact CG1-CZ 3.86Å; I315-F368 HydrophobicContact CD1-CD2 3.6Å; I315-F368 HydrophobicContact CD1-CE2 3.36Å; I315-F368 HydrophobicContact CD1-CZ 4.41Å; I315-Q371 HydrophobicContact CG2-CB 3.87Å; I315-L372 HydrophobicContact CD1-CD2 4.38Å; I315-L372 HydrophobicContact CG2-CD2 3.97Å
316K95.3Very high94.7Very high108 Ų10848.6 Ų48.647%0.4722%0.221SC..Hα-helixtrans-57.3-46.1179.5179.8-176.1168-121.40112.1V312 H313 Y314 Q371V312-K316 PolarHBondContact O-N 3.22Å; H313-K316 WeakPolarHBondContact O-CB 3.45Å; H313-K316 PolarHBondContact O-N 3.12Å; Y314-K316 VanDerWaalsContact C-N 3.33Å; Y314-K316 PolarHBondContact O-N 2.88Å; K316-Q371 HydrophobicContact CB-CG 4.34Å
317E95.1Very high94.5Very high54 Ų5449 Ų4925%0.25223%0.229SC..Hα-helixtrans-81.9-31.1-173.3-54-58.1144.200112.4L243 Q246 H313 Y314 I315L243-E317 HydrophobicContact CD2-CB 3.56Å; L243-E317 HydrophobicContact CD2-CG 3.63Å; Q246-E317 PolarHBondContact NE2-O 3.08Å; H313-E317 IonicContact CE1-OE1 3.12Å; H313-E317 IonicContact ND1-OE1 3.66Å; H313-E317 WeakPolarHBondContact O-CG 3.44Å; H313-E317 PolarHBondContact O-N 2.99Å; Y314-E317 PolarHBondContact O-N 3.36Å; I315-E317 VanDerWaalsContact C-N 3.33Å; I315-E317 PolarHBondContact O-N 3.11Å
318F94.9Very high94.4Very high1 Ų150.9 Ų50.90%0.00424%0.242CC..Hα-helixtrans-113.524.1-176.9-61.8-78.2000114.8L243 Q246 E250 H255 Y314 Y320 F321 L322L243-F318 HydrophobicContact CD2-CD2 4.49Å; L243-F318 HydrophobicContact CD2-CE2 3.6Å; L243-F318 HydrophobicContact CD2-CZ 4.07Å; L243-F318 HydrophobicContact CG-CE2 4.44Å; Q246-F318 HydrophobicContact CB-CE1 4.43Å; Q246-F318 HydrophobicContact CB-CZ 4.43Å; Q246-F318 HydrophobicContact CG-CE1 3.77Å; Q246-F318 HydrophobicContact CG-CZ 4.13Å; E250-F318 HydrophobicContact CB-CD1 4.3Å; E250-F318 HydrophobicContact CB-CE1 4.11Å; H255-F318 AromaticContact CE1-CD1 3.27Å; H255-F318 WeakPolarHBondContact CE1-CD1 3.39Å; H255-F318 AromaticContact CE1-CE1 3.73Å; H255-F318 AromaticContact CE1-CG 3.65Å; H255-F318 AromaticContact ND1-CG 4Å; H255-F318 AromaticContact NE2-CD1 3.99Å; Y314-F318 HydrophobicContact CD1-CD2 4.06Å; Y314-F318 AromaticContact CD2-CD2 3.69Å; Y314-F318 HydrophobicContact CD2-CD2 3.69Å; Y314-F318 AromaticContact CD2-CE2 3.77Å; Y314-F318 HydrophobicContact CD2-CE2 3.77Å; Y314-F318 HydrophobicContact CE1-CB 4.33Å; Y314-F318 AromaticContact CE1-CD2 3.87Å; Y314-F318 HydrophobicContact CE1-CD2 3.87Å; Y314-F318 HydrophobicContact CE1-CG 4.31Å; Y314-F318 AromaticContact CE2-CD2 3.49Å; Y314-F318 HydrophobicContact CE2-CD2 3.49Å; Y314-F318 VanDerWaalsContact CE2-CD2 3.49Å; Y314-F318 AromaticContact CE2-CE2 3.4Å; Y314-F318 HydrophobicContact CE2-CE2 3.4Å; Y314-F318 VanDerWaalsContact CE2-CE2 3.4Å; Y314-F318 HydrophobicContact CE2-CZ 4.37Å; Y314-F318 AromaticContact CG-CD2 3.98Å; Y314-F318 HydrophobicContact CG-CD2 3.98Å; Y314-F318 AromaticContact CZ-CD2 3.58Å; Y314-F318 AromaticContact CZ-CE2 3.86Å; Y314-F318 PolarHBondContact O-N 3.37Å; F318-Y320 VanDerWaalsContact C-N 3.26Å; F318-Y320 PolarHBondContact O-N 3.37Å; F318-F321 PolarHBondContact O-N 3.39Å; F318-F321 VanDerWaalsContact O-N 3.08Å; F318-L322 HydrophobicContact CB-CD1 4.31Å
319K90.9Very high94.4Very high77 Ų7750.8 Ų50.834%0.33524%0.242SC..G310 helixtrans-49.3-38.5-169.767.9-176.8-177.7175.70115.5I315 F321 L322 L375I315-K319 WeakPolarHBondContact O-CA 3.37Å; I315-K319 VanDerWaalsContact O-CB 3.27Å; I315-K319 WeakPolarHBondContact O-CB 3.26Å; I315-K319 PolarHBondContact O-N 3.15Å; K319-F321 VanDerWaalsContact C-N 3.35Å; K319-F321 PolarHBondContact O-N 3.01Å; K319-L322 PolarHBondContact O-N 3.37Å; K319-L375 HydrophobicContact CB-CD2 4.32Å
320Y90.3Very high94.3Very high171 Ų17147.5 Ų47.567%0.67122%0.224SC*.G310 helixtrans-67.2-35.5-175.8-60.5-65000112.5F318 L322 T323F318-Y320 VanDerWaalsContact C-N 3.26Å; F318-Y320 PolarHBondContact O-N 3.37Å; Y320-L322 VanDerWaalsContact C-N 3.29Å; Y320-L322 PolarHBondContact O-N 2.88Å; Y320-T323 WeakPolarHBondContact O-CG2 3.41Å; Y320-T323 PolarHBondContact O-OG1 2.97Å; Y320-T323 VanDerWaalsContact O-OG1 3.07Å
321F92.6Very high94.3Very high76 Ų7652.2 Ų52.233%0.33324%0.244SC..G310 helixtrans-77.9-15.9178.9-59.8-81.8000113.1E250 E251 H255 F318 K319E250-F321 HydrophobicContact CB-CD2 4.46Å; E250-F321 HydrophobicContact CB-CE2 3.66Å; E250-F321 HydrophobicContact CB-CZ 3.83Å; E250-F321 HydrophobicContact CG-CE2 3.94Å; E250-F321 HydrophobicContact CG-CZ 3.77Å; E250-F321 WeakPolarHBondContact O-CE1 3.38Å; E251-F321 HydrophobicContact CG-CE1 4.37Å; E251-F321 HydrophobicContact CG-CZ 4.38Å; H255-F321 HydrophobicContact CB-CB 4.41Å; H255-F321 WeakPolarHBondContact CD2-CB 3.46Å; H255-F321 AromaticContact CD2-CG 3.66Å; H255-F321 AromaticContact NE2-CD2 3.88Å; H255-F321 AromaticContact NE2-CG 3.68Å; F318-F321 PolarHBondContact O-N 3.39Å; F318-F321 VanDerWaalsContact O-N 3.08Å; K319-F321 VanDerWaalsContact C-N 3.35Å; K319-F321 PolarHBondContact O-N 3.01Å
322L93Very high94.3Very high0 Ų052.3 Ų52.30%025%0.245CC..G310 helixtrans-99.8-2.3-174.4-62.9174.9000114H255 V259 Y314 I315 F318 K319 Y320 K324 K325 F329H255-L322 HydrophobicContact CB-CD2 3.81Å; V259-L322 HydrophobicContact CB-CD2 4.32Å; V259-L322 HydrophobicContact CG2-CD1 4.09Å; V259-L322 HydrophobicContact CG2-CD2 3.6Å; Y314-L322 HydrophobicContact CD1-CD1 4.17Å; I315-L322 HydrophobicContact CB-CD1 4.3Å; I315-L322 HydrophobicContact CG1-CD1 3.92Å; F318-L322 HydrophobicContact CB-CD1 4.31Å; K319-L322 PolarHBondContact O-N 3.37Å; Y320-L322 VanDerWaalsContact C-N 3.29Å; Y320-L322 PolarHBondContact O-N 2.88Å; L322-K324 PolarHBondContact O-N 3.41Å; L322-K325 WeakPolarHBondContact O-CB 3.23Å; L322-K325 PolarHBondContact O-N 3.01Å; L322-F329 HydrophobicContact CB-CE2 4.17Å; L322-F329 HydrophobicContact CB-CZ 4.28Å; L322-F329 HydrophobicContact CD1-CZ 4.46Å
323T90.1Very high94.3Very high42 Ų4251.5 Ų51.526%0.25824%0.24SC..G310 helixtrans-50.2-42178.648.60000113Y320 K325 S326 L375Y320-T323 WeakPolarHBondContact O-CG2 3.41Å; Y320-T323 PolarHBondContact O-OG1 2.97Å; Y320-T323 VanDerWaalsContact O-OG1 3.07Å; T323-K325 PolarHBondContact O-N 3.18Å; T323-S326 WeakPolarHBondContact O-CB 3.41Å; T323-S326 PolarHBondContact O-N 3.45Å; T323-S326 PolarHBondContact O-OG 3.47Å; T323-L375 HydrophobicContact CG2-CD2 4.36Å
324K90.1Very high94.3Very high190 Ų19047.9 Ų47.983%0.82622%0.223SC*.G310 helixtrans-69.5-9.7178.1-64.2-179-179.1175.20114.7L322L322-K324 PolarHBondContact O-N 3.41Å
325K93.4Very high94.3Very high54 Ų5451.6 Ų51.624%0.23524%0.241CC..G310 helixtrans-99.87.9-179.4-60.8-68.1176.1161.80113.3G256 L322 T323 S327 C328 F329G256-K325 VanDerWaalsContact CA-CE 3.43Å; L322-K325 WeakPolarHBondContact O-CB 3.23Å; L322-K325 PolarHBondContact O-N 3.01Å; T323-K325 PolarHBondContact O-N 3.18Å; K325-S327 VanDerWaalsContact C-N 3.27Å; K325-S327 PolarHBondContact O-N 3.26Å; K325-C328 WeakPolarHBondContact O-CB 3.49Å; K325-C328 PolarHBondContact O-N 3Å; K325-F329 HydrophobicContact CB-CD2 4.47Å; K325-F329 HydrophobicContact CB-CE2 3.94Å; K325-F329 HydrophobicContact CB-CZ 4.11Å; K325-F329 WeakPolarHBondContact O-CD2 3.42Å; K325-F329 PolarHBondContact O-N 3.23Å
326S94.2Very high94.3Very high3 Ų351.6 Ų51.62%0.02124%0.241CC..Hα-helixtrans-53.9-38.5179.6-65.20000114.2T323 F329 H330 F378T323-S326 WeakPolarHBondContact O-CB 3.41Å; T323-S326 PolarHBondContact O-N 3.45Å; T323-S326 PolarHBondContact O-OG 3.47Å; S326-F329 PolarHBondContact O-N 2.94Å; S326-H330 PolarHBondContact O-N 3.38Å; S326-F378 PolarHBondContact OG-N 3.36Å
327S93.6Very high94.2Very high55 Ų5547.9 Ų47.939%0.38523%0.225SC..Hα-helixtrans-65.1-40.5175.355.40000112.9K325 F329 H330 Q331K325-S327 VanDerWaalsContact C-N 3.27Å; K325-S327 PolarHBondContact O-N 3.26Å; S327-F329 VanDerWaalsContact C-N 3.35Å; S327-H330 PolarHBondContact O-N 3.42Å; S327-Q331 WeakPolarHBondContact O-CG 3.31Å; S327-Q331 PolarHBondContact O-N 3.14Å
328C94.8Very high94.2Very high41 Ų4145.4 Ų45.428%0.27721%0.213SC..Hα-helixtrans-64-40.9174.6-57.60000111.2K325 Q331 L332K325-C328 WeakPolarHBondContact O-CB 3.49Å; K325-C328 PolarHBondContact O-N 3Å; C328-Q331 PolarHBondContact O-N 2.9Å; C328-L332 VanDerWaalsContact O-CB 3.32Å; C328-L332 WeakPolarHBondContact O-CB 3.38Å; C328-L332 PolarHBondContact O-N 3.39Å
329F96.8Very high94.1Very high0 Ų048.2 Ų48.20%023%0.226CC..Hα-helixtrans-65.1-41.4177.2-64.4-40.6000113.2V259 L311 I315 L322 K325 S326 S327 L332 Y333 F368 L372 F378V259-F329 HydrophobicContact CG1-CD1 4.4Å; V259-F329 HydrophobicContact CG1-CE1 3.31Å; V259-F329 HydrophobicContact CG1-CZ 3.67Å; L311-F329 HydrophobicContact CD1-CE1 4.33Å; I315-F329 HydrophobicContact CD1-CD1 4.25Å; I315-F329 HydrophobicContact CD1-CE1 3.7Å; I315-F329 HydrophobicContact CD1-CE2 4.43Å; I315-F329 HydrophobicContact CD1-CZ 3.82Å; I315-F329 HydrophobicContact CG1-CE1 4.18Å; I315-F329 HydrophobicContact CG1-CZ 3.86Å; L322-F329 HydrophobicContact CB-CE2 4.17Å; L322-F329 HydrophobicContact CB-CZ 4.28Å; L322-F329 HydrophobicContact CD1-CZ 4.46Å; K325-F329 HydrophobicContact CB-CD2 4.47Å; K325-F329 HydrophobicContact CB-CE2 3.94Å; K325-F329 HydrophobicContact CB-CZ 4.11Å; K325-F329 WeakPolarHBondContact O-CD2 3.42Å; K325-F329 PolarHBondContact O-N 3.23Å; S326-F329 PolarHBondContact O-N 2.94Å; S327-F329 VanDerWaalsContact C-N 3.35Å; F329-L332 PolarHBondContact O-N 3.25Å; F329-Y333 PolarHBondContact O-N 2.89Å; F329-F368 HydrophobicContact CB-CE1 4.32Å; F329-F368 HydrophobicContact CB-CZ 3.7Å; F329-F368 AromaticContact CD1-CE2 3.85Å; F329-F368 HydrophobicContact CD1-CE2 3.85Å; F329-F368 AromaticContact CD1-CZ 3.66Å; F329-F368 HydrophobicContact CD1-CZ 3.66Å; F329-F368 HydrophobicContact CE1-CE2 4.33Å; F329-F368 HydrophobicContact CG-CE2 4.41Å; F329-F368 AromaticContact CG-CZ 3.93Å; F329-F368 HydrophobicContact CG-CZ 3.93Å; F329-L372 HydrophobicContact CB-CD1 3.83Å; F329-L372 HydrophobicContact CB-CD2 4.5Å; F329-L372 HydrophobicContact CD2-CD1 4.44Å; F329-L372 HydrophobicContact CD2-CD2 3.59Å; F329-L372 HydrophobicContact CE2-CD2 4Å; F329-L372 HydrophobicContact CG-CD1 4.24Å; F329-L372 HydrophobicContact CG-CD2 4.15Å; F329-F378 HydrophobicContact CB-CD2 4.45Å; F329-F378 HydrophobicContact CB-CE2 4.28Å
330H96.6Very high94.1Very high11 Ų1144.9 Ų44.95%0.05121%0.211CC..Hα-helixtrans-60.8-49.3173.8174.5-135.7000110.8S326 S327 L332 Y333 L334 F378 V381 H397S326-H330 PolarHBondContact O-N 3.38Å; S327-H330 PolarHBondContact O-N 3.42Å; H330-L332 PolarHBondContact O-N 3.08Å; H330-Y333 PolarHBondContact O-N 3.5Å; H330-L334 VanDerWaalsContact NE2-CD1 3.29Å; H330-L334 WeakPolarHBondContact NE2-CD1 3.46Å; H330-L334 WeakPolarHBondContact O-CG 3.45Å; H330-L334 PolarHBondContact O-N 3.43Å; H330-L334 VanDerWaalsContact O-N 3.08Å; H330-F378 HydrophobicContact CB-CE2 4.12Å; H330-V381 HydrophobicContact CB-CG1 3.83Å; H330-V381 WeakPolarHBondContact ND1-CG1 3.35Å; H330-H397 AromaticContact NE2-CE1 3.84Å; H330-H397 AromaticContact NE2-ND1 3.25Å; H330-H397 PolarHBondContact NE2-ND1 3.06Å
331Q95.9Very high94Very high114 Ų11440.4 Ų40.453%0.53320%0.203SC..Hα-helixtrans-60.7-43.8177.4-72.1177.4-1.800112.7S327 C328 Y333 L334 Q335S327-Q331 WeakPolarHBondContact O-CG 3.31Å; S327-Q331 PolarHBondContact O-N 3.14Å; C328-Q331 PolarHBondContact O-N 2.9Å; Q331-Y333 VanDerWaalsContact C-N 3.34Å; Q331-Y333 PolarHBondContact O-N 2.98Å; Q331-L334 PolarHBondContact O-N 3.01Å; Q331-Q335 WeakPolarHBondContact O-CB 3.38Å; Q331-Q335 VanDerWaalsContact O-CG 3.32Å; Q331-Q335 WeakPolarHBondContact O-CG 3.3Å; Q331-Q335 PolarHBondContact O-N 3.35Å
332L97.4Very high93.9Very high3 Ų338.3 Ų38.32%0.01620%0.197CC..Hα-helixtrans-57.2-47176.6177.464.8000111.3L267 L311 C328 F329 H330 L334 Q335 I336 F368L267-L332 HydrophobicContact CD1-CD1 3.75Å; L267-L332 HydrophobicContact CD2-CD1 3.86Å; L267-L332 HydrophobicContact CG-CD1 3.6Å; L311-L332 HydrophobicContact CD2-CD2 3.56Å; C328-L332 VanDerWaalsContact O-CB 3.32Å; C328-L332 WeakPolarHBondContact O-CB 3.38Å; C328-L332 PolarHBondContact O-N 3.39Å; F329-L332 PolarHBondContact O-N 3.25Å; H330-L332 PolarHBondContact O-N 3.08Å; L332-L334 PolarHBondContact O-N 3.44Å; L332-Q335 PolarHBondContact O-N 3.25Å; L332-I336 HydrophobicContact CD1-CD1 3.81Å; L332-I336 HydrophobicContact CD1-CG1 4.27Å; L332-I336 HydrophobicContact CG-CD1 3.93Å; L332-I336 WeakPolarHBondContact O-CB 3.49Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 2.91Å; L332-F368 HydrophobicContact CD2-CE2 4.35Å; L332-F368 HydrophobicContact CD2-CZ 4.17Å
333Y97.2Very high93.8Very high1 Ų139 Ų390%0.00420%0.202CC..Hα-helixtrans-58.9-49.3177.2-171.6-76.5000111F329 H330 Q331 Q335 I336 F337 M365 F368 L369 M400 N403F329-Y333 PolarHBondContact O-N 2.89Å; H330-Y333 PolarHBondContact O-N 3.5Å; Q331-Y333 VanDerWaalsContact C-N 3.34Å; Q331-Y333 PolarHBondContact O-N 2.98Å; Y333-Q335 PolarHBondContact O-N 3.47Å; Y333-I336 PolarHBondContact O-N 3.38Å; Y333-F337 AromaticContact CD1-CD2 3.66Å; Y333-F337 HydrophobicContact CD1-CD2 3.66Å; Y333-F337 HydrophobicContact CD1-CE2 4.05Å; Y333-F337 HydrophobicContact CD1-CG 4.24Å; Y333-F337 HydrophobicContact CD2-CD2 4.19Å; Y333-F337 AromaticContact CD2-CE2 3.83Å; Y333-F337 HydrophobicContact CD2-CE2 3.83Å; Y333-F337 HydrophobicContact CE1-CB 4.4Å; Y333-F337 HydrophobicContact CE1-CD1 4.22Å; Y333-F337 AromaticContact CE1-CD2 3.4Å; Y333-F337 HydrophobicContact CE1-CD2 3.4Å; Y333-F337 VanDerWaalsContact CE1-CD2 3.4Å; Y333-F337 HydrophobicContact CE1-CE1 4.34Å; Y333-F337 AromaticContact CE1-CE2 3.56Å; Y333-F337 HydrophobicContact CE1-CE2 3.56Å; Y333-F337 AromaticContact CE1-CG 3.75Å; Y333-F337 HydrophobicContact CE1-CG 3.75Å; Y333-F337 HydrophobicContact CE1-CZ 4.03Å; Y333-F337 AromaticContact CE2-CD2 4Å; Y333-F337 HydrophobicContact CE2-CD2 4Å; Y333-F337 AromaticContact CE2-CE2 3.34Å; Y333-F337 HydrophobicContact CE2-CE2 3.34Å; Y333-F337 AromaticContact CE2-CZ 3.83Å; Y333-F337 HydrophobicContact CE2-CZ 3.83Å; Y333-F337 HydrophobicContact CG-CD2 4.04Å; Y333-F337 HydrophobicContact CG-CE2 4.17Å; Y333-F337 AromaticContact CZ-CD2 3.61Å; Y333-F337 AromaticContact CZ-CE2 3.19Å; Y333-F337 AromaticContact CZ-CZ 3.42Å; Y333-F337 VanDerWaalsContact CZ-CZ 3.42Å; Y333-F337 WeakPolarHBondContact O-CD2 3.35Å; Y333-F337 PolarHBondContact O-N 3.28Å; Y333-F337 WeakPolarHBondContact OH-CZ 3.29Å; Y333-M365 HydrophobicContact CD2-CE 3.83Å; Y333-M365 HydrophobicContact CG-CE 4.41Å; Y333-F368 HydrophobicContact CD2-CD1 4.4Å; Y333-L369 HydrophobicContact CE2-CB 4.37Å; Y333-L369 HydrophobicContact CE2-CD2 4.24Å; Y333-M400 HydrophobicContact CD1-CB 4.01Å; Y333-M400 HydrophobicContact CD1-CG 3.9Å; Y333-M400 HydrophobicContact CD1-SD 3.76Å; Y333-M400 HydrophobicContact CE1-CB 3.48Å; Y333-M400 VanDerWaalsContact CE1-CB 3.48Å; Y333-M400 HydrophobicContact CE1-CG 3.62Å; Y333-M400 HydrophobicContact CE1-SD 4.14Å; Y333-M400 HydrophobicContact CE2-CG 4.34Å; Y333-M400 HydrophobicContact CG-CG 4.4Å; Y333-M400 HydrophobicContact CG-SD 3.99Å; Y333-N403 PolarHBondContact OH-ND2 3.06Å
334L96.6Very high93.6Very high4 Ų439.6 Ų39.62%0.02120%0.203CC..Hα-helixtrans-62.4-44-179.3-62.3179.3000112.4H330 Q331 L332 F337 S338 L389 H393 P396 H397H330-L334 VanDerWaalsContact NE2-CD1 3.29Å; H330-L334 WeakPolarHBondContact NE2-CD1 3.46Å; H330-L334 WeakPolarHBondContact O-CG 3.45Å; H330-L334 PolarHBondContact O-N 3.43Å; H330-L334 VanDerWaalsContact O-N 3.08Å; Q331-L334 PolarHBondContact O-N 3.01Å; L332-L334 PolarHBondContact O-N 3.44Å; L334-F337 PolarHBondContact O-N 3Å; L334-S338 VanDerWaalsContact O-CB 3.31Å; L334-S338 WeakPolarHBondContact O-CB 3.34Å; L334-S338 PolarHBondContact O-N 3.08Å; L334-L389 HydrophobicContact CD1-CD2 3.78Å; L334-H393 HydrophobicContact CB-CB 4.23Å; L334-H393 HydrophobicContact CD1-CB 4.06Å; L334-P396 HydrophobicContact CD2-CB 3.85Å; L334-H397 VanDerWaalsContact CD2-CA 3.4Å; L334-H397 HydrophobicContact CD2-CB 3.6Å; L334-H397 VanDerWaalsContact CD2-N 3.27Å
335Q95.3Very high93.4Very high78 Ų7832.4 Ų32.436%0.36418%0.177SC..Hα-helixtrans-60.5-47.5178-76.5177.4-23.200111.1L267 Q331 L332 Y333 S338L267-Q335 HydrophobicContact CD2-CB 4.05Å; Q331-Q335 WeakPolarHBondContact O-CB 3.38Å; Q331-Q335 VanDerWaalsContact O-CG 3.32Å; Q331-Q335 WeakPolarHBondContact O-CG 3.3Å; Q331-Q335 PolarHBondContact O-N 3.35Å; L332-Q335 PolarHBondContact O-N 3.25Å; Y333-Q335 PolarHBondContact O-N 3.47Å; Q335-S338 PolarHBondContact O-OG 2.92Å
336I95.6Very high93.1Very high0 Ų030.9 Ų30.90%017%0.174CC..Hα-helixtrans-59.9-56.6177.4-70.6171.8000110.3L266 L267 L270 L332 Y333 S338 K339 F340 V361 L362 M365L266-I336 HydrophobicContact CD2-CD1 3.66Å; L266-I336 HydrophobicContact CG-CD1 4.16Å; L267-I336 HydrophobicContact CD2-CG1 3.89Å; L270-I336 HydrophobicContact CD2-CB 4.33Å; L270-I336 HydrophobicContact CD2-CG1 4.06Å; L270-I336 HydrophobicContact CD2-CG2 4.2Å; L332-I336 HydrophobicContact CD1-CD1 3.81Å; L332-I336 HydrophobicContact CD1-CG1 4.27Å; L332-I336 HydrophobicContact CG-CD1 3.93Å; L332-I336 WeakPolarHBondContact O-CB 3.49Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 2.91Å; Y333-I336 PolarHBondContact O-N 3.38Å; I336-S338 VanDerWaalsContact C-N 3.27Å; I336-S338 PolarHBondContact O-N 3.39Å; I336-K339 WeakPolarHBondContact O-CB 3.14Å; I336-K339 PolarHBondContact O-N 2.72Å; I336-F340 HydrophobicContact CG2-CD2 4.34Å; I336-F340 HydrophobicContact CG2-CE2 3.89Å; I336-F340 WeakPolarHBondContact O-CD2 3.39Å; I336-V361 HydrophobicContact CD1-CG1 4.47Å; I336-V361 HydrophobicContact CG2-CG1 3.5Å; I336-L362 HydrophobicContact CG2-CD2 4.3Å; I336-M365 HydrophobicContact CD1-CE 3.93Å; I336-M365 HydrophobicContact CD1-CG 4.31Å; I336-M365 HydrophobicContact CD1-SD 3.75Å; I336-M365 HydrophobicContact CG2-CG 4.37Å
337F94.7Very high92.6Very high31 Ų3132 Ų3214%0.13618%0.181CC..Hα-helixtrans-66.4-26.4-174-84.6-102.7000113.3Y333 L334 K339 F340 L362 M365 P396Y333-F337 AromaticContact CD1-CD2 3.66Å; Y333-F337 HydrophobicContact CD1-CD2 3.66Å; Y333-F337 HydrophobicContact CD1-CE2 4.05Å; Y333-F337 HydrophobicContact CD1-CG 4.24Å; Y333-F337 HydrophobicContact CD2-CD2 4.19Å; Y333-F337 AromaticContact CD2-CE2 3.83Å; Y333-F337 HydrophobicContact CD2-CE2 3.83Å; Y333-F337 HydrophobicContact CE1-CB 4.4Å; Y333-F337 HydrophobicContact CE1-CD1 4.22Å; Y333-F337 AromaticContact CE1-CD2 3.4Å; Y333-F337 HydrophobicContact CE1-CD2 3.4Å; Y333-F337 VanDerWaalsContact CE1-CD2 3.4Å; Y333-F337 HydrophobicContact CE1-CE1 4.34Å; Y333-F337 AromaticContact CE1-CE2 3.56Å; Y333-F337 HydrophobicContact CE1-CE2 3.56Å; Y333-F337 AromaticContact CE1-CG 3.75Å; Y333-F337 HydrophobicContact CE1-CG 3.75Å; Y333-F337 HydrophobicContact CE1-CZ 4.03Å; Y333-F337 AromaticContact CE2-CD2 4Å; Y333-F337 HydrophobicContact CE2-CD2 4Å; Y333-F337 AromaticContact CE2-CE2 3.34Å; Y333-F337 HydrophobicContact CE2-CE2 3.34Å; Y333-F337 AromaticContact CE2-CZ 3.83Å; Y333-F337 HydrophobicContact CE2-CZ 3.83Å; Y333-F337 HydrophobicContact CG-CD2 4.04Å; Y333-F337 HydrophobicContact CG-CE2 4.17Å; Y333-F337 AromaticContact CZ-CD2 3.61Å; Y333-F337 AromaticContact CZ-CE2 3.19Å; Y333-F337 AromaticContact CZ-CZ 3.42Å; Y333-F337 VanDerWaalsContact CZ-CZ 3.42Å; Y333-F337 WeakPolarHBondContact O-CD2 3.35Å; Y333-F337 PolarHBondContact O-N 3.28Å; Y333-F337 WeakPolarHBondContact OH-CZ 3.29Å; L334-F337 PolarHBondContact O-N 3Å; F337-K339 PolarHBondContact O-N 3.34Å; F337-F340 PolarHBondContact O-N 3.47Å; F337-L362 HydrophobicContact CD1-CD2 4.13Å; F337-L362 HydrophobicContact CD2-CD2 4.24Å; F337-L362 HydrophobicContact CE1-CD2 3.88Å; F337-L362 HydrophobicContact CE2-CD2 3.98Å; F337-L362 HydrophobicContact CG-CD2 4.32Å; F337-L362 HydrophobicContact CZ-CD2 3.81Å; F337-M365 HydrophobicContact CE2-CB 3.86Å; F337-M365 HydrophobicContact CE2-CG 4.38Å; F337-M365 HydrophobicContact CZ-CB 4.32Å; F337-P396 HydrophobicContact CB-CB 3.93Å; F337-P396 HydrophobicContact CB-CG 4.45Å
338S93.8Very high92.1Very high2 Ų233.8 Ų33.81%0.01419%0.194CC..Hα-helixtrans-61.6-22.8173.574.50000113.6L334 Q335 I336 S343L334-S338 VanDerWaalsContact O-CB 3.31Å; L334-S338 WeakPolarHBondContact O-CB 3.34Å; L334-S338 PolarHBondContact O-N 3.08Å; Q335-S338 PolarHBondContact O-OG 2.92Å; I336-S338 VanDerWaalsContact C-N 3.27Å; I336-S338 PolarHBondContact O-N 3.39Å; S338-S343 VanDerWaalsContact O-CB 3.24Å; S338-S343 WeakPolarHBondContact O-CB 3.29Å; S338-S343 PolarHBondContact O-OG 2.89Å
339K92.4Very high91.6Very high60 Ų6033.1 Ų33.126%0.26119%0.187SC..THydrogen-bonded Turntrans-89.6-2.9179.8-55.2-55.2179.1-173.30113.9I336 F337I336-K339 WeakPolarHBondContact O-CB 3.14Å; I336-K339 PolarHBondContact O-N 2.72Å; F337-K339 PolarHBondContact O-N 3.34Å
340F91.5Very high91.2Very high6 Ų634.1 Ų34.13%0.02619%0.193CC..SBendtrans-113.6146.5179.6-67.9-86.8000111.8L270 I336 F337 S343 L357 S358 V361 L362L270-F340 HydrophobicContact CD1-CE2 3.96Å; L270-F340 HydrophobicContact CD1-CZ 3.68Å; L270-F340 HydrophobicContact CD2-CE2 4.11Å; I336-F340 HydrophobicContact CG2-CD2 4.34Å; I336-F340 HydrophobicContact CG2-CE2 3.89Å; I336-F340 WeakPolarHBondContact O-CD2 3.39Å; F337-F340 PolarHBondContact O-N 3.47Å; F340-S343 WeakPolarHBondContact O-CB 3.48Å; F340-S343 PolarHBondContact O-N 3.29Å; F340-L357 HydrophobicContact CE1-CB 4.17Å; F340-L357 HydrophobicContact CE1-CD2 4.02Å; F340-L357 HydrophobicContact CE1-CG 3.77Å; F340-L357 HydrophobicContact CZ-CD2 4.16Å; F340-L357 HydrophobicContact CZ-CG 3.86Å; F340-S358 WeakPolarHBondContact CD1-OG 3.33Å; F340-V361 HydrophobicContact CE2-CB 4.38Å; F340-V361 HydrophobicContact CE2-CG1 4.3Å; F340-V361 HydrophobicContact CZ-CB 3.99Å; F340-V361 HydrophobicContact CZ-CG1 4.38Å; F340-V361 HydrophobicContact CZ-CG2 4.3Å; F340-L362 HydrophobicContact CB-CD1 4.18Å; F340-L362 HydrophobicContact CD1-CD1 4.15Å; F340-L362 HydrophobicContact CD1-CG 4.37Å; F340-L362 HydrophobicContact CD2-CD1 4.5Å; F340-L362 HydrophobicContact CD2-CD2 3.65Å; F340-L362 HydrophobicContact CD2-CG 4.29Å; F340-L362 HydrophobicContact CE2-CD2 3.91Å; F340-L362 HydrophobicContact CE2-CG 4.46Å; F340-L362 HydrophobicContact CG-CD1 4.02Å; F340-L362 HydrophobicContact CG-CD2 4.02Å; F340-L362 HydrophobicContact CG-CG 4.25Å; F340-L362 HydrophobicContact CZ-CD2 4.47Å
341P88.5Confident90.6Very high78 Ų7839.7 Ų39.751%0.50623%0.229SC..THydrogen-bonded Turntrans-54.5142.6166.4-24.334.8000111T354P341-T354 HydrophobicContact CG-CG2 4.05Å
342P89.6Confident90.2Very high32 Ų3237.5 Ų37.521%0.20823%0.23CC..THydrogen-bonded Turncis-97.623.410.939.5-37.1000114.7L344 L395 L399 V453 L455P342-L344 PolarHBondContact O-N 3.24Å; P342-L395 HydrophobicContact CG-CD2 4.4Å; P342-L399 HydrophobicContact CG-CD1 4.43Å; P342-V453 HydrophobicContact CB-CG1 3.55Å; P342-V453 HydrophobicContact CG-CG1 3.58Å; P342-L455 HydrophobicContact CG-CD2 3.63Å; P342-L455 HydrophobicContact CG-CG 4.13Å
343S91.1Very high89.8Confident13 Ų1337.4 Ų37.49%0.09123%0.229CC..  trans-54131.7172.8175.60000110.9S338 F340 C345 A346S338-S343 VanDerWaalsContact O-CB 3.24Å; S338-S343 WeakPolarHBondContact O-CB 3.29Å; S338-S343 PolarHBondContact O-OG 2.89Å; F340-S343 WeakPolarHBondContact O-CB 3.48Å; F340-S343 PolarHBondContact O-N 3.29Å; S343-C345 PolarHBondContact O-N 2.98Å; S343-C345 PolarHBondContact OG-N 2.94Å; S343-A346 VanDerWaalsContact O-CB 3.28Å; S343-A346 WeakPolarHBondContact O-CB 3.39Å; S343-A346 PolarHBondContact O-N 2.88Å; S343-A346 VanDerWaalsContact O-N 3.1Å
344L86.6Confident89.4Confident55 Ų5538.4 Ų38.429%0.28824%0.236SC..THydrogen-bonded Turntrans-70.3-14.9177.6-60.8180000112.5P342 T447 E448 V451 V453 L814P342-L344 PolarHBondContact O-N 3.24Å; L344-T447 HydrophobicContact CD1-CG2 3.66Å; L344-E448 HydrophobicContact CD1-CG 3.83Å; L344-E448 HydrophobicContact CG-CG 4.12Å; L344-V451 HydrophobicContact CD1-CB 4.35Å; L344-V451 HydrophobicContact CD1-CG2 4.46Å; L344-V451 HydrophobicContact CD2-CB 4.37Å; L344-V451 HydrophobicContact CD2-CG1 3.94Å; L344-V453 HydrophobicContact CD2-CG2 4.14Å; L344-L814 HydrophobicContact CB-CD1 4.35Å; L344-L814 HydrophobicContact CD1-CD1 3.9Å
345C85Confident89.1Confident40 Ų4040.1 Ų40.127%0.2725%0.254SS..THydrogen-bonded Turntrans-93-2.3174-61.40000112.9S343 E392S343-C345 PolarHBondContact O-N 2.98Å; S343-C345 PolarHBondContact OG-N 2.94Å; C345-E392 HydrophobicContact CB-CB 4.28Å; C345-E392 HydrophobicContact CB-CG 4.43Å; C345-E392 WeakPolarHBondContact SG-CG 3.2Å
346A87.5Confident88.9Confident22 Ų2238.7 Ų38.718%0.18225%0.247CC..SBendtrans-70.4139.4178.700000111S343S343-A346 VanDerWaalsContact O-CB 3.28Å; S343-A346 WeakPolarHBondContact O-CB 3.39Å; S343-A346 PolarHBondContact O-N 2.88Å; S343-A346 VanDerWaalsContact O-N 3.1Å
347P84.6Confident88.8Confident26 Ų2638.9 Ų38.917%0.16925%0.248CC..  trans-64.8144175.928.1-34.7000111V274 E278 L349V274-P347 HydrophobicContact CG1-CB 4.25Å; V274-P347 HydrophobicContact CG1-CG 3.64Å; E278-P347 WeakPolarHBondContact OE1-CB 3.3Å; P347-L349 HydrophobicContact CB-CG 4.21Å; P347-L349 HydrophobicContact CG-CD1 4.05Å; P347-L349 HydrophobicContact CG-CG 4.09Å; P347-L349 PolarHBondContact O-N 3.47Å
348S83.6Confident88.7Confident93 Ų9338.7 Ų38.765%0.6525%0.251SS*.  trans-76.488.7176175.60000110K281K281-S348 WeakPolarHBondContact CD-O 3.4Å; K281-S348 PolarHBondContact NZ-O 2.98Å; K281-S348 PolarHBondContact NZ-OG 3.48Å
349L84.4Confident88.6Confident27 Ų2740.7 Ų40.714%0.14127%0.267CS..  trans-100.4154.9-179.9-65.6178.5000112.3A277 E278 P347 T354A277-L349 HydrophobicContact CB-CD1 3.94Å; A277-L349 HydrophobicContact CB-CD2 3.6Å; A277-L349 HydrophobicContact CB-CG 4.33Å; E278-L349 HydrophobicContact CG-CD2 3.68Å; P347-L349 HydrophobicContact CB-CG 4.21Å; P347-L349 HydrophobicContact CG-CD1 4.05Å; P347-L349 HydrophobicContact CG-CG 4.09Å; P347-L349 PolarHBondContact O-N 3.47Å; L349-T354 VanDerWaalsContact CB-OG1 3.31Å; L349-T354 WeakPolarHBondContact CB-OG1 3.28Å
350P86.4Confident88.7Confident20 Ų2037.9 Ų37.913%0.1326%0.256CS..  trans-57142171-23.333.9000112K281 Q286 A352 L353 T354K281-P350 HydrophobicContact CB-CG 4.09Å; K281-P350 HydrophobicContact CG-CG 4.2Å; Q286-P350 HydrophobicContact CG-CB 4.44Å; Q286-P350 HydrophobicContact CG-CG 3.91Å; P350-A352 VanDerWaalsContact C-N 3.31Å; P350-A352 PolarHBondContact O-N 3.44Å; P350-L353 HydrophobicContact CB-CD1 4.38Å; P350-L353 HydrophobicContact CG-CD1 4.07Å; P350-L353 PolarHBondContact O-N 2.91Å; P350-T354 PolarHBondContact O-N 3.45Å; P350-T354 PolarHBondContact O-OG1 3.24Å
351T85.8Confident88.8Confident129 Ų12937.6 Ų37.679%0.79125%0.254SS*.Hα-helixtrans-59.1-38.6-173.4-46.70000113.1T354 G355T351-T354 PolarHBondContact O-N 3.24Å; T351-G355 PolarHBondContact O-N 3.27Å
352A87.1Confident89.1Confident67 Ų6735.5 Ų35.555%0.55424%0.238SC*.Hα-helixtrans-63.3-48.3179.600000112.3P350 G355 E356P350-A352 VanDerWaalsContact C-N 3.31Å; P350-A352 PolarHBondContact O-N 3.44Å; A352-G355 PolarHBondContact O-N 3.23Å; A352-E356 PolarHBondContact O-N 3.1Å
353L89.1Confident89.2Confident2 Ų238.4 Ų38.41%0.0126%0.255CS..Hα-helixtrans-65.1-42.3177.7-66.2175.6000111.3A277 I280 Y294 F297 P350 G355 E356 L357A277-L353 HydrophobicContact CB-CB 4.45Å; A277-L353 HydrophobicContact CB-CD1 3.91Å; I280-L353 HydrophobicContact CB-CD1 4.29Å; I280-L353 HydrophobicContact CD1-CD1 4.48Å; I280-L353 HydrophobicContact CG2-CD1 3.97Å; Y294-L353 HydrophobicContact CD2-CD2 3.89Å; Y294-L353 HydrophobicContact CE2-CD2 3.33Å; Y294-L353 HydrophobicContact CE2-CG 4.33Å; F297-L353 HydrophobicContact CD1-CD2 3.74Å; F297-L353 HydrophobicContact CE1-CB 4.47Å; F297-L353 HydrophobicContact CE1-CD2 3.54Å; F297-L353 HydrophobicContact CG-CD2 4.35Å; F297-L353 HydrophobicContact CZ-CB 4.16Å; F297-L353 HydrophobicContact CZ-CD2 3.97Å; P350-L353 HydrophobicContact CB-CD1 4.38Å; P350-L353 HydrophobicContact CG-CD1 4.07Å; P350-L353 PolarHBondContact O-N 2.91Å; L353-G355 VanDerWaalsContact C-N 3.33Å; L353-G355 PolarHBondContact O-N 3.43Å; L353-E356 PolarHBondContact O-N 3.16Å; L353-L357 WeakPolarHBondContact O-CB 3.42Å; L353-L357 PolarHBondContact O-N 2.68Å
354T89.3Confident89.4Confident22 Ų2238 Ų3814%0.13525%0.253CS..Hα-helixtrans-60.9-43.5176.8-52.70000111P341 L349 P350 T351 S358P341-T354 HydrophobicContact CG-CG2 4.05Å; L349-T354 VanDerWaalsContact CB-OG1 3.31Å; L349-T354 WeakPolarHBondContact CB-OG1 3.28Å; P350-T354 PolarHBondContact O-N 3.45Å; P350-T354 PolarHBondContact O-OG1 3.24Å; T351-T354 PolarHBondContact O-N 3.24Å; T354-S358 WeakPolarHBondContact O-CB 3.41Å; T354-S358 PolarHBondContact O-N 2.99Å; T354-S358 PolarHBondContact O-OG 3.47Å
355G89.7Confident89.8Confident39 Ų3935.5 Ų35.540%0.40224%0.239SC..Hα-helixtrans-63.1-45.717700000112.9T351 A352 L353 S358 A359T351-G355 PolarHBondContact O-N 3.27Å; A352-G355 PolarHBondContact O-N 3.23Å; L353-G355 VanDerWaalsContact C-N 3.33Å; L353-G355 PolarHBondContact O-N 3.43Å; G355-S358 PolarHBondContact O-N 2.89Å; G355-A359 WeakPolarHBondContact O-CB 3.29Å; G355-A359 PolarHBondContact O-N 3.13Å
356E91.3Very high90.2Very high49 Ų4936.7 Ų36.723%0.22924%0.243CC..Hα-helixtrans-64.2-41.8178.1-175.3170.1-178.500112.2Y294 Q298 A352 L353 S360Y294-E356 PolarHBondContact OH-OE2 3.1Å; Q298-E356 WeakPolarHBondContact CG-OE1 3.32Å; Q298-E356 PolarHBondContact NE2-OE1 2.71Å; Q298-E356 PolarHBondContact NE2-OE2 3.42Å; A352-E356 PolarHBondContact O-N 3.1Å; L353-E356 PolarHBondContact O-N 3.16Å; E356-S360 WeakPolarHBondContact O-CB 3.49Å; E356-S360 PolarHBondContact O-N 3.15Å; E356-S360 VanDerWaalsContact O-N 3.1Å; E356-S360 PolarHBondContact O-OG 3.18Å
357L93.1Very high90.5Very high3 Ų337.4 Ų37.42%0.01625%0.249CC..Hα-helixtrans-68.1-43.8177-169.560.6000111.5L270 C273 V274 F297 A301 F340 L353 A359 S360 V361L270-L357 HydrophobicContact CD1-CD1 4.05Å; L270-L357 HydrophobicContact CD1-CD2 3.84Å; L270-L357 HydrophobicContact CD1-CG 4.07Å; C273-L357 HydrophobicContact CB-CD1 3.65Å; C273-L357 HydrophobicContact CB-CD2 4.17Å; V274-L357 HydrophobicContact CG2-CD2 4.24Å; F297-L357 HydrophobicContact CZ-CB 4.19Å; A301-L357 HydrophobicContact CB-CD1 4.31Å; F340-L357 HydrophobicContact CE1-CB 4.17Å; F340-L357 HydrophobicContact CE1-CD2 4.02Å; F340-L357 HydrophobicContact CE1-CG 3.77Å; F340-L357 HydrophobicContact CZ-CD2 4.16Å; F340-L357 HydrophobicContact CZ-CG 3.86Å; L353-L357 WeakPolarHBondContact O-CB 3.42Å; L353-L357 PolarHBondContact O-N 2.68Å; L357-A359 VanDerWaalsContact C-N 3.34Å; L357-A359 PolarHBondContact O-N 3.28Å; L357-S360 WeakPolarHBondContact O-CA 3.31Å; L357-S360 PolarHBondContact O-N 2.92Å; L357-V361 HydrophobicContact CD1-CG2 4.24Å; L357-V361 PolarHBondContact O-N 2.95Å
358S91.8Very high91.1Very high27 Ų2736.2 Ų36.219%0.18924%0.242CC..Hα-helixtrans-59.1-45.6176.8-60.70000111F340 T354 G355 S360 V361 L362F340-S358 WeakPolarHBondContact CD1-OG 3.33Å; T354-S358 WeakPolarHBondContact O-CB 3.41Å; T354-S358 PolarHBondContact O-N 2.99Å; T354-S358 PolarHBondContact O-OG 3.47Å; G355-S358 PolarHBondContact O-N 2.89Å; S358-S360 PolarHBondContact O-N 3.07Å; S358-V361 PolarHBondContact O-N 3.39Å; S358-L362 WeakPolarHBondContact O-CA 3.35Å; S358-L362 VanDerWaalsContact O-CB 3.3Å; S358-L362 WeakPolarHBondContact O-CB 3.48Å; S358-L362 PolarHBondContact O-N 3.42Å
359A92.6Very high91.7Very high44 Ų4431.8 Ų31.836%0.36421%0.211SC..Hα-helixtrans-66.4-23.1175.900000113.3R305 G355 L357R305-A359 VanDerWaalsContact NH2-C 3.27Å; R305-A359 PolarHBondContact NH2-O 3.09Å; G355-A359 WeakPolarHBondContact O-CB 3.29Å; G355-A359 PolarHBondContact O-N 3.13Å; L357-A359 VanDerWaalsContact C-N 3.34Å; L357-A359 PolarHBondContact O-N 3.28Å
360S94Very high92.2Very high2 Ų233.4 Ų33.41%0.01422%0.219CC..Hα-helixtrans-84.9-29.3179.2-59.50000112.9A301 R305 E356 L357 S358A301-S360 WeakPolarHBondContact O-CB 3.45Å; R305-S360 WeakPolarHBondContact CA-O 3.39Å; R305-S360 VanDerWaalsContact CB-O 3.28Å; R305-S360 WeakPolarHBondContact CB-O 3.38Å; R305-S360 PolarHBondContact NH1-OG 2.98Å; R305-S360 VanDerWaalsContact NH2-CA 3.29Å; R305-S360 PolarHBondContact NH2-OG 3.04Å; R305-S360 VanDerWaalsContact NH2-OG 3.15Å; E356-S360 WeakPolarHBondContact O-CB 3.49Å; E356-S360 PolarHBondContact O-N 3.15Å; E356-S360 VanDerWaalsContact O-N 3.1Å; E356-S360 PolarHBondContact O-OG 3.18Å; L357-S360 WeakPolarHBondContact O-CA 3.31Å; L357-S360 PolarHBondContact O-N 2.92Å; S358-S360 PolarHBondContact O-N 3.07Å
361V94.8Very high92.6Very high0 Ų035 Ų350%023%0.225CC..Hα-helixtrans-111.9-54-174.8-175.10000112.4L270 C304 I336 F340 L357 S358 V363 P364 M365L270-V361 HydrophobicContact CD1-CG2 4.32Å; C304-V361 HydrophobicContact CB-CG2 3.56Å; I336-V361 HydrophobicContact CD1-CG1 4.47Å; I336-V361 HydrophobicContact CG2-CG1 3.5Å; F340-V361 HydrophobicContact CE2-CB 4.38Å; F340-V361 HydrophobicContact CE2-CG1 4.3Å; F340-V361 HydrophobicContact CZ-CB 3.99Å; F340-V361 HydrophobicContact CZ-CG1 4.38Å; F340-V361 HydrophobicContact CZ-CG2 4.3Å; L357-V361 HydrophobicContact CD1-CG2 4.24Å; L357-V361 PolarHBondContact O-N 2.95Å; S358-V361 PolarHBondContact O-N 3.39Å; V361-V363 PolarHBondContact O-N 2.87Å; V361-P364 VanDerWaalsContact O-CD 3.28Å; V361-P364 WeakPolarHBondContact O-CD 3.45Å; V361-M365 HydrophobicContact CG1-CG 4.23Å; V361-M365 VanDerWaalsContact O-CG 3.23Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.41Å; V361-M365 VanDerWaalsContact O-N 3.14Å
362L93.3Very high93.1Very high33 Ų3328.9 Ų28.917%0.17319%0.187CC..Hα-helixtrans-65.9-36.6-171.5-57.2-176000112.7I336 F337 F340 S358 M365 D366I336-L362 HydrophobicContact CG2-CD2 4.3Å; F337-L362 HydrophobicContact CD1-CD2 4.13Å; F337-L362 HydrophobicContact CD2-CD2 4.24Å; F337-L362 HydrophobicContact CE1-CD2 3.88Å; F337-L362 HydrophobicContact CE2-CD2 3.98Å; F337-L362 HydrophobicContact CG-CD2 4.32Å; F337-L362 HydrophobicContact CZ-CD2 3.81Å; F340-L362 HydrophobicContact CB-CD1 4.18Å; F340-L362 HydrophobicContact CD1-CD1 4.15Å; F340-L362 HydrophobicContact CD1-CG 4.37Å; F340-L362 HydrophobicContact CD2-CD1 4.5Å; F340-L362 HydrophobicContact CD2-CD2 3.65Å; F340-L362 HydrophobicContact CD2-CG 4.29Å; F340-L362 HydrophobicContact CE2-CD2 3.91Å; F340-L362 HydrophobicContact CE2-CG 4.46Å; F340-L362 HydrophobicContact CG-CD1 4.02Å; F340-L362 HydrophobicContact CG-CD2 4.02Å; F340-L362 HydrophobicContact CG-CG 4.25Å; F340-L362 HydrophobicContact CZ-CD2 4.47Å; S358-L362 WeakPolarHBondContact O-CA 3.35Å; S358-L362 VanDerWaalsContact O-CB 3.3Å; S358-L362 WeakPolarHBondContact O-CB 3.48Å; S358-L362 PolarHBondContact O-N 3.42Å; L362-M365 WeakPolarHBondContact O-CB 3.36Å; L362-M365 PolarHBondContact O-N 3.23Å; L362-M365 VanDerWaalsContact O-N 3.08Å; L362-D366 PolarHBondContact O-N 3.33Å
363V92.1Very high93.6Very high93 Ų9325.7 Ų25.756%0.56416%0.161SC*.Hα-helixtrans-62.1-51.5178.6172.20000112.1V361 M365 D366V361-V363 PolarHBondContact O-N 2.87Å; V363-M365 PolarHBondContact O-N 2.95Å; V363-D366 PolarHBondContact O-N 3.41Å
364P94.9Very high93.9Very high6 Ų628.7 Ų28.74%0.03918%0.18CC..Hα-helixtrans-57.9-32.9169.3-2934.6000114.4R305 A308 N309 V361 D366 A367 F368R305-P364 HydrophobicContact CG-CG 4.21Å; A308-P364 HydrophobicContact CB-CB 3.55Å; A308-P364 HydrophobicContact CB-CG 4.17Å; N309-P364 WeakPolarHBondContact OD1-CB 3.46Å; N309-P364 WeakPolarHBondContact OD1-CG 3.36Å; V361-P364 VanDerWaalsContact O-CD 3.28Å; V361-P364 WeakPolarHBondContact O-CD 3.45Å; P364-D366 VanDerWaalsContact C-N 3.31Å; P364-D366 PolarHBondContact O-N 3.19Å; P364-A367 WeakPolarHBondContact O-CB 3.43Å; P364-A367 PolarHBondContact O-N 2.89Å; P364-F368 PolarHBondContact O-N 3.49Å
365M95.3Very high94.1Very high1 Ų128.3 Ų28.31%0.00518%0.177CC..Hα-helixtrans-69.6-26.6-179.6-69.1-56.5-62.400113.4L266 Y333 I336 F337 V361 L362 V363 F368 L369L266-M365 HydrophobicContact CD2-SD 4.45Å; Y333-M365 HydrophobicContact CD2-CE 3.83Å; Y333-M365 HydrophobicContact CG-CE 4.41Å; I336-M365 HydrophobicContact CD1-CE 3.93Å; I336-M365 HydrophobicContact CD1-CG 4.31Å; I336-M365 HydrophobicContact CD1-SD 3.75Å; I336-M365 HydrophobicContact CG2-CG 4.37Å; F337-M365 HydrophobicContact CE2-CB 3.86Å; F337-M365 HydrophobicContact CE2-CG 4.38Å; F337-M365 HydrophobicContact CZ-CB 4.32Å; V361-M365 HydrophobicContact CG1-CG 4.23Å; V361-M365 VanDerWaalsContact O-CG 3.23Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.41Å; V361-M365 VanDerWaalsContact O-N 3.14Å; L362-M365 WeakPolarHBondContact O-CB 3.36Å; L362-M365 PolarHBondContact O-N 3.23Å; L362-M365 VanDerWaalsContact O-N 3.08Å; V363-M365 PolarHBondContact O-N 2.95Å; M365-F368 HydrophobicContact CE-CB 4.31Å; M365-F368 HydrophobicContact CE-CD1 3.41Å; M365-F368 VanDerWaalsContact CE-CD1 3.41Å; M365-F368 HydrophobicContact CE-CE1 3.68Å; M365-F368 HydrophobicContact CE-CG 3.88Å; M365-F368 HydrophobicContact CE-CZ 4.36Å; M365-F368 WeakPolarHBondContact O-CB 3.48Å; M365-F368 PolarHBondContact O-N 2.85Å; M365-F368 HydrophobicContact SD-CB 4.24Å; M365-F368 HydrophobicContact SD-CD1 4.35Å; M365-F368 HydrophobicContact SD-CG 4.24Å; M365-L369 PolarHBondContact O-N 2.89Å
366D92.9Very high94.4Very high65 Ų6532.4 Ų32.435%0.34818%0.181SC..Hα-helixtrans-64.4-43.1169.5-71.4-33.7000111L362 V363 P364 F368 L369 L370 N403L362-D366 PolarHBondContact O-N 3.33Å; V363-D366 PolarHBondContact O-N 3.41Å; P364-D366 VanDerWaalsContact C-N 3.31Å; P364-D366 PolarHBondContact O-N 3.19Å; D366-F368 VanDerWaalsContact C-N 3.33Å; D366-L369 PolarHBondContact O-N 3.13Å; D366-L370 PolarHBondContact O-N 2.9Å; D366-L370 VanDerWaalsContact O-N 3.15Å; D366-N403 PolarHBondContact OD1-ND2 3.41Å
367A95.2Very high94.6Very high38 Ų3832.1 Ų32.131%0.31418%0.183SC..Hα-helixtrans-67.8-33.717500000112.3V312 P364 L370 Q371V312-A367 HydrophobicContact CG1-CB 4.15Å; V312-A367 HydrophobicContact CG2-CB 4.46Å; P364-A367 WeakPolarHBondContact O-CB 3.43Å; P364-A367 PolarHBondContact O-N 2.89Å; A367-L370 WeakPolarHBondContact O-CB 3.43Å; A367-L370 PolarHBondContact O-N 2.8Å; A367-Q371 WeakPolarHBondContact O-CG 3.28Å; A367-Q371 PolarHBondContact O-N 3.07Å
368F96.5Very high94.7Very high1 Ų132 Ų320%0.00418%0.182CC..Hα-helixtrans-59.3-49.6172.8171.2-94000111.1L311 V312 I315 F329 L332 Y333 P364 M365 D366 L370 Q371 L372L311-F368 HydrophobicContact CD2-CD2 4.06Å; L311-F368 HydrophobicContact CD2-CE2 3.64Å; L311-F368 HydrophobicContact CG-CD2 4.2Å; L311-F368 HydrophobicContact CG-CE2 4Å; V312-F368 HydrophobicContact CG2-CB 3.72Å; I315-F368 HydrophobicContact CD1-CD2 3.6Å; I315-F368 HydrophobicContact CD1-CE2 3.36Å; I315-F368 HydrophobicContact CD1-CZ 4.41Å; F329-F368 HydrophobicContact CB-CE1 4.32Å; F329-F368 HydrophobicContact CB-CZ 3.7Å; F329-F368 AromaticContact CD1-CE2 3.85Å; F329-F368 HydrophobicContact CD1-CE2 3.85Å; F329-F368 AromaticContact CD1-CZ 3.66Å; F329-F368 HydrophobicContact CD1-CZ 3.66Å; F329-F368 HydrophobicContact CE1-CE2 4.33Å; F329-F368 HydrophobicContact CG-CE2 4.41Å; F329-F368 AromaticContact CG-CZ 3.93Å; F329-F368 HydrophobicContact CG-CZ 3.93Å; L332-F368 HydrophobicContact CD2-CE2 4.35Å; L332-F368 HydrophobicContact CD2-CZ 4.17Å; Y333-F368 HydrophobicContact CD2-CD1 4.4Å; P364-F368 PolarHBondContact O-N 3.49Å; M365-F368 HydrophobicContact CE-CB 4.31Å; M365-F368 HydrophobicContact CE-CD1 3.41Å; M365-F368 VanDerWaalsContact CE-CD1 3.41Å; M365-F368 HydrophobicContact CE-CE1 3.68Å; M365-F368 HydrophobicContact CE-CG 3.88Å; M365-F368 HydrophobicContact CE-CZ 4.36Å; M365-F368 WeakPolarHBondContact O-CB 3.48Å; M365-F368 PolarHBondContact O-N 2.85Å; M365-F368 HydrophobicContact SD-CB 4.24Å; M365-F368 HydrophobicContact SD-CD1 4.35Å; M365-F368 HydrophobicContact SD-CG 4.24Å; D366-F368 VanDerWaalsContact C-N 3.33Å; F368-L370 VanDerWaalsContact C-N 3.29Å; F368-L370 PolarHBondContact O-N 3.45Å; F368-Q371 PolarHBondContact O-N 3.34Å; F368-L372 HydrophobicContact CD1-CD1 3.77Å; F368-L372 HydrophobicContact CE1-CD1 3.33Å; F368-L372 HydrophobicContact CE2-CD1 4.22Å; F368-L372 HydrophobicContact CG-CD1 4.4Å; F368-L372 HydrophobicContact CZ-CD1 3.6Å; F368-L372 WeakPolarHBondContact O-CG 3.32Å; F368-L372 PolarHBondContact O-N 3.14Å
369L96.1Very high94.9Very high0 Ų030.7 Ų30.70%017%0.173CC..Hα-helixtrans-59.7-42.1178-173.961.2000111.5Y333 M365 D366 Q371 L372 L373 F378 M400 N403 I404Y333-L369 HydrophobicContact CE2-CB 4.37Å; Y333-L369 HydrophobicContact CE2-CD2 4.24Å; M365-L369 PolarHBondContact O-N 2.89Å; D366-L369 PolarHBondContact O-N 3.13Å; L369-Q371 VanDerWaalsContact C-N 3.31Å; L369-Q371 PolarHBondContact O-N 3.08Å; L369-L372 PolarHBondContact O-N 3.36Å; L369-L373 WeakPolarHBondContact O-CG 3.21Å; L369-L373 PolarHBondContact O-N 2.96Å; L369-L373 VanDerWaalsContact O-N 3.12Å; L369-F378 HydrophobicContact CD1-CE1 3.83Å; L369-F378 HydrophobicContact CD1-CZ 3.97Å; L369-M400 HydrophobicContact CD1-CG 4.15Å; L369-M400 HydrophobicContact CD2-CG 4.4Å; L369-N403 HydrophobicContact CD2-CB 3.91Å; L369-I404 HydrophobicContact CD1-CD1 4.21Å; L369-I404 HydrophobicContact CD1-CG1 3.94Å; L369-I404 HydrophobicContact CD2-CG1 3.89Å; L369-I404 HydrophobicContact CG-CG1 4.16Å
370L95.3Very high95.1Very high61 Ų6130.3 Ų30.332%0.31916%0.164SC..Hα-helixtrans-57.8-40177.5-166.971.1000112.9D366 A367 F368 L372 L373 Q411D366-L370 PolarHBondContact O-N 2.9Å; D366-L370 VanDerWaalsContact O-N 3.15Å; A367-L370 WeakPolarHBondContact O-CB 3.43Å; A367-L370 PolarHBondContact O-N 2.8Å; F368-L370 VanDerWaalsContact C-N 3.29Å; F368-L370 PolarHBondContact O-N 3.45Å; L370-L372 PolarHBondContact O-N 3.32Å; L370-L373 HydrophobicContact CD1-CD1 4.16Å; L370-Q411 VanDerWaalsContact CD1-NE2 3.27Å
371Q95.4Very high95.1Very high54 Ų5431.9 Ų31.925%0.25217%0.173SC..Hα-helixtrans-68.8-23.4176.7-61.4-50.4-51.500112.9V312 I315 K316 A367 F368 L369V312-Q371 HydrophobicContact CG1-CG 3.92Å; I315-Q371 HydrophobicContact CG2-CB 3.87Å; K316-Q371 HydrophobicContact CB-CG 4.34Å; A367-Q371 WeakPolarHBondContact O-CG 3.28Å; A367-Q371 PolarHBondContact O-N 3.07Å; F368-Q371 PolarHBondContact O-N 3.34Å; L369-Q371 VanDerWaalsContact C-N 3.31Å; L369-Q371 PolarHBondContact O-N 3.08Å
372L96.5Very high95.2Very high0 Ų031.9 Ų31.90%017%0.173CC..Hα-helixtrans-90.4-21.8-177.4-62.5175.2000113.4I315 F329 F368 L369 L370 P374 L375 F378I315-L372 HydrophobicContact CD1-CD2 4.38Å; I315-L372 HydrophobicContact CG2-CD2 3.97Å; F329-L372 HydrophobicContact CB-CD1 3.83Å; F329-L372 HydrophobicContact CB-CD2 4.5Å; F329-L372 HydrophobicContact CD2-CD1 4.44Å; F329-L372 HydrophobicContact CD2-CD2 3.59Å; F329-L372 HydrophobicContact CE2-CD2 4Å; F329-L372 HydrophobicContact CG-CD1 4.24Å; F329-L372 HydrophobicContact CG-CD2 4.15Å; F368-L372 HydrophobicContact CD1-CD1 3.77Å; F368-L372 HydrophobicContact CE1-CD1 3.33Å; F368-L372 HydrophobicContact CE2-CD1 4.22Å; F368-L372 HydrophobicContact CG-CD1 4.4Å; F368-L372 HydrophobicContact CZ-CD1 3.6Å; F368-L372 WeakPolarHBondContact O-CG 3.32Å; F368-L372 PolarHBondContact O-N 3.14Å; L369-L372 PolarHBondContact O-N 3.36Å; L370-L372 PolarHBondContact O-N 3.32Å; L372-P374 VanDerWaalsContact C-CD 3.42Å; L372-P374 VanDerWaalsContact C-N 3.32Å; L372-L375 HydrophobicContact CD2-CD1 3.69Å; L372-L375 WeakPolarHBondContact O-CB 3.04Å; L372-L375 PolarHBondContact O-N 2.99Å; L372-F378 HydrophobicContact CB-CD1 3.64Å; L372-F378 HydrophobicContact CB-CD2 4.39Å; L372-F378 HydrophobicContact CB-CE1 3.79Å; L372-F378 HydrophobicContact CB-CG 3.96Å; L372-F378 HydrophobicContact CB-CZ 4.23Å; L372-F378 HydrophobicContact CD1-CD2 4.14Å; L372-F378 HydrophobicContact CD1-CE1 4.28Å; L372-F378 HydrophobicContact CD1-CE2 3.78Å; L372-F378 HydrophobicContact CD1-CZ 3.85Å
373L96Very high95.4Very high0 Ų030.4 Ų30.40%017%0.165CC..THydrogen-bonded Turntrans-51.9-40.5-178.6-65.3-177.2000114.4L369 L370 L375 I404 Q407 Q411 V415 W419L369-L373 WeakPolarHBondContact O-CG 3.21Å; L369-L373 PolarHBondContact O-N 2.96Å; L369-L373 VanDerWaalsContact O-N 3.12Å; L370-L373 HydrophobicContact CD1-CD1 4.16Å; L373-L375 PolarHBondContact O-N 3.38Å; L373-I404 HydrophobicContact CD2-CB 4.37Å; L373-I404 HydrophobicContact CD2-CG1 3.95Å; L373-I404 HydrophobicContact CD2-CG2 3.88Å; L373-Q407 HydrophobicContact CD1-CB 3.99Å; L373-Q411 HydrophobicContact CD1-CG 3.85Å; L373-V415 HydrophobicContact CB-CG1 3.95Å; L373-W419 HydrophobicContact CD2-CZ2 3.98Å; L373-W419 PolarHBondContact O-NE1 3.07Å
374P95.2Very high95.5Very high65 Ų6530.6 Ų30.642%0.42216%0.16SC..THydrogen-bonded Turntrans-73.7-9179.6-17.533.4000114.3L372 R376 V415L372-P374 VanDerWaalsContact C-CD 3.42Å; L372-P374 VanDerWaalsContact C-N 3.32Å; P374-R376 PolarHBondContact O-N 3.27Å; P374-V415 HydrophobicContact CB-CG2 4.09Å; P374-V415 HydrophobicContact CG-CG2 4.22Å
375L95.1Very high95.2Very high13 Ų1332.4 Ų32.47%0.06817%0.172CC..  trans-85.6108.2-175.5-56.1-178.8000110.5K319 T323 L372 L373 F378 A379K319-L375 HydrophobicContact CB-CD2 4.32Å; T323-L375 HydrophobicContact CG2-CD2 4.36Å; L372-L375 HydrophobicContact CD2-CD1 3.69Å; L372-L375 WeakPolarHBondContact O-CB 3.04Å; L372-L375 PolarHBondContact O-N 2.99Å; L373-L375 PolarHBondContact O-N 3.38Å; L375-F378 HydrophobicContact CB-CB 3.99Å; L375-F378 WeakPolarHBondContact O-CB 3.34Å; L375-F378 PolarHBondContact O-N 3.02Å; L375-A379 PolarHBondContact O-N 3.19Å; L375-A379 VanDerWaalsContact O-N 3.15Å
376R94.4Very high94.7Very high126 Ų12638 Ų3848%0.47520%0.202SC..Hα-helixtrans-50.8-47.5175173.3-178.4-72.1-132.51.9113.4P374 F378 A379 E380 L418 D428P374-R376 PolarHBondContact O-N 3.27Å; R376-F378 PolarHBondContact O-N 3.36Å; R376-F378 VanDerWaalsContact O-N 3.17Å; R376-A379 WeakPolarHBondContact O-CB 3.39Å; R376-A379 PolarHBondContact O-N 3.38Å; R376-A379 VanDerWaalsContact O-N 3.07Å; R376-E380 WeakPolarHBondContact CD-OE1 3.45Å; R376-E380 HydrophobicContact CG-CG 4.21Å; R376-E380 WeakPolarHBondContact CG-OE1 3.38Å; R376-E380 WeakPolarHBondContact O-CG 3.5Å; R376-E380 PolarHBondContact O-N 3.18Å; R376-L418 HydrophobicContact CB-CD1 3.97Å; R376-L418 HydrophobicContact CB-CD2 4.37Å; R376-L418 HydrophobicContact CG-CD1 3.95Å; R376-D428 IonicContact NH1-OD1 3.93Å
377P95.4Very high94.3Very high42 Ų4235.6 Ų35.627%0.27319%0.19SC..Hα-helixtrans-62.6-24.6179.3-26.838.7000114V381P377-V381 WeakPolarHBondContact O-CG2 3.44Å; P377-V381 PolarHBondContact O-N 3.05Å
378F96.5Very high93.7Very high0 Ų045.3 Ų45.30%022%0.218CC..Hα-helixtrans-74.5-44.7173-176.7-106.5000111.4S326 F329 H330 L369 L372 L375 R376 E380 V381 V382 M400 W419S326-F378 PolarHBondContact OG-N 3.36Å; F329-F378 HydrophobicContact CB-CD2 4.45Å; F329-F378 HydrophobicContact CB-CE2 4.28Å; H330-F378 HydrophobicContact CB-CE2 4.12Å; L369-F378 HydrophobicContact CD1-CE1 3.83Å; L369-F378 HydrophobicContact CD1-CZ 3.97Å; L372-F378 HydrophobicContact CB-CD1 3.64Å; L372-F378 HydrophobicContact CB-CD2 4.39Å; L372-F378 HydrophobicContact CB-CE1 3.79Å; L372-F378 HydrophobicContact CB-CG 3.96Å; L372-F378 HydrophobicContact CB-CZ 4.23Å; L372-F378 HydrophobicContact CD1-CD2 4.14Å; L372-F378 HydrophobicContact CD1-CE1 4.28Å; L372-F378 HydrophobicContact CD1-CE2 3.78Å; L372-F378 HydrophobicContact CD1-CZ 3.85Å; L375-F378 HydrophobicContact CB-CB 3.99Å; L375-F378 WeakPolarHBondContact O-CB 3.34Å; L375-F378 PolarHBondContact O-N 3.02Å; R376-F378 PolarHBondContact O-N 3.36Å; R376-F378 VanDerWaalsContact O-N 3.17Å; F378-E380 VanDerWaalsContact C-N 3.27Å; F378-E380 PolarHBondContact O-N 2.85Å; F378-V381 PolarHBondContact O-N 3.37Å; F378-V382 HydrophobicContact CD1-CG2 4.25Å; F378-V382 HydrophobicContact CD2-CG2 4.27Å; F378-V382 HydrophobicContact CE1-CG2 3.88Å; F378-V382 HydrophobicContact CE2-CG2 3.9Å; F378-V382 HydrophobicContact CG-CG2 4.44Å; F378-V382 HydrophobicContact CZ-CG2 3.7Å; F378-V382 WeakPolarHBondContact O-CB 3.2Å; F378-V382 VanDerWaalsContact O-CG2 3.29Å; F378-V382 WeakPolarHBondContact O-CG2 3.23Å; F378-V382 PolarHBondContact O-N 3.38Å; F378-M400 HydrophobicContact CZ-SD 4.34Å; F378-W419 HydrophobicContact CD1-CH2 4.04Å; F378-W419 AromaticContact CD1-CZ2 3.93Å; F378-W419 HydrophobicContact CD1-CZ2 3.93Å; F378-W419 HydrophobicContact CE1-CH2 4.11Å; F378-W419 HydrophobicContact CE1-CZ2 4.27Å
379A96.2Very high93.3Very high0 Ų047 Ų470%023%0.227CC..Hα-helixtrans-59.2-39.3172.500000112L375 R376 V382 L383 L418 W419 R431L375-A379 PolarHBondContact O-N 3.19Å; L375-A379 VanDerWaalsContact O-N 3.15Å; R376-A379 WeakPolarHBondContact O-CB 3.39Å; R376-A379 PolarHBondContact O-N 3.38Å; R376-A379 VanDerWaalsContact O-N 3.07Å; A379-V382 PolarHBondContact O-N 3.08Å; A379-L383 VanDerWaalsContact O-CB 3.27Å; A379-L383 WeakPolarHBondContact O-CB 3.46Å; A379-L383 PolarHBondContact O-N 3.32Å; A379-L418 HydrophobicContact CB-CD1 4.02Å; A379-L418 HydrophobicContact CB-CD2 3.94Å; A379-L418 HydrophobicContact CB-CG 3.83Å; A379-W419 HydrophobicContact CB-CD2 4.23Å; A379-W419 HydrophobicContact CB-CE3 4.49Å; A379-W419 HydrophobicContact CB-CH2 4.03Å; A379-W419 HydrophobicContact CB-CZ2 3.76Å; A379-W419 HydrophobicContact CB-CZ3 4.38Å; A379-R431 WeakPolarHBondContact O-CD 3.47Å
380E95.3Very high92.9Very high36 Ų3649.6 Ų49.617%0.16825%0.246CC..Hα-helixtrans-60.7-47.4176.2-71.8170.5172.800112.3R376 F378 E384 T429R376-E380 WeakPolarHBondContact CD-OE1 3.45Å; R376-E380 HydrophobicContact CG-CG 4.21Å; R376-E380 WeakPolarHBondContact CG-OE1 3.38Å; R376-E380 WeakPolarHBondContact O-CG 3.5Å; R376-E380 PolarHBondContact O-N 3.18Å; F378-E380 VanDerWaalsContact C-N 3.27Å; F378-E380 PolarHBondContact O-N 2.85Å; E380-E384 PolarHBondContact O-N 3.35Å; E380-E384 VanDerWaalsContact O-N 3.16Å; E380-T429 HydrophobicContact CB-CG2 4.12Å; E380-T429 HydrophobicContact CG-CG2 4.03Å; E380-T429 PolarHBondContact OE1-OG1 2.95Å
381V95.6Very high92.4Very high35 Ų3549.8 Ų49.821%0.21225%0.252CS..Hα-helixtrans-64.3-43.2176.51700000111.7H330 P377 F378H330-V381 HydrophobicContact CB-CG1 3.83Å; H330-V381 WeakPolarHBondContact ND1-CG1 3.35Å; P377-V381 WeakPolarHBondContact O-CG2 3.44Å; P377-V381 PolarHBondContact O-N 3.05Å; F378-V381 PolarHBondContact O-N 3.37Å
382V96.8Very high92.1Very high1 Ų151.1 Ų51.11%0.00626%0.258CS..Hα-helixtrans-72.7-35.5-174.6170.50000112.3F378 A379 H397 M400 L401 I404 W419F378-V382 HydrophobicContact CD1-CG2 4.25Å; F378-V382 HydrophobicContact CD2-CG2 4.27Å; F378-V382 HydrophobicContact CE1-CG2 3.88Å; F378-V382 HydrophobicContact CE2-CG2 3.9Å; F378-V382 HydrophobicContact CG-CG2 4.44Å; F378-V382 HydrophobicContact CZ-CG2 3.7Å; F378-V382 WeakPolarHBondContact O-CB 3.2Å; F378-V382 VanDerWaalsContact O-CG2 3.29Å; F378-V382 WeakPolarHBondContact O-CG2 3.23Å; F378-V382 PolarHBondContact O-N 3.38Å; A379-V382 PolarHBondContact O-N 3.08Å; V382-H397 PolarHBondContact O-CE1 3.05Å; V382-H397 VanDerWaalsContact O-CE1 3.23Å; V382-M400 HydrophobicContact CB-CE 4.19Å; V382-M400 HydrophobicContact CG1-CE 3.49Å; V382-M400 VanDerWaalsContact CG1-CE 3.49Å; V382-M400 HydrophobicContact CG2-CE 3.64Å; V382-M400 HydrophobicContact CG2-SD 4.47Å; V382-L401 HydrophobicContact CG1-CD2 3.59Å; V382-I404 HydrophobicContact CG1-CD1 4.09Å; V382-W419 HydrophobicContact CB-CH2 3.98Å; V382-W419 HydrophobicContact CB-CZ3 4.09Å; V382-W419 HydrophobicContact CG1-CH2 3.99Å; V382-W419 HydrophobicContact CG1-CZ3 3.75Å; V382-W419 HydrophobicContact CG2-CH2 4.32Å
383L96.8Very high92Very high1 Ų153 Ų531%0.00527%0.267CS..THydrogen-bonded Turntrans-105.818.4-174.6-64170.8000112.5A379 L401 W419 R431 L432 L434 A437A379-L383 VanDerWaalsContact O-CB 3.27Å; A379-L383 WeakPolarHBondContact O-CB 3.46Å; A379-L383 PolarHBondContact O-N 3.32Å; L383-L401 HydrophobicContact CD2-CD2 3.95Å; L383-W419 HydrophobicContact CD1-CD2 4.31Å; L383-W419 HydrophobicContact CD1-CE3 3.47Å; L383-W419 VanDerWaalsContact CD1-CE3 3.47Å; L383-W419 HydrophobicContact CD1-CZ3 3.81Å; L383-W419 HydrophobicContact CD2-CE3 4.41Å; L383-W419 HydrophobicContact CD2-CZ3 4.36Å; L383-W419 HydrophobicContact CG-CE3 3.99Å; L383-W419 HydrophobicContact CG-CZ3 3.84Å; L383-R431 HydrophobicContact CB-CG 3.39Å; L383-R431 HydrophobicContact CD1-CG 3.95Å; L383-R431 HydrophobicContact CG-CG 4.33Å; L383-L432 WeakPolarHBondContact CD1-O 3.5Å; L383-L432 PolarHBondContact O-N 3.46Å; L383-L434 HydrophobicContact CD2-CD1 4.07Å; L383-A437 HydrophobicContact CD2-CB 3.42Å; L383-A437 VanDerWaalsContact CD2-CB 3.42Å
384E94.7Very high91.9Very high97 Ų9753.9 Ų53.945%0.45327%0.271SS..  trans-58.4137.7174.3176.3178.4-154.100110.2E380 D386 V387E380-E384 PolarHBondContact O-N 3.35Å; E380-E384 VanDerWaalsContact O-N 3.16Å; E384-D386 PolarHBondContact O-N 2.94Å; E384-V387 HydrophobicContact CB-CG2 3.67Å; E384-V387 HydrophobicContact CG-CG2 4.39Å; E384-V387 VanDerWaalsContact O-CG2 3.28Å; E384-V387 WeakPolarHBondContact O-CG2 3.28Å
385P88.4Confident91.9Very high45 Ų4550.9 Ų50.929%0.29225%0.251SS..THydrogen-bonded Turntrans-61-40.8-178.6-26.434.4000114.2P430 L432P385-P430 HydrophobicContact CG-CB 4.14Å; P385-L432 HydrophobicContact CB-CD1 4.41Å; P385-L432 HydrophobicContact CB-CD2 4.17Å; P385-L432 HydrophobicContact CB-CG 4.24Å; P385-L432 HydrophobicContact CG-CD2 4.02Å; P385-L432 HydrophobicContact CG-CG 4.05Å
386D84Confident92Very high119 Ų11950.4 Ų50.464%0.63625%0.249SC*.THydrogen-bonded Turntrans-109.941.2-174.3-68.6-47000112.3E384 W388E384-D386 PolarHBondContact O-N 2.94Å; D386-W388 PolarHBondContact O-N 3.22Å
387V84.4Confident92.1Very high13 Ų1344.7 Ų44.78%0.07923%0.228CC..  trans-55.5117176.9-177.10000109.5E384 L389 R444E384-V387 HydrophobicContact CB-CG2 3.67Å; E384-V387 HydrophobicContact CG-CG2 4.39Å; E384-V387 VanDerWaalsContact O-CG2 3.28Å; E384-V387 WeakPolarHBondContact O-CG2 3.28Å; V387-L389 HydrophobicContact CB-CG 4.46Å; V387-L389 HydrophobicContact CG1-CD1 4.26Å; V387-L389 HydrophobicContact CG1-CD2 3.52Å; V387-L389 HydrophobicContact CG1-CG 3.63Å; V387-L389 PolarHBondContact O-N 2.81Å; V387-R444 PolarHBondContact O-NH1 2.8Å
388W82.6Confident92.2Very high242 Ų24242.7 Ų42.792%0.91722%0.215SC*.  trans-79.6102174.1-72.885.7000109.9D386D386-W388 PolarHBondContact O-N 3.22Å
389L88.4Confident92.1Very high36 Ų3644.1 Ų44.119%0.18822%0.222CC..  trans-108.7140.2176.9-61175.2000110.6L334 V387 H393 E394 H397L334-L389 HydrophobicContact CD1-CD2 3.78Å; V387-L389 HydrophobicContact CB-CG 4.46Å; V387-L389 HydrophobicContact CG1-CD1 4.26Å; V387-L389 HydrophobicContact CG1-CD2 3.52Å; V387-L389 HydrophobicContact CG1-CG 3.63Å; V387-L389 PolarHBondContact O-N 2.81Å; L389-H393 HydrophobicContact CD2-CB 4.38Å; L389-E394 HydrophobicContact CB-CG 4.22Å; L389-H397 HydrophobicContact CD1-CB 3.65Å
390S88.6Confident92.2Very high56 Ų5644.1 Ų44.139%0.39222%0.222SC..  trans-71.2157.4162.566.30000109.6E392 H393 E394S390-E392 PolarHBondContact O-N 3.36Å; S390-H393 PolarHBondContact O-N 2.96Å; S390-H393 PolarHBondContact OG-ND1 3.38Å; S390-E394 PolarHBondContact O-N 3.09Å
391S85Confident92.3Very high64 Ų6442.4 Ų42.445%0.44821%0.214SC..THydrogen-bonded Turntrans-57-26.7-179.960.10000113.6H393S391-H393 VanDerWaalsContact C-N 3.3Å
392E89.1Confident92.3Very high82 Ų8241.1 Ų41.138%0.38321%0.207SC..THydrogen-bonded Turntrans-77-19.3-179.3-42.8-161.6144.400112.7C345 S390 P396C345-E392 HydrophobicContact CB-CB 4.28Å; C345-E392 HydrophobicContact CB-CG 4.43Å; C345-E392 WeakPolarHBondContact SG-CG 3.2Å; S390-E392 PolarHBondContact O-N 3.36Å; E392-P396 WeakPolarHBondContact O-CD 3.43Å; E392-P396 WeakPolarHBondContact O-CG 3.42Å
393H94.1Very high92.2Very high41 Ų4142.9 Ų42.919%0.1922%0.216CC..THydrogen-bonded Turntrans-103.3-8.3-175.8-62.8152000113.6L334 L389 S390 S391 H397L334-H393 HydrophobicContact CB-CB 4.23Å; L334-H393 HydrophobicContact CD1-CB 4.06Å; L389-H393 HydrophobicContact CD2-CB 4.38Å; S390-H393 PolarHBondContact O-N 2.96Å; S390-H393 PolarHBondContact OG-ND1 3.38Å; S391-H393 VanDerWaalsContact C-N 3.3Å; H393-H397 WeakPolarHBondContact O-CB 3.33Å; H393-H397 PolarHBondContact O-N 3.47Å
394E93.8Very high92.2Very high17 Ų1742.9 Ų42.98%0.07922%0.216CC..Hα-helixtrans-61.4-50.5-179.8-68.8178.6155.100112.5L389 S390 H397 F398 R444 K821L389-E394 HydrophobicContact CB-CG 4.22Å; S390-E394 PolarHBondContact O-N 3.09Å; E394-H397 PolarHBondContact O-N 3.25Å; E394-F398 WeakPolarHBondContact O-CB 3.46Å; E394-F398 PolarHBondContact O-N 3.38Å; E394-R444 HydrophobicContact CG-CB 4.49Å; E394-R444 VanDerWaalsContact OE2-O 3.14Å; E394-K821 IonicContact OE1-NZ 2.85Å; E394-K821 PolarHBondContact OE1-NZ 2.7Å; E394-K821 IonicContact OE2-NZ 3.4Å; E394-K821 PolarHBondContact OE2-NZ 2.99Å
395L95Very high92.3Very high2 Ų238.3 Ų38.31%0.0120%0.195CC..Hα-helixtrans-67.6-46.4177177.268.2000112.5P342 H397 F398 L399 E448 V453 L470P342-L395 HydrophobicContact CG-CD2 4.4Å; L395-H397 VanDerWaalsContact C-N 3.25Å; L395-H397 PolarHBondContact O-N 3.15Å; L395-F398 HydrophobicContact CD1-CD1 4.16Å; L395-F398 WeakPolarHBondContact O-CB 3.26Å; L395-F398 PolarHBondContact O-N 3.35Å; L395-L399 HydrophobicContact CD1-CD1 4.17Å; L395-L399 HydrophobicContact CD1-CD2 4.34Å; L395-L399 HydrophobicContact CD1-CG 3.97Å; L395-L399 HydrophobicContact CG-CD1 4.05Å; L395-L399 HydrophobicContact CG-CG 4.26Å; L395-L399 WeakPolarHBondContact O-CG 3.41Å; L395-L399 PolarHBondContact O-N 3.33Å; L395-E448 HydrophobicContact CB-CG 3.94Å; L395-E448 HydrophobicContact CD1-CG 4.34Å; L395-E448 HydrophobicContact CD2-CG 3.76Å; L395-E448 HydrophobicContact CG-CG 4.21Å; L395-V453 HydrophobicContact CD2-CG2 4.43Å; L395-L470 HydrophobicContact CD1-CD1 4.07Å; L395-L470 HydrophobicContact CD1-CD2 4.38Å
396P96.1Very high92.5Very high3 Ų338.1 Ų38.12%0.01920%0.201CC..Hα-helixtrans-53-41.3171.9-31.737000113.7L334 F337 E392 L399 M400L334-P396 HydrophobicContact CD2-CB 3.85Å; F337-P396 HydrophobicContact CB-CB 3.93Å; F337-P396 HydrophobicContact CB-CG 4.45Å; E392-P396 WeakPolarHBondContact O-CD 3.43Å; E392-P396 WeakPolarHBondContact O-CG 3.42Å; P396-L399 PolarHBondContact O-N 3.43Å; P396-M400 WeakPolarHBondContact O-CB 3.23Å; P396-M400 PolarHBondContact O-N 3.02Å
397H97.2Very high93Very high7 Ų733.8 Ų33.83%0.03218%0.176CC..Hα-helixtrans-67.7-43.9177.2-179.669.8000111.7H330 L334 V382 L389 H393 E394 L395 L399 M400 L401H330-H397 AromaticContact NE2-CE1 3.84Å; H330-H397 AromaticContact NE2-ND1 3.25Å; H330-H397 PolarHBondContact NE2-ND1 3.06Å; L334-H397 VanDerWaalsContact CD2-CA 3.4Å; L334-H397 HydrophobicContact CD2-CB 3.6Å; L334-H397 VanDerWaalsContact CD2-N 3.27Å; V382-H397 PolarHBondContact O-CE1 3.05Å; V382-H397 VanDerWaalsContact O-CE1 3.23Å; L389-H397 HydrophobicContact CD1-CB 3.65Å; H393-H397 WeakPolarHBondContact O-CB 3.33Å; H393-H397 PolarHBondContact O-N 3.47Å; E394-H397 PolarHBondContact O-N 3.25Å; L395-H397 VanDerWaalsContact C-N 3.25Å; L395-H397 PolarHBondContact O-N 3.15Å; H397-L399 PolarHBondContact O-N 2.95Å; H397-M400 WeakPolarHBondContact ND1-CE 3.41Å; H397-M400 WeakPolarHBondContact O-CB 3.42Å; H397-M400 PolarHBondContact O-N 3.39Å; H397-L401 WeakPolarHBondContact O-CG 3.17Å; H397-L401 PolarHBondContact O-N 3.48Å
398F96.9Very high93.4Very high0 Ų033.1 Ų33.10%017%0.173CC..Hα-helixtrans-55.5-52.2173.5176.8-109.1000111.3E394 L395 M400 L401 V402 I438 S441 F442 L470 I474E394-F398 WeakPolarHBondContact O-CB 3.46Å; E394-F398 PolarHBondContact O-N 3.38Å; L395-F398 HydrophobicContact CD1-CD1 4.16Å; L395-F398 WeakPolarHBondContact O-CB 3.26Å; L395-F398 PolarHBondContact O-N 3.35Å; F398-M400 VanDerWaalsContact C-N 3.27Å; F398-M400 PolarHBondContact O-N 3.23Å; F398-L401 WeakPolarHBondContact O-CB 3.21Å; F398-L401 PolarHBondContact O-N 3.46Å; F398-L401 VanDerWaalsContact O-N 3.08Å; F398-V402 HydrophobicContact CD1-CG2 4.38Å; F398-V402 HydrophobicContact CE1-CG2 3.99Å; F398-V402 HydrophobicContact CE2-CG2 4.24Å; F398-V402 HydrophobicContact CZ-CG2 3.94Å; F398-V402 WeakPolarHBondContact O-CG2 3.37Å; F398-V402 PolarHBondContact O-N 3.22Å; F398-I438 HydrophobicContact CE2-CG2 4.11Å; F398-S441 WeakPolarHBondContact CA-OG 3.38Å; F398-S441 WeakPolarHBondContact CB-OG 3.45Å; F398-S441 PolarHBondContact N-OG 3.18Å; F398-F442 HydrophobicContact CD2-CB 4.3Å; F398-F442 HydrophobicContact CE1-CD2 4.5Å; F398-F442 HydrophobicContact CE2-CB 3.71Å; F398-F442 HydrophobicContact CE2-CD2 4.11Å; F398-F442 HydrophobicContact CE2-CG 4.4Å; F398-F442 HydrophobicContact CZ-CB 4.29Å; F398-F442 AromaticContact CZ-CD2 3.82Å; F398-F442 HydrophobicContact CZ-CD2 3.82Å; F398-L470 HydrophobicContact CD1-CD1 4.04Å; F398-L470 HydrophobicContact CE1-CD1 3.58Å; F398-L470 HydrophobicContact CE1-CG 4.19Å; F398-I474 HydrophobicContact CE1-CB 4.45Å; F398-I474 HydrophobicContact CE2-CD1 4.31Å; F398-I474 HydrophobicContact CE2-CG1 4.26Å; F398-I474 HydrophobicContact CZ-CB 3.77Å; F398-I474 HydrophobicContact CZ-CD1 3.88Å; F398-I474 HydrophobicContact CZ-CG1 3.69Å; F398-I474 HydrophobicContact CZ-CG2 4.24Å
399L96Very high93.4Very high30 Ų3025.2 Ų25.216%0.15715%0.148CC..Hα-helixtrans-63.2-32.5-179.9-65.9178.6000112.4P342 L395 P396 H397 V402 N403 L455P342-L399 HydrophobicContact CG-CD1 4.43Å; L395-L399 HydrophobicContact CD1-CD1 4.17Å; L395-L399 HydrophobicContact CD1-CD2 4.34Å; L395-L399 HydrophobicContact CD1-CG 3.97Å; L395-L399 HydrophobicContact CG-CD1 4.05Å; L395-L399 HydrophobicContact CG-CG 4.26Å; L395-L399 WeakPolarHBondContact O-CG 3.41Å; L395-L399 PolarHBondContact O-N 3.33Å; P396-L399 PolarHBondContact O-N 3.43Å; H397-L399 PolarHBondContact O-N 2.95Å; L399-V402 PolarHBondContact O-N 3.24Å; L399-N403 WeakPolarHBondContact O-CB 3.46Å; L399-N403 PolarHBondContact O-N 3.23Å; L399-L455 HydrophobicContact CD2-CD1 4.01Å; L399-L455 HydrophobicContact CD2-CD2 4.16Å
400M97.4Very high93.3Very high0 Ų027.7 Ų27.70%017%0.168CC..Hα-helixtrans-61.4-47.4171.1-170-177.962.700111.3Y333 L369 F378 V382 P396 H397 F398 V402 N403 I404Y333-M400 HydrophobicContact CD1-CB 4.01Å; Y333-M400 HydrophobicContact CD1-CG 3.9Å; Y333-M400 HydrophobicContact CD1-SD 3.76Å; Y333-M400 HydrophobicContact CE1-CB 3.48Å; Y333-M400 VanDerWaalsContact CE1-CB 3.48Å; Y333-M400 HydrophobicContact CE1-CG 3.62Å; Y333-M400 HydrophobicContact CE1-SD 4.14Å; Y333-M400 HydrophobicContact CE2-CG 4.34Å; Y333-M400 HydrophobicContact CG-CG 4.4Å; Y333-M400 HydrophobicContact CG-SD 3.99Å; L369-M400 HydrophobicContact CD1-CG 4.15Å; L369-M400 HydrophobicContact CD2-CG 4.4Å; F378-M400 HydrophobicContact CZ-SD 4.34Å; V382-M400 HydrophobicContact CB-CE 4.19Å; V382-M400 HydrophobicContact CG1-CE 3.49Å; V382-M400 VanDerWaalsContact CG1-CE 3.49Å; V382-M400 HydrophobicContact CG2-CE 3.64Å; V382-M400 HydrophobicContact CG2-SD 4.47Å; P396-M400 WeakPolarHBondContact O-CB 3.23Å; P396-M400 PolarHBondContact O-N 3.02Å; H397-M400 WeakPolarHBondContact ND1-CE 3.41Å; H397-M400 WeakPolarHBondContact O-CB 3.42Å; H397-M400 PolarHBondContact O-N 3.39Å; F398-M400 VanDerWaalsContact C-N 3.27Å; F398-M400 PolarHBondContact O-N 3.23Å; M400-V402 VanDerWaalsContact C-N 3.28Å; M400-V402 PolarHBondContact O-N 2.86Å; M400-N403 WeakPolarHBondContact O-CB 3.42Å; M400-N403 PolarHBondContact O-N 3.5Å; M400-N403 VanDerWaalsContact O-N 3.13Å; M400-I404 HydrophobicContact CG-CD1 4.03Å; M400-I404 VanDerWaalsContact O-CG1 3.26Å; M400-I404 WeakPolarHBondContact O-CG1 3.21Å; M400-I404 PolarHBondContact O-N 3.18Å
401L97.8Very high93.6Very high0 Ų026.7 Ų26.70%016%0.157CC..Hα-helixtrans-60.7-38177-64.5171.8000112V382 L383 H397 F398 I404 L405 L434 A437 I438V382-L401 HydrophobicContact CG1-CD2 3.59Å; L383-L401 HydrophobicContact CD2-CD2 3.95Å; H397-L401 WeakPolarHBondContact O-CG 3.17Å; H397-L401 PolarHBondContact O-N 3.48Å; F398-L401 WeakPolarHBondContact O-CB 3.21Å; F398-L401 PolarHBondContact O-N 3.46Å; F398-L401 VanDerWaalsContact O-N 3.08Å; L401-I404 PolarHBondContact O-N 3.19Å; L401-L405 WeakPolarHBondContact O-CB 3.19Å; L401-L405 PolarHBondContact O-N 3.49Å; L401-L434 HydrophobicContact CB-CD1 4.33Å; L401-L434 HydrophobicContact CD2-CD1 3.85Å; L401-A437 HydrophobicContact CD1-CB 4.17Å; L401-A437 HydrophobicContact CD2-CB 4.49Å; L401-I438 HydrophobicContact CB-CG1 3.8Å; L401-I438 HydrophobicContact CD1-CG1 4.45Å
402V95.8Very high94.1Very high8 Ų827 Ų275%0.04816%0.158CC..Hα-helixtrans-66.1-41174.2-176.10000111.7F398 L399 M400 L405 G406 I474 Q477F398-V402 HydrophobicContact CD1-CG2 4.38Å; F398-V402 HydrophobicContact CE1-CG2 3.99Å; F398-V402 HydrophobicContact CE2-CG2 4.24Å; F398-V402 HydrophobicContact CZ-CG2 3.94Å; F398-V402 WeakPolarHBondContact O-CG2 3.37Å; F398-V402 PolarHBondContact O-N 3.22Å; L399-V402 PolarHBondContact O-N 3.24Å; M400-V402 VanDerWaalsContact C-N 3.28Å; M400-V402 PolarHBondContact O-N 2.86Å; V402-L405 WeakPolarHBondContact O-CB 3.48Å; V402-L405 PolarHBondContact O-N 2.87Å; V402-G406 PolarHBondContact O-N 2.91Å; V402-G406 VanDerWaalsContact O-N 3.09Å; V402-I474 HydrophobicContact CG1-CD1 4.34Å; V402-I474 HydrophobicContact CG2-CD1 3.52Å; V402-Q477 HydrophobicContact CG1-CB 4.07Å; V402-Q477 HydrophobicContact CG1-CG 3.86Å
403N94.8Very high94.3Very high38 Ų3829.6 Ų29.620%0.20317%0.17CC..Hα-helixtrans-64.3-45176.5-163.22.1000110.9Y333 D366 L369 L399 M400 L405 G406 Q407Y333-N403 PolarHBondContact OH-ND2 3.06Å; D366-N403 PolarHBondContact OD1-ND2 3.41Å; L369-N403 HydrophobicContact CD2-CB 3.91Å; L399-N403 WeakPolarHBondContact O-CB 3.46Å; L399-N403 PolarHBondContact O-N 3.23Å; M400-N403 WeakPolarHBondContact O-CB 3.42Å; M400-N403 PolarHBondContact O-N 3.5Å; M400-N403 VanDerWaalsContact O-N 3.13Å; N403-L405 VanDerWaalsContact C-N 3.33Å; N403-L405 PolarHBondContact O-N 3.3Å; N403-G406 PolarHBondContact O-N 3.48Å; N403-G406 VanDerWaalsContact O-N 3.15Å; N403-Q407 WeakPolarHBondContact O-CG 3.37Å; N403-Q407 PolarHBondContact O-N 3.26Å; N403-Q407 PolarHBondContact OD1-NE2 2.92Å
404I96.9Very high94.3Very high0 Ų035 Ų350%020%0.195CC..Hα-helixtrans-55.4-49.3173.4-67164.7000110.1L369 L373 V382 M400 L401 G406 Q407 L408 W419 L434L369-I404 HydrophobicContact CD1-CD1 4.21Å; L369-I404 HydrophobicContact CD1-CG1 3.94Å; L369-I404 HydrophobicContact CD2-CG1 3.89Å; L369-I404 HydrophobicContact CG-CG1 4.16Å; L373-I404 HydrophobicContact CD2-CB 4.37Å; L373-I404 HydrophobicContact CD2-CG1 3.95Å; L373-I404 HydrophobicContact CD2-CG2 3.88Å; V382-I404 HydrophobicContact CG1-CD1 4.09Å; M400-I404 HydrophobicContact CG-CD1 4.03Å; M400-I404 VanDerWaalsContact O-CG1 3.26Å; M400-I404 WeakPolarHBondContact O-CG1 3.21Å; M400-I404 PolarHBondContact O-N 3.18Å; L401-I404 PolarHBondContact O-N 3.19Å; I404-G406 VanDerWaalsContact C-N 3.27Å; I404-G406 PolarHBondContact O-N 3.05Å; I404-Q407 PolarHBondContact O-N 3.47Å; I404-L408 HydrophobicContact CG2-CD1 3.79Å; I404-L408 HydrophobicContact CG2-CG 3.94Å; I404-L408 VanDerWaalsContact O-CG 3.27Å; I404-L408 WeakPolarHBondContact O-CG 3.33Å; I404-L408 PolarHBondContact O-N 3.41Å; I404-W419 HydrophobicContact CD1-CE3 4.41Å; I404-W419 HydrophobicContact CD1-CH2 3.64Å; I404-W419 HydrophobicContact CD1-CZ2 4.45Å; I404-W419 HydrophobicContact CD1-CZ3 3.62Å; I404-W419 HydrophobicContact CG2-CD2 3.94Å; I404-W419 HydrophobicContact CG2-CE3 3.75Å; I404-W419 HydrophobicContact CG2-CH2 4.48Å; I404-W419 HydrophobicContact CG2-CZ3 4.07Å; I404-L434 HydrophobicContact CG2-CD1 4.47Å; I404-L434 HydrophobicContact CG2-CD2 4.15Å
405L95.9Very high94.4Very high2 Ų234.6 Ų34.61%0.0119%0.194CC..Hα-helixtrans-54.8-43.1178-173.373000112.3L401 V402 N403 Y420 L434 F435 I438 L478 S481L401-L405 WeakPolarHBondContact O-CB 3.19Å; L401-L405 PolarHBondContact O-N 3.49Å; V402-L405 WeakPolarHBondContact O-CB 3.48Å; V402-L405 PolarHBondContact O-N 2.87Å; N403-L405 VanDerWaalsContact C-N 3.33Å; N403-L405 PolarHBondContact O-N 3.3Å; L405-Y420 HydrophobicContact CD1-CE1 4.21Å; L405-L434 HydrophobicContact CB-CD2 4.26Å; L405-L434 HydrophobicContact CD1-CD2 3.8Å; L405-L434 HydrophobicContact CD1-CG 4.48Å; L405-F435 HydrophobicContact CD1-CD1 4.43Å; L405-F435 HydrophobicContact CD1-CE1 3.79Å; L405-F435 HydrophobicContact CD1-CZ 4.21Å; L405-I438 HydrophobicContact CB-CD1 4.2Å; L405-I438 HydrophobicContact CD1-CD1 4.27Å; L405-I438 HydrophobicContact CD2-CD1 3.99Å; L405-I438 HydrophobicContact CG-CD1 4.39Å; L405-L478 HydrophobicContact CD2-CD2 3.88Å; L405-L478 HydrophobicContact CD2-CG 4.5Å; L405-S481 WeakPolarHBondContact CD1-OG 3.19Å
406G92.7Very high94.5Very high41 Ų4135.8 Ų35.842%0.42320%0.2SC..Hα-helixtrans-68.6-33.4177.700000113.7V402 N403 I404V402-G406 PolarHBondContact O-N 2.91Å; V402-G406 VanDerWaalsContact O-N 3.09Å; N403-G406 PolarHBondContact O-N 3.48Å; N403-G406 VanDerWaalsContact O-N 3.15Å; I404-G406 VanDerWaalsContact C-N 3.27Å; I404-G406 PolarHBondContact O-N 3.05Å
407Q93.7Very high94.4Very high27 Ų2739.9 Ų39.913%0.12622%0.219CC..Hα-helixtrans-82.2-31-178.2-67.7-17720.600113.3L373 N403 I404 L409 S410L373-Q407 HydrophobicContact CD1-CB 3.99Å; N403-Q407 WeakPolarHBondContact O-CG 3.37Å; N403-Q407 PolarHBondContact O-N 3.26Å; N403-Q407 PolarHBondContact OD1-NE2 2.92Å; I404-Q407 PolarHBondContact O-N 3.47Å; Q407-L409 PolarHBondContact O-N 3.32Å; Q407-L409 VanDerWaalsContact O-N 3.16Å; Q407-S410 PolarHBondContact O-N 2.81Å; Q407-S410 VanDerWaalsContact O-N 3.1Å; Q407-S410 PolarHBondContact O-OG 3.15Å
408L93.1Very high94.3Very high0 Ų040.4 Ų40.40%022%0.222CC..Hα-helixtrans-58.4-31-174.2-81.8172.8000114.6I404 S410 Q411 V415 W419 Y420 L434I404-L408 HydrophobicContact CG2-CD1 3.79Å; I404-L408 HydrophobicContact CG2-CG 3.94Å; I404-L408 VanDerWaalsContact O-CG 3.27Å; I404-L408 WeakPolarHBondContact O-CG 3.33Å; I404-L408 PolarHBondContact O-N 3.41Å; L408-S410 PolarHBondContact O-N 3.38Å; L408-S410 VanDerWaalsContact O-N 3.12Å; L408-Q411 WeakPolarHBondContact O-CB 3.39Å; L408-Q411 PolarHBondContact O-N 2.99Å; L408-V415 HydrophobicContact CD2-CG1 4.08Å; L408-W419 HydrophobicContact CD1-CB 3.61Å; L408-W419 HydrophobicContact CD1-CG 4.08Å; L408-W419 HydrophobicContact CD2-CB 3.94Å; L408-W419 HydrophobicContact CD2-CG 3.81Å; L408-W419 HydrophobicContact CG-CB 4.44Å; L408-Y420 HydrophobicContact CD1-CE2 4.46Å; L408-L434 HydrophobicContact CD1-CD2 3.31Å
409L82.8Confident94.3Very high75 Ų7540.4 Ų40.439%0.39322%0.222SC..THydrogen-bonded Turntrans-62.5-21.4-179.6-61.3171.5000113.4Q407 V484Q407-L409 PolarHBondContact O-N 3.32Å; Q407-L409 VanDerWaalsContact O-N 3.16Å; L409-V484 HydrophobicContact CD1-CG2 3.46Å; L409-V484 VanDerWaalsContact CD1-CG2 3.46Å; L409-V484 HydrophobicContact CD2-CB 4.42Å; L409-V484 HydrophobicContact CD2-CG2 3.37Å; L409-V484 HydrophobicContact CG-CG2 3.99Å
410S87.4Confident94.3Very high88 Ų8839 Ų3962%0.61521%0.214SC*.THydrogen-bonded Turntrans-93.8-0.8177.4680000113.6Q407 L408Q407-S410 PolarHBondContact O-N 2.81Å; Q407-S410 VanDerWaalsContact O-N 3.1Å; Q407-S410 PolarHBondContact O-OG 3.15Å; L408-S410 PolarHBondContact O-N 3.38Å; L408-S410 VanDerWaalsContact O-N 3.12Å
411Q94.4Very high94Very high35 Ų3540.2 Ų40.216%0.16422%0.223CC..SBendtrans-96.6158.9-171.4-62.2-57.9-61.400112.9L370 L373 L408 V415L370-Q411 VanDerWaalsContact CD1-NE2 3.27Å; L373-Q411 HydrophobicContact CD1-CG 3.85Å; L408-Q411 WeakPolarHBondContact O-CB 3.39Å; L408-Q411 PolarHBondContact O-N 2.99Å; Q411-V415 HydrophobicContact CB-CB 3.95Å; Q411-V415 HydrophobicContact CB-CG1 3.94Å; Q411-V415 HydrophobicContact CG-CG1 4.18Å
412P94.8Very high93.6Very high72 Ų7240.3 Ų40.347%0.46822%0.224SC..  trans-58.6157.9172.2-22.833.8000113.2E414 V415 M416P412-E414 VanDerWaalsContact C-N 3.29Å; P412-E414 PolarHBondContact O-N 2.63Å; P412-V415 HydrophobicContact CB-CG2 4.5Å; P412-V415 HydrophobicContact CG-CG2 4.48Å; P412-V415 WeakPolarHBondContact O-CB 3.4Å; P412-V415 PolarHBondContact O-N 3.36Å; P412-M416 PolarHBondContact O-N 3.49Å
413E93.9Very high93.3Very high135 Ų13541.9 Ų41.963%0.63124%0.235SC*.Hα-helixtrans-57.1-39.9-177.9-171.4170.9-167.400113.2V415 M416 E417E413-V415 VanDerWaalsContact C-N 3.27Å; E413-V415 PolarHBondContact O-N 2.84Å; E413-M416 HydrophobicContact CB-CE 4.28Å; E413-M416 WeakPolarHBondContact O-CB 3.31Å; E413-M416 PolarHBondContact O-N 3.2Å; E413-M416 VanDerWaalsContact O-N 3.14Å; E413-E417 WeakPolarHBondContact O-CB 3.4Å; E413-E417 PolarHBondContact O-N 2.97Å
414E94.8Very high92.8Very high155 Ų15544.8 Ų44.872%0.72425%0.247SC*.Hα-helixtrans-59.7-37.4177.4-61.5144-17600112.3P412 L418P412-E414 VanDerWaalsContact C-N 3.29Å; P412-E414 PolarHBondContact O-N 2.63Å; E414-L418 WeakPolarHBondContact O-CB 3.43Å; E414-L418 PolarHBondContact O-N 3.28Å; E414-L418 VanDerWaalsContact O-N 3.13Å
415V95.8Very high92.4Very high9 Ų950.6 Ų50.66%0.05527%0.273CS..Hα-helixtrans-74.2-43.4176.9-177.30000109.3L373 P374 L408 Q411 P412 E413 E417 L418 W419L373-V415 HydrophobicContact CB-CG1 3.95Å; P374-V415 HydrophobicContact CB-CG2 4.09Å; P374-V415 HydrophobicContact CG-CG2 4.22Å; L408-V415 HydrophobicContact CD2-CG1 4.08Å; Q411-V415 HydrophobicContact CB-CB 3.95Å; Q411-V415 HydrophobicContact CB-CG1 3.94Å; Q411-V415 HydrophobicContact CG-CG1 4.18Å; P412-V415 HydrophobicContact CB-CG2 4.5Å; P412-V415 HydrophobicContact CG-CG2 4.48Å; P412-V415 WeakPolarHBondContact O-CB 3.4Å; P412-V415 PolarHBondContact O-N 3.36Å; E413-V415 VanDerWaalsContact C-N 3.27Å; E413-V415 PolarHBondContact O-N 2.84Å; V415-E417 VanDerWaalsContact C-N 3.31Å; V415-E417 PolarHBondContact O-N 2.72Å; V415-L418 WeakPolarHBondContact O-CB 3.36Å; V415-L418 PolarHBondContact O-N 3.42Å; V415-W419 VanDerWaalsContact O-CD1 3.23Å; V415-W419 PolarHBondContact O-N 2.71Å
416M95.5Very high91.8Very high27 Ų2756.5 Ų56.513%0.13331%0.312CS..Hα-helixtrans-58.4-43.7175.3-69.1-170.4-73.500111.8P412 E413 L418 W419 Y420 P486 Y489P412-M416 PolarHBondContact O-N 3.49Å; E413-M416 HydrophobicContact CB-CE 4.28Å; E413-M416 WeakPolarHBondContact O-CB 3.31Å; E413-M416 PolarHBondContact O-N 3.2Å; E413-M416 VanDerWaalsContact O-N 3.14Å; M416-L418 PolarHBondContact O-N 2.96Å; M416-W419 PolarHBondContact O-N 2.92Å; M416-Y420 HydrophobicContact CB-CD2 4.01Å; M416-Y420 HydrophobicContact CB-CE2 4.17Å; M416-Y420 HydrophobicContact CG-CE2 4.34Å; M416-Y420 WeakPolarHBondContact O-CB 3.4Å; M416-Y420 VanDerWaalsContact O-CD2 3.27Å; M416-Y420 WeakPolarHBondContact O-CD2 3.31Å; M416-Y420 PolarHBondContact O-N 3.22Å; M416-P486 HydrophobicContact SD-CG 4.4Å; M416-Y489 HydrophobicContact CB-CE2 4.12Å
417E95.1Very high91.5Very high88 Ų8862.4 Ų62.441%0.41133%0.328SS..Hα-helixtrans-61.8-44.5178.6-172.1-177.8-17700111.3E413 V415 W419 S421 Q424 Y489E413-E417 WeakPolarHBondContact O-CB 3.4Å; E413-E417 PolarHBondContact O-N 2.97Å; V415-E417 VanDerWaalsContact C-N 3.31Å; V415-E417 PolarHBondContact O-N 2.72Å; E417-W419 PolarHBondContact O-N 2.97Å; E417-S421 WeakPolarHBondContact O-CB 3.43Å; E417-S421 PolarHBondContact O-N 3.46Å; E417-S421 PolarHBondContact O-OG 2.94Å; E417-Q424 PolarHBondContact OE1-NE2 3.09Å; E417-Y489 VanDerWaalsContact CA-OH 3.26Å; E417-Y489 WeakPolarHBondContact CA-OH 3.28Å; E417-Y489 HydrophobicContact CB-CE1 4.46Å; E417-Y489 WeakPolarHBondContact CB-OH 3.49Å; E417-Y489 PolarHBondContact N-OH 3.39Å; E417-Y489 VanDerWaalsContact N-OH 3.15Å
418L95.4Very high91.3Very high18 Ų1862.9 Ų62.99%0.09433%0.332CS..Hα-helixtrans-54.2-38.5176.2174.864.5000111.6R376 A379 E414 V415 M416 R431R376-L418 HydrophobicContact CB-CD1 3.97Å; R376-L418 HydrophobicContact CB-CD2 4.37Å; R376-L418 HydrophobicContact CG-CD1 3.95Å; A379-L418 HydrophobicContact CB-CD1 4.02Å; A379-L418 HydrophobicContact CB-CD2 3.94Å; A379-L418 HydrophobicContact CB-CG 3.83Å; E414-L418 WeakPolarHBondContact O-CB 3.43Å; E414-L418 PolarHBondContact O-N 3.28Å; E414-L418 VanDerWaalsContact O-N 3.13Å; V415-L418 WeakPolarHBondContact O-CB 3.36Å; V415-L418 PolarHBondContact O-N 3.42Å; M416-L418 PolarHBondContact O-N 2.96Å; L418-R431 PolarHBondContact O-NH1 3.03Å; L418-R431 PolarHBondContact O-NH2 3.4Å
419W96.9Very high91.1Very high0 Ų066.2 Ų66.20%035%0.352CS..Hα-helixtrans-93.1-38.7-175.8-72.388.4000113.8L373 F378 A379 V382 L383 I404 L408 V415 M416 E417 L434L373-W419 HydrophobicContact CD2-CZ2 3.98Å; L373-W419 PolarHBondContact O-NE1 3.07Å; F378-W419 HydrophobicContact CD1-CH2 4.04Å; F378-W419 AromaticContact CD1-CZ2 3.93Å; F378-W419 HydrophobicContact CD1-CZ2 3.93Å; F378-W419 HydrophobicContact CE1-CH2 4.11Å; F378-W419 HydrophobicContact CE1-CZ2 4.27Å; A379-W419 HydrophobicContact CB-CD2 4.23Å; A379-W419 HydrophobicContact CB-CE3 4.49Å; A379-W419 HydrophobicContact CB-CH2 4.03Å; A379-W419 HydrophobicContact CB-CZ2 3.76Å; A379-W419 HydrophobicContact CB-CZ3 4.38Å; V382-W419 HydrophobicContact CB-CH2 3.98Å; V382-W419 HydrophobicContact CB-CZ3 4.09Å; V382-W419 HydrophobicContact CG1-CH2 3.99Å; V382-W419 HydrophobicContact CG1-CZ3 3.75Å; V382-W419 HydrophobicContact CG2-CH2 4.32Å; L383-W419 HydrophobicContact CD1-CD2 4.31Å; L383-W419 HydrophobicContact CD1-CE3 3.47Å; L383-W419 VanDerWaalsContact CD1-CE3 3.47Å; L383-W419 HydrophobicContact CD1-CZ3 3.81Å; L383-W419 HydrophobicContact CD2-CE3 4.41Å; L383-W419 HydrophobicContact CD2-CZ3 4.36Å; L383-W419 HydrophobicContact CG-CE3 3.99Å; L383-W419 HydrophobicContact CG-CZ3 3.84Å; I404-W419 HydrophobicContact CD1-CE3 4.41Å; I404-W419 HydrophobicContact CD1-CH2 3.64Å; I404-W419 HydrophobicContact CD1-CZ2 4.45Å; I404-W419 HydrophobicContact CD1-CZ3 3.62Å; I404-W419 HydrophobicContact CG2-CD2 3.94Å; I404-W419 HydrophobicContact CG2-CE3 3.75Å; I404-W419 HydrophobicContact CG2-CH2 4.48Å; I404-W419 HydrophobicContact CG2-CZ3 4.07Å; L408-W419 HydrophobicContact CD1-CB 3.61Å; L408-W419 HydrophobicContact CD1-CG 4.08Å; L408-W419 HydrophobicContact CD2-CB 3.94Å; L408-W419 HydrophobicContact CD2-CG 3.81Å; L408-W419 HydrophobicContact CG-CB 4.44Å; V415-W419 VanDerWaalsContact O-CD1 3.23Å; V415-W419 PolarHBondContact O-N 2.71Å; M416-W419 PolarHBondContact O-N 2.92Å; E417-W419 PolarHBondContact O-N 2.97Å; W419-L434 HydrophobicContact CE3-CD1 4.47Å; W419-L434 WeakPolarHBondContact O-CB 3.47Å; W419-L434 PolarHBondContact O-N 2.61Å; W419-L434 VanDerWaalsContact O-N 3.08Å
420Y95.8Very high91.5Very high1 Ų166.7 Ų66.70%0.00436%0.359CS..Hα-helixtrans-77.7-38.7-175.3-74.1-55.9000113.7L405 L408 M416 G422 P433 L434 F435 L485 Y489 V492L405-Y420 HydrophobicContact CD1-CE1 4.21Å; L408-Y420 HydrophobicContact CD1-CE2 4.46Å; M416-Y420 HydrophobicContact CB-CD2 4.01Å; M416-Y420 HydrophobicContact CB-CE2 4.17Å; M416-Y420 HydrophobicContact CG-CE2 4.34Å; M416-Y420 WeakPolarHBondContact O-CB 3.4Å; M416-Y420 VanDerWaalsContact O-CD2 3.27Å; M416-Y420 WeakPolarHBondContact O-CD2 3.31Å; M416-Y420 PolarHBondContact O-N 3.22Å; Y420-G422 PolarHBondContact O-N 3.4Å; Y420-P433 WeakPolarHBondContact O-CB 2.85Å; Y420-L434 HydrophobicContact CE1-CD2 4.37Å; Y420-F435 HydrophobicContact CD1-CD2 4.09Å; Y420-F435 AromaticContact CD1-CE2 3.57Å; Y420-F435 HydrophobicContact CD1-CE2 3.57Å; Y420-F435 HydrophobicContact CD1-CZ 4.2Å; Y420-F435 HydrophobicContact CE1-CD2 4.34Å; Y420-F435 AromaticContact CE1-CE2 3.53Å; Y420-F435 HydrophobicContact CE1-CE2 3.53Å; Y420-F435 AromaticContact CE1-CZ 3.66Å; Y420-F435 HydrophobicContact CE1-CZ 3.66Å; Y420-L485 HydrophobicContact CD1-CD1 4.42Å; Y420-L485 HydrophobicContact CE1-CD1 4.04Å; Y420-L485 HydrophobicContact CE2-CD1 4.21Å; Y420-Y489 HydrophobicContact CD2-CD1 4.38Å; Y420-Y489 AromaticContact CD2-CD2 3.77Å; Y420-Y489 HydrophobicContact CD2-CD2 3.77Å; Y420-Y489 AromaticContact CD2-CE2 3.95Å; Y420-Y489 HydrophobicContact CD2-CE2 3.95Å; Y420-Y489 HydrophobicContact CD2-CG 4.01Å; Y420-Y489 HydrophobicContact CE2-CD2 4.41Å; Y420-Y489 HydrophobicContact CG-CD1 4.29Å; Y420-Y489 HydrophobicContact CG-CD2 4.32Å; Y420-Y489 HydrophobicContact CG-CG 4.09Å; Y420-V492 WeakPolarHBondContact O-CG1 3.48Å
421S91.4Very high91.9Very high26 Ų2663.5 Ų63.518%0.18233%0.334CS..SBendtrans-79.9-19-166.1-60.50000115.2E417E417-S421 WeakPolarHBondContact O-CB 3.43Å; E417-S421 PolarHBondContact O-N 3.46Å; E417-S421 PolarHBondContact O-OG 2.94Å
422G88.9Confident92Very high1 Ų163.1 Ų63.11%0.0133%0.333CS..  trans68.2-166.3-168.400000112.5Y420 R431Y420-G422 PolarHBondContact O-N 3.4Å; G422-R431 CarbonylContact C-O 3.46Å; G422-R431 VanDerWaalsContact CA-O 3.27Å; G422-R431 WeakPolarHBondContact CA-O 3.44Å; G422-R431 PolarHBondContact O-NH1 3.49Å; G422-R431 PolarHBondContact O-NH2 2.97Å
423S90Very high92.1Very high41 Ų4161.1 Ų61.129%0.28732%0.32SS..  trans-66.7130.1168.3-58.70000110.2T429 P430 R431S423-T429 PolarHBondContact OG-O 3.47Å; S423-P430 WeakPolarHBondContact OG-CA 3.38Å; S423-R431 PolarHBondContact N-O 2.95Å; S423-R431 WeakPolarHBondContact OG-CB 3.45Å; S423-R431 PolarHBondContact OG-N 3.45Å; S423-R431 PolarHBondContact OG-O 2.87Å
424Q84.2Confident92.3Very high100 Ų10054.7 Ų54.747%0.46729%0.29SS..  trans-100.3-28.5179.7-63.3-174.517.200111.5E417 D428E417-Q424 PolarHBondContact OE1-NE2 3.09Å; Q424-D428 PolarHBondContact N-OD2 3.04Å; Q424-D428 VanDerWaalsContact N-OD2 3.08Å
425F87Confident92.4Very high121 Ų12147.3 Ų47.353%0.53126%0.255SS..SBendtrans-120.3150.1-176-55.1-78000111.7E427 D428F425-E427 WeakPolarHBondContact CB-OE2 3.23Å; F425-E427 PolarHBondContact O-N 3.43Å; F425-D428 PolarHBondContact N-OD2 3.17Å; F425-D428 WeakPolarHBondContact O-CB 3.31Å; F425-D428 PolarHBondContact O-N 3Å; F425-D428 VanDerWaalsContact O-N 3.12Å
426P83.4Confident92.5Very high127 Ų12749.1 Ų49.183%0.82526%0.263SS*.THydrogen-bonded Turntrans-62.2-25.6176.4-21.132.9000113.9D428P426-D428 VanDerWaalsContact C-N 3.31Å
427E87.6Confident92.6Very high164 Ų16448.1 Ų48.177%0.76626%0.259SS*.THydrogen-bonded Turntrans-78.5-14.6177.1-54.484.9179.700113.2F425F425-E427 WeakPolarHBondContact CB-OE2 3.23Å; F425-E427 PolarHBondContact O-N 3.43Å
428D88.2Confident92.7Very high38 Ų3844 Ų4420%0.20324%0.24CC..SBendtrans-67.4147.9177.1-72.9-37.1000110.7R376 Q424 F425 P426 P430R376-D428 IonicContact NH1-OD1 3.93Å; Q424-D428 PolarHBondContact N-OD2 3.04Å; Q424-D428 VanDerWaalsContact N-OD2 3.08Å; F425-D428 PolarHBondContact N-OD2 3.17Å; F425-D428 WeakPolarHBondContact O-CB 3.31Å; F425-D428 PolarHBondContact O-N 3Å; F425-D428 VanDerWaalsContact O-N 3.12Å; P426-D428 VanDerWaalsContact C-N 3.31Å; D428-P430 WeakPolarHBondContact O-CD 3.45Å
429T89.7Confident92.8Very high70 Ų7043.3 Ų43.343%0.42924%0.236SC..PPolyproline II helixtrans-54.3127.1162.9-51.30000109E380 S423 R431E380-T429 HydrophobicContact CB-CG2 4.12Å; E380-T429 HydrophobicContact CG-CG2 4.03Å; E380-T429 PolarHBondContact OE1-OG1 2.95Å; S423-T429 PolarHBondContact OG-O 3.47Å; T429-R431 PolarHBondContact O-N 3.18Å
430P92.2Very high92.8Very high84 Ų8445.5 Ų45.555%0.54525%0.248SC..PPolyproline II helixtrans-58.1125.2-177.1-27.535.1000112.5P385 S423 D428P385-P430 HydrophobicContact CG-CB 4.14Å; S423-P430 WeakPolarHBondContact OG-CA 3.38Å; D428-P430 WeakPolarHBondContact O-CD 3.45Å
431R94.9Very high92.8Very high21 Ų2145.6 Ų45.68%0.07925%0.248CC..  trans-148.3126.3-173.6-164.4171.741.969.71.2110.7A379 L383 L418 G422 S423 T429A379-R431 WeakPolarHBondContact O-CD 3.47Å; L383-R431 HydrophobicContact CB-CG 3.39Å; L383-R431 HydrophobicContact CD1-CG 3.95Å; L383-R431 HydrophobicContact CG-CG 4.33Å; L418-R431 PolarHBondContact O-NH1 3.03Å; L418-R431 PolarHBondContact O-NH2 3.4Å; G422-R431 CarbonylContact C-O 3.46Å; G422-R431 VanDerWaalsContact CA-O 3.27Å; G422-R431 WeakPolarHBondContact CA-O 3.44Å; G422-R431 PolarHBondContact O-NH1 3.49Å; G422-R431 PolarHBondContact O-NH2 2.97Å; S423-R431 PolarHBondContact N-O 2.95Å; S423-R431 WeakPolarHBondContact OG-CB 3.45Å; S423-R431 PolarHBondContact OG-N 3.45Å; S423-R431 PolarHBondContact OG-O 2.87Å; T429-R431 PolarHBondContact O-N 3.18Å
432L95.9Very high93Very high28 Ų2844.5 Ų44.515%0.14724%0.24CC..  trans-75.1148.5177.5-62.3176.4000111.2L383 P385 A437 I440L383-L432 WeakPolarHBondContact CD1-O 3.5Å; L383-L432 PolarHBondContact O-N 3.46Å; P385-L432 HydrophobicContact CB-CD1 4.41Å; P385-L432 HydrophobicContact CB-CD2 4.17Å; P385-L432 HydrophobicContact CB-CG 4.24Å; P385-L432 HydrophobicContact CG-CD2 4.02Å; P385-L432 HydrophobicContact CG-CG 4.05Å; L432-A437 HydrophobicContact CB-CB 4.31Å; L432-A437 HydrophobicContact CD1-CB 4.46Å; L432-I440 HydrophobicContact CD1-CD1 3.73Å
433P96.9Very high93.2Very high29 Ų2947 Ų4719%0.18825%0.249CC..  trans-55.3140.1160.4-26.236.6000111.2Y420 F435 H436 A437 V492Y420-P433 WeakPolarHBondContact O-CB 2.85Å; P433-F435 VanDerWaalsContact C-N 3.31Å; P433-F435 PolarHBondContact O-N 2.66Å; P433-H436 HydrophobicContact CB-CB 4.26Å; P433-H436 WeakPolarHBondContact O-CB 3.44Å; P433-H436 PolarHBondContact O-N 3.46Å; P433-A437 PolarHBondContact O-N 3.13Å; P433-V492 HydrophobicContact CB-CG1 3.7Å; P433-V492 HydrophobicContact CG-CG1 3.98Å
434L97.6Very high93.3Very high0 Ų047.8 Ų47.80%025%0.246CC..Hα-helixtrans-53.1-44.7-177.8176.262.1000113.4L383 L401 I404 L405 L408 W419 Y420 H436 A437 I438L383-L434 HydrophobicContact CD2-CD1 4.07Å; L401-L434 HydrophobicContact CB-CD1 4.33Å; L401-L434 HydrophobicContact CD2-CD1 3.85Å; I404-L434 HydrophobicContact CG2-CD1 4.47Å; I404-L434 HydrophobicContact CG2-CD2 4.15Å; L405-L434 HydrophobicContact CB-CD2 4.26Å; L405-L434 HydrophobicContact CD1-CD2 3.8Å; L405-L434 HydrophobicContact CD1-CG 4.48Å; L408-L434 HydrophobicContact CD1-CD2 3.31Å; W419-L434 HydrophobicContact CE3-CD1 4.47Å; W419-L434 WeakPolarHBondContact O-CB 3.47Å; W419-L434 PolarHBondContact O-N 2.61Å; W419-L434 VanDerWaalsContact O-N 3.08Å; Y420-L434 HydrophobicContact CE1-CD2 4.37Å; L434-H436 VanDerWaalsContact C-N 3.3Å; L434-H436 PolarHBondContact O-N 3.04Å; L434-A437 PolarHBondContact O-N 3.07Å; L434-I438 HydrophobicContact CD1-CD1 4.11Å; L434-I438 HydrophobicContact CD1-CG1 4.22Å; L434-I438 HydrophobicContact CG-CD1 3.99Å; L434-I438 WeakPolarHBondContact O-CG1 3.48Å; L434-I438 PolarHBondContact O-N 3.23Å
435F97.6Very high93.8Very high1 Ų143 Ų430%0.00422%0.224CC..Hα-helixtrans-59.9-41.3178.4-69.2-64000112L405 Y420 P433 I438 F439 L478 L485 L493 C496L405-F435 HydrophobicContact CD1-CD1 4.43Å; L405-F435 HydrophobicContact CD1-CE1 3.79Å; L405-F435 HydrophobicContact CD1-CZ 4.21Å; Y420-F435 HydrophobicContact CD1-CD2 4.09Å; Y420-F435 AromaticContact CD1-CE2 3.57Å; Y420-F435 HydrophobicContact CD1-CE2 3.57Å; Y420-F435 HydrophobicContact CD1-CZ 4.2Å; Y420-F435 HydrophobicContact CE1-CD2 4.34Å; Y420-F435 AromaticContact CE1-CE2 3.53Å; Y420-F435 HydrophobicContact CE1-CE2 3.53Å; Y420-F435 AromaticContact CE1-CZ 3.66Å; Y420-F435 HydrophobicContact CE1-CZ 3.66Å; P433-F435 VanDerWaalsContact C-N 3.31Å; P433-F435 PolarHBondContact O-N 2.66Å; F435-I438 PolarHBondContact O-N 3.04Å; F435-F439 WeakPolarHBondContact O-CD2 3.5Å; F435-F439 PolarHBondContact O-N 2.92Å; F435-L478 HydrophobicContact CD1-CD2 3.73Å; F435-L478 HydrophobicContact CE1-CD2 3.98Å; F435-L485 HydrophobicContact CE2-CD1 4.01Å; F435-L485 HydrophobicContact CE2-CD2 4.2Å; F435-L485 HydrophobicContact CZ-CD1 4.06Å; F435-L485 HydrophobicContact CZ-CD2 4.41Å; F435-L493 HydrophobicContact CD1-CD1 4.12Å; F435-L493 HydrophobicContact CD2-CB 4.37Å; F435-L493 HydrophobicContact CD2-CD1 4.1Å; F435-L493 HydrophobicContact CE1-CD1 4.2Å; F435-L493 HydrophobicContact CE2-CB 4.35Å; F435-L493 HydrophobicContact CE2-CD1 4.19Å; F435-L493 HydrophobicContact CG-CD1 4.07Å; F435-L493 HydrophobicContact CZ-CD1 4.24Å; F435-C496 HydrophobicContact CB-CB 3.84Å
436H97.3Very high94Very high46 Ų4638 Ų3821%0.21320%0.201CC..Hα-helixtrans-65-45.1177.4-166.483.2000111.3P433 L434 I438 F439 I440 D499P433-H436 HydrophobicContact CB-CB 4.26Å; P433-H436 WeakPolarHBondContact O-CB 3.44Å; P433-H436 PolarHBondContact O-N 3.46Å; L434-H436 VanDerWaalsContact C-N 3.3Å; L434-H436 PolarHBondContact O-N 3.04Å; H436-I438 VanDerWaalsContact C-N 3.3Å; H436-I438 PolarHBondContact O-N 3.42Å; H436-F439 PolarHBondContact O-N 3.35Å; H436-I440 VanDerWaalsContact CD2-CD1 3.42Å; H436-I440 WeakPolarHBondContact CD2-CD1 3.33Å; H436-I440 WeakPolarHBondContact NE2-CD1 3.42Å; H436-I440 PolarHBondContact O-N 3.25Å; H436-D499 IonicContact CE1-OD2 2.66Å; H436-D499 IonicContact ND1-OD2 3.4Å
437A97.6Very high94.3Very high7 Ų732.4 Ų32.46%0.05817%0.165CC..Hα-helixtrans-59.6-39.217600000112.3L383 L401 L432 P433 L434 I440 S441L383-A437 HydrophobicContact CD2-CB 3.42Å; L383-A437 VanDerWaalsContact CD2-CB 3.42Å; L401-A437 HydrophobicContact CD1-CB 4.17Å; L401-A437 HydrophobicContact CD2-CB 4.49Å; L432-A437 HydrophobicContact CB-CB 4.31Å; L432-A437 HydrophobicContact CD1-CB 4.46Å; P433-A437 PolarHBondContact O-N 3.13Å; L434-A437 PolarHBondContact O-N 3.07Å; A437-I440 PolarHBondContact O-N 3.01Å; A437-S441 VanDerWaalsContact O-CB 3.23Å; A437-S441 WeakPolarHBondContact O-CB 3.31Å; A437-S441 PolarHBondContact O-N 3.4Å
438I98Very high94.4Very high0 Ų025.2 Ų25.20%013%0.131CC..Hα-helixtrans-61.1-46.2175.3-72.3169.2000111.3F398 L401 L405 L434 F435 H436 S441 F442 I474 L478F398-I438 HydrophobicContact CE2-CG2 4.11Å; L401-I438 HydrophobicContact CB-CG1 3.8Å; L401-I438 HydrophobicContact CD1-CG1 4.45Å; L405-I438 HydrophobicContact CB-CD1 4.2Å; L405-I438 HydrophobicContact CD1-CD1 4.27Å; L405-I438 HydrophobicContact CD2-CD1 3.99Å; L405-I438 HydrophobicContact CG-CD1 4.39Å; L434-I438 HydrophobicContact CD1-CD1 4.11Å; L434-I438 HydrophobicContact CD1-CG1 4.22Å; L434-I438 HydrophobicContact CG-CD1 3.99Å; L434-I438 WeakPolarHBondContact O-CG1 3.48Å; L434-I438 PolarHBondContact O-N 3.23Å; F435-I438 PolarHBondContact O-N 3.04Å; H436-I438 VanDerWaalsContact C-N 3.3Å; H436-I438 PolarHBondContact O-N 3.42Å; I438-S441 PolarHBondContact O-N 3.34Å; I438-F442 WeakPolarHBondContact O-CB 3.49Å; I438-F442 PolarHBondContact O-N 3.05Å; I438-I474 HydrophobicContact CG2-CD1 3.82Å; I438-I474 HydrophobicContact CG2-CG1 4.19Å; I438-L478 HydrophobicContact CD1-CD2 4.29Å; I438-L478 HydrophobicContact CG2-CD1 4.37Å; I438-L478 HydrophobicContact CG2-CD2 4.29Å
439F97.9Very high94.5Very high4 Ų425.7 Ų25.72%0.01813%0.13CC..Hα-helixtrans-65-42.6178.7-71.7-62.9000112.1F435 H436 S441 F442 R443 L478 L497 A500 T508 L511 A512F435-F439 WeakPolarHBondContact O-CD2 3.5Å; F435-F439 PolarHBondContact O-N 2.92Å; H436-F439 PolarHBondContact O-N 3.35Å; F439-S441 VanDerWaalsContact C-N 3.34Å; F439-S441 PolarHBondContact O-N 3.36Å; F439-F442 PolarHBondContact O-N 2.95Å; F439-R443 PolarHBondContact O-N 3.45Å; F439-L478 HydrophobicContact CE1-CD1 4.09Å; F439-L478 HydrophobicContact CZ-CD1 4.11Å; F439-L497 HydrophobicContact CE2-CD2 4.2Å; F439-L497 HydrophobicContact CZ-CD2 3.81Å; F439-A500 HydrophobicContact CB-CB 4.06Å; F439-A500 HydrophobicContact CD1-CB 3.89Å; F439-A500 HydrophobicContact CD2-CB 3.73Å; F439-A500 HydrophobicContact CE1-CB 4.25Å; F439-A500 HydrophobicContact CE2-CB 4.12Å; F439-A500 HydrophobicContact CG-CB 3.63Å; F439-A500 HydrophobicContact CZ-CB 4.37Å; F439-T508 HydrophobicContact CB-CG2 3.98Å; F439-T508 HydrophobicContact CD1-CG2 3.94Å; F439-T508 HydrophobicContact CG-CG2 4.42Å; F439-T508 WeakPolarHBondContact O-CG2 3.5Å; F439-L511 HydrophobicContact CD1-CD2 4.24Å; F439-L511 HydrophobicContact CE1-CD2 4.11Å; F439-L511 HydrophobicContact CE1-CG 4.06Å; F439-A512 HydrophobicContact CE1-CB 3.91Å; F439-A512 HydrophobicContact CZ-CB 4.12Å
440I95.7Very high94.4Very high47 Ų4727.1 Ų27.124%0.24113%0.13CC..Hα-helixtrans-60.3-46.3174.5-71.8176.4000110.6L432 H436 A437 F442 R443 R444L432-I440 HydrophobicContact CD1-CD1 3.73Å; H436-I440 VanDerWaalsContact CD2-CD1 3.42Å; H436-I440 WeakPolarHBondContact CD2-CD1 3.33Å; H436-I440 WeakPolarHBondContact NE2-CD1 3.42Å; H436-I440 PolarHBondContact O-N 3.25Å; A437-I440 PolarHBondContact O-N 3.01Å; I440-F442 PolarHBondContact O-N 3.31Å; I440-R443 WeakPolarHBondContact O-CB 3.42Å; I440-R443 PolarHBondContact O-N 3.44Å; I440-R444 WeakPolarHBondContact O-CG 3.48Å; I440-R444 PolarHBondContact O-N 3.38Å
441S96.1Very high94Very high3 Ų324.5 Ų24.52%0.02111%0.113CC..Hα-helixtrans-67.3-37.4-178.6-174.50000112F398 A437 I438 F439 R443 R444 C445F398-S441 WeakPolarHBondContact CA-OG 3.38Å; F398-S441 WeakPolarHBondContact CB-OG 3.45Å; F398-S441 PolarHBondContact N-OG 3.18Å; A437-S441 VanDerWaalsContact O-CB 3.23Å; A437-S441 WeakPolarHBondContact O-CB 3.31Å; A437-S441 PolarHBondContact O-N 3.4Å; I438-S441 PolarHBondContact O-N 3.34Å; F439-S441 VanDerWaalsContact C-N 3.34Å; F439-S441 PolarHBondContact O-N 3.36Å; S441-R443 VanDerWaalsContact C-N 3.34Å; S441-R443 PolarHBondContact O-N 3.04Å; S441-R444 PolarHBondContact O-N 2.78Å; S441-C445 PolarHBondContact O-N 2.88Å; S441-C445 PolarHBondContact O-SG 3.36Å
442F95.9Very high92.8Very high2 Ų227.2 Ų27.21%0.00913%0.133CC..Hα-helixtrans-61.3-40.9171.8-176.2-107.9000112.2F398 I438 F439 I440 C445 R449 L470 H471 I474 T508 L511F398-F442 HydrophobicContact CD2-CB 4.3Å; F398-F442 HydrophobicContact CE1-CD2 4.5Å; F398-F442 HydrophobicContact CE2-CB 3.71Å; F398-F442 HydrophobicContact CE2-CD2 4.11Å; F398-F442 HydrophobicContact CE2-CG 4.4Å; F398-F442 HydrophobicContact CZ-CB 4.29Å; F398-F442 AromaticContact CZ-CD2 3.82Å; F398-F442 HydrophobicContact CZ-CD2 3.82Å; I438-F442 WeakPolarHBondContact O-CB 3.49Å; I438-F442 PolarHBondContact O-N 3.05Å; F439-F442 PolarHBondContact O-N 2.95Å; I440-F442 PolarHBondContact O-N 3.31Å; F442-C445 PolarHBondContact O-N 2.93Å; F442-R449 HydrophobicContact CE2-CG 4Å; F442-R449 VanDerWaalsContact CZ-CD 3.44Å; F442-R449 HydrophobicContact CZ-CG 4.08Å; F442-R449 WeakPolarHBondContact O-CD 3.44Å; F442-R449 PolarHBondContact O-NE 3.39Å; F442-R449 VanDerWaalsContact O-NE 3.12Å; F442-L470 HydrophobicContact CE2-CD2 4.37Å; F442-L470 HydrophobicContact CE2-CG 4.25Å; F442-H471 HydrophobicContact CZ-CB 4.38Å; F442-H471 AromaticContact CZ-ND1 3.77Å; F442-I474 HydrophobicContact CD2-CG2 4.09Å; F442-I474 HydrophobicContact CE2-CG2 3.9Å; F442-T508 HydrophobicContact CD1-CG2 4.05Å; F442-L511 HydrophobicContact CB-CD2 4.5Å; F442-L511 HydrophobicContact CD1-CD2 3.73Å; F442-L511 HydrophobicContact CD2-CD2 4.23Å; F442-L511 HydrophobicContact CE1-CB 4.14Å; F442-L511 HydrophobicContact CE1-CD2 3.87Å; F442-L511 HydrophobicContact CE2-CD2 4.36Å; F442-L511 HydrophobicContact CG-CD2 3.9Å; F442-L511 HydrophobicContact CZ-CD2 4.18Å
443R94.1Very high92.3Very high53 Ų5326.2 Ų26.220%0.213%0.128CC..Hα-helixtrans-60.3-43.5174.1174.4174.7170.3171.7-2111.7F439 I440 S441 C445 R449 D505 E832F439-R443 PolarHBondContact O-N 3.45Å; I440-R443 WeakPolarHBondContact O-CB 3.42Å; I440-R443 PolarHBondContact O-N 3.44Å; S441-R443 VanDerWaalsContact C-N 3.34Å; S441-R443 PolarHBondContact O-N 3.04Å; R443-C445 VanDerWaalsContact C-N 3.3Å; R443-C445 PolarHBondContact O-N 3.18Å; R443-R449 PolarHBondContact O-NH2 3.49Å; R443-D505 HydrophobicContact CG-CB 3.91Å; R443-E832 IonicContact CZ-OE1 2.76Å; R443-E832 IonicContact CZ-OE2 3.82Å; R443-E832 IonicContact NH1-OE1 3.82Å; R443-E832 PolarHBondContact NH1-OE1 3.1Å; R443-E832 IonicContact NH1-OE2 3.98Å; R443-E832 PolarHBondContact NH1-OE2 3.44Å; R443-E832 IonicContact NH2-OE1 3.48Å; R443-E832 PolarHBondContact NH2-OE1 3.24Å; R443-E832 IonicContact NH2-OE2 2.87Å; R443-E832 PolarHBondContact NH2-OE2 2.78Å
444R92.5Very high91.8Very high58 Ų5830.6 Ų30.622%0.21914%0.141CC..Hα-helixtrans-62.9-32.4179.4-68.7176.5-175.7-169.8-5.2112.8V387 E394 I440 S441 Y446 K821V387-R444 PolarHBondContact O-NH1 2.8Å; E394-R444 HydrophobicContact CG-CB 4.49Å; E394-R444 VanDerWaalsContact OE2-O 3.14Å; I440-R444 WeakPolarHBondContact O-CG 3.48Å; I440-R444 PolarHBondContact O-N 3.38Å; S441-R444 PolarHBondContact O-N 2.78Å; R444-Y446 PolarHBondContact O-N 3.42Å; R444-K821 WeakPolarHBondContact O-CE 3.44Å; R444-K821 PolarHBondContact O-NZ 3.39Å
445C92.8Very high91.4Very high0 Ų031.1 Ų31.10%014%0.144CC..  trans-72.847.2177.5-62.90000113.9S441 F442 R443 T447 E448 R449 L470S441-C445 PolarHBondContact O-N 2.88Å; S441-C445 PolarHBondContact O-SG 3.36Å; F442-C445 PolarHBondContact O-N 2.93Å; R443-C445 VanDerWaalsContact C-N 3.3Å; R443-C445 PolarHBondContact O-N 3.18Å; C445-T447 PolarHBondContact O-N 3Å; C445-E448 WeakPolarHBondContact CA-OE2 3.27Å; C445-E448 HydrophobicContact CB-CB 4.35Å; C445-R449 WeakPolarHBondContact O-CG 3.38Å; C445-R449 PolarHBondContact O-N 3.37Å; C445-R449 VanDerWaalsContact O-N 3.14Å; C445-R449 PolarHBondContact O-NE 2.97Å; C445-L470 HydrophobicContact CB-CD2 4.33Å
446Y91.6Very high90.9Very high16 Ų1634.4 Ų34.46%0.06317%0.165CC..Hα-helixtrans-58.7-47.8-176.9-177.7-96.7000112.7R444 E448 R449 K450 L817 E820 K821 I824R444-Y446 PolarHBondContact O-N 3.42Å; Y446-E448 PolarHBondContact O-N 2.89Å; Y446-R449 PolarHBondContact O-N 3.15Å; Y446-K450 HydrophobicContact CE1-CG 4.15Å; Y446-K450 WeakPolarHBondContact O-CG 3.3Å; Y446-K450 PolarHBondContact O-N 3.39Å; Y446-K450 WeakPolarHBondContact OH-CE 3.45Å; Y446-L817 HydrophobicContact CE1-CD2 4.42Å; Y446-E820 HydrophobicContact CE1-CB 4.33Å; Y446-E820 HydrophobicContact CE1-CG 4.25Å; Y446-E820 PolarHBondContact OH-OE1 3.24Å; Y446-K821 HydrophobicContact CD1-CB 3.7Å; Y446-K821 HydrophobicContact CD1-CG 4.2Å; Y446-K821 HydrophobicContact CE1-CB 4.41Å; Y446-K821 HydrophobicContact CG-CB 4.16Å; Y446-K821 HydrophobicContact CG-CG 4.16Å; Y446-I824 HydrophobicContact CD2-CG2 4.5Å; Y446-I824 HydrophobicContact CE2-CB 4.35Å; Y446-I824 HydrophobicContact CE2-CG1 4.2Å; Y446-I824 HydrophobicContact CE2-CG2 4.12Å
447T90.2Very high90.3Very high9 Ų932.7 Ų32.76%0.05516%0.159CC..Hα-helixtrans-65.3-43.5-174.2-490000110.6L344 C445 R449 K450 V451 L814 L817L344-T447 HydrophobicContact CD1-CG2 3.66Å; C445-T447 PolarHBondContact O-N 3Å; T447-R449 VanDerWaalsContact C-N 3.31Å; T447-R449 PolarHBondContact O-N 3.08Å; T447-K450 PolarHBondContact O-N 3.37Å; T447-K450 VanDerWaalsContact O-N 3.11Å; T447-V451 HydrophobicContact CG2-CG2 4.21Å; T447-V451 WeakPolarHBondContact O-CB 3.29Å; T447-V451 WeakPolarHBondContact O-CG2 3.49Å; T447-V451 PolarHBondContact O-N 2.85Å; T447-L814 HydrophobicContact CG2-CD1 4.02Å; T447-L817 HydrophobicContact CG2-CB 4.17Å; T447-L817 HydrophobicContact CG2-CD1 4.5Å
448E90.5Very high89.4Confident13 Ų1336.5 Ų36.56%0.06118%0.182CC..Hα-helixtrans-71.4-23.6-178.6-63.474.1-160.600112.9L344 L395 C445 Y446 V451 V453 L470L344-E448 HydrophobicContact CD1-CG 3.83Å; L344-E448 HydrophobicContact CG-CG 4.12Å; L395-E448 HydrophobicContact CB-CG 3.94Å; L395-E448 HydrophobicContact CD1-CG 4.34Å; L395-E448 HydrophobicContact CD2-CG 3.76Å; L395-E448 HydrophobicContact CG-CG 4.21Å; C445-E448 WeakPolarHBondContact CA-OE2 3.27Å; C445-E448 HydrophobicContact CB-CB 4.35Å; Y446-E448 PolarHBondContact O-N 2.89Å; E448-V451 CarbonylContact C-O 3.53Å; E448-V453 HydrophobicContact CB-CG2 3.88Å; E448-V453 HydrophobicContact CG-CG2 4.16Å; E448-L470 HydrophobicContact CB-CD2 4.08Å
449R90.4Very high88.4Confident49 Ų4942 Ų4219%0.18521%0.209CC..Hα-helixtrans-75.6-27.1170.5-71.2-179.7-59.2162.25.5112F442 R443 C445 Y446 T447 L470 D505 T508F442-R449 HydrophobicContact CE2-CG 4Å; F442-R449 VanDerWaalsContact CZ-CD 3.44Å; F442-R449 HydrophobicContact CZ-CG 4.08Å; F442-R449 WeakPolarHBondContact O-CD 3.44Å; F442-R449 PolarHBondContact O-NE 3.39Å; F442-R449 VanDerWaalsContact O-NE 3.12Å; R443-R449 PolarHBondContact O-NH2 3.49Å; C445-R449 WeakPolarHBondContact O-CG 3.38Å; C445-R449 PolarHBondContact O-N 3.37Å; C445-R449 VanDerWaalsContact O-N 3.14Å; C445-R449 PolarHBondContact O-NE 2.97Å; Y446-R449 PolarHBondContact O-N 3.15Å; T447-R449 VanDerWaalsContact C-N 3.31Å; T447-R449 PolarHBondContact O-N 3.08Å; R449-L470 HydrophobicContact CG-CD2 3.97Å; R449-D505 IonicContact CZ-OD1 3.88Å; R449-D505 IonicContact CZ-OD2 3.89Å; R449-D505 IonicContact NH1-OD1 3.07Å; R449-D505 IonicContact NH1-OD2 2.91Å; R449-D505 PolarHBondContact NH1-OD2 3.19Å; R449-D505 IonicContact NH2-OD1 3.21Å; R449-D505 PolarHBondContact NH2-OD1 3.18Å; R449-D505 VanDerWaalsContact NH2-OD1 3.12Å; R449-D505 IonicContact NH2-OD2 3.8Å; R449-D505 PolarHBondContact NH2-OD2 3.19Å; R449-T508 PolarHBondContact NH1-OG1 3.23Å
450K87.3Confident87.2Confident99 Ų9947.2 Ų47.243%0.4324%0.237SC..Hα-helixtrans-98.6-31.8-176.3-65.2-69.7-173172.20113.8Y446 T447 R813 L817Y446-K450 HydrophobicContact CE1-CG 4.15Å; Y446-K450 WeakPolarHBondContact O-CG 3.3Å; Y446-K450 PolarHBondContact O-N 3.39Å; Y446-K450 WeakPolarHBondContact OH-CE 3.45Å; T447-K450 PolarHBondContact O-N 3.37Å; T447-K450 VanDerWaalsContact O-N 3.11Å; K450-R813 PolarHBondContact O-NH2 2.89Å; K450-L817 HydrophobicContact CB-CD1 4.03Å; K450-L817 HydrophobicContact CB-CD2 3.86Å; K450-L817 HydrophobicContact CG-CD2 4.24Å
451V82.8Confident85.8Confident30 Ų3055.2 Ų55.218%0.18227%0.27CS..THydrogen-bonded Turntrans-89117.3165.5-1780000105.6L344 T447 E448 V453 L814 L817L344-V451 HydrophobicContact CD1-CB 4.35Å; L344-V451 HydrophobicContact CD1-CG2 4.46Å; L344-V451 HydrophobicContact CD2-CB 4.37Å; L344-V451 HydrophobicContact CD2-CG1 3.94Å; T447-V451 HydrophobicContact CG2-CG2 4.21Å; T447-V451 WeakPolarHBondContact O-CB 3.29Å; T447-V451 WeakPolarHBondContact O-CG2 3.49Å; T447-V451 PolarHBondContact O-N 2.85Å; E448-V451 CarbonylContact C-O 3.53Å; V451-V453 VanDerWaalsContact C-N 3.29Å; V451-V453 PolarHBondContact O-N 3.17Å; V451-L814 HydrophobicContact CG2-CD1 4.44Å; V451-L817 HydrophobicContact CG2-CD1 3.45Å; V451-L817 VanDerWaalsContact CG2-CD1 3.45Å
452P70.5Confident84.5Confident78 Ų7858.8 Ų58.851%0.50631%0.306SS..THydrogen-bonded Turntrans-66.487.3-170.927.7-34.8000111.3R454P452-R454 PolarHBondContact O-N 2.92Å
453V85.1Confident83.2Confident6 Ų665.2 Ų65.24%0.03634%0.337CS..  trans-63.5127.2167.1159.80000107.9P342 L344 L395 E448 V451 L455 L470P342-V453 HydrophobicContact CB-CG1 3.55Å; P342-V453 HydrophobicContact CG-CG1 3.58Å; L344-V453 HydrophobicContact CD2-CG2 4.14Å; L395-V453 HydrophobicContact CD2-CG2 4.43Å; E448-V453 HydrophobicContact CB-CG2 3.88Å; E448-V453 HydrophobicContact CG-CG2 4.16Å; V451-V453 VanDerWaalsContact C-N 3.29Å; V451-V453 PolarHBondContact O-N 3.17Å; V453-L455 HydrophobicContact CG1-CD1 4.4Å; V453-L455 HydrophobicContact CG1-CG 4.22Å; V453-L470 PolarHBondContact O-N 3.45Å
454R87.4Confident82Confident122 Ų12267 Ų6746%0.4636%0.362SS..EExtended strand (participates in β ladder)trans-103.3126.5179.3-67.1-63.7-179.5166.7-0.2109.3P452 E467 V468P452-R454 PolarHBondContact O-N 2.92Å; R454-E467 HydrophobicContact CB-CB 4.09Å; R454-E467 HydrophobicContact CB-CG 4.43Å; R454-E467 WeakPolarHBondContact CB-OE2 3.38Å; R454-E467 HydrophobicContact CG-CB 4.44Å; R454-E467 PolarHBondContact NH1-O 3.28Å; R454-V468 WeakPolarHBondContact CA-O 3.32Å
455L89.1Confident81.4Confident11 Ų1169.5 Ų69.56%0.05838%0.377CS..EExtended strand (participates in β ladder)trans-123.2154.3178.5-78.3163000109.7P342 L399 V453 G457 E467 V468 L470 H473P342-L455 HydrophobicContact CG-CD2 3.63Å; P342-L455 HydrophobicContact CG-CG 4.13Å; L399-L455 HydrophobicContact CD2-CD1 4.01Å; L399-L455 HydrophobicContact CD2-CD2 4.16Å; V453-L455 HydrophobicContact CG1-CD1 4.4Å; V453-L455 HydrophobicContact CG1-CG 4.22Å; L455-G457 PolarHBondContact O-N 3.28Å; L455-E467 WeakPolarHBondContact O-CA 3.19Å; L455-V468 PolarHBondContact N-O 3.46Å; L455-V468 WeakPolarHBondContact O-CG2 3.45Å; L455-V468 PolarHBondContact O-N 3.27Å; L455-L470 HydrophobicContact CD1-CD1 3.51Å; L455-H473 HydrophobicContact CB-CB 4.1Å; L455-H473 HydrophobicContact CD1-CB 3.91Å
456P85.9Confident81Confident70 Ų7072.4 Ų72.446%0.45540%0.401SS..EExtended strand (participates in β ladder)trans-59.9125.7174.222.8-31.1000110.3Q465 H473P456-Q465 HydrophobicContact CB-CG 4.39Å; P456-H473 PolarHBondContact O-ND1 3.48Å; P456-H473 VanDerWaalsContact O-ND1 3.13Å
457G85.1Confident80.8Confident9 Ų978 Ų789%0.09343%0.427CS..  trans-81.6-176.6170.300000112.3L455 Q465 A466L455-G457 PolarHBondContact O-N 3.28Å; G457-Q465 VanDerWaalsContact O-CG 3.25Å; G457-Q465 WeakPolarHBondContact O-CG 3.36Å; G457-Q465 PolarHBondContact O-NE2 3.1Å; G457-A466 VanDerWaalsContact CA-O 3.31Å; G457-A466 WeakPolarHBondContact CA-O 3.4Å; G457-A466 PolarHBondContact N-O 3.01Å
458V78.9Confident80.9Confident87 Ų8778.1 Ų78.153%0.52743%0.428SS..  trans-84.3134.3175-176.50000109.4L460 V476V458-L460 HydrophobicContact CG1-CD2 4.5Å; V458-L460 PolarHBondContact O-N 3.43Å; V458-V476 HydrophobicContact CG2-CG1 3.89Å
459M76.8Confident80.9Confident116 Ų11680.1 Ų80.157%0.57144%0.441SS*.  trans-68.4121.6170.6-71.3-175.973.700109.8Q463 Q465M459-Q463 WeakPolarHBondContact CE-O 3.3Å; M459-Q465 HydrophobicContact CG-CB 3.75Å; M459-Q465 HydrophobicContact CG-CG 4.16Å; M459-Q465 HydrophobicContact SD-CB 4.49Å
460L72.8Confident81Confident114 Ų11478 Ų7860%0.59743%0.434SS*.  trans-111.5123.9178.5-66173.4000109.8V458 G462 Q463V458-L460 HydrophobicContact CG1-CD2 4.5Å; V458-L460 PolarHBondContact O-N 3.43Å; L460-G462 VanDerWaalsContact C-N 3.3Å; L460-G462 PolarHBondContact O-N 3.43Å; L460-G462 VanDerWaalsContact O-N 3.16Å; L460-Q463 WeakPolarHBondContact O-CB 3.36Å; L460-Q463 PolarHBondContact O-N 2.94Å
461K65.6Low81.3Confident215 Ų21576 Ų7694%0.93543%0.425SS*.THydrogen-bonded Turntrans51.142.5167.9-57.5-178.7178.4-179.70114.5Q463K461-Q463 VanDerWaalsContact C-N 3.25Å; K461-Q463 PolarHBondContact O-N 2.76Å
462G68.8Low81.8Confident77 Ų7779.3 Ų79.379%0.79444%0.439SS*.THydrogen-bonded Turntrans74.66.6178.200000115.3L460L460-G462 VanDerWaalsContact C-N 3.3Å; L460-G462 PolarHBondContact O-N 3.43Å; L460-G462 VanDerWaalsContact O-N 3.16Å
463Q68.9Low83Confident138 Ų13876.8 Ų76.865%0.64542%0.421SS*.  trans-74.4150.6169.8-64.2-175.9-19.800110.8M459 L460 K461M459-Q463 WeakPolarHBondContact CE-O 3.3Å; L460-Q463 WeakPolarHBondContact O-CB 3.36Å; L460-Q463 PolarHBondContact O-N 2.94Å; K461-Q463 VanDerWaalsContact C-N 3.25Å; K461-Q463 PolarHBondContact O-N 2.76Å
464A69.7Low83.5Confident89 Ų8976.5 Ų76.574%0.73642%0.419SS*.  trans-56.5143.3173.900000110.5A466A464-A466 PolarHBondContact O-N 3.2Å; A464-A466 VanDerWaalsContact O-N 3.1Å
465Q79.5Confident83.9Confident111 Ų11171.8 Ų71.852%0.51940%0.404SS..  trans-59.7115.2178.4-168.9171.329.800109.7P456 G457 M459P456-Q465 HydrophobicContact CB-CG 4.39Å; G457-Q465 VanDerWaalsContact O-CG 3.25Å; G457-Q465 WeakPolarHBondContact O-CG 3.36Å; G457-Q465 PolarHBondContact O-NE2 3.1Å; M459-Q465 HydrophobicContact CG-CB 3.75Å; M459-Q465 HydrophobicContact CG-CG 4.16Å; M459-Q465 HydrophobicContact SD-CB 4.49Å
466A83.6Confident84.1Confident61 Ų6174.2 Ų74.250%0.50442%0.419SS..  trans-83.2146.8179.300000110.9G457 A464G457-A466 VanDerWaalsContact CA-O 3.31Å; G457-A466 WeakPolarHBondContact CA-O 3.4Å; G457-A466 PolarHBondContact N-O 3.01Å; A464-A466 PolarHBondContact O-N 3.2Å; A464-A466 VanDerWaalsContact O-N 3.1Å
467E88.1Confident84.6Confident133 Ų13373.6 Ų73.662%0.62141%0.41SS*.EExtended strand (participates in β ladder)trans-82.2123.7170.9-70.7-168.5161.800111.4R454 L455R454-E467 HydrophobicContact CB-CB 4.09Å; R454-E467 HydrophobicContact CB-CG 4.43Å; R454-E467 WeakPolarHBondContact CB-OE2 3.38Å; R454-E467 HydrophobicContact CG-CB 4.44Å; R454-E467 PolarHBondContact NH1-O 3.28Å; L455-E467 WeakPolarHBondContact O-CA 3.19Å
468V91.3Very high85.1Confident13 Ų1373.2 Ų73.28%0.07941%0.406CS..EExtended strand (participates in β ladder)trans-112.9161.8-176.9-61.90000111.3R454 L455 Q472 H473R454-V468 WeakPolarHBondContact CA-O 3.32Å; L455-V468 PolarHBondContact N-O 3.46Å; L455-V468 WeakPolarHBondContact O-CG2 3.45Å; L455-V468 PolarHBondContact O-N 3.27Å; V468-Q472 HydrophobicContact CB-CB 4.14Å; V468-Q472 HydrophobicContact CB-CG 4.04Å; V468-Q472 HydrophobicContact CG1-CG 4.25Å; V468-H473 HydrophobicContact CG2-CB 3.94Å
469T91.5Very high86Confident54 Ų5469.7 Ų69.733%0.33139%0.386SS..EExtended strand (participates in β ladder)trans-71.4160.7176.163.30000111.2H471 Q472 H473T469-H471 VanDerWaalsContact C-N 3.29Å; T469-H471 PolarHBondContact O-N 3.37Å; T469-Q472 PolarHBondContact O-N 3.03Å; T469-Q472 VanDerWaalsContact O-N 3.17Å; T469-Q472 PolarHBondContact OG1-N 3.26Å; T469-H473 WeakPolarHBondContact O-CB 3.28Å; T469-H473 PolarHBondContact O-N 3.12Å
470L92.9Very high86.8Confident5 Ų566.5 Ų66.53%0.02638%0.377CS..Hα-helixtrans-51.5-46.6174.5-171.664.2000112.5L395 F398 F442 C445 E448 R449 V453 L455 H473 I474L395-L470 HydrophobicContact CD1-CD1 4.07Å; L395-L470 HydrophobicContact CD1-CD2 4.38Å; F398-L470 HydrophobicContact CD1-CD1 4.04Å; F398-L470 HydrophobicContact CE1-CD1 3.58Å; F398-L470 HydrophobicContact CE1-CG 4.19Å; F442-L470 HydrophobicContact CE2-CD2 4.37Å; F442-L470 HydrophobicContact CE2-CG 4.25Å; C445-L470 HydrophobicContact CB-CD2 4.33Å; E448-L470 HydrophobicContact CB-CD2 4.08Å; R449-L470 HydrophobicContact CG-CD2 3.97Å; V453-L470 PolarHBondContact O-N 3.45Å; L455-L470 HydrophobicContact CD1-CD1 3.51Å; L470-H473 PolarHBondContact O-N 2.97Å; L470-I474 WeakPolarHBondContact O-CG2 3.3Å; L470-I474 PolarHBondContact O-N 3.25Å
471H94.1Very high87.8Confident56 Ų5661.2 Ų61.226%0.25935%0.35SS..Hα-helixtrans-59.4-47.8177.7-17397.7000112.3F442 T469 I474 C475 D514F442-H471 HydrophobicContact CZ-CB 4.38Å; F442-H471 AromaticContact CZ-ND1 3.77Å; T469-H471 VanDerWaalsContact C-N 3.29Å; T469-H471 PolarHBondContact O-N 3.37Å; H471-I474 WeakPolarHBondContact O-CG2 3.42Å; H471-C475 WeakPolarHBondContact O-CB 3.35Å; H471-C475 PolarHBondContact O-N 2.56Å; H471-D514 IonicContact CD2-OD2 3.48Å; H471-D514 IonicContact CE1-OD2 3.58Å; H471-D514 IonicContact NE2-OD2 2.76Å; H471-D514 PolarHBondContact NE2-OD2 3.4Å
472Q93.1Very high89.3Confident101 Ų10151.7 Ų51.747%0.47231%0.31SS..Hα-helixtrans-66.1-40.9-179.4-178.7177.2-3.500111.2V468 T469 V476V468-Q472 HydrophobicContact CB-CB 4.14Å; V468-Q472 HydrophobicContact CB-CG 4.04Å; V468-Q472 HydrophobicContact CG1-CG 4.25Å; T469-Q472 PolarHBondContact O-N 3.03Å; T469-Q472 VanDerWaalsContact O-N 3.17Å; T469-Q472 PolarHBondContact OG1-N 3.26Å; Q472-V476 VanDerWaalsContact O-CG2 3.31Å; Q472-V476 WeakPolarHBondContact O-CG2 3.37Å; Q472-V476 PolarHBondContact O-N 3.18Å; Q472-V476 VanDerWaalsContact O-N 3.11Å
473H94Very high90.5Very high25 Ų2549.3 Ų49.312%0.11628%0.283CS..Hα-helixtrans-58.1-55177.4-176.986.7000111L455 P456 V468 T469 L470 C475 V476 Q477L455-H473 HydrophobicContact CB-CB 4.1Å; L455-H473 HydrophobicContact CD1-CB 3.91Å; P456-H473 PolarHBondContact O-ND1 3.48Å; P456-H473 VanDerWaalsContact O-ND1 3.13Å; V468-H473 HydrophobicContact CG2-CB 3.94Å; T469-H473 WeakPolarHBondContact O-CB 3.28Å; T469-H473 PolarHBondContact O-N 3.12Å; L470-H473 PolarHBondContact O-N 2.97Å; H473-C475 PolarHBondContact O-N 2.82Å; H473-V476 PolarHBondContact O-N 3.41Å; H473-Q477 WeakPolarHBondContact O-CG 3.46Å; H473-Q477 PolarHBondContact O-N 3.36Å; H473-Q477 VanDerWaalsContact O-N 3.12Å
474I95.5Very high91.6Very high0 Ų046.8 Ų46.80%028%0.277CS..Hα-helixtrans-66.6-39.2-178.6-175.559.8000112.9F398 V402 I438 F442 L470 H471 V476 Q477 L478 L511F398-I474 HydrophobicContact CE1-CB 4.45Å; F398-I474 HydrophobicContact CE2-CD1 4.31Å; F398-I474 HydrophobicContact CE2-CG1 4.26Å; F398-I474 HydrophobicContact CZ-CB 3.77Å; F398-I474 HydrophobicContact CZ-CD1 3.88Å; F398-I474 HydrophobicContact CZ-CG1 3.69Å; F398-I474 HydrophobicContact CZ-CG2 4.24Å; V402-I474 HydrophobicContact CG1-CD1 4.34Å; V402-I474 HydrophobicContact CG2-CD1 3.52Å; I438-I474 HydrophobicContact CG2-CD1 3.82Å; I438-I474 HydrophobicContact CG2-CG1 4.19Å; F442-I474 HydrophobicContact CD2-CG2 4.09Å; F442-I474 HydrophobicContact CE2-CG2 3.9Å; L470-I474 WeakPolarHBondContact O-CG2 3.3Å; L470-I474 PolarHBondContact O-N 3.25Å; H471-I474 WeakPolarHBondContact O-CG2 3.42Å; I474-V476 VanDerWaalsContact C-N 3.29Å; I474-V476 PolarHBondContact O-N 3.12Å; I474-Q477 PolarHBondContact O-N 3.35Å; I474-L478 HydrophobicContact CD1-CD1 4.15Å; I474-L478 HydrophobicContact CD1-CG 3.93Å; I474-L478 HydrophobicContact CG1-CD1 3.77Å; I474-L478 HydrophobicContact CG1-CG 4.06Å; I474-L478 WeakPolarHBondContact O-CB 3.38Å; I474-L478 PolarHBondContact O-N 3.2Å; I474-L511 HydrophobicContact CG1-CD2 4.1Å; I474-L511 HydrophobicContact CG2-CD1 3.81Å; I474-L511 HydrophobicContact CG2-CD2 3.64Å; I474-L511 HydrophobicContact CG2-CG 4.39Å
475C96.5Very high92.8Very high23 Ų2343.6 Ų43.616%0.15525%0.247CC..Hα-helixtrans-58.4-44.6178.4-176.60000111H471 H473 C479 L511H471-C475 WeakPolarHBondContact O-CB 3.35Å; H471-C475 PolarHBondContact O-N 2.56Å; H473-C475 PolarHBondContact O-N 2.82Å; C475-C479 WeakPolarHBondContact O-CB 3.4Å; C475-C479 PolarHBondContact O-N 2.96Å; C475-C479 PolarHBondContact O-SG 3.29Å; C475-L511 HydrophobicContact CB-CD1 3.64Å
476V94.4Very high93.4Very high61 Ų6140 Ų4037%0.3723%0.234SC..Hα-helixtrans-64.3-43.8176.5172.60000111.7V458 Q472 H473 I474 C479 A480V458-V476 HydrophobicContact CG2-CG1 3.89Å; Q472-V476 VanDerWaalsContact O-CG2 3.31Å; Q472-V476 WeakPolarHBondContact O-CG2 3.37Å; Q472-V476 PolarHBondContact O-N 3.18Å; Q472-V476 VanDerWaalsContact O-N 3.11Å; H473-V476 PolarHBondContact O-N 3.41Å; I474-V476 VanDerWaalsContact C-N 3.29Å; I474-V476 PolarHBondContact O-N 3.12Å; V476-C479 PolarHBondContact O-N 3.4Å; V476-A480 VanDerWaalsContact O-CB 3.31Å; V476-A480 WeakPolarHBondContact O-CB 3.37Å; V476-A480 PolarHBondContact O-N 3.06Å
477Q94.8Very high93.8Very high57 Ų5742.6 Ų42.627%0.26625%0.245SC..Hα-helixtrans-65.8-42.9179.9-65.5-60.2-18.200112.6V402 H473 I474 A480 S481V402-Q477 HydrophobicContact CG1-CB 4.07Å; V402-Q477 HydrophobicContact CG1-CG 3.86Å; H473-Q477 WeakPolarHBondContact O-CG 3.46Å; H473-Q477 PolarHBondContact O-N 3.36Å; H473-Q477 VanDerWaalsContact O-N 3.12Å; I474-Q477 PolarHBondContact O-N 3.35Å; Q477-A480 PolarHBondContact O-N 3.19Å; Q477-S481 PolarHBondContact O-N 2.92Å
478L97Very high94.1Very high1 Ų140.9 Ų40.91%0.00524%0.243CC..Hα-helixtrans-61.6-48.5173.9-76.1171.9000110.9L405 F435 I438 F439 I474 A480 S481 V482 L511 V515L405-L478 HydrophobicContact CD2-CD2 3.88Å; L405-L478 HydrophobicContact CD2-CG 4.5Å; F435-L478 HydrophobicContact CD1-CD2 3.73Å; F435-L478 HydrophobicContact CE1-CD2 3.98Å; I438-L478 HydrophobicContact CD1-CD2 4.29Å; I438-L478 HydrophobicContact CG2-CD1 4.37Å; I438-L478 HydrophobicContact CG2-CD2 4.29Å; F439-L478 HydrophobicContact CE1-CD1 4.09Å; F439-L478 HydrophobicContact CZ-CD1 4.11Å; I474-L478 HydrophobicContact CD1-CD1 4.15Å; I474-L478 HydrophobicContact CD1-CG 3.93Å; I474-L478 HydrophobicContact CG1-CD1 3.77Å; I474-L478 HydrophobicContact CG1-CG 4.06Å; I474-L478 WeakPolarHBondContact O-CB 3.38Å; I474-L478 PolarHBondContact O-N 3.2Å; L478-A480 VanDerWaalsContact C-N 3.32Å; L478-A480 PolarHBondContact O-N 2.84Å; L478-S481 PolarHBondContact O-N 3.46Å; L478-V482 VanDerWaalsContact O-CG2 3.31Å; L478-V482 WeakPolarHBondContact O-CG2 3.48Å; L478-V482 PolarHBondContact O-N 3.49Å; L478-L511 HydrophobicContact CD1-CD1 4.48Å; L478-L511 HydrophobicContact CD1-CD2 4.22Å; L478-L511 HydrophobicContact CD1-CG 4.34Å; L478-V515 HydrophobicContact CB-CG1 4.23Å; L478-V515 HydrophobicContact CB-CG2 3.67Å; L478-V515 HydrophobicContact CD1-CG2 3.86Å; L478-V515 HydrophobicContact CG-CG2 4.41Å
479C96.5Very high94.3Very high14 Ų1440.6 Ų40.610%0.09524%0.241CC..Hα-helixtrans-60.6-41.3177.7-67.10000112.1C475 V476 V482 A483 F518C475-C479 WeakPolarHBondContact O-CB 3.4Å; C475-C479 PolarHBondContact O-N 2.96Å; C475-C479 PolarHBondContact O-SG 3.29Å; V476-C479 PolarHBondContact O-N 3.4Å; C479-V482 PolarHBondContact O-N 3.25Å; C479-A483 PolarHBondContact O-N 3.18Å; C479-F518 HydrophobicContact CB-CB 4.37Å; C479-F518 HydrophobicContact CB-CD1 3.57Å; C479-F518 HydrophobicContact CB-CD2 3.91Å; C479-F518 HydrophobicContact CB-CE1 3.74Å; C479-F518 HydrophobicContact CB-CE2 4.06Å; C479-F518 HydrophobicContact CB-CG 3.66Å; C479-F518 HydrophobicContact CB-CZ 3.98Å; C479-F518 WeakPolarHBondContact O-CE1 3.47Å; C479-F518 WeakPolarHBondContact SG-CB 3.07Å; C479-F518 WeakPolarHBondContact SG-CG 3.43Å
480A94.1Very high94.5Very high48 Ų4840.4 Ų40.440%0.39724%0.236SC..Hα-helixtrans-61.5-44.2175.300000111.5V476 Q477 L478 A483 V484V476-A480 VanDerWaalsContact O-CB 3.31Å; V476-A480 WeakPolarHBondContact O-CB 3.37Å; V476-A480 PolarHBondContact O-N 3.06Å; Q477-A480 PolarHBondContact O-N 3.19Å; L478-A480 VanDerWaalsContact C-N 3.32Å; L478-A480 PolarHBondContact O-N 2.84Å; A480-A483 PolarHBondContact O-N 3.04Å; A480-V484 WeakPolarHBondContact O-CG2 3.48Å
481S94.9Very high94.6Very high3 Ų342.7 Ų42.72%0.02125%0.251CS..Hα-helixtrans-63.1-43.5175.5178.70000112.4L405 Q477 L478 A483 V484 L485L405-S481 WeakPolarHBondContact CD1-OG 3.19Å; Q477-S481 PolarHBondContact O-N 2.92Å; L478-S481 PolarHBondContact O-N 3.46Å; S481-A483 VanDerWaalsContact C-N 3.28Å; S481-A483 PolarHBondContact O-N 2.76Å; S481-V484 WeakPolarHBondContact O-CG2 3.43Å; S481-V484 PolarHBondContact O-N 3.47Å; S481-L485 PolarHBondContact O-N 3.12Å; S481-L485 VanDerWaalsContact O-N 3.07Å
482V95.5Very high94.7Very high15 Ų1541.1 Ų41.19%0.09125%0.245CC..Hα-helixtrans-58.5-40.9176.5171.70000111.5L478 C479 V484 L485 L493 V515 F518 T519L478-V482 VanDerWaalsContact O-CG2 3.31Å; L478-V482 WeakPolarHBondContact O-CG2 3.48Å; L478-V482 PolarHBondContact O-N 3.49Å; C479-V482 PolarHBondContact O-N 3.25Å; V482-V484 PolarHBondContact O-N 3.39Å; V482-V484 VanDerWaalsContact O-N 3.13Å; V482-L485 PolarHBondContact O-N 3.08Å; V482-L493 HydrophobicContact CB-CD2 4.42Å; V482-L493 HydrophobicContact CG1-CD2 4.04Å; V482-L493 HydrophobicContact CG2-CD1 4.08Å; V482-L493 HydrophobicContact CG2-CD2 3.66Å; V482-V515 HydrophobicContact CG2-CG1 4.01Å; V482-F518 HydrophobicContact CB-CE1 4.39Å; V482-F518 HydrophobicContact CG1-CD1 4.48Å; V482-F518 HydrophobicContact CG1-CE1 4.42Å; V482-T519 HydrophobicContact CG1-CG2 4.05Å
483A94.2Very high94.9Very high28 Ų2836.3 Ų36.323%0.23122%0.223CC..Hα-helixtrans-62.5-21.2-177.400000114C479 A480 S481 F518 Y522C479-A483 PolarHBondContact O-N 3.18Å; A480-A483 PolarHBondContact O-N 3.04Å; S481-A483 VanDerWaalsContact C-N 3.28Å; S481-A483 PolarHBondContact O-N 2.76Å; A483-F518 HydrophobicContact CB-CE1 4.33Å; A483-F518 HydrophobicContact CB-CZ 4.23Å; A483-Y522 HydrophobicContact CB-CD1 4.28Å; A483-Y522 HydrophobicContact CB-CE1 3.78Å; A483-Y522 HydrophobicContact CB-CE2 4.22Å
484V92.7Very high95Very high85 Ų8537.6 Ų37.652%0.51523%0.228SC..THydrogen-bonded Turntrans-121.612.2-179.2-62.90000112.7L409 A480 S481 V482 P486L409-V484 HydrophobicContact CD1-CG2 3.46Å; L409-V484 VanDerWaalsContact CD1-CG2 3.46Å; L409-V484 HydrophobicContact CD2-CB 4.42Å; L409-V484 HydrophobicContact CD2-CG2 3.37Å; L409-V484 HydrophobicContact CG-CG2 3.99Å; A480-V484 WeakPolarHBondContact O-CG2 3.48Å; S481-V484 WeakPolarHBondContact O-CG2 3.43Å; S481-V484 PolarHBondContact O-N 3.47Å; V482-V484 PolarHBondContact O-N 3.39Å; V482-V484 VanDerWaalsContact O-N 3.13Å; V484-P486 WeakPolarHBondContact O-CD 3.17Å
485L93.8Very high95.1Very high22 Ų2245.4 Ų45.412%0.11526%0.258CS..  trans-69.5128.7-176.7-173.169.5000110.9Y420 F435 S481 V482 Y489 L493Y420-L485 HydrophobicContact CD1-CD1 4.42Å; Y420-L485 HydrophobicContact CE1-CD1 4.04Å; Y420-L485 HydrophobicContact CE2-CD1 4.21Å; F435-L485 HydrophobicContact CE2-CD1 4.01Å; F435-L485 HydrophobicContact CE2-CD2 4.2Å; F435-L485 HydrophobicContact CZ-CD1 4.06Å; F435-L485 HydrophobicContact CZ-CD2 4.41Å; S481-L485 PolarHBondContact O-N 3.12Å; S481-L485 VanDerWaalsContact O-N 3.07Å; V482-L485 PolarHBondContact O-N 3.08Å; L485-Y489 HydrophobicContact CD1-CD2 4.47Å; L485-L493 HydrophobicContact CD2-CB 3.97Å; L485-L493 HydrophobicContact CD2-CD2 3.85Å; L485-L493 HydrophobicContact CD2-CG 4.48Å
486P92.9Very high95.1Very high36 Ų3644.4 Ų44.423%0.23425%0.251CS..  trans-59.6140.6172.9-25.934.7000112.4M416 V484 V488 Y489M416-P486 HydrophobicContact SD-CG 4.4Å; V484-P486 WeakPolarHBondContact O-CD 3.17Å; P486-V488 HydrophobicContact CB-CG1 4.2Å; P486-V488 PolarHBondContact O-N 3.29Å; P486-Y489 HydrophobicContact CB-CD2 3.84Å; P486-Y489 HydrophobicContact CB-CE2 4.07Å; P486-Y489 HydrophobicContact CG-CD2 4Å; P486-Y489 HydrophobicContact CG-CE2 4.09Å; P486-Y489 PolarHBondContact O-N 3.14Å
487P92.8Very high95.3Very high115 Ų11541.6 Ų41.675%0.74723%0.234SC*.G310 helixtrans-56.2-29.8-175.7-28.235000115Y489 F490P487-Y489 PolarHBondContact O-N 2.88Å; P487-F490 WeakPolarHBondContact O-CB 3.24Å; P487-F490 PolarHBondContact O-N 2.82Å; P487-F490 VanDerWaalsContact O-N 3.16Å
488V94.2Very high95.4Very high96 Ų9640.3 Ų40.358%0.58223%0.229SC*.G310 helixtrans-60.4-28.9179.166.60000112.9P486P486-V488 HydrophobicContact CB-CG1 4.2Å; P486-V488 PolarHBondContact O-N 3.29Å
489Y95.1Very high95.4Very high7 Ų744.1 Ų44.13%0.02725%0.249CC..G310 helixtrans-95.4-5.5-179.2-54.4-59.6000113.4M416 E417 Y420 L485 P486 P487 V492 L493M416-Y489 HydrophobicContact CB-CE2 4.12Å; E417-Y489 VanDerWaalsContact CA-OH 3.26Å; E417-Y489 WeakPolarHBondContact CA-OH 3.28Å; E417-Y489 HydrophobicContact CB-CE1 4.46Å; E417-Y489 WeakPolarHBondContact CB-OH 3.49Å; E417-Y489 PolarHBondContact N-OH 3.39Å; E417-Y489 VanDerWaalsContact N-OH 3.15Å; Y420-Y489 HydrophobicContact CD2-CD1 4.38Å; Y420-Y489 AromaticContact CD2-CD2 3.77Å; Y420-Y489 HydrophobicContact CD2-CD2 3.77Å; Y420-Y489 AromaticContact CD2-CE2 3.95Å; Y420-Y489 HydrophobicContact CD2-CE2 3.95Å; Y420-Y489 HydrophobicContact CD2-CG 4.01Å; Y420-Y489 HydrophobicContact CE2-CD2 4.41Å; Y420-Y489 HydrophobicContact CG-CD1 4.29Å; Y420-Y489 HydrophobicContact CG-CD2 4.32Å; Y420-Y489 HydrophobicContact CG-CG 4.09Å; L485-Y489 HydrophobicContact CD1-CD2 4.47Å; P486-Y489 HydrophobicContact CB-CD2 3.84Å; P486-Y489 HydrophobicContact CB-CE2 4.07Å; P486-Y489 HydrophobicContact CG-CD2 4Å; P486-Y489 HydrophobicContact CG-CE2 4.09Å; P486-Y489 PolarHBondContact O-N 3.14Å; P487-Y489 PolarHBondContact O-N 2.88Å; Y489-V492 WeakPolarHBondContact O-CB 3.46Å; Y489-V492 PolarHBondContact O-N 2.83Å; Y489-V492 VanDerWaalsContact O-N 3.12Å; Y489-L493 PolarHBondContact O-N 3.47Å; Y489-L493 VanDerWaalsContact O-N 3.12Å
490F95.2Very high95.4Very high51 Ų5143.6 Ų43.622%0.22425%0.246CC..Hα-helixtrans-60-42.4-178.5-167.6-98.6000113.5P487 V492 L493 E494 T519 L527P487-F490 WeakPolarHBondContact O-CB 3.24Å; P487-F490 PolarHBondContact O-N 2.82Å; P487-F490 VanDerWaalsContact O-N 3.16Å; F490-V492 PolarHBondContact O-N 3.29Å; F490-L493 HydrophobicContact CD2-CD2 4.19Å; F490-L493 HydrophobicContact CE2-CD2 4.17Å; F490-L493 WeakPolarHBondContact O-CB 3.4Å; F490-L493 PolarHBondContact O-N 3.26Å; F490-L493 VanDerWaalsContact O-N 3.13Å; F490-E494 HydrophobicContact CD1-CG 3.99Å; F490-E494 HydrophobicContact CE1-CG 3.67Å; F490-E494 VanDerWaalsContact CE1-OE1 3.31Å; F490-E494 WeakPolarHBondContact CE1-OE1 3.41Å; F490-E494 HydrophobicContact CZ-CG 4.18Å; F490-E494 PolarHBondContact O-N 2.92Å; F490-T519 HydrophobicContact CE2-CG2 3.72Å; F490-T519 HydrophobicContact CZ-CG2 3.87Å; F490-L527 HydrophobicContact CE1-CD1 4.13Å; F490-L527 HydrophobicContact CZ-CD1 4.27Å; F490-L527 HydrophobicContact CZ-CD2 3.9Å
491P95.6Very high95.6Very high53 Ų5341.3 Ų41.334%0.34423%0.227SC..Hα-helixtrans-61.8-30.4175.9-23.735.2000113.3R495P491-R495 WeakPolarHBondContact O-CG 3.27Å; P491-R495 PolarHBondContact O-N 3.34Å
492V96.3Very high95.6Very high22 Ų2244 Ų4413%0.13324%0.241CC..Hα-helixtrans-70.2-44176.2-177.60000110.2Y420 P433 Y489 F490 E494 R495 C496Y420-V492 WeakPolarHBondContact O-CG1 3.48Å; P433-V492 HydrophobicContact CB-CG1 3.7Å; P433-V492 HydrophobicContact CG-CG1 3.98Å; Y489-V492 WeakPolarHBondContact O-CB 3.46Å; Y489-V492 PolarHBondContact O-N 2.83Å; Y489-V492 VanDerWaalsContact O-N 3.12Å; F490-V492 PolarHBondContact O-N 3.29Å; V492-E494 VanDerWaalsContact C-N 3.35Å; V492-E494 PolarHBondContact O-N 3.24Å; V492-R495 PolarHBondContact O-N 3.04Å; V492-C496 PolarHBondContact O-N 3.12Å; V492-C496 PolarHBondContact O-SG 2.94Å
493L96.9Very high95.5Very high1 Ų144.3 Ų44.31%0.00524%0.241CC..Hα-helixtrans-56.5-47.9173.5172.569.4000111.4F435 V482 L485 Y489 F490 R495 C496 L497F435-L493 HydrophobicContact CD1-CD1 4.12Å; F435-L493 HydrophobicContact CD2-CB 4.37Å; F435-L493 HydrophobicContact CD2-CD1 4.1Å; F435-L493 HydrophobicContact CE1-CD1 4.2Å; F435-L493 HydrophobicContact CE2-CB 4.35Å; F435-L493 HydrophobicContact CE2-CD1 4.19Å; F435-L493 HydrophobicContact CG-CD1 4.07Å; F435-L493 HydrophobicContact CZ-CD1 4.24Å; V482-L493 HydrophobicContact CB-CD2 4.42Å; V482-L493 HydrophobicContact CG1-CD2 4.04Å; V482-L493 HydrophobicContact CG2-CD1 4.08Å; V482-L493 HydrophobicContact CG2-CD2 3.66Å; L485-L493 HydrophobicContact CD2-CB 3.97Å; L485-L493 HydrophobicContact CD2-CD2 3.85Å; L485-L493 HydrophobicContact CD2-CG 4.48Å; Y489-L493 PolarHBondContact O-N 3.47Å; Y489-L493 VanDerWaalsContact O-N 3.12Å; F490-L493 HydrophobicContact CD2-CD2 4.19Å; F490-L493 HydrophobicContact CE2-CD2 4.17Å; F490-L493 WeakPolarHBondContact O-CB 3.4Å; F490-L493 PolarHBondContact O-N 3.26Å; F490-L493 VanDerWaalsContact O-N 3.13Å; L493-R495 VanDerWaalsContact C-N 3.34Å; L493-R495 PolarHBondContact O-N 2.86Å; L493-C496 PolarHBondContact O-N 3.48Å; L493-L497 HydrophobicContact CD1-CD1 4.01Å; L493-L497 HydrophobicContact CD1-CG 4.04Å; L493-L497 HydrophobicContact CD2-CD1 4.46Å; L493-L497 HydrophobicContact CG-CD1 3.89Å; L493-L497 HydrophobicContact CG-CG 4.32Å; L493-L497 WeakPolarHBondContact O-CG 3.47Å; L493-L497 PolarHBondContact O-N 2.86Å
494E96.3Very high95.5Very high51 Ų5143.2 Ų43.224%0.23823%0.232CC..Hα-helixtrans-59-43.7-179.6-71-178.5124.500112.3F490 V492 L497 M498 H531F490-E494 HydrophobicContact CD1-CG 3.99Å; F490-E494 HydrophobicContact CE1-CG 3.67Å; F490-E494 VanDerWaalsContact CE1-OE1 3.31Å; F490-E494 WeakPolarHBondContact CE1-OE1 3.41Å; F490-E494 HydrophobicContact CZ-CG 4.18Å; F490-E494 PolarHBondContact O-N 2.92Å; V492-E494 VanDerWaalsContact C-N 3.35Å; V492-E494 PolarHBondContact O-N 3.24Å; E494-L497 PolarHBondContact O-N 3.44Å; E494-M498 WeakPolarHBondContact O-CB 3.34Å; E494-M498 PolarHBondContact O-N 3.27Å; E494-H531 IonicContact OE1-CD2 2.66Å; E494-H531 IonicContact OE1-CE1 3.14Å; E494-H531 IonicContact OE1-NE2 2.72Å; E494-H531 PolarHBondContact OE1-NE2 2.98Å
495R96.5Very high95.7Very high164 Ų16439.5 Ų39.562%0.61921%0.209SC*.Hα-helixtrans-62.6-46.1174.9-68.4174.4-162.5145.74.2111.5P491 V492 L493 L497 M498 D499P491-R495 WeakPolarHBondContact O-CG 3.27Å; P491-R495 PolarHBondContact O-N 3.34Å; V492-R495 PolarHBondContact O-N 3.04Å; L493-R495 VanDerWaalsContact C-N 3.34Å; L493-R495 PolarHBondContact O-N 2.86Å; R495-L497 VanDerWaalsContact C-N 3.32Å; R495-L497 PolarHBondContact O-N 3.13Å; R495-M498 WeakPolarHBondContact O-CB 3.49Å; R495-M498 PolarHBondContact O-N 3.48Å; R495-D499 VanDerWaalsContact O-CG 3.27Å; R495-D499 PolarHBondContact O-N 3.22Å
496C97.9Very high95.7Very high3 Ų341.5 Ų41.52%0.0222%0.222CC..Hα-helixtrans-61.6-40.7178.8-64.50000112.1F435 V492 L493 A500F435-C496 HydrophobicContact CB-CB 3.84Å; V492-C496 PolarHBondContact O-N 3.12Å; V492-C496 PolarHBondContact O-SG 2.94Å; L493-C496 PolarHBondContact O-N 3.48Å; C496-A500 WeakPolarHBondContact O-CB 3.48Å; C496-A500 PolarHBondContact O-N 2.93Å
497L98.1Very high95.8Very high1 Ų142.1 Ų42.11%0.00523%0.227CC..Hα-helixtrans-65.4-42.2175.5-71.4172000111.3F439 L493 E494 R495 A500 V501 A512 V515 W516F439-L497 HydrophobicContact CE2-CD2 4.2Å; F439-L497 HydrophobicContact CZ-CD2 3.81Å; L493-L497 HydrophobicContact CD1-CD1 4.01Å; L493-L497 HydrophobicContact CD1-CG 4.04Å; L493-L497 HydrophobicContact CD2-CD1 4.46Å; L493-L497 HydrophobicContact CG-CD1 3.89Å; L493-L497 HydrophobicContact CG-CG 4.32Å; L493-L497 WeakPolarHBondContact O-CG 3.47Å; L493-L497 PolarHBondContact O-N 2.86Å; E494-L497 PolarHBondContact O-N 3.44Å; R495-L497 VanDerWaalsContact C-N 3.32Å; R495-L497 PolarHBondContact O-N 3.13Å; L497-A500 PolarHBondContact O-N 3.23Å; L497-V501 VanDerWaalsContact O-CG2 3.27Å; L497-V501 WeakPolarHBondContact O-CG2 3.39Å; L497-V501 PolarHBondContact O-N 2.96Å; L497-A512 HydrophobicContact CD2-CB 4.28Å; L497-V515 HydrophobicContact CD2-CB 4.02Å; L497-V515 HydrophobicContact CD2-CG1 3.91Å; L497-W516 HydrophobicContact CB-CD2 4.03Å; L497-W516 HydrophobicContact CB-CE3 3.64Å; L497-W516 HydrophobicContact CB-CZ3 3.93Å; L497-W516 HydrophobicContact CD1-CB 4.09Å; L497-W516 HydrophobicContact CD1-CD2 4.15Å; L497-W516 HydrophobicContact CD1-CG 3.95Å
498M97.1Very high96Very high31 Ų3136.7 Ų36.715%0.15319%0.191CC..Hα-helixtrans-60.5-53.3175.8-172.464.381.900111.6E494 R495 A500 V501 L502 W516 L534 L538 L552E494-M498 WeakPolarHBondContact O-CB 3.34Å; E494-M498 PolarHBondContact O-N 3.27Å; R495-M498 WeakPolarHBondContact O-CB 3.49Å; R495-M498 PolarHBondContact O-N 3.48Å; M498-A500 PolarHBondContact O-N 2.88Å; M498-V501 PolarHBondContact O-N 3.44Å; M498-L502 HydrophobicContact CG-CD1 3.79Å; M498-L502 HydrophobicContact CG-CG 4.32Å; M498-L502 VanDerWaalsContact O-CG 3.32Å; M498-L502 WeakPolarHBondContact O-CG 3.4Å; M498-L502 PolarHBondContact O-N 2.99Å; M498-L502 HydrophobicContact SD-CD1 3.99Å; M498-L502 HydrophobicContact SD-CG 4.16Å; M498-W516 HydrophobicContact CB-CH2 4.11Å; M498-W516 HydrophobicContact CB-CZ3 4.27Å; M498-W516 HydrophobicContact CE-CH2 3.63Å; M498-W516 HydrophobicContact CE-CZ3 4.39Å; M498-W516 HydrophobicContact SD-CH2 4.05Å; M498-W516 HydrophobicContact SD-CZ3 4.23Å; M498-L534 HydrophobicContact CE-CD2 4.31Å; M498-L538 HydrophobicContact CE-CD1 3.28Å; M498-L538 HydrophobicContact SD-CD1 3.89Å; M498-L552 HydrophobicContact SD-CD2 4.39Å
499D95.9Very high96.1Very high81 Ų8132.1 Ų32.143%0.43316%0.163SC..Hα-helixtrans-56.2-42.6178.3-65.4-21.9000110.9H436 R495 V501 L502 Q503H436-D499 IonicContact CE1-OD2 2.66Å; H436-D499 IonicContact ND1-OD2 3.4Å; R495-D499 VanDerWaalsContact O-CG 3.27Å; R495-D499 PolarHBondContact O-N 3.22Å; D499-V501 PolarHBondContact O-N 3.35Å; D499-L502 PolarHBondContact O-N 3.28Å; D499-Q503 PolarHBondContact O-N 2.97Å
500A97.6Very high96.2Very high3 Ų334.8 Ų34.83%0.02518%0.178CC..Hα-helixtrans-69.9-29.8179.600000113.4F439 C496 L497 M498 Q503 A509 A512F439-A500 HydrophobicContact CB-CB 4.06Å; F439-A500 HydrophobicContact CD1-CB 3.89Å; F439-A500 HydrophobicContact CD2-CB 3.73Å; F439-A500 HydrophobicContact CE1-CB 4.25Å; F439-A500 HydrophobicContact CE2-CB 4.12Å; F439-A500 HydrophobicContact CG-CB 3.63Å; F439-A500 HydrophobicContact CZ-CB 4.37Å; C496-A500 WeakPolarHBondContact O-CB 3.48Å; C496-A500 PolarHBondContact O-N 2.93Å; L497-A500 PolarHBondContact O-N 3.23Å; M498-A500 PolarHBondContact O-N 2.88Å; A500-Q503 VanDerWaalsContact CA-NE2 3.32Å; A500-Q503 VanDerWaalsContact O-CG 3.3Å; A500-Q503 WeakPolarHBondContact O-CG 3.46Å; A500-Q503 PolarHBondContact O-NE2 3.46Å; A500-A509 VanDerWaalsContact O-CA 3.28Å; A500-A509 WeakPolarHBondContact O-CA 3.25Å; A500-A512 HydrophobicContact CB-CB 3.57Å
501V97.3Very high96.4Very high0 Ų032.3 Ų32.30%017%0.167CC..Hα-helixtrans-73.7-37.1173.1168.10000111.2L497 M498 D499 Q503 A512 V513 W516 H551 L552 L555L497-V501 VanDerWaalsContact O-CG2 3.27Å; L497-V501 WeakPolarHBondContact O-CG2 3.39Å; L497-V501 PolarHBondContact O-N 2.96Å; M498-V501 PolarHBondContact O-N 3.44Å; D499-V501 PolarHBondContact O-N 3.35Å; V501-Q503 VanDerWaalsContact C-N 3.32Å; V501-Q503 PolarHBondContact O-N 3.36Å; V501-A512 HydrophobicContact CG2-CB 3.82Å; V501-V513 HydrophobicContact CG2-CG2 3.97Å; V501-W516 HydrophobicContact CG2-CE3 4.01Å; V501-W516 HydrophobicContact CG2-CZ3 4.17Å; V501-H551 HydrophobicContact CG1-CB 3.96Å; V501-H551 WeakPolarHBondContact O-CB 3.5Å; V501-H551 PolarHBondContact O-ND1 3.15Å; V501-L552 HydrophobicContact CG1-CD2 3.98Å; V501-L552 HydrophobicContact CG1-CG 4.37Å; V501-L555 HydrophobicContact CG2-CD2 4.42Å
502L95Very high96.5Very high60 Ų6029.8 Ų29.831%0.31415%0.151SC..Hα-helixtrans-82.7-1.6-176-63.9179000114.6M498 D499 Y547 Q548 L552M498-L502 HydrophobicContact CG-CD1 3.79Å; M498-L502 HydrophobicContact CG-CG 4.32Å; M498-L502 VanDerWaalsContact O-CG 3.32Å; M498-L502 WeakPolarHBondContact O-CG 3.4Å; M498-L502 PolarHBondContact O-N 2.99Å; M498-L502 HydrophobicContact SD-CD1 3.99Å; M498-L502 HydrophobicContact SD-CG 4.16Å; D499-L502 PolarHBondContact O-N 3.28Å; L502-Y547 VanDerWaalsContact O-CE2 3.26Å; L502-Y547 WeakPolarHBondContact O-CE2 3.41Å; L502-Q548 HydrophobicContact CB-CG 4.24Å; L502-Q548 HydrophobicContact CD2-CB 3.84Å; L502-Q548 HydrophobicContact CD2-CG 3.93Å; L502-Q548 WeakPolarHBondContact O-CG 3.42Å; L502-L552 HydrophobicContact CD2-CD1 3.86Å; L502-L552 HydrophobicContact CD2-CD2 4.12Å; L502-L552 HydrophobicContact CD2-CG 3.99Å
503Q94.4Very high96.6Very high21 Ų2128.8 Ų28.810%0.09815%0.145CC..SBendtrans-80.4162.6176.581-171.9-6300113.2D499 A500 V501 T508 Y547 H551D499-Q503 PolarHBondContact O-N 2.97Å; A500-Q503 VanDerWaalsContact CA-NE2 3.32Å; A500-Q503 VanDerWaalsContact O-CG 3.3Å; A500-Q503 WeakPolarHBondContact O-CG 3.46Å; A500-Q503 PolarHBondContact O-NE2 3.46Å; V501-Q503 VanDerWaalsContact C-N 3.32Å; V501-Q503 PolarHBondContact O-N 3.36Å; Q503-T508 VanDerWaalsContact NE2-CB 3.31Å; Q503-Y547 WeakPolarHBondContact O-CD2 3.29Å; Q503-Y547 VanDerWaalsContact O-CE2 3.32Å; Q503-Y547 WeakPolarHBondContact O-CE2 3.14Å; Q503-H551 PolarHBondContact O-CE1 2.91Å; Q503-H551 VanDerWaalsContact O-CE1 3.25Å; Q503-H551 PolarHBondContact O-ND1 3.4Å
504A94.9Very high96.7Very high5 Ų530.5 Ų30.54%0.04115%0.154CC..SBendtrans-76.3-25.3-176.800000114.7T506 Y547 N828 L831 E832A504-T506 PolarHBondContact O-N 3.35Å; A504-Y547 VanDerWaalsContact CA-CE2 3.48Å; A504-Y547 HydrophobicContact CB-CD2 4.39Å; A504-Y547 HydrophobicContact CB-CE1 4.38Å; A504-Y547 HydrophobicContact CB-CE2 4.02Å; A504-N828 HydrophobicContact CB-CB 3.95Å; A504-L831 HydrophobicContact CB-CB 4.11Å; A504-L831 HydrophobicContact CB-CD1 4.13Å; A504-E832 HydrophobicContact CB-CG 3.87Å; A504-E832 PolarHBondContact N-OE1 3.23Å; A504-E832 VanDerWaalsContact N-OE1 3.09Å
505D95.1Very high96.8Very high7 Ų728.1 Ų28.14%0.03714%0.143CC..  trans-73.698.3179.5-175.886.2000111.7R443 R449 P507 T508 A509R443-D505 HydrophobicContact CG-CB 3.91Å; R449-D505 IonicContact CZ-OD1 3.88Å; R449-D505 IonicContact CZ-OD2 3.89Å; R449-D505 IonicContact NH1-OD1 3.07Å; R449-D505 IonicContact NH1-OD2 2.91Å; R449-D505 PolarHBondContact NH1-OD2 3.19Å; R449-D505 IonicContact NH2-OD1 3.21Å; R449-D505 PolarHBondContact NH2-OD1 3.18Å; R449-D505 VanDerWaalsContact NH2-OD1 3.12Å; R449-D505 IonicContact NH2-OD2 3.8Å; R449-D505 PolarHBondContact NH2-OD2 3.19Å; D505-P507 WeakPolarHBondContact OD2-CD 3.34Å; D505-T508 PolarHBondContact O-N 2.89Å; D505-T508 VanDerWaalsContact O-N 3.12Å; D505-T508 VanDerWaalsContact OD2-CB 3.3Å; D505-T508 WeakPolarHBondContact OD2-CB 3.29Å; D505-T508 PolarHBondContact OD2-N 2.9Å; D505-T508 PolarHBondContact OD2-OG1 3.12Å; D505-A509 PolarHBondContact O-N 3.38Å
506T94.5Very high96.8Very high63 Ų6320.5 Ų20.539%0.38711%0.114SC..Hα-helixtrans-53.5-43.9-177.4-53.50000114.4A504 T508 A509 L510 H551A504-T506 PolarHBondContact O-N 3.35Å; T506-T508 VanDerWaalsContact C-N 3.3Å; T506-T508 PolarHBondContact O-N 3.48Å; T506-A509 PolarHBondContact O-N 2.94Å; T506-L510 HydrophobicContact CG2-CD1 4.11Å; T506-L510 HydrophobicContact CG2-CG 4.22Å; T506-L510 WeakPolarHBondContact O-CB 3.24Å; T506-L510 VanDerWaalsContact O-CG 3.28Å; T506-L510 WeakPolarHBondContact O-CG 3.26Å; T506-L510 PolarHBondContact O-N 3.24Å; T506-H551 PolarHBondContact OG1-NE2 3.35Å
507P94.9Very high96.8Very high50 Ų5020.9 Ų20.933%0.32512%0.116SC..Hα-helixtrans-63-34.8179-20.331.4000113.5D505 L510 L511D505-P507 WeakPolarHBondContact OD2-CD 3.34Å; P507-L510 PolarHBondContact O-N 2.93Å; P507-L511 PolarHBondContact O-N 3.21Å; P507-L511 VanDerWaalsContact O-N 3.09Å
508T96.9Very high96.8Very high0 Ų023.8 Ų23.80%013%0.129CC..Hα-helixtrans-72-40.2174.9-50.10000111.3F439 F442 R449 Q503 D505 T506 L510 L511 A512F439-T508 HydrophobicContact CB-CG2 3.98Å; F439-T508 HydrophobicContact CD1-CG2 3.94Å; F439-T508 HydrophobicContact CG-CG2 4.42Å; F439-T508 WeakPolarHBondContact O-CG2 3.5Å; F442-T508 HydrophobicContact CD1-CG2 4.05Å; R449-T508 PolarHBondContact NH1-OG1 3.23Å; Q503-T508 VanDerWaalsContact NE2-CB 3.31Å; D505-T508 PolarHBondContact O-N 2.89Å; D505-T508 VanDerWaalsContact O-N 3.12Å; D505-T508 VanDerWaalsContact OD2-CB 3.3Å; D505-T508 WeakPolarHBondContact OD2-CB 3.29Å; D505-T508 PolarHBondContact OD2-N 2.9Å; D505-T508 PolarHBondContact OD2-OG1 3.12Å; T506-T508 VanDerWaalsContact C-N 3.3Å; T506-T508 PolarHBondContact O-N 3.48Å; T508-L510 VanDerWaalsContact C-N 3.3Å; T508-L510 PolarHBondContact O-N 3.3Å; T508-L511 WeakPolarHBondContact O-CB 3.48Å; T508-L511 PolarHBondContact O-N 3.42Å; T508-A512 PolarHBondContact O-N 3.31Å
509A97.6Very high96.8Very high0 Ų022.5 Ų22.50%012%0.123CC..Hα-helixtrans-59.7-41.2172.100000111.8A500 D505 T506 L511 A512 V513 H551A500-A509 VanDerWaalsContact O-CA 3.28Å; A500-A509 WeakPolarHBondContact O-CA 3.25Å; D505-A509 PolarHBondContact O-N 3.38Å; T506-A509 PolarHBondContact O-N 2.94Å; A509-L511 PolarHBondContact O-N 2.89Å; A509-A512 PolarHBondContact O-N 3.49Å; A509-V513 VanDerWaalsContact O-CG2 3.31Å; A509-V513 WeakPolarHBondContact O-CG2 3.25Å; A509-V513 PolarHBondContact O-N 3.5Å; A509-H551 HydrophobicContact CB-CB 4.34Å; A509-H551 VanDerWaalsContact CB-ND1 3.3Å; A509-H551 WeakPolarHBondContact CB-ND1 3.38Å
510L97.2Very high96.7Very high63 Ų6318.9 Ų18.933%0.3310%0.104SC..Hα-helixtrans-62-41.1175.1-73.5173.8000112.7T506 P507 T508 A512 V513 D514 L554T506-L510 HydrophobicContact CG2-CD1 4.11Å; T506-L510 HydrophobicContact CG2-CG 4.22Å; T506-L510 WeakPolarHBondContact O-CB 3.24Å; T506-L510 VanDerWaalsContact O-CG 3.28Å; T506-L510 WeakPolarHBondContact O-CG 3.26Å; T506-L510 PolarHBondContact O-N 3.24Å; P507-L510 PolarHBondContact O-N 2.93Å; T508-L510 VanDerWaalsContact C-N 3.3Å; T508-L510 PolarHBondContact O-N 3.3Å; L510-A512 VanDerWaalsContact C-N 3.34Å; L510-V513 PolarHBondContact O-N 3.1Å; L510-D514 VanDerWaalsContact O-CG 3.31Å; L510-D514 PolarHBondContact O-N 3.17Å; L510-L554 HydrophobicContact CD2-CD2 3.25Å
511L98.1Very high96.6Very high0 Ų028.1 Ų28.10%014%0.139CC..Hα-helixtrans-60.5-45.3174177.562.9000111F439 F442 I474 C475 L478 P507 T508 A509 D514 V515F439-L511 HydrophobicContact CD1-CD2 4.24Å; F439-L511 HydrophobicContact CE1-CD2 4.11Å; F439-L511 HydrophobicContact CE1-CG 4.06Å; F442-L511 HydrophobicContact CB-CD2 4.5Å; F442-L511 HydrophobicContact CD1-CD2 3.73Å; F442-L511 HydrophobicContact CD2-CD2 4.23Å; F442-L511 HydrophobicContact CE1-CB 4.14Å; F442-L511 HydrophobicContact CE1-CD2 3.87Å; F442-L511 HydrophobicContact CE2-CD2 4.36Å; F442-L511 HydrophobicContact CG-CD2 3.9Å; F442-L511 HydrophobicContact CZ-CD2 4.18Å; I474-L511 HydrophobicContact CG1-CD2 4.1Å; I474-L511 HydrophobicContact CG2-CD1 3.81Å; I474-L511 HydrophobicContact CG2-CD2 3.64Å; I474-L511 HydrophobicContact CG2-CG 4.39Å; C475-L511 HydrophobicContact CB-CD1 3.64Å; L478-L511 HydrophobicContact CD1-CD1 4.48Å; L478-L511 HydrophobicContact CD1-CD2 4.22Å; L478-L511 HydrophobicContact CD1-CG 4.34Å; P507-L511 PolarHBondContact O-N 3.21Å; P507-L511 VanDerWaalsContact O-N 3.09Å; T508-L511 WeakPolarHBondContact O-CB 3.48Å; T508-L511 PolarHBondContact O-N 3.42Å; A509-L511 PolarHBondContact O-N 2.89Å; L511-D514 WeakPolarHBondContact O-CB 3.48Å; L511-D514 PolarHBondContact O-N 2.87Å; L511-V515 HydrophobicContact CD1-CG2 4.44Å; L511-V515 WeakPolarHBondContact O-CG2 3.32Å; L511-V515 PolarHBondContact O-N 2.79Å
512A98.4Very high96.4Very high0 Ų035 Ų350%017%0.165CC..Hα-helixtrans-62.7-42.217600000111.9F439 L497 A500 V501 T508 A509 L510 D514 V515 W516F439-A512 HydrophobicContact CE1-CB 3.91Å; F439-A512 HydrophobicContact CZ-CB 4.12Å; L497-A512 HydrophobicContact CD2-CB 4.28Å; A500-A512 HydrophobicContact CB-CB 3.57Å; V501-A512 HydrophobicContact CG2-CB 3.82Å; T508-A512 PolarHBondContact O-N 3.31Å; A509-A512 PolarHBondContact O-N 3.49Å; L510-A512 VanDerWaalsContact C-N 3.34Å; A512-D514 VanDerWaalsContact C-N 3.33Å; A512-D514 PolarHBondContact O-N 3.47Å; A512-V515 PolarHBondContact O-N 3.01Å; A512-W516 VanDerWaalsContact O-CB 3.32Å; A512-W516 WeakPolarHBondContact O-CB 3.39Å; A512-W516 PolarHBondContact O-N 3.42Å
513V98.3Very high96.3Very high1 Ų133.8 Ų33.81%0.00617%0.167CC..Hα-helixtrans-59.8-42.3174.1169.30000111.7V501 A509 L510 W516 C517 L555V501-V513 HydrophobicContact CG2-CG2 3.97Å; A509-V513 VanDerWaalsContact O-CG2 3.31Å; A509-V513 WeakPolarHBondContact O-CG2 3.25Å; A509-V513 PolarHBondContact O-N 3.5Å; L510-V513 PolarHBondContact O-N 3.1Å; V513-W516 PolarHBondContact O-N 2.88Å; V513-C517 WeakPolarHBondContact O-CB 3.2Å; V513-C517 PolarHBondContact O-N 2.84Å; V513-C517 PolarHBondContact O-SG 2.97Å; V513-L555 HydrophobicContact CB-CD1 4.23Å; V513-L555 HydrophobicContact CG1-CB 4.32Å; V513-L555 HydrophobicContact CG1-CD1 3.82Å; V513-L555 HydrophobicContact CG2-CB 3.97Å; V513-L555 HydrophobicContact CG2-CD1 4.2Å
514D98.2Very high96.3Very high37 Ų3736.6 Ų36.620%0.19819%0.186CC..Hα-helixtrans-60.9-49176.9-74-29.1000111.6H471 L510 L511 A512 C517 F518 R558H471-D514 IonicContact CD2-OD2 3.48Å; H471-D514 IonicContact CE1-OD2 3.58Å; H471-D514 IonicContact NE2-OD2 2.76Å; H471-D514 PolarHBondContact NE2-OD2 3.4Å; L510-D514 VanDerWaalsContact O-CG 3.31Å; L510-D514 PolarHBondContact O-N 3.17Å; L511-D514 WeakPolarHBondContact O-CB 3.48Å; L511-D514 PolarHBondContact O-N 2.87Å; A512-D514 VanDerWaalsContact C-N 3.33Å; A512-D514 PolarHBondContact O-N 3.47Å; D514-C517 PolarHBondContact O-N 3.38Å; D514-F518 PolarHBondContact O-N 2.95Å; D514-R558 IonicContact OD1-CZ 2.73Å; D514-R558 IonicContact OD1-NH1 3.63Å; D514-R558 PolarHBondContact OD1-NH1 3.48Å; D514-R558 IonicContact OD1-NH2 3.18Å; D514-R558 PolarHBondContact OD1-NH2 3.1Å
515V98.2Very high96.3Very high1 Ų138.2 Ų38.21%0.00620%0.199CC..Hα-helixtrans-66.1-39.2179.9176.40000111.2L478 V482 L497 L511 A512 F518 T519L478-V515 HydrophobicContact CB-CG1 4.23Å; L478-V515 HydrophobicContact CB-CG2 3.67Å; L478-V515 HydrophobicContact CD1-CG2 3.86Å; L478-V515 HydrophobicContact CG-CG2 4.41Å; V482-V515 HydrophobicContact CG2-CG1 4.01Å; L497-V515 HydrophobicContact CD2-CB 4.02Å; L497-V515 HydrophobicContact CD2-CG1 3.91Å; L511-V515 HydrophobicContact CD1-CG2 4.44Å; L511-V515 WeakPolarHBondContact O-CG2 3.32Å; L511-V515 PolarHBondContact O-N 2.79Å; A512-V515 PolarHBondContact O-N 3.01Å; V515-F518 WeakPolarHBondContact O-CB 3.44Å; V515-F518 PolarHBondContact O-N 2.91Å; V515-T519 PolarHBondContact O-N 3.43Å; V515-T519 PolarHBondContact O-OG1 3.29Å
516W98Very high96.4Very high3 Ų343.5 Ų43.51%0.01122%0.224CC..Hα-helixtrans-69.7-39.5177.9-154.8-18.2000111.9L497 M498 V501 A512 V513 F518 T519 A520 H531 L555 M559L497-W516 HydrophobicContact CB-CD2 4.03Å; L497-W516 HydrophobicContact CB-CE3 3.64Å; L497-W516 HydrophobicContact CB-CZ3 3.93Å; L497-W516 HydrophobicContact CD1-CB 4.09Å; L497-W516 HydrophobicContact CD1-CD2 4.15Å; L497-W516 HydrophobicContact CD1-CG 3.95Å; M498-W516 HydrophobicContact CB-CH2 4.11Å; M498-W516 HydrophobicContact CB-CZ3 4.27Å; M498-W516 HydrophobicContact CE-CH2 3.63Å; M498-W516 HydrophobicContact CE-CZ3 4.39Å; M498-W516 HydrophobicContact SD-CH2 4.05Å; M498-W516 HydrophobicContact SD-CZ3 4.23Å; V501-W516 HydrophobicContact CG2-CE3 4.01Å; V501-W516 HydrophobicContact CG2-CZ3 4.17Å; A512-W516 VanDerWaalsContact O-CB 3.32Å; A512-W516 WeakPolarHBondContact O-CB 3.39Å; A512-W516 PolarHBondContact O-N 3.42Å; V513-W516 PolarHBondContact O-N 2.88Å; W516-F518 VanDerWaalsContact C-N 3.3Å; W516-F518 PolarHBondContact O-N 2.91Å; W516-T519 WeakPolarHBondContact O-CB 3.34Å; W516-T519 PolarHBondContact O-N 3.44Å; W516-T519 VanDerWaalsContact O-N 3.16Å; W516-A520 PolarHBondContact O-N 3.16Å; W516-H531 AromaticContact CD1-ND1 3.68Å; W516-H531 AromaticContact NE1-CE1 3.4Å; W516-H531 PolarHBondContact NE1-CE1 3.18Å; W516-H531 AromaticContact NE1-CG 3.6Å; W516-H531 AromaticContact NE1-ND1 3.04Å; W516-H531 PolarHBondContact NE1-ND1 3.48Å; W516-L555 HydrophobicContact CB-CD1 4.11Å; W516-L555 HydrophobicContact CD2-CD2 3.91Å; W516-L555 HydrophobicContact CE3-CD2 3.52Å; W516-L555 HydrophobicContact CG-CD1 4.4Å; W516-L555 HydrophobicContact CG-CD2 4.46Å; W516-L555 HydrophobicContact CZ3-CD2 3.92Å; W516-M559 HydrophobicContact CB-CE 4.22Å; W516-M559 HydrophobicContact CD2-CE 4.29Å; W516-M559 HydrophobicContact CG-CE 3.62Å
517C97.7Very high96.4Very high11 Ų1142.5 Ų42.57%0.07422%0.216CC..Hα-helixtrans-61.7-39.5171.8-72.20000111.7V513 D514 R521 L562V513-C517 WeakPolarHBondContact O-CB 3.2Å; V513-C517 PolarHBondContact O-N 2.84Å; V513-C517 PolarHBondContact O-SG 2.97Å; D514-C517 PolarHBondContact O-N 3.38Å; C517-R521 VanDerWaalsContact O-CB 3.32Å; C517-R521 WeakPolarHBondContact O-CB 3.31Å; C517-R521 PolarHBondContact O-N 3.12Å; C517-L562 WeakPolarHBondContact O-CD1 3.39Å
518F97.6Very high96.5Very high62 Ų6240.2 Ų40.227%0.27220%0.201SC..Hα-helixtrans-61.2-46.5172.1172.2-91.5000111.1C479 V482 A483 D514 V515 W516 A520 R521 Y522C479-F518 HydrophobicContact CB-CB 4.37Å; C479-F518 HydrophobicContact CB-CD1 3.57Å; C479-F518 HydrophobicContact CB-CD2 3.91Å; C479-F518 HydrophobicContact CB-CE1 3.74Å; C479-F518 HydrophobicContact CB-CE2 4.06Å; C479-F518 HydrophobicContact CB-CG 3.66Å; C479-F518 HydrophobicContact CB-CZ 3.98Å; C479-F518 WeakPolarHBondContact O-CE1 3.47Å; C479-F518 WeakPolarHBondContact SG-CB 3.07Å; C479-F518 WeakPolarHBondContact SG-CG 3.43Å; V482-F518 HydrophobicContact CB-CE1 4.39Å; V482-F518 HydrophobicContact CG1-CD1 4.48Å; V482-F518 HydrophobicContact CG1-CE1 4.42Å; A483-F518 HydrophobicContact CB-CE1 4.33Å; A483-F518 HydrophobicContact CB-CZ 4.23Å; D514-F518 PolarHBondContact O-N 2.95Å; V515-F518 WeakPolarHBondContact O-CB 3.44Å; V515-F518 PolarHBondContact O-N 2.91Å; W516-F518 VanDerWaalsContact C-N 3.3Å; W516-F518 PolarHBondContact O-N 2.91Å; F518-A520 PolarHBondContact O-N 2.88Å; F518-R521 PolarHBondContact O-N 3.42Å; F518-R521 VanDerWaalsContact O-N 3.12Å; F518-Y522 HydrophobicContact CE1-CG 4.17Å; F518-Y522 HydrophobicContact CE2-CD2 4.45Å; F518-Y522 AromaticContact CZ-CD2 3.93Å; F518-Y522 HydrophobicContact CZ-CD2 3.93Å; F518-Y522 AromaticContact CZ-CG 3.97Å; F518-Y522 HydrophobicContact CZ-CG 3.97Å; F518-Y522 VanDerWaalsContact O-CB 3.26Å; F518-Y522 WeakPolarHBondContact O-CB 3.45Å; F518-Y522 PolarHBondContact O-N 2.86Å
519T96.5Very high96.5Very high5 Ų541 Ų413%0.03121%0.205CC..Hα-helixtrans-56.7-48.3178.6-52.50000111.3V482 F490 V515 W516 R521 Y522 G523V482-T519 HydrophobicContact CG1-CG2 4.05Å; F490-T519 HydrophobicContact CE2-CG2 3.72Å; F490-T519 HydrophobicContact CZ-CG2 3.87Å; V515-T519 PolarHBondContact O-N 3.43Å; V515-T519 PolarHBondContact O-OG1 3.29Å; W516-T519 WeakPolarHBondContact O-CB 3.34Å; W516-T519 PolarHBondContact O-N 3.44Å; W516-T519 VanDerWaalsContact O-N 3.16Å; T519-R521 VanDerWaalsContact C-N 3.32Å; T519-R521 PolarHBondContact O-N 2.98Å; T519-Y522 PolarHBondContact O-N 3.41Å; T519-G523 PolarHBondContact O-N 2.96Å
520A95.1Very high96.5Very high4 Ų446.4 Ų46.43%0.03323%0.23CC..Hα-helixtrans-66-32.3177.700000113.2W516 F518 C528 M559 L562W516-A520 PolarHBondContact O-N 3.16Å; F518-A520 PolarHBondContact O-N 2.88Å; A520-C528 HydrophobicContact CB-CB 4.25Å; A520-M559 HydrophobicContact CB-CE 3.71Å; A520-L562 HydrophobicContact CB-CD1 4.14Å
521R94.1Very high96.5Very high198 Ų19843.4 Ų43.475%0.74722%0.215SC*.Hα-helixtrans-76.6-36.8176.9-177.1176.4178178.50.8112.9C517 F518 T519 L562C517-R521 VanDerWaalsContact O-CB 3.32Å; C517-R521 WeakPolarHBondContact O-CB 3.31Å; C517-R521 PolarHBondContact O-N 3.12Å; F518-R521 PolarHBondContact O-N 3.42Å; F518-R521 VanDerWaalsContact O-N 3.12Å; T519-R521 VanDerWaalsContact C-N 3.32Å; T519-R521 PolarHBondContact O-N 2.98Å; R521-L562 HydrophobicContact CB-CD1 4.03Å; R521-L562 HydrophobicContact CB-CD2 4.24Å; R521-L562 HydrophobicContact CG-CD2 4.31Å
522Y94.4Very high96.5Very high144 Ų14443.4 Ų43.457%0.56522%0.215SC*.Hα-helixtrans-81.8-34-177.1-173-97.9000111.8A483 F518 T519A483-Y522 HydrophobicContact CB-CD1 4.28Å; A483-Y522 HydrophobicContact CB-CE1 3.78Å; A483-Y522 HydrophobicContact CB-CE2 4.22Å; F518-Y522 HydrophobicContact CE1-CG 4.17Å; F518-Y522 HydrophobicContact CE2-CD2 4.45Å; F518-Y522 AromaticContact CZ-CD2 3.93Å; F518-Y522 HydrophobicContact CZ-CD2 3.93Å; F518-Y522 AromaticContact CZ-CG 3.97Å; F518-Y522 HydrophobicContact CZ-CG 3.97Å; F518-Y522 VanDerWaalsContact O-CB 3.26Å; F518-Y522 WeakPolarHBondContact O-CB 3.45Å; F518-Y522 PolarHBondContact O-N 2.86Å; T519-Y522 PolarHBondContact O-N 3.41Å
523G92.4Very high96.4Very high34 Ų3445.6 Ų45.635%0.35123%0.226SC..SBendtrans-73.8-168.9175.400000113.9T519T519-G523 PolarHBondContact O-N 2.96Å
524T94.3Very high96.3Very high81 Ų8148.9 Ų48.950%0.49724%0.243SC..  trans-77.7159.2-179.179.20000112E526 L527 C528T524-E526 WeakPolarHBondContact CB-OE2 3.42Å; T524-E526 PolarHBondContact O-N 2.91Å; T524-E526 PolarHBondContact OG1-OE2 3.42Å; T524-L527 WeakPolarHBondContact O-CB 3.38Å; T524-L527 PolarHBondContact O-N 2.86Å; T524-L527 PolarHBondContact OG1-N 3.11Å; T524-C528 PolarHBondContact O-N 2.91Å; T524-C528 VanDerWaalsContact O-N 3.1Å
525A95.1Very high96.3Very high38 Ų3847.1 Ų47.131%0.31423%0.234SC..Hα-helixtrans-62.6-30.8177.500000112C528 L529 T564 H567A525-C528 PolarHBondContact O-N 3.41Å; A525-L529 PolarHBondContact O-N 3.5Å; A525-T564 HydrophobicContact CB-CG2 4.27Å; A525-H567 VanDerWaalsContact C-CE1 3.41Å; A525-H567 PolarHBondContact O-CE1 3.26Å; A525-H567 VanDerWaalsContact O-CE1 3.25Å; A525-H567 PolarHBondContact O-ND1 2.92Å; A525-H567 VanDerWaalsContact O-ND1 3.12Å
526E96.4Very high96.2Very high119 Ų11947.1 Ų47.156%0.55623%0.234SC*.Hα-helixtrans-68.6-40.4175.4-58.975.3-164.400111.5T524 C528 L529 H530T524-E526 WeakPolarHBondContact CB-OE2 3.42Å; T524-E526 PolarHBondContact O-N 2.91Å; T524-E526 PolarHBondContact OG1-OE2 3.42Å; E526-C528 VanDerWaalsContact C-N 3.34Å; E526-L529 PolarHBondContact O-N 2.85Å; E526-H530 WeakPolarHBondContact O-CB 3.49Å; E526-H530 PolarHBondContact O-N 3.07Å
527L94.9Very high96.1Very high41 Ų4151.4 Ų51.422%0.21525%0.254CS..Hα-helixtrans-62.3-44.5174.3-178.866.1000110.8F490 T524 L529 H530 H531F490-L527 HydrophobicContact CE1-CD1 4.13Å; F490-L527 HydrophobicContact CZ-CD1 4.27Å; F490-L527 HydrophobicContact CZ-CD2 3.9Å; T524-L527 WeakPolarHBondContact O-CB 3.38Å; T524-L527 PolarHBondContact O-N 2.86Å; T524-L527 PolarHBondContact OG1-N 3.11Å; L527-L529 PolarHBondContact O-N 3.13Å; L527-H530 PolarHBondContact O-N 3.37Å; L527-H531 PolarHBondContact O-N 2.86Å
528C97.4Very high95.9Very high3 Ų353.6 Ų53.62%0.0227%0.265CS..Hα-helixtrans-58-46.7174.7-179.60000111.6A520 T524 A525 E526 H530 H531 V532A520-C528 HydrophobicContact CB-CB 4.25Å; T524-C528 PolarHBondContact O-N 2.91Å; T524-C528 VanDerWaalsContact O-N 3.1Å; A525-C528 PolarHBondContact O-N 3.41Å; E526-C528 VanDerWaalsContact C-N 3.34Å; C528-H530 PolarHBondContact O-N 3.11Å; C528-H531 PolarHBondContact O-N 3.19Å; C528-V532 WeakPolarHBondContact O-CB 3.38Å; C528-V532 VanDerWaalsContact O-CG2 3.29Å; C528-V532 WeakPolarHBondContact O-CG2 3.32Å; C528-V532 PolarHBondContact O-N 3.14Å
529L97.5Very high95.7Very high16 Ų1650.7 Ų50.78%0.08425%0.252CS..Hα-helixtrans-57.8-49174.7171.264.6000111.3A525 E526 L527 H531 V532 L533 M563 H567 E570A525-L529 PolarHBondContact O-N 3.5Å; E526-L529 PolarHBondContact O-N 2.85Å; L527-L529 PolarHBondContact O-N 3.13Å; L529-H531 PolarHBondContact O-N 3.43Å; L529-V532 PolarHBondContact O-N 3.33Å; L529-L533 HydrophobicContact CD1-CD1 3.84Å; L529-L533 HydrophobicContact CD1-CD2 4.24Å; L529-L533 HydrophobicContact CD1-CG 3.84Å; L529-L533 HydrophobicContact CG-CD1 4.02Å; L529-L533 HydrophobicContact CG-CG 4.37Å; L529-L533 WeakPolarHBondContact O-CG 3.34Å; L529-L533 PolarHBondContact O-N 3.05Å; L529-M563 HydrophobicContact CD1-CE 3.68Å; L529-H567 HydrophobicContact CB-CB 4.29Å; L529-H567 HydrophobicContact CD1-CB 4.04Å; L529-H567 HydrophobicContact CD2-CB 4.42Å; L529-H567 HydrophobicContact CG-CB 4.48Å; L529-E570 HydrophobicContact CD1-CB 4.32Å; L529-E570 VanDerWaalsContact CD2-OE2 3.29Å; L529-E570 WeakPolarHBondContact CD2-OE2 3.39Å
530H96.4Very high95.5Very high114 Ų11453 Ų5353%0.52826%0.261SS..Hα-helixtrans-57.7-47.8-179.6-176.670.6000112.1E526 L527 C528 L533 L534E526-H530 WeakPolarHBondContact O-CB 3.49Å; E526-H530 PolarHBondContact O-N 3.07Å; L527-H530 PolarHBondContact O-N 3.37Å; C528-H530 PolarHBondContact O-N 3.11Å; H530-L533 PolarHBondContact O-N 3.38Å; H530-L534 WeakPolarHBondContact O-CB 3.46Å; H530-L534 PolarHBondContact O-N 2.95Å
531H97.2Very high95.3Very high0 Ų055.8 Ų55.80%028%0.284CS..Hα-helixtrans-62-44.4176.3-71.1174.5000112.1E494 W516 L527 C528 L529 L533 L534 I535 M559E494-H531 IonicContact OE1-CD2 2.66Å; E494-H531 IonicContact OE1-CE1 3.14Å; E494-H531 IonicContact OE1-NE2 2.72Å; E494-H531 PolarHBondContact OE1-NE2 2.98Å; W516-H531 AromaticContact CD1-ND1 3.68Å; W516-H531 AromaticContact NE1-CE1 3.4Å; W516-H531 PolarHBondContact NE1-CE1 3.18Å; W516-H531 AromaticContact NE1-CG 3.6Å; W516-H531 AromaticContact NE1-ND1 3.04Å; W516-H531 PolarHBondContact NE1-ND1 3.48Å; L527-H531 PolarHBondContact O-N 2.86Å; C528-H531 PolarHBondContact O-N 3.19Å; L529-H531 PolarHBondContact O-N 3.43Å; H531-L533 PolarHBondContact O-N 3.2Å; H531-L534 PolarHBondContact O-N 3.25Å; H531-I535 HydrophobicContact CB-CD1 4.43Å; H531-I535 WeakPolarHBondContact O-CB 3.32Å; H531-I535 VanDerWaalsContact O-CD1 3.25Å; H531-I535 WeakPolarHBondContact O-CD1 3.37Å; H531-I535 WeakPolarHBondContact O-CG1 3.33Å; H531-I535 PolarHBondContact O-N 3.12Å; H531-M559 HydrophobicContact CB-CE 4.12Å; H531-M559 HydrophobicContact CB-SD 4.15Å
532V97.7Very high95Very high0 Ų048 Ų480%026%0.26CS..Hα-helixtrans-59.5-45.9177.6168.30000111.4C528 L529 I535 A536 L556 M559 V560 M563 L571C528-V532 WeakPolarHBondContact O-CB 3.38Å; C528-V532 VanDerWaalsContact O-CG2 3.29Å; C528-V532 WeakPolarHBondContact O-CG2 3.32Å; C528-V532 PolarHBondContact O-N 3.14Å; L529-V532 PolarHBondContact O-N 3.33Å; V532-I535 PolarHBondContact O-N 3.42Å; V532-A536 VanDerWaalsContact O-CB 3.24Å; V532-A536 WeakPolarHBondContact O-CB 3.43Å; V532-A536 PolarHBondContact O-N 2.81Å; V532-L556 HydrophobicContact CG1-CD1 3.91Å; V532-M559 HydrophobicContact CG2-CB 3.57Å; V532-M559 HydrophobicContact CG2-SD 4.3Å; V532-V560 HydrophobicContact CG1-CG2 4.32Å; V532-M563 HydrophobicContact CB-CE 4.45Å; V532-M563 HydrophobicContact CB-SD 4.16Å; V532-M563 HydrophobicContact CG1-CE 4.17Å; V532-M563 HydrophobicContact CG1-SD 3.7Å; V532-M563 HydrophobicContact CG2-CG 4.14Å; V532-M563 HydrophobicContact CG2-SD 3.98Å; V532-L571 HydrophobicContact CG1-CD1 3.98Å; V532-L571 HydrophobicContact CG1-CD2 4.31Å
533L97.6Very high93.6Very high45 Ų4548.8 Ų48.824%0.23627%0.274CS..Hα-helixtrans-63.7-42.8179.2-66.3176.7000111.5L529 H530 H531 A536 Q537 L571 E574 F575L529-L533 HydrophobicContact CD1-CD1 3.84Å; L529-L533 HydrophobicContact CD1-CD2 4.24Å; L529-L533 HydrophobicContact CD1-CG 3.84Å; L529-L533 HydrophobicContact CG-CD1 4.02Å; L529-L533 HydrophobicContact CG-CG 4.37Å; L529-L533 WeakPolarHBondContact O-CG 3.34Å; L529-L533 PolarHBondContact O-N 3.05Å; H530-L533 PolarHBondContact O-N 3.38Å; H531-L533 PolarHBondContact O-N 3.2Å; L533-A536 PolarHBondContact O-N 3.45Å; L533-Q537 WeakPolarHBondContact O-CB 3.43Å; L533-Q537 PolarHBondContact O-N 2.8Å; L533-L571 HydrophobicContact CD2-CD1 4.06Å; L533-E574 HydrophobicContact CD2-CB 4.26Å; L533-E574 HydrophobicContact CD2-CG 4.41Å; L533-F575 HydrophobicContact CD2-CD2 4.27Å; L533-F575 HydrophobicContact CD2-CE2 3.82Å
534L96.1Very high92.7Very high71 Ų7151 Ų5137%0.37228%0.284SS..Hα-helixtrans-59.4-49.3175.3177.465.4000111.4M498 H530 H531 Q537 L538M498-L534 HydrophobicContact CE-CD2 4.31Å; H530-L534 WeakPolarHBondContact O-CB 3.46Å; H530-L534 PolarHBondContact O-N 2.95Å; H531-L534 PolarHBondContact O-N 3.25Å; L534-Q537 WeakPolarHBondContact O-CB 3.31Å; L534-Q537 PolarHBondContact O-N 3.31Å; L534-L538 HydrophobicContact CG-CD1 4.36Å; L534-L538 WeakPolarHBondContact O-CG 3.45Å; L534-L538 PolarHBondContact O-N 3.09Å
535I97Very high91.9Very high0 Ų055.1 Ų55.10%030%0.298CS..Hα-helixtrans-67.3-40.1-178.4-63.6156000110.7H531 V532 Q537 L538 V539 L552 L555 L556 M559H531-I535 HydrophobicContact CB-CD1 4.43Å; H531-I535 WeakPolarHBondContact O-CB 3.32Å; H531-I535 VanDerWaalsContact O-CD1 3.25Å; H531-I535 WeakPolarHBondContact O-CD1 3.37Å; H531-I535 WeakPolarHBondContact O-CG1 3.33Å; H531-I535 PolarHBondContact O-N 3.12Å; V532-I535 PolarHBondContact O-N 3.42Å; I535-Q537 VanDerWaalsContact C-N 3.29Å; I535-Q537 PolarHBondContact O-N 3.23Å; I535-L538 PolarHBondContact O-N 3.21Å; I535-V539 HydrophobicContact CG2-CG2 4.4Å; I535-V539 WeakPolarHBondContact O-CG2 3.31Å; I535-V539 PolarHBondContact O-N 3.26Å; I535-L552 HydrophobicContact CG2-CD2 4.36Å; I535-L555 HydrophobicContact CD1-CD2 3.43Å; I535-L555 VanDerWaalsContact CD1-CD2 3.43Å; I535-L555 HydrophobicContact CD1-CG 3.75Å; I535-L555 HydrophobicContact CG1-CD2 4.04Å; I535-L556 HydrophobicContact CG2-CB 3.89Å; I535-M559 HydrophobicContact CD1-CE 4.07Å; I535-M559 HydrophobicContact CD1-SD 3.32Å; I535-M559 WeakPolarHBondContact CD1-SD 3.48Å
536A96.3Very high91.5Very high0 Ų054.7 Ų54.70%029%0.292CS..Hα-helixtrans-59.8-40.7174.100000111.5V532 L533 V539 K540 L556 L571 F575 V585V532-A536 VanDerWaalsContact O-CB 3.24Å; V532-A536 WeakPolarHBondContact O-CB 3.43Å; V532-A536 PolarHBondContact O-N 2.81Å; L533-A536 PolarHBondContact O-N 3.45Å; A536-V539 PolarHBondContact O-N 2.88Å; A536-K540 WeakPolarHBondContact O-CB 3.49Å; A536-K540 PolarHBondContact O-N 2.84Å; A536-L556 HydrophobicContact CB-CD1 4.15Å; A536-L556 HydrophobicContact CB-CD2 4.47Å; A536-L571 HydrophobicContact CB-CD1 4.33Å; A536-F575 HydrophobicContact CB-CD2 4.12Å; A536-F575 HydrophobicContact CB-CE1 4.14Å; A536-F575 HydrophobicContact CB-CE2 3.62Å; A536-F575 HydrophobicContact CB-CZ 3.64Å; A536-V585 HydrophobicContact CB-CG1 3.82Å; A536-V585 HydrophobicContact CB-CG2 4.28Å; A536-V585 WeakPolarHBondContact O-CG2 3.35Å
537Q95.8Very high91.1Very high94 Ų9450.6 Ų50.644%0.43927%0.272SS..Hα-helixtrans-64.3-39.9174.9-173.663.111.800112.2L533 L534 I535 K540 A541 F575L533-Q537 WeakPolarHBondContact O-CB 3.43Å; L533-Q537 PolarHBondContact O-N 2.8Å; L534-Q537 WeakPolarHBondContact O-CB 3.31Å; L534-Q537 PolarHBondContact O-N 3.31Å; I535-Q537 VanDerWaalsContact C-N 3.29Å; I535-Q537 PolarHBondContact O-N 3.23Å; Q537-K540 PolarHBondContact O-N 3.47Å; Q537-A541 WeakPolarHBondContact O-CB 3.48Å; Q537-A541 PolarHBondContact O-N 3.01Å; Q537-F575 HydrophobicContact CB-CZ 4.15Å
538L94.4Very high91.1Very high57 Ų5750 Ų5030%0.29827%0.268SS..Hα-helixtrans-66.7-44.1175.8-67.5169.6000112M498 L534 I535 K540 A541 C542 L552M498-L538 HydrophobicContact CE-CD1 3.28Å; M498-L538 HydrophobicContact SD-CD1 3.89Å; L534-L538 HydrophobicContact CG-CD1 4.36Å; L534-L538 WeakPolarHBondContact O-CG 3.45Å; L534-L538 PolarHBondContact O-N 3.09Å; I535-L538 PolarHBondContact O-N 3.21Å; L538-K540 VanDerWaalsContact C-N 3.28Å; L538-K540 PolarHBondContact O-N 2.96Å; L538-A541 PolarHBondContact O-N 3.42Å; L538-A541 VanDerWaalsContact O-N 3.08Å; L538-C542 PolarHBondContact O-N 3.07Å; L538-C542 PolarHBondContact O-SG 3.37Å; L538-C542 VanDerWaalsContact O-SG 3.37Å; L538-L552 HydrophobicContact CB-CD1 4.02Å; L538-L552 HydrophobicContact CD1-CD2 4.39Å
539V93.9Very high90.9Very high0 Ų050.4 Ų50.40%027%0.27CS..Hα-helixtrans-57.6-42.5173.31670000110.7I535 A536 A541 C542 L549 L552 L556 P584I535-V539 HydrophobicContact CG2-CG2 4.4Å; I535-V539 WeakPolarHBondContact O-CG2 3.31Å; I535-V539 PolarHBondContact O-N 3.26Å; A536-V539 PolarHBondContact O-N 2.88Å; V539-A541 VanDerWaalsContact C-N 3.33Å; V539-A541 PolarHBondContact O-N 3.4Å; V539-C542 PolarHBondContact O-N 3.37Å; V539-L549 HydrophobicContact CB-CD1 4.36Å; V539-L549 HydrophobicContact CG1-CD1 3.87Å; V539-L549 HydrophobicContact CG2-CD1 4.42Å; V539-L552 HydrophobicContact CG2-CB 3.77Å; V539-L556 HydrophobicContact CG2-CD2 4.24Å; V539-P584 HydrophobicContact CG1-CB 4.49Å
540K91.9Very high90.6Very high53 Ų5354.7 Ų54.723%0.2329%0.292CS..Hα-helixtrans-64.2-35.2175.4178.3176175.3176.60112.7A536 Q537 L538 C542 F575 E581 N582 V585A536-K540 WeakPolarHBondContact O-CB 3.49Å; A536-K540 PolarHBondContact O-N 2.84Å; Q537-K540 PolarHBondContact O-N 3.47Å; L538-K540 VanDerWaalsContact C-N 3.28Å; L538-K540 PolarHBondContact O-N 2.96Å; K540-C542 VanDerWaalsContact C-N 3.33Å; K540-F575 HydrophobicContact CD-CD1 4.31Å; K540-F575 HydrophobicContact CD-CE1 4.14Å; K540-E581 WeakPolarHBondContact CE-O 3.16Å; K540-E581 IonicContact NZ-OE1 2.61Å; K540-N582 WeakPolarHBondContact CE-OD1 3.34Å; K540-N582 PolarHBondContact NZ-OD1 3.04Å; K540-V585 HydrophobicContact CB-CG2 4.06Å
541A91Very high90.6Very high63 Ų6349.5 Ų49.552%0.52127%0.268SS..Hα-helixtrans-76.7-16.5-178.900000113.8Q537 L538 V539 N543Q537-A541 WeakPolarHBondContact O-CB 3.48Å; Q537-A541 PolarHBondContact O-N 3.01Å; L538-A541 PolarHBondContact O-N 3.42Å; L538-A541 VanDerWaalsContact O-N 3.08Å; V539-A541 VanDerWaalsContact C-N 3.33Å; V539-A541 PolarHBondContact O-N 3.4Å; A541-N543 PolarHBondContact O-N 3.37Å
542C86.4Confident90.6Very high34 Ų3449.7 Ų49.723%0.2327%0.269CS..  trans-72.7111.3175-69.40000110.8L538 V539 K540 L549L538-C542 PolarHBondContact O-N 3.07Å; L538-C542 PolarHBondContact O-SG 3.37Å; L538-C542 VanDerWaalsContact O-SG 3.37Å; V539-C542 PolarHBondContact O-N 3.37Å; K540-C542 VanDerWaalsContact C-N 3.33Å; C542-L549 HydrophobicContact CB-CB 4.17Å; C542-L549 HydrophobicContact CB-CD1 3.9Å; C542-L549 HydrophobicContact CB-CD2 4.32Å; C542-L549 HydrophobicContact CB-CG 4.35Å
543N67.1Low90.4Very high162 Ų16249.7 Ų49.787%0.86627%0.27SS*.  trans-84.5-8-175.7-66.2-31.5000114.6A541A541-N543 PolarHBondContact O-N 3.37Å
544S72.3Confident90.3Very high81 Ų8150.2 Ų50.257%0.56627%0.272SS*.SBendtrans-146.4155-176.655.60000112.1C546S544-C546 PolarHBondContact O-N 3.15Å; S544-C546 VanDerWaalsContact O-N 3.08Å
545E76.9Confident90.3Very high167 Ų16746.9 Ų46.978%0.7826%0.255SS*.  trans-61.6107.8169.6-68.9-74.6174.200109.8
546C86.6Confident90.3Very high29 Ų2946.9 Ų46.920%0.19626%0.255CS..  trans-136.7168.6175.466.50000110.4S544 Q548 L549 L550S544-C546 PolarHBondContact O-N 3.15Å; S544-C546 VanDerWaalsContact O-N 3.08Å; C546-Q548 VanDerWaalsContact C-N 3.27Å; C546-Q548 PolarHBondContact O-N 3.29Å; C546-Q548 PolarHBondContact SG-OE1 3.32Å; C546-L549 PolarHBondContact O-N 3.47Å; C546-L549 PolarHBondContact SG-N 2.99Å; C546-L550 PolarHBondContact O-N 2.83Å; C546-L550 VanDerWaalsContact O-N 3.15Å
547Y89.9Confident90.2Very high33 Ų3351.9 Ų51.913%0.12927%0.274CS..Hα-helixtrans-66.5-29.7-178.866.8-93.6000112L502 Q503 A504 L550 H551 L831 E835L502-Y547 VanDerWaalsContact O-CE2 3.26Å; L502-Y547 WeakPolarHBondContact O-CE2 3.41Å; Q503-Y547 WeakPolarHBondContact O-CD2 3.29Å; Q503-Y547 VanDerWaalsContact O-CE2 3.32Å; Q503-Y547 WeakPolarHBondContact O-CE2 3.14Å; A504-Y547 VanDerWaalsContact CA-CE2 3.48Å; A504-Y547 HydrophobicContact CB-CD2 4.39Å; A504-Y547 HydrophobicContact CB-CE1 4.38Å; A504-Y547 HydrophobicContact CB-CE2 4.02Å; Y547-L550 WeakPolarHBondContact O-CB 3.33Å; Y547-L550 PolarHBondContact O-N 3.48Å; Y547-H551 PolarHBondContact O-CD2 3.46Å; Y547-H551 VanDerWaalsContact O-CG 3.23Å; Y547-H551 PolarHBondContact O-N 3.01Å; Y547-L831 HydrophobicContact CD1-CB 4.33Å; Y547-L831 HydrophobicContact CD1-CD1 4.33Å; Y547-L831 HydrophobicContact CE1-CB 3.91Å; Y547-E835 PolarHBondContact OH-OE2 3.22Å
548Q93.2Very high90.1Very high29 Ų2951.5 Ų51.514%0.13627%0.268CS..Hα-helixtrans-65.5-43.9174.2-61.794.1-31.900111.6L502 C546 L550 H551 L552 E835L502-Q548 HydrophobicContact CB-CG 4.24Å; L502-Q548 HydrophobicContact CD2-CB 3.84Å; L502-Q548 HydrophobicContact CD2-CG 3.93Å; L502-Q548 WeakPolarHBondContact O-CG 3.42Å; C546-Q548 VanDerWaalsContact C-N 3.27Å; C546-Q548 PolarHBondContact O-N 3.29Å; C546-Q548 PolarHBondContact SG-OE1 3.32Å; Q548-L550 PolarHBondContact O-N 3.36Å; Q548-H551 PolarHBondContact O-N 3.18Å; Q548-L552 VanDerWaalsContact O-CB 3.31Å; Q548-L552 WeakPolarHBondContact O-CB 3.3Å; Q548-L552 VanDerWaalsContact O-CG 3.29Å; Q548-L552 WeakPolarHBondContact O-CG 3.28Å; Q548-L552 PolarHBondContact O-N 3.46Å; Q548-E835 PolarHBondContact NE2-OE2 3.1Å; Q548-E835 PolarHBondContact OE1-OE1 3.41Å
549L93Very high90.2Very high11 Ų1148.8 Ų48.86%0.05825%0.254CS..Hα-helixtrans-59.5-40.4175.617858.3000110.5V539 C542 C546 G553V539-L549 HydrophobicContact CB-CD1 4.36Å; V539-L549 HydrophobicContact CG1-CD1 3.87Å; V539-L549 HydrophobicContact CG2-CD1 4.42Å; C542-L549 HydrophobicContact CB-CB 4.17Å; C542-L549 HydrophobicContact CB-CD1 3.9Å; C542-L549 HydrophobicContact CB-CD2 4.32Å; C542-L549 HydrophobicContact CB-CG 4.35Å; C546-L549 PolarHBondContact O-N 3.47Å; C546-L549 PolarHBondContact SG-N 2.99Å; L549-G553 WeakPolarHBondContact O-CA 3.44Å; L549-G553 PolarHBondContact O-N 3.48Å
550L92.1Very high90.2Very high106 Ų10648.8 Ų48.856%0.55525%0.254SS*.Hα-helixtrans-60-48174.7-178.571.1000111.9C546 Y547 Q548 L554C546-L550 PolarHBondContact O-N 2.83Å; C546-L550 VanDerWaalsContact O-N 3.15Å; Y547-L550 WeakPolarHBondContact O-CB 3.33Å; Y547-L550 PolarHBondContact O-N 3.48Å; Q548-L550 PolarHBondContact O-N 3.36Å; L550-L554 WeakPolarHBondContact O-CB 3.47Å; L550-L554 PolarHBondContact O-N 3.05Å
551H96Very high90.3Very high4 Ų450.8 Ų50.82%0.01926%0.263CS..Hα-helixtrans-68.7-46.3-178.8-60.6165000112.2V501 Q503 T506 A509 Y547 Q548 L554 L555V501-H551 HydrophobicContact CG1-CB 3.96Å; V501-H551 WeakPolarHBondContact O-CB 3.5Å; V501-H551 PolarHBondContact O-ND1 3.15Å; Q503-H551 PolarHBondContact O-CE1 2.91Å; Q503-H551 VanDerWaalsContact O-CE1 3.25Å; Q503-H551 PolarHBondContact O-ND1 3.4Å; T506-H551 PolarHBondContact OG1-NE2 3.35Å; A509-H551 HydrophobicContact CB-CB 4.34Å; A509-H551 VanDerWaalsContact CB-ND1 3.3Å; A509-H551 WeakPolarHBondContact CB-ND1 3.38Å; Y547-H551 PolarHBondContact O-CD2 3.46Å; Y547-H551 VanDerWaalsContact O-CG 3.23Å; Y547-H551 PolarHBondContact O-N 3.01Å; Q548-H551 PolarHBondContact O-N 3.18Å; H551-L554 WeakPolarHBondContact O-CB 3.5Å; H551-L554 PolarHBondContact O-N 2.65Å; H551-L555 PolarHBondContact O-N 2.87Å
552L96.6Very high90.5Very high4 Ų450.8 Ų50.82%0.02125%0.254CS..Hα-helixtrans-61.7-43.5175.4-71.5171.3000111.5M498 V501 L502 I535 L538 V539 Q548 L554 L555 L556M498-L552 HydrophobicContact SD-CD2 4.39Å; V501-L552 HydrophobicContact CG1-CD2 3.98Å; V501-L552 HydrophobicContact CG1-CG 4.37Å; L502-L552 HydrophobicContact CD2-CD1 3.86Å; L502-L552 HydrophobicContact CD2-CD2 4.12Å; L502-L552 HydrophobicContact CD2-CG 3.99Å; I535-L552 HydrophobicContact CG2-CD2 4.36Å; L538-L552 HydrophobicContact CB-CD1 4.02Å; L538-L552 HydrophobicContact CD1-CD2 4.39Å; V539-L552 HydrophobicContact CG2-CB 3.77Å; Q548-L552 VanDerWaalsContact O-CB 3.31Å; Q548-L552 WeakPolarHBondContact O-CB 3.3Å; Q548-L552 VanDerWaalsContact O-CG 3.29Å; Q548-L552 WeakPolarHBondContact O-CG 3.28Å; Q548-L552 PolarHBondContact O-N 3.46Å; L552-L554 VanDerWaalsContact C-N 3.32Å; L552-L554 PolarHBondContact O-N 2.98Å; L552-L555 WeakPolarHBondContact O-CB 3.47Å; L552-L555 PolarHBondContact O-N 3.27Å; L552-L556 WeakPolarHBondContact O-CB 3.31Å; L552-L556 PolarHBondContact O-N 3.43Å
553G94.1Very high91Very high1 Ų149.8 Ų49.81%0.0125%0.246CC..Hα-helixtrans-61.7-39.8175.700000112.2L549 R557L549-G553 WeakPolarHBondContact O-CA 3.44Å; L549-G553 PolarHBondContact O-N 3.48Å; G553-R557 WeakPolarHBondContact O-CB 3.15Å; G553-R557 PolarHBondContact O-N 3.11Å
554L94.9Very high92.3Very high56 Ų5644.5 Ų44.529%0.29322%0.219SC..Hα-helixtrans-65.3-40.7173.7179.863.7000112.3L510 L550 H551 L552 R557 R558L510-L554 HydrophobicContact CD2-CD2 3.25Å; L550-L554 WeakPolarHBondContact O-CB 3.47Å; L550-L554 PolarHBondContact O-N 3.05Å; H551-L554 WeakPolarHBondContact O-CB 3.5Å; H551-L554 PolarHBondContact O-N 2.65Å; L552-L554 VanDerWaalsContact C-N 3.32Å; L552-L554 PolarHBondContact O-N 2.98Å; L554-R557 WeakPolarHBondContact O-CB 3.4Å; L554-R558 WeakPolarHBondContact O-CG 3.42Å; L554-R558 PolarHBondContact O-N 3.44Å
555L97.4Very high93.3Very high0 Ų044.4 Ų44.40%022%0.217CC..Hα-helixtrans-62.5-52.3176.1-178.658.6000111.1V501 V513 W516 I535 H551 L552 R557 R558 M559V501-L555 HydrophobicContact CG2-CD2 4.42Å; V513-L555 HydrophobicContact CB-CD1 4.23Å; V513-L555 HydrophobicContact CG1-CB 4.32Å; V513-L555 HydrophobicContact CG1-CD1 3.82Å; V513-L555 HydrophobicContact CG2-CB 3.97Å; V513-L555 HydrophobicContact CG2-CD1 4.2Å; W516-L555 HydrophobicContact CB-CD1 4.11Å; W516-L555 HydrophobicContact CD2-CD2 3.91Å; W516-L555 HydrophobicContact CE3-CD2 3.52Å; W516-L555 HydrophobicContact CG-CD1 4.4Å; W516-L555 HydrophobicContact CG-CD2 4.46Å; W516-L555 HydrophobicContact CZ3-CD2 3.92Å; I535-L555 HydrophobicContact CD1-CD2 3.43Å; I535-L555 VanDerWaalsContact CD1-CD2 3.43Å; I535-L555 HydrophobicContact CD1-CG 3.75Å; I535-L555 HydrophobicContact CG1-CD2 4.04Å; H551-L555 PolarHBondContact O-N 2.87Å; L552-L555 WeakPolarHBondContact O-CB 3.47Å; L552-L555 PolarHBondContact O-N 3.27Å; L555-R557 VanDerWaalsContact C-N 3.3Å; L555-R557 PolarHBondContact O-N 3.32Å; L555-R558 PolarHBondContact O-N 3.33Å; L555-R558 VanDerWaalsContact O-N 3.07Å; L555-M559 HydrophobicContact CD1-CE 3.98Å; L555-M559 HydrophobicContact CD1-CG 4.08Å; L555-M559 HydrophobicContact CD1-SD 4.17Å; L555-M559 HydrophobicContact CG-CE 4.47Å; L555-M559 HydrophobicContact CG-CG 4.43Å; L555-M559 HydrophobicContact CG-SD 4.21Å; L555-M559 WeakPolarHBondContact O-CG 3.42Å; L555-M559 PolarHBondContact O-N 3.28Å
556L96.4Very high94.2Very high0 Ų039.6 Ų39.60%020%0.202CC..Hα-helixtrans-53.6-49.4176.6-179.862.6000110.8V532 I535 A536 V539 L552 R558 M559 V560 V585 H588 V589V532-L556 HydrophobicContact CG1-CD1 3.91Å; I535-L556 HydrophobicContact CG2-CB 3.89Å; A536-L556 HydrophobicContact CB-CD1 4.15Å; A536-L556 HydrophobicContact CB-CD2 4.47Å; V539-L556 HydrophobicContact CG2-CD2 4.24Å; L552-L556 WeakPolarHBondContact O-CB 3.31Å; L552-L556 PolarHBondContact O-N 3.43Å; L556-R558 PolarHBondContact O-N 3.49Å; L556-M559 PolarHBondContact O-N 3.47Å; L556-V560 HydrophobicContact CD1-CG2 4.16Å; L556-V560 WeakPolarHBondContact O-CG2 3.48Å; L556-V560 PolarHBondContact O-N 3.22Å; L556-V585 HydrophobicContact CD2-CG1 3.87Å; L556-H588 HydrophobicContact CD2-CB 4.35Å; L556-V589 HydrophobicContact CD2-CG2 4.18Å; L556-V589 HydrophobicContact CG-CG2 4.3Å
557R93.5Very high94.6Very high106 Ų10639 Ų3940%0.420%0.196SC..Hα-helixtrans-53.1-39.8178.8-175.8172.2168.8173.11.1112.8G553 L554 L555 F561 H588 L590G553-R557 WeakPolarHBondContact O-CB 3.15Å; G553-R557 PolarHBondContact O-N 3.11Å; L554-R557 WeakPolarHBondContact O-CB 3.4Å; L555-R557 VanDerWaalsContact C-N 3.3Å; L555-R557 PolarHBondContact O-N 3.32Å; R557-F561 VanDerWaalsContact O-CD2 3.3Å; R557-F561 WeakPolarHBondContact O-CD2 3.45Å; R557-H588 WeakPolarHBondContact CB-O 3.37Å; R557-H588 WeakPolarHBondContact CG-O 3.42Å; R557-L590 HydrophobicContact CG-CD1 4.24Å; R557-L590 HydrophobicContact CG-CG 3.85Å
558R95.3Very high94.9Very high85 Ų8537.9 Ų37.932%0.32119%0.192SC..Hα-helixtrans-80.7-39.3-178.7-71175.364.4172.40.6112D514 L554 L555 L556 F561D514-R558 IonicContact OD1-CZ 2.73Å; D514-R558 IonicContact OD1-NH1 3.63Å; D514-R558 PolarHBondContact OD1-NH1 3.48Å; D514-R558 IonicContact OD1-NH2 3.18Å; D514-R558 PolarHBondContact OD1-NH2 3.1Å; L554-R558 WeakPolarHBondContact O-CG 3.42Å; L554-R558 PolarHBondContact O-N 3.44Å; L555-R558 PolarHBondContact O-N 3.33Å; L555-R558 VanDerWaalsContact O-N 3.07Å; L556-R558 PolarHBondContact O-N 3.49Å; R558-F561 PolarHBondContact O-N 3.36Å
559M95.8Very high95Very high0 Ų040.3 Ų40.30%021%0.206CC..Hα-helixtrans-68.5-32.9-179-73-168.8154.400113.2W516 A520 H531 V532 I535 L555 L556 F561 L562W516-M559 HydrophobicContact CB-CE 4.22Å; W516-M559 HydrophobicContact CD2-CE 4.29Å; W516-M559 HydrophobicContact CG-CE 3.62Å; A520-M559 HydrophobicContact CB-CE 3.71Å; H531-M559 HydrophobicContact CB-CE 4.12Å; H531-M559 HydrophobicContact CB-SD 4.15Å; V532-M559 HydrophobicContact CG2-CB 3.57Å; V532-M559 HydrophobicContact CG2-SD 4.3Å; I535-M559 HydrophobicContact CD1-CE 4.07Å; I535-M559 HydrophobicContact CD1-SD 3.32Å; I535-M559 WeakPolarHBondContact CD1-SD 3.48Å; L555-M559 HydrophobicContact CD1-CE 3.98Å; L555-M559 HydrophobicContact CD1-CG 4.08Å; L555-M559 HydrophobicContact CD1-SD 4.17Å; L555-M559 HydrophobicContact CG-CE 4.47Å; L555-M559 HydrophobicContact CG-CG 4.43Å; L555-M559 HydrophobicContact CG-SD 4.21Å; L555-M559 WeakPolarHBondContact O-CG 3.42Å; L555-M559 PolarHBondContact O-N 3.28Å; L556-M559 PolarHBondContact O-N 3.47Å; M559-F561 PolarHBondContact O-N 2.98Å; M559-F561 VanDerWaalsContact O-N 3.16Å; M559-L562 WeakPolarHBondContact O-CA 3.44Å; M559-L562 VanDerWaalsContact O-CB 3.3Å; M559-L562 WeakPolarHBondContact O-CB 3.37Å; M559-L562 PolarHBondContact O-N 2.86Å
560V94.6Very high95.2Very high0 Ų044.1 Ų44.10%022%0.223CC..G310 helixtrans-60.2-28.5177.6173.60000112.6V532 L556 L562 M563 L571 V589 A593 L594V532-V560 HydrophobicContact CG1-CG2 4.32Å; L556-V560 HydrophobicContact CD1-CG2 4.16Å; L556-V560 WeakPolarHBondContact O-CG2 3.48Å; L556-V560 PolarHBondContact O-N 3.22Å; V560-L562 PolarHBondContact O-N 3.32Å; V560-M563 HydrophobicContact CG1-SD 4.48Å; V560-M563 HydrophobicContact CG2-SD 4.23Å; V560-M563 PolarHBondContact O-N 3.14Å; V560-L571 HydrophobicContact CG2-CD2 4.16Å; V560-V589 HydrophobicContact CG1-CG1 4.06Å; V560-V589 HydrophobicContact CG2-CG1 4.47Å; V560-V589 HydrophobicContact CG2-CG2 4.14Å; V560-A593 HydrophobicContact CG1-CB 4Å; V560-L594 HydrophobicContact CG1-CD2 3.75Å
561F93.9Very high95.4Very high96 Ų9639.1 Ų39.142%0.42120%0.197SC..G310 helixtrans-66.1-17.8172.8-79-84.6000114R557 R558 M559 L590 R592 A593R557-F561 VanDerWaalsContact O-CD2 3.3Å; R557-F561 WeakPolarHBondContact O-CD2 3.45Å; R558-F561 PolarHBondContact O-N 3.36Å; M559-F561 PolarHBondContact O-N 2.98Å; M559-F561 VanDerWaalsContact O-N 3.16Å; F561-L590 HydrophobicContact CE2-CB 4.36Å; F561-L590 HydrophobicContact CE2-CD1 3.95Å; F561-L590 HydrophobicContact CZ-CB 4.38Å; F561-L590 HydrophobicContact CZ-CD1 3.98Å; F561-R592 HydrophobicContact CE1-CG 4.47Å; F561-R592 HydrophobicContact CZ-CG 4.11Å; F561-A593 HydrophobicContact CD1-CB 3.61Å; F561-A593 HydrophobicContact CD2-CB 3.72Å; F561-A593 HydrophobicContact CE1-CB 3.55Å; F561-A593 HydrophobicContact CE2-CB 3.66Å; F561-A593 HydrophobicContact CG-CB 3.69Å; F561-A593 HydrophobicContact CZ-CB 3.58Å
562L95.1Very high95.4Very high62 Ų6238.9 Ų38.933%0.32520%0.196SC..G310 helixtrans-93.7-9.3-178.3-52.2176.6000112.2C517 A520 R521 M559 V560C517-L562 WeakPolarHBondContact O-CD1 3.39Å; A520-L562 HydrophobicContact CB-CD1 4.14Å; R521-L562 HydrophobicContact CB-CD1 4.03Å; R521-L562 HydrophobicContact CB-CD2 4.24Å; R521-L562 HydrophobicContact CG-CD2 4.31Å; M559-L562 WeakPolarHBondContact O-CA 3.44Å; M559-L562 VanDerWaalsContact O-CB 3.3Å; M559-L562 WeakPolarHBondContact O-CB 3.37Å; M559-L562 PolarHBondContact O-N 2.86Å; V560-L562 PolarHBondContact O-N 3.32Å
563M96.1Very high95.4Very high14 Ų1442.2 Ų42.27%0.06922%0.224CC..  trans-77147.4-177.6-62.5-178.580.400112.3L529 V532 V560 H567 Q568 L571L529-M563 HydrophobicContact CD1-CE 3.68Å; V532-M563 HydrophobicContact CB-CE 4.45Å; V532-M563 HydrophobicContact CB-SD 4.16Å; V532-M563 HydrophobicContact CG1-CE 4.17Å; V532-M563 HydrophobicContact CG1-SD 3.7Å; V532-M563 HydrophobicContact CG2-CG 4.14Å; V532-M563 HydrophobicContact CG2-SD 3.98Å; V560-M563 HydrophobicContact CG1-SD 4.48Å; V560-M563 HydrophobicContact CG2-SD 4.23Å; V560-M563 PolarHBondContact O-N 3.14Å; M563-H567 HydrophobicContact CB-CB 4.45Å; M563-H567 VanDerWaalsContact CE-C 3.44Å; M563-H567 HydrophobicContact CE-CB 3.65Å; M563-H567 WeakPolarHBondContact CE-O 3.42Å; M563-Q568 HydrophobicContact CB-CG 3.87Å; M563-Q568 HydrophobicContact SD-CG 4.49Å; M563-L571 HydrophobicContact CE-CB 4.17Å; M563-L571 HydrophobicContact SD-CD2 4.16Å
564T93.8Very high95.4Very high50 Ų5048.2 Ų48.231%0.30725%0.251SS..  trans-74.7159.4167.763.90000110.8A525 S566 H567 Q568A525-T564 HydrophobicContact CB-CG2 4.27Å; T564-S566 VanDerWaalsContact C-N 3.26Å; T564-S566 PolarHBondContact O-N 2.94Å; T564-S566 PolarHBondContact OG1-OG 3.21Å; T564-H567 PolarHBondContact O-N 2.98Å; T564-H567 WeakPolarHBondContact OG1-CB 3.41Å; T564-H567 VanDerWaalsContact OG1-CG 3.23Å; T564-H567 PolarHBondContact OG1-N 3.38Å; T564-H567 PolarHBondContact OG1-ND1 2.9Å; T564-Q568 WeakPolarHBondContact O-CG 3.45Å; T564-Q568 PolarHBondContact O-N 3.27Å
565P94.1Very high95.4Very high79 Ų7945.8 Ų45.851%0.51324%0.238SC..Hα-helixtrans-57.4-34.8176-27.135.9000114.3Q568 L569P565-Q568 PolarHBondContact O-N 3.41Å; P565-L569 PolarHBondContact O-N 2.95Å
566S95.3Very high95.3Very high66 Ų6647 Ų4746%0.46225%0.247SC..Hα-helixtrans-64.8-4717654.30000111.6T564 Q568 L569 E570T564-S566 VanDerWaalsContact C-N 3.26Å; T564-S566 PolarHBondContact O-N 2.94Å; T564-S566 PolarHBondContact OG1-OG 3.21Å; S566-Q568 VanDerWaalsContact C-N 3.27Å; S566-Q568 PolarHBondContact O-N 2.6Å; S566-L569 WeakPolarHBondContact O-CB 3.33Å; S566-L569 PolarHBondContact O-N 2.78Å; S566-E570 PolarHBondContact O-N 2.73Å
567H96.3Very high95Very high18 Ų1847 Ų478%0.08325%0.247CC..Hα-helixtrans-66.6-31.1178.4-65.7172.4000111.9A525 L529 M563 T564 L569 E570 L571A525-H567 VanDerWaalsContact C-CE1 3.41Å; A525-H567 PolarHBondContact O-CE1 3.26Å; A525-H567 VanDerWaalsContact O-CE1 3.25Å; A525-H567 PolarHBondContact O-ND1 2.92Å; A525-H567 VanDerWaalsContact O-ND1 3.12Å; L529-H567 HydrophobicContact CB-CB 4.29Å; L529-H567 HydrophobicContact CD1-CB 4.04Å; L529-H567 HydrophobicContact CD2-CB 4.42Å; L529-H567 HydrophobicContact CG-CB 4.48Å; M563-H567 HydrophobicContact CB-CB 4.45Å; M563-H567 VanDerWaalsContact CE-C 3.44Å; M563-H567 HydrophobicContact CE-CB 3.65Å; M563-H567 WeakPolarHBondContact CE-O 3.42Å; T564-H567 PolarHBondContact O-N 2.98Å; T564-H567 WeakPolarHBondContact OG1-CB 3.41Å; T564-H567 VanDerWaalsContact OG1-CG 3.23Å; T564-H567 PolarHBondContact OG1-N 3.38Å; T564-H567 PolarHBondContact OG1-ND1 2.9Å; H567-L569 VanDerWaalsContact C-N 3.3Å; H567-L569 PolarHBondContact O-N 3.33Å; H567-E570 IonicContact CD2-OE1 3.97Å; H567-E570 PolarHBondContact CD2-OE1 3.47Å; H567-E570 PolarHBondContact O-N 3.45Å; H567-L571 PolarHBondContact O-N 2.9Å
568Q96.1Very high94.8Very high8 Ų843.7 Ų43.74%0.03724%0.24CC..Hα-helixtrans-64-34.6172.3-69.7174.30.300112.2M563 T564 P565 S566 L571 V572 A593 L594 S595 V598M563-Q568 HydrophobicContact CB-CG 3.87Å; M563-Q568 HydrophobicContact SD-CG 4.49Å; T564-Q568 WeakPolarHBondContact O-CG 3.45Å; T564-Q568 PolarHBondContact O-N 3.27Å; P565-Q568 PolarHBondContact O-N 3.41Å; S566-Q568 VanDerWaalsContact C-N 3.27Å; S566-Q568 PolarHBondContact O-N 2.6Å; Q568-L571 PolarHBondContact O-N 2.66Å; Q568-V572 WeakPolarHBondContact O-CG2 3.31Å; Q568-V572 PolarHBondContact O-N 2.97Å; Q568-V572 VanDerWaalsContact O-N 3.13Å; Q568-A593 PolarHBondContact NE2-O 3.36Å; Q568-L594 HydrophobicContact CB-CD2 4.46Å; Q568-L594 HydrophobicContact CG-CD2 4.14Å; Q568-S595 PolarHBondContact OE1-OG 3.27Å; Q568-S595 VanDerWaalsContact OE1-OG 3.05Å; Q568-V598 HydrophobicContact CB-CG1 4.14Å; Q568-V598 HydrophobicContact CB-CG2 4.12Å
569L95.5Very high94.5Very high81 Ų8145 Ų4542%0.42425%0.248SC..Hα-helixtrans-67.3-37.6173.3-71.8167.7000111.8P565 S566 H567 V572 A573 V598P565-L569 PolarHBondContact O-N 2.95Å; S566-L569 WeakPolarHBondContact O-CB 3.33Å; S566-L569 PolarHBondContact O-N 2.78Å; H567-L569 VanDerWaalsContact C-N 3.3Å; H567-L569 PolarHBondContact O-N 3.33Å; L569-V572 PolarHBondContact O-N 2.92Å; L569-A573 WeakPolarHBondContact O-CB 3.35Å; L569-A573 PolarHBondContact O-N 3.49Å; L569-V598 HydrophobicContact CD2-CG2 3.73Å; L569-V598 HydrophobicContact CG-CG2 3.83Å
570E96.4Very high93.9Very high91 Ų9147.7 Ų47.743%0.42527%0.265SS..Hα-helixtrans-64.5-41.9174.7-67.7177.2-121.400111.7L529 S566 H567 V572 A573 E574L529-E570 HydrophobicContact CD1-CB 4.32Å; L529-E570 VanDerWaalsContact CD2-OE2 3.29Å; L529-E570 WeakPolarHBondContact CD2-OE2 3.39Å; S566-E570 PolarHBondContact O-N 2.73Å; H567-E570 IonicContact CD2-OE1 3.97Å; H567-E570 PolarHBondContact CD2-OE1 3.47Å; H567-E570 PolarHBondContact O-N 3.45Å; E570-V572 VanDerWaalsContact C-N 3.31Å; E570-V572 PolarHBondContact O-N 3.39Å; E570-A573 WeakPolarHBondContact O-CB 3.42Å; E570-A573 PolarHBondContact O-N 2.98Å; E570-A573 VanDerWaalsContact O-N 3.12Å; E570-E574 PolarHBondContact O-N 3.25Å
571L96.7Very high93.5Very high0 Ų053 Ų530%029%0.289CS..Hα-helixtrans-57.2-44172.5178.367.7000111.8V532 L533 A536 V560 M563 H567 Q568 A573 F575 W586V532-L571 HydrophobicContact CG1-CD1 3.98Å; V532-L571 HydrophobicContact CG1-CD2 4.31Å; L533-L571 HydrophobicContact CD2-CD1 4.06Å; A536-L571 HydrophobicContact CB-CD1 4.33Å; V560-L571 HydrophobicContact CG2-CD2 4.16Å; M563-L571 HydrophobicContact CE-CB 4.17Å; M563-L571 HydrophobicContact SD-CD2 4.16Å; H567-L571 PolarHBondContact O-N 2.9Å; Q568-L571 PolarHBondContact O-N 2.66Å; L571-A573 VanDerWaalsContact C-N 3.34Å; L571-F575 HydrophobicContact CD1-CD2 3.73Å; L571-F575 HydrophobicContact CD1-CE2 4.25Å; L571-F575 WeakPolarHBondContact O-CB 3.43Å; L571-F575 PolarHBondContact O-N 3.28Å; L571-W586 HydrophobicContact CD2-CH2 4.38Å; L571-W586 HydrophobicContact CG-CH2 4.43Å
572V95.8Very high93.4Very high0 Ų048.5 Ų48.50%027%0.27CS..Hα-helixtrans-67.5-35.5176.5173.30000111.9Q568 L569 E570 F575 S576 W586 V598 V602Q568-V572 WeakPolarHBondContact O-CG2 3.31Å; Q568-V572 PolarHBondContact O-N 2.97Å; Q568-V572 VanDerWaalsContact O-N 3.13Å; L569-V572 PolarHBondContact O-N 2.92Å; E570-V572 VanDerWaalsContact C-N 3.31Å; E570-V572 PolarHBondContact O-N 3.39Å; V572-F575 CarbonylContact O-C 3.58Å; V572-S576 WeakPolarHBondContact O-CA 3.49Å; V572-S576 PolarHBondContact O-N 3.4Å; V572-S576 VanDerWaalsContact O-N 3.11Å; V572-W586 HydrophobicContact CG2-CH2 3.56Å; V572-W586 HydrophobicContact CG2-CZ2 3.93Å; V572-V598 HydrophobicContact CG2-CG1 3.73Å; V572-V602 HydrophobicContact CG2-CG2 3.61Å
573A95.3Very high93Very high73 Ų7345.6 Ų45.660%0.60326%0.255SS*.Hα-helixtrans-65.5-45.9177.700000111.4L569 E570 L571L569-A573 WeakPolarHBondContact O-CB 3.35Å; L569-A573 PolarHBondContact O-N 3.49Å; E570-A573 WeakPolarHBondContact O-CB 3.42Å; E570-A573 PolarHBondContact O-N 2.98Å; E570-A573 VanDerWaalsContact O-N 3.12Å; L571-A573 VanDerWaalsContact C-N 3.34Å
574E96Very high92.5Very high128 Ų12846.7 Ų46.760%0.59826%0.263SS*.Hα-helixtrans-71.2-46.4179.4-169.463-162.600111.5L533 E570L533-E574 HydrophobicContact CD2-CB 4.26Å; L533-E574 HydrophobicContact CD2-CG 4.41Å; E570-E574 PolarHBondContact O-N 3.25Å
575F95Very high92.4Very high4 Ų444.3 Ų44.32%0.01825%0.248CC..THydrogen-bonded Turntrans-111.260.5-177.5-59.3-86.6000111.7L533 A536 Q537 K540 L571 V572 P577 N582 V585 W586L533-F575 HydrophobicContact CD2-CD2 4.27Å; L533-F575 HydrophobicContact CD2-CE2 3.82Å; A536-F575 HydrophobicContact CB-CD2 4.12Å; A536-F575 HydrophobicContact CB-CE1 4.14Å; A536-F575 HydrophobicContact CB-CE2 3.62Å; A536-F575 HydrophobicContact CB-CZ 3.64Å; Q537-F575 HydrophobicContact CB-CZ 4.15Å; K540-F575 HydrophobicContact CD-CD1 4.31Å; K540-F575 HydrophobicContact CD-CE1 4.14Å; L571-F575 HydrophobicContact CD1-CD2 3.73Å; L571-F575 HydrophobicContact CD1-CE2 4.25Å; L571-F575 WeakPolarHBondContact O-CB 3.43Å; L571-F575 PolarHBondContact O-N 3.28Å; V572-F575 CarbonylContact O-C 3.58Å; F575-P577 WeakPolarHBondContact O-CD 3.42Å; F575-N582 HydrophobicContact CB-CB 4.45Å; F575-V585 HydrophobicContact CD1-CG2 3.86Å; F575-V585 HydrophobicContact CE1-CG2 4.27Å; F575-V585 HydrophobicContact CG-CG2 4.42Å; F575-W586 WeakPolarHBondContact O-CZ2 3.48Å; F575-W586 PolarHBondContact O-NE1 3.42Å
576S93.9Very high92.2Very high25 Ų2540.6 Ų40.618%0.17522%0.224CC..  trans-52.7123.9-179.6172.70000112.6V572 S578 K579 N582 E605V572-S576 WeakPolarHBondContact O-CA 3.49Å; V572-S576 PolarHBondContact O-N 3.4Å; V572-S576 VanDerWaalsContact O-N 3.11Å; S576-S578 PolarHBondContact O-N 3.21Å; S576-S578 PolarHBondContact OG-N 3.21Å; S576-K579 PolarHBondContact O-N 3.36Å; S576-N582 PolarHBondContact N-ND2 3.4Å; S576-N582 WeakPolarHBondContact O-CB 3.48Å; S576-N582 PolarHBondContact O-ND2 3.47Å; S576-N582 VanDerWaalsContact O-ND2 3.11Å; S576-E605 PolarHBondContact OG-OE2 3.34Å
577P90.6Very high91.7Very high0 Ų040.1 Ų40.10%021%0.214CC..THydrogen-bonded Turntrans-61.6-19.8176.6-14.719.7000114.1F575 K579 W586 V602 E605 I606 L609F575-P577 WeakPolarHBondContact O-CD 3.42Å; P577-K579 PolarHBondContact O-N 3.25Å; P577-W586 HydrophobicContact CB-CG 4.45Å; P577-W586 HydrophobicContact CG-CD2 4.2Å; P577-W586 HydrophobicContact CG-CZ2 3.84Å; P577-V602 HydrophobicContact CB-CG1 4.48Å; P577-V602 HydrophobicContact CG-CB 4.27Å; P577-V602 HydrophobicContact CG-CG1 3.95Å; P577-V602 HydrophobicContact CG-CG2 3.99Å; P577-E605 HydrophobicContact CB-CB 3.95Å; P577-E605 WeakPolarHBondContact CD-OE2 3.19Å; P577-E605 HydrophobicContact CG-CB 4.24Å; P577-I606 HydrophobicContact CB-CG1 3.85Å; P577-L609 WeakPolarHBondContact O-CD2 3.46Å
578S89.4Confident91.3Very high37 Ų3741.3 Ų41.326%0.25922%0.22SC..THydrogen-bonded Turntrans-68.1-9.4177.3-63.20000114.3S576 E605S576-S578 PolarHBondContact O-N 3.21Å; S576-S578 PolarHBondContact OG-N 3.21Å; S578-E605 PolarHBondContact N-OE2 2.87Å; S578-E605 WeakPolarHBondContact OG-CG 3.33Å; S578-E605 PolarHBondContact OG-OE2 3.06Å
579K88.3Confident91Very high112 Ų11241 Ų4149%0.48722%0.218SC..SBendtrans-108.5127.6-179.9-61.9-175.8-179.9178.60111.1S576 P577 E581 N582S576-K579 PolarHBondContact O-N 3.36Å; P577-K579 PolarHBondContact O-N 3.25Å; K579-E581 VanDerWaalsContact C-N 3.27Å; K579-E581 HydrophobicContact CB-CG 3.96Å; K579-E581 PolarHBondContact O-N 3.38Å; K579-N582 PolarHBondContact O-N 3.12Å
580V84Confident90.6Very high58 Ų5838.1 Ų38.135%0.35220%0.203SC..G310 helixtrans-57.1-38.5-178.9-179.90000112.4N582 L583 L609 T632V580-N582 PolarHBondContact O-N 2.88Å; V580-L583 HydrophobicContact CG1-CD1 4.33Å; V580-L583 WeakPolarHBondContact O-CB 3.4Å; V580-L583 WeakPolarHBondContact O-CG 3.2Å; V580-L583 PolarHBondContact O-N 3.04Å; V580-L583 VanDerWaalsContact O-N 3.14Å; V580-L609 HydrophobicContact CG2-CD1 4.12Å; V580-L609 HydrophobicContact CG2-CD2 4.32Å; V580-T632 HydrophobicContact CG1-CG2 4.5Å
581E86.5Confident90.1Very high111 Ų11133.9 Ų33.952%0.51918%0.183SC..G310 helixtrans-61.8-21.117857174.3-164.400114.5K540 K579K540-E581 WeakPolarHBondContact CE-O 3.16Å; K540-E581 IonicContact NZ-OE1 2.61Å; K579-E581 VanDerWaalsContact C-N 3.27Å; K579-E581 HydrophobicContact CB-CG 3.96Å; K579-E581 PolarHBondContact O-N 3.38Å
582N90.8Very high89.5Confident2 Ų240.9 Ų40.91%0.01121%0.21CC..G310 helixtrans-96.6-8.6-179.7-68.3-21.7000112.4K540 F575 S576 K579 V580 P584 V585K540-N582 WeakPolarHBondContact CE-OD1 3.34Å; K540-N582 PolarHBondContact NZ-OD1 3.04Å; F575-N582 HydrophobicContact CB-CB 4.45Å; S576-N582 PolarHBondContact N-ND2 3.4Å; S576-N582 WeakPolarHBondContact O-CB 3.48Å; S576-N582 PolarHBondContact O-ND2 3.47Å; S576-N582 VanDerWaalsContact O-ND2 3.11Å; K579-N582 PolarHBondContact O-N 3.12Å; V580-N582 PolarHBondContact O-N 2.88Å; N582-P584 VanDerWaalsContact C-N 3.35Å; N582-V585 WeakPolarHBondContact O-CB 3.35Å; N582-V585 PolarHBondContact O-N 3.3Å; N582-V585 VanDerWaalsContact O-N 3.15Å
583L86.2Confident89.2Confident1 Ų141.6 Ų41.61%0.00522%0.215CC..Hα-helixtrans-56.7-39.2-178.2-69.6-175000113.9V580 V585 W586 H587 L609 T632 S636V580-L583 HydrophobicContact CG1-CD1 4.33Å; V580-L583 WeakPolarHBondContact O-CB 3.4Å; V580-L583 WeakPolarHBondContact O-CG 3.2Å; V580-L583 PolarHBondContact O-N 3.04Å; V580-L583 VanDerWaalsContact O-N 3.14Å; L583-V585 PolarHBondContact O-N 2.98Å; L583-V585 VanDerWaalsContact O-N 3.1Å; L583-W586 PolarHBondContact O-N 3.25Å; L583-H587 PolarHBondContact O-N 3.47Å; L583-H587 PolarHBondContact O-ND1 3.22Å; L583-L609 HydrophobicContact CD1-CD2 3.83Å; L583-L609 HydrophobicContact CD2-CD2 3.82Å; L583-L609 HydrophobicContact CG-CD2 4.09Å; L583-T632 HydrophobicContact CB-CG2 3.92Å; L583-T632 HydrophobicContact CD1-CG2 3.8Å; L583-S636 WeakPolarHBondContact CB-OG 3.3Å; L583-S636 WeakPolarHBondContact CD2-OG 3.48Å
584P87.4Confident89Confident37 Ų3738.3 Ų38.324%0.2419%0.188CC..Hα-helixtrans-49.2-39.3176.3-30.137.3000113.4V539 N582 W586 H587 H588V539-P584 HydrophobicContact CG1-CB 4.49Å; N582-P584 VanDerWaalsContact C-N 3.35Å; P584-W586 PolarHBondContact O-N 3.13Å; P584-H587 WeakPolarHBondContact CA-ND1 3.46Å; P584-H587 WeakPolarHBondContact O-CB 3.32Å; P584-H587 PolarHBondContact O-N 2.98Å; P584-H588 PolarHBondContact O-CD2 3.16Å; P584-H588 VanDerWaalsContact O-CD2 3.24Å
585V91Very high88.8Confident0 Ų033.7 Ų33.70%017%0.17CC..Hα-helixtrans-60-50.2175.8-176.40000111A536 K540 L556 F575 N582 L583 H587 H588 V589A536-V585 HydrophobicContact CB-CG1 3.82Å; A536-V585 HydrophobicContact CB-CG2 4.28Å; A536-V585 WeakPolarHBondContact O-CG2 3.35Å; K540-V585 HydrophobicContact CB-CG2 4.06Å; L556-V585 HydrophobicContact CD2-CG1 3.87Å; F575-V585 HydrophobicContact CD1-CG2 3.86Å; F575-V585 HydrophobicContact CE1-CG2 4.27Å; F575-V585 HydrophobicContact CG-CG2 4.42Å; N582-V585 WeakPolarHBondContact O-CB 3.35Å; N582-V585 PolarHBondContact O-N 3.3Å; N582-V585 VanDerWaalsContact O-N 3.15Å; L583-V585 PolarHBondContact O-N 2.98Å; L583-V585 VanDerWaalsContact O-N 3.1Å; V585-H587 VanDerWaalsContact C-N 3.29Å; V585-H587 PolarHBondContact O-N 3.31Å; V585-H588 PolarHBondContact O-N 2.86Å; V585-H588 VanDerWaalsContact O-N 3.08Å; V585-V589 HydrophobicContact CG1-CG2 4.47Å; V585-V589 WeakPolarHBondContact O-CG2 3.39Å; V585-V589 PolarHBondContact O-N 3.01Å
586W89.8Confident88.5Confident0 Ų039.9 Ų39.90%020%0.199CC..Hα-helixtrans-72.2-16.3-177.3-62.4106.9000114.5L571 V572 F575 P577 L583 P584 H588 V589 L594 V602 I606 S639L571-W586 HydrophobicContact CD2-CH2 4.38Å; L571-W586 HydrophobicContact CG-CH2 4.43Å; V572-W586 HydrophobicContact CG2-CH2 3.56Å; V572-W586 HydrophobicContact CG2-CZ2 3.93Å; F575-W586 WeakPolarHBondContact O-CZ2 3.48Å; F575-W586 PolarHBondContact O-NE1 3.42Å; P577-W586 HydrophobicContact CB-CG 4.45Å; P577-W586 HydrophobicContact CG-CD2 4.2Å; P577-W586 HydrophobicContact CG-CZ2 3.84Å; L583-W586 PolarHBondContact O-N 3.25Å; P584-W586 PolarHBondContact O-N 3.13Å; W586-H588 VanDerWaalsContact C-N 3.26Å; W586-V589 HydrophobicContact CE3-CB 4.07Å; W586-V589 HydrophobicContact CE3-CG1 4.23Å; W586-V589 HydrophobicContact CE3-CG2 4.34Å; W586-V589 HydrophobicContact CZ3-CB 4.39Å; W586-V589 HydrophobicContact CZ3-CG1 4.11Å; W586-L594 HydrophobicContact CZ3-CD1 4.13Å; W586-V602 HydrophobicContact CD2-CG1 4.27Å; W586-V602 HydrophobicContact CE3-CG1 3.8Å; W586-V602 HydrophobicContact CH2-CG2 3.8Å; W586-V602 HydrophobicContact CZ2-CG2 4.38Å; W586-V602 HydrophobicContact CZ3-CG1 3.93Å; W586-V602 HydrophobicContact CZ3-CG2 3.87Å; W586-I606 HydrophobicContact CB-CD1 4.45Å; W586-S639 PolarHBondContact O-OG 3.35Å
587H85.5Confident88.2Confident57 Ų5745 Ų4526%0.26422%0.224SC..Hα-helixtrans-66.3-31.8168.2-69.893.2000112.1L583 P584 V585 T632 G635 S636L583-H587 PolarHBondContact O-N 3.47Å; L583-H587 PolarHBondContact O-ND1 3.22Å; P584-H587 WeakPolarHBondContact CA-ND1 3.46Å; P584-H587 WeakPolarHBondContact O-CB 3.32Å; P584-H587 PolarHBondContact O-N 2.98Å; V585-H587 VanDerWaalsContact C-N 3.29Å; V585-H587 PolarHBondContact O-N 3.31Å; H587-T632 PolarHBondContact CE1-O 3.22Å; H587-T632 VanDerWaalsContact CE1-O 3.31Å; H587-T632 PolarHBondContact NE2-O 3.11Å; H587-T632 VanDerWaalsContact NE2-O 3.09Å; H587-G635 PolarHBondContact CD2-O 3.15Å; H587-G635 VanDerWaalsContact NE2-CA 3.35Å; H587-G635 WeakPolarHBondContact NE2-CA 3.37Å; H587-S636 PolarHBondContact CD2-N 3.38Å; H587-S636 PolarHBondContact CE1-OG 3.35Å; H587-S636 PolarHBondContact NE2-N 3.06Å; H587-S636 PolarHBondContact NE2-OG 3.25Å
588H87.8Confident88.2Confident43 Ų4345.1 Ų45.120%0.19923%0.225CC..Hα-helixtrans-97.3-14.9-176.3-67.5-72.7000113.5L556 R557 P584 V585 W586L556-H588 HydrophobicContact CD2-CB 4.35Å; R557-H588 WeakPolarHBondContact CB-O 3.37Å; R557-H588 WeakPolarHBondContact CG-O 3.42Å; P584-H588 PolarHBondContact O-CD2 3.16Å; P584-H588 VanDerWaalsContact O-CD2 3.24Å; V585-H588 PolarHBondContact O-N 2.86Å; V585-H588 VanDerWaalsContact O-N 3.08Å; W586-H588 VanDerWaalsContact C-N 3.26Å
589V88.8Confident88.2Confident1 Ų146.5 Ų46.51%0.00623%0.225CC..SBendtrans-81.3129.9174.4177.50000111L556 V560 V585 W586 L594L556-V589 HydrophobicContact CD2-CG2 4.18Å; L556-V589 HydrophobicContact CG-CG2 4.3Å; V560-V589 HydrophobicContact CG1-CG1 4.06Å; V560-V589 HydrophobicContact CG2-CG1 4.47Å; V560-V589 HydrophobicContact CG2-CG2 4.14Å; V585-V589 HydrophobicContact CG1-CG2 4.47Å; V585-V589 WeakPolarHBondContact O-CG2 3.39Å; V585-V589 PolarHBondContact O-N 3.01Å; W586-V589 HydrophobicContact CE3-CB 4.07Å; W586-V589 HydrophobicContact CE3-CG1 4.23Å; W586-V589 HydrophobicContact CE3-CG2 4.34Å; W586-V589 HydrophobicContact CZ3-CB 4.39Å; W586-V589 HydrophobicContact CZ3-CG1 4.11Å; V589-L594 HydrophobicContact CG1-CD2 4.47Å
590L86.6Confident88.2Confident20 Ų2044.1 Ų44.111%0.10522%0.217CC..  trans-83.3117.5167.2-70.5-174.1000110.3R557 F561 R592 A593R557-L590 HydrophobicContact CG-CD1 4.24Å; R557-L590 HydrophobicContact CG-CG 3.85Å; F561-L590 HydrophobicContact CE2-CB 4.36Å; F561-L590 HydrophobicContact CE2-CD1 3.95Å; F561-L590 HydrophobicContact CZ-CB 4.38Å; F561-L590 HydrophobicContact CZ-CD1 3.98Å; L590-R592 HydrophobicContact CB-CG 4.14Å; L590-R592 HydrophobicContact CD1-CG 4.38Å; L590-R592 PolarHBondContact O-N 3.03Å; L590-R592 VanDerWaalsContact O-N 3.09Å; L590-A593 WeakPolarHBondContact O-CB 3.31Å; L590-A593 PolarHBondContact O-N 3.24Å
591L85.9Confident88.4Confident2 Ų246.7 Ų46.71%0.0122%0.22CC..G310 helixtrans-58.6-28.1179.2-59.8-170.2000113.4A593 L594 R599 V602 E603 L640L591-A593 PolarHBondContact O-N 3.21Å; L591-L594 HydrophobicContact CD2-CD1 3.86Å; L591-L594 WeakPolarHBondContact O-CB 3.25Å; L591-L594 PolarHBondContact O-N 3.19Å; L591-R599 HydrophobicContact CB-CG 4.24Å; L591-R599 PolarHBondContact O-NE 2.72Å; L591-V602 HydrophobicContact CD2-CB 4.45Å; L591-V602 HydrophobicContact CD2-CG1 3.63Å; L591-E603 HydrophobicContact CD1-CG 3.67Å; L591-L640 HydrophobicContact CD1-CB 3.76Å; L591-L640 HydrophobicContact CD1-CD1 4.01Å; L591-L640 HydrophobicContact CD1-CG 3.78Å
592R85Confident88.6Confident148 Ų14841.4 Ų41.456%0.55820%0.195SC*.G310 helixtrans-63.6-16.7174.172.8177.4-175.5-167.80.6114.5F561 L590 L594 R599F561-R592 HydrophobicContact CE1-CG 4.47Å; F561-R592 HydrophobicContact CZ-CG 4.11Å; L590-R592 HydrophobicContact CB-CG 4.14Å; L590-R592 HydrophobicContact CD1-CG 4.38Å; L590-R592 PolarHBondContact O-N 3.03Å; L590-R592 VanDerWaalsContact O-N 3.09Å; R592-L594 VanDerWaalsContact C-N 3.34Å; R592-R599 PolarHBondContact O-NH2 3.23Å; R592-R599 VanDerWaalsContact O-NH2 3.08Å
593A88.6Confident88.5Confident14 Ų1441.8 Ų41.812%0.11620%0.197CC..G310 helixtrans-77.5-22.9174.300000112.5V560 F561 Q568 L590 L591V560-A593 HydrophobicContact CG1-CB 4Å; F561-A593 HydrophobicContact CD1-CB 3.61Å; F561-A593 HydrophobicContact CD2-CB 3.72Å; F561-A593 HydrophobicContact CE1-CB 3.55Å; F561-A593 HydrophobicContact CE2-CB 3.66Å; F561-A593 HydrophobicContact CG-CB 3.69Å; F561-A593 HydrophobicContact CZ-CB 3.58Å; Q568-A593 PolarHBondContact NE2-O 3.36Å; L590-A593 WeakPolarHBondContact O-CB 3.31Å; L590-A593 PolarHBondContact O-N 3.24Å; L591-A593 PolarHBondContact O-N 3.21Å
594L91Very high88.6Confident5 Ų546.3 Ų46.33%0.02623%0.225CC..SBendtrans-79.5149.3-177.8-54.3174.8000110.8V560 Q568 W586 V589 L591 R592 V598 R599 V602V560-L594 HydrophobicContact CG1-CD2 3.75Å; Q568-L594 HydrophobicContact CB-CD2 4.46Å; Q568-L594 HydrophobicContact CG-CD2 4.14Å; W586-L594 HydrophobicContact CZ3-CD1 4.13Å; V589-L594 HydrophobicContact CG1-CD2 4.47Å; L591-L594 HydrophobicContact CD2-CD1 3.86Å; L591-L594 WeakPolarHBondContact O-CB 3.25Å; L591-L594 PolarHBondContact O-N 3.19Å; R592-L594 VanDerWaalsContact C-N 3.34Å; L594-V598 HydrophobicContact CB-CB 4.44Å; L594-V598 HydrophobicContact CB-CG1 4.45Å; L594-V598 HydrophobicContact CD1-CG1 4.32Å; L594-V598 HydrophobicContact CD2-CG1 4.4Å; L594-R599 HydrophobicContact CB-CB 4.11Å; L594-R599 PolarHBondContact O-NH2 2.75Å; L594-V602 HydrophobicContact CD1-CB 4.39Å; L594-V602 HydrophobicContact CD1-CG2 4.11Å
595S91.9Very high88.8Confident31 Ų3145.9 Ų45.922%0.21722%0.219CC..  trans-59.1155.416658.30000110.9Q568 D597 V598 R599Q568-S595 PolarHBondContact OE1-OG 3.27Å; Q568-S595 VanDerWaalsContact OE1-OG 3.05Å; S595-D597 PolarHBondContact O-N 2.95Å; S595-V598 PolarHBondContact O-N 3.18Å; S595-V598 WeakPolarHBondContact OG-CG2 3.31Å; S595-R599 VanDerWaalsContact O-CB 3.23Å; S595-R599 WeakPolarHBondContact O-CB 3.41Å; S595-R599 PolarHBondContact O-N 2.92Å
596Q89.1Confident88.7Confident133 Ų13346 Ų4662%0.62122%0.22SC*.Hα-helixtrans-57-45.8-172.1-174.8169.50.200112.7R599 L600Q596-R599 WeakPolarHBondContact O-CB 3.48Å; Q596-R599 PolarHBondContact O-N 3.07Å; Q596-L600 HydrophobicContact CG-CD1 4.25Å; Q596-L600 WeakPolarHBondContact O-CG 3.2Å; Q596-L600 PolarHBondContact O-N 2.83Å
597D88.5Confident88.7Confident133 Ų13347 Ų4771%0.71123%0.225SC*.Hα-helixtrans-65.5-44.6-179.4-59.3-41.2000112.3S595 R599 L600 R601S595-D597 PolarHBondContact O-N 2.95Å; D597-R599 VanDerWaalsContact C-N 3.34Å; D597-L600 PolarHBondContact O-N 3.35Å; D597-R601 PolarHBondContact O-N 3.21Å; D597-R601 VanDerWaalsContact O-N 3.12Å
598V91.1Very high88.9Confident3 Ų346.2 Ų46.22%0.01823%0.229CC..Hα-helixtrans-65.9-40.9178-1780000110.4Q568 L569 V572 L594 S595 R601 V602Q568-V598 HydrophobicContact CB-CG1 4.14Å; Q568-V598 HydrophobicContact CB-CG2 4.12Å; L569-V598 HydrophobicContact CD2-CG2 3.73Å; L569-V598 HydrophobicContact CG-CG2 3.83Å; V572-V598 HydrophobicContact CG2-CG1 3.73Å; L594-V598 HydrophobicContact CB-CB 4.44Å; L594-V598 HydrophobicContact CB-CG1 4.45Å; L594-V598 HydrophobicContact CD1-CG1 4.32Å; L594-V598 HydrophobicContact CD2-CG1 4.4Å; S595-V598 PolarHBondContact O-N 3.18Å; S595-V598 WeakPolarHBondContact OG-CG2 3.31Å; V598-R601 PolarHBondContact O-N 3.25Å; V598-V602 HydrophobicContact CG1-CG2 4.35Å; V598-V602 WeakPolarHBondContact O-CG2 3.45Å; V598-V602 PolarHBondContact O-N 3.15Å
599R89.2Confident89.1Confident66 Ų6644.4 Ų44.425%0.24922%0.221CC..Hα-helixtrans-58.4-53.6176.3-175.8-176.8-55.9159.29.4111.1L591 R592 L594 S595 Q596 D597 R601 V602 E603L591-R599 HydrophobicContact CB-CG 4.24Å; L591-R599 PolarHBondContact O-NE 2.72Å; R592-R599 PolarHBondContact O-NH2 3.23Å; R592-R599 VanDerWaalsContact O-NH2 3.08Å; L594-R599 HydrophobicContact CB-CB 4.11Å; L594-R599 PolarHBondContact O-NH2 2.75Å; S595-R599 VanDerWaalsContact O-CB 3.23Å; S595-R599 WeakPolarHBondContact O-CB 3.41Å; S595-R599 PolarHBondContact O-N 2.92Å; Q596-R599 WeakPolarHBondContact O-CB 3.48Å; Q596-R599 PolarHBondContact O-N 3.07Å; D597-R599 VanDerWaalsContact C-N 3.34Å; R599-R601 VanDerWaalsContact C-N 3.26Å; R599-R601 PolarHBondContact O-N 3.13Å; R599-V602 PolarHBondContact O-N 3.23Å; R599-V602 VanDerWaalsContact O-N 3.13Å; R599-E603 HydrophobicContact CG-CG 4.25Å; R599-E603 WeakPolarHBondContact CG-OE1 3.49Å; R599-E603 VanDerWaalsContact O-CG 3.31Å; R599-E603 WeakPolarHBondContact O-CG 3.44Å; R599-E603 PolarHBondContact O-N 3.2Å
600L87.2Confident89.1Confident62 Ų6244.4 Ų44.433%0.32522%0.221SC..Hα-helixtrans-57.6-40.8-179.9-74.1171.1000111.7Q596 D597 T604Q596-L600 HydrophobicContact CG-CD1 4.25Å; Q596-L600 WeakPolarHBondContact O-CG 3.2Å; Q596-L600 PolarHBondContact O-N 2.83Å; D597-L600 PolarHBondContact O-N 3.35Å; L600-T604 WeakPolarHBondContact O-CB 3.41Å; L600-T604 PolarHBondContact O-N 2.82Å; L600-T604 PolarHBondContact O-OG1 3.35Å
601R89.4Confident89.3Confident112 Ų11247.4 Ų47.442%0.42323%0.234SC..Hα-helixtrans-60.7-51.2174.6179.9178174.2-178.3-0.4111.8D597 V598 R599 E603 T604 E605D597-R601 PolarHBondContact O-N 3.21Å; D597-R601 VanDerWaalsContact O-N 3.12Å; V598-R601 PolarHBondContact O-N 3.25Å; R599-R601 VanDerWaalsContact C-N 3.26Å; R599-R601 PolarHBondContact O-N 3.13Å; R601-E603 PolarHBondContact O-N 2.7Å; R601-T604 PolarHBondContact O-N 3.01Å; R601-E605 IonicContact CZ-OE1 3.63Å; R601-E605 IonicContact NE-OE1 3.53Å; R601-E605 PolarHBondContact NE-OE1 3.1Å; R601-E605 IonicContact NH2-OE1 2.75Å; R601-E605 WeakPolarHBondContact O-CG 3.43Å; R601-E605 PolarHBondContact O-N 2.94Å
602V90.1Very high89.6Confident0 Ų052.7 Ų52.70%025%0.254CS..Hα-helixtrans-62.7-42.9-179.71720000111.3V572 P577 W586 L591 L594 V598 R599 T604 E605 I606V572-V602 HydrophobicContact CG2-CG2 3.61Å; P577-V602 HydrophobicContact CB-CG1 4.48Å; P577-V602 HydrophobicContact CG-CB 4.27Å; P577-V602 HydrophobicContact CG-CG1 3.95Å; P577-V602 HydrophobicContact CG-CG2 3.99Å; W586-V602 HydrophobicContact CD2-CG1 4.27Å; W586-V602 HydrophobicContact CE3-CG1 3.8Å; W586-V602 HydrophobicContact CH2-CG2 3.8Å; W586-V602 HydrophobicContact CZ2-CG2 4.38Å; W586-V602 HydrophobicContact CZ3-CG1 3.93Å; W586-V602 HydrophobicContact CZ3-CG2 3.87Å; L591-V602 HydrophobicContact CD2-CB 4.45Å; L591-V602 HydrophobicContact CD2-CG1 3.63Å; L594-V602 HydrophobicContact CD1-CB 4.39Å; L594-V602 HydrophobicContact CD1-CG2 4.11Å; V598-V602 HydrophobicContact CG1-CG2 4.35Å; V598-V602 WeakPolarHBondContact O-CG2 3.45Å; V598-V602 PolarHBondContact O-N 3.15Å; R599-V602 PolarHBondContact O-N 3.23Å; R599-V602 VanDerWaalsContact O-N 3.13Å; V602-T604 PolarHBondContact O-N 3.33Å; V602-E605 PolarHBondContact O-N 3.49Å; V602-I606 HydrophobicContact CG1-CD1 3.69Å; V602-I606 HydrophobicContact CG1-CG1 4.33Å; V602-I606 VanDerWaalsContact O-CG1 3.32Å; V602-I606 WeakPolarHBondContact O-CG1 3.48Å; V602-I606 PolarHBondContact O-N 3.31Å
603E88.3Confident89.9Confident10 Ų1046.1 Ų46.15%0.04723%0.23CC..Hα-helixtrans-59.8-46.5177-70.6-178.2-18000111.7L591 R599 R601 E605 I606 I607 L640 H644L591-E603 HydrophobicContact CD1-CG 3.67Å; R599-E603 HydrophobicContact CG-CG 4.25Å; R599-E603 WeakPolarHBondContact CG-OE1 3.49Å; R599-E603 VanDerWaalsContact O-CG 3.31Å; R599-E603 WeakPolarHBondContact O-CG 3.44Å; R599-E603 PolarHBondContact O-N 3.2Å; R601-E603 PolarHBondContact O-N 2.7Å; E603-E605 PolarHBondContact O-N 2.98Å; E603-I606 PolarHBondContact O-N 3.17Å; E603-I607 WeakPolarHBondContact O-CB 3.44Å; E603-I607 WeakPolarHBondContact O-CD1 3.49Å; E603-I607 VanDerWaalsContact O-CG1 3.26Å; E603-I607 WeakPolarHBondContact O-CG1 3.19Å; E603-I607 PolarHBondContact O-N 2.91Å; E603-L640 HydrophobicContact CB-CD1 3.78Å; E603-L640 HydrophobicContact CG-CD1 3.62Å; E603-L640 HydrophobicContact CG-CG 4.2Å; E603-H644 IonicContact OE1-CD2 2.85Å; E603-H644 IonicContact OE1-CE1 3.4Å; E603-H644 PolarHBondContact OE1-CE1 3.24Å; E603-H644 IonicContact OE1-NE2 2.89Å; E603-H644 PolarHBondContact OE1-NE2 3.08Å; E603-H644 IonicContact OE2-NE2 3.86Å
604T88.6Confident90Very high95 Ų9545.7 Ų45.758%0.58323%0.226SC*.Hα-helixtrans-62-44.5178.3-56.10000111.5L600 R601 V602 A608L600-T604 WeakPolarHBondContact O-CB 3.41Å; L600-T604 PolarHBondContact O-N 2.82Å; L600-T604 PolarHBondContact O-OG1 3.35Å; R601-T604 PolarHBondContact O-N 3.01Å; V602-T604 PolarHBondContact O-N 3.33Å; T604-A608 VanDerWaalsContact O-CB 3.26Å; T604-A608 WeakPolarHBondContact O-CB 3.44Å; T604-A608 PolarHBondContact O-N 3.31Å
605E90.8Very high90Very high28 Ų2850.9 Ų50.913%0.13125%0.251CS..Hα-helixtrans-65.4-41.5179.1-72.7-170.6-143.900112.3S576 P577 S578 R601 V602 E603 L609S576-E605 PolarHBondContact OG-OE2 3.34Å; P577-E605 HydrophobicContact CB-CB 3.95Å; P577-E605 WeakPolarHBondContact CD-OE2 3.19Å; P577-E605 HydrophobicContact CG-CB 4.24Å; S578-E605 PolarHBondContact N-OE2 2.87Å; S578-E605 WeakPolarHBondContact OG-CG 3.33Å; S578-E605 PolarHBondContact OG-OE2 3.06Å; R601-E605 IonicContact CZ-OE1 3.63Å; R601-E605 IonicContact NE-OE1 3.53Å; R601-E605 PolarHBondContact NE-OE1 3.1Å; R601-E605 IonicContact NH2-OE1 2.75Å; R601-E605 WeakPolarHBondContact O-CG 3.43Å; R601-E605 PolarHBondContact O-N 2.94Å; V602-E605 PolarHBondContact O-N 3.49Å; E603-E605 PolarHBondContact O-N 2.98Å; E605-L609 WeakPolarHBondContact O-CB 3.48Å; E605-L609 PolarHBondContact O-N 2.66Å
606I89.7Confident89.9Confident3 Ų354 Ų542%0.01526%0.262CS..Hα-helixtrans-65.8-44.4177.2-69.1172.6000111.2P577 W586 V602 E603 L609 M610P577-I606 HydrophobicContact CB-CG1 3.85Å; W586-I606 HydrophobicContact CB-CD1 4.45Å; V602-I606 HydrophobicContact CG1-CD1 3.69Å; V602-I606 HydrophobicContact CG1-CG1 4.33Å; V602-I606 VanDerWaalsContact O-CG1 3.32Å; V602-I606 WeakPolarHBondContact O-CG1 3.48Å; V602-I606 PolarHBondContact O-N 3.31Å; E603-I606 PolarHBondContact O-N 3.17Å; I606-L609 PolarHBondContact O-N 2.86Å; I606-M610 PolarHBondContact O-N 3.04Å
607I89.1Confident90.1Very high20 Ų2048.9 Ų48.910%0.10324%0.237CC..Hα-helixtrans-64.1-45.3178.6-69166.5000110.5E603 L609 M610 Q611 L637 L640 C651 V655 M658E603-I607 WeakPolarHBondContact O-CB 3.44Å; E603-I607 WeakPolarHBondContact O-CD1 3.49Å; E603-I607 VanDerWaalsContact O-CG1 3.26Å; E603-I607 WeakPolarHBondContact O-CG1 3.19Å; E603-I607 PolarHBondContact O-N 2.91Å; I607-L609 VanDerWaalsContact C-N 3.3Å; I607-L609 PolarHBondContact O-N 2.95Å; I607-M610 PolarHBondContact O-N 3.02Å; I607-Q611 WeakPolarHBondContact O-CG 3.44Å; I607-Q611 PolarHBondContact O-N 3.09Å; I607-L637 HydrophobicContact CG1-CD1 4.33Å; I607-L640 HydrophobicContact CD1-CD1 4.46Å; I607-L640 HydrophobicContact CG1-CD1 4.38Å; I607-C651 WeakPolarHBondContact CD1-SG 3.35Å; I607-V655 HydrophobicContact CD1-CG2 4.44Å; I607-V655 HydrophobicContact CG1-CG2 4.45Å; I607-M658 HydrophobicContact CG2-CE 4.17Å
608A90.3Very high90.1Very high41 Ų4146.5 Ų46.534%0.33922%0.222SC..Hα-helixtrans-61.7-39.4177.800000111.9T604 R612T604-A608 VanDerWaalsContact O-CB 3.26Å; T604-A608 WeakPolarHBondContact O-CB 3.44Å; T604-A608 PolarHBondContact O-N 3.31Å; A608-R612 WeakPolarHBondContact O-CB 3.42Å; A608-R612 PolarHBondContact O-N 3.38Å
609L91.1Very high90.1Very high6 Ų653.2 Ų53.23%0.03126%0.258CS..Hα-helixtrans-65.5-46.2175-179.463.3000111.7P577 V580 L583 E605 I606 I607 Q611 R612 V613P577-L609 WeakPolarHBondContact O-CD2 3.46Å; V580-L609 HydrophobicContact CG2-CD1 4.12Å; V580-L609 HydrophobicContact CG2-CD2 4.32Å; L583-L609 HydrophobicContact CD1-CD2 3.83Å; L583-L609 HydrophobicContact CD2-CD2 3.82Å; L583-L609 HydrophobicContact CG-CD2 4.09Å; E605-L609 WeakPolarHBondContact O-CB 3.48Å; E605-L609 PolarHBondContact O-N 2.66Å; I606-L609 PolarHBondContact O-N 2.86Å; I607-L609 VanDerWaalsContact C-N 3.3Å; I607-L609 PolarHBondContact O-N 2.95Å; L609-Q611 VanDerWaalsContact C-N 3.33Å; L609-Q611 PolarHBondContact O-N 2.9Å; L609-R612 WeakPolarHBondContact O-CB 3.37Å; L609-R612 PolarHBondContact O-N 3.45Å; L609-R612 VanDerWaalsContact O-N 3.17Å; L609-V613 HydrophobicContact CD1-CG2 4.21Å; L609-V613 HydrophobicContact CG-CG2 4.4Å; L609-V613 WeakPolarHBondContact O-CG2 3.41Å; L609-V613 PolarHBondContact O-N 3.24Å
610M90.7Very high89.9Confident1 Ų151 Ų511%0.00526%0.256CS..Hα-helixtrans-60-44.3178.6-176.763.3-17200111.5I606 I607 R612 V613 L614 V630 A633 L634 L637 M658 L662I606-M610 PolarHBondContact O-N 3.04Å; I607-M610 PolarHBondContact O-N 3.02Å; M610-R612 VanDerWaalsContact C-N 3.33Å; M610-R612 PolarHBondContact O-N 2.95Å; M610-V613 PolarHBondContact O-N 3.18Å; M610-L614 HydrophobicContact CE-CD1 3.88Å; M610-L614 HydrophobicContact CE-CD2 3.8Å; M610-L614 HydrophobicContact CE-CG 3.77Å; M610-L614 HydrophobicContact CG-CD1 4.37Å; M610-L614 WeakPolarHBondContact O-CG 3.31Å; M610-L614 PolarHBondContact O-N 3.05Å; M610-V630 HydrophobicContact CE-CG1 4.45Å; M610-A633 HydrophobicContact SD-CB 3.45Å; M610-A633 WeakPolarHBondContact SD-CB 3.18Å; M610-L634 HydrophobicContact CE-CB 4.14Å; M610-L634 HydrophobicContact CE-CD1 4.29Å; M610-L637 HydrophobicContact CG-CD2 4.24Å; M610-M658 HydrophobicContact CB-CE 4.45Å; M610-M658 HydrophobicContact CB-SD 3.94Å; M610-M658 HydrophobicContact CG-CE 4.22Å; M610-M658 HydrophobicContact CG-SD 3.52Å; M610-M658 VanDerWaalsContact CG-SD 3.52Å; M610-L662 HydrophobicContact CE-CD1 3.74Å
611Q90.6Very high89.9Confident83 Ų8350.6 Ų50.639%0.38827%0.267SS..Hα-helixtrans-59.6-44.1175.2-73.1176.7-6.900111.6I607 L609 L614 M615 M658I607-Q611 WeakPolarHBondContact O-CG 3.44Å; I607-Q611 PolarHBondContact O-N 3.09Å; L609-Q611 VanDerWaalsContact C-N 3.33Å; L609-Q611 PolarHBondContact O-N 2.9Å; Q611-L614 PolarHBondContact O-N 3.31Å; Q611-M615 WeakPolarHBondContact O-CG 3.29Å; Q611-M615 PolarHBondContact O-N 3.43Å; Q611-M658 HydrophobicContact CG-SD 3.6Å; Q611-M658 VanDerWaalsContact CG-SD 3.6Å
612R91.2Very high89.8Confident113 Ų11348.2 Ų48.243%0.42626%0.258SS..Hα-helixtrans-60.9-47.6176.7-169.5-169.5-55.5150.85.8111.8A608 L609 M610 L614 M615 E616A608-R612 WeakPolarHBondContact O-CB 3.42Å; A608-R612 PolarHBondContact O-N 3.38Å; L609-R612 WeakPolarHBondContact O-CB 3.37Å; L609-R612 PolarHBondContact O-N 3.45Å; L609-R612 VanDerWaalsContact O-N 3.17Å; M610-R612 VanDerWaalsContact C-N 3.33Å; M610-R612 PolarHBondContact O-N 2.95Å; R612-L614 VanDerWaalsContact C-N 3.32Å; R612-L614 PolarHBondContact O-N 3.44Å; R612-M615 PolarHBondContact O-N 3.26Å; R612-E616 WeakPolarHBondContact O-CG 3.44Å; R612-E616 PolarHBondContact O-N 2.91Å
613V91.1Very high89.7Confident9 Ų954.8 Ų54.86%0.05529%0.287CS..Hα-helixtrans-62-39.8179170.60000111.3L609 M610 W617 K629 V630 A633L609-V613 HydrophobicContact CD1-CG2 4.21Å; L609-V613 HydrophobicContact CG-CG2 4.4Å; L609-V613 WeakPolarHBondContact O-CG2 3.41Å; L609-V613 PolarHBondContact O-N 3.24Å; M610-V613 PolarHBondContact O-N 3.18Å; V613-W617 WeakPolarHBondContact O-CB 3.49Å; V613-W617 PolarHBondContact O-N 3.32Å; V613-K629 HydrophobicContact CG1-CB 4.44Å; V613-V630 HydrophobicContact CG1-CG2 4.02Å; V613-A633 HydrophobicContact CB-CB 4.3Å; V613-A633 HydrophobicContact CG1-CB 4.21Å; V613-A633 HydrophobicContact CG2-CB 4.23Å
614L91Very high89.5Confident6 Ų657.8 Ų57.83%0.03130%0.303CS..Hα-helixtrans-66.1-42.3175.2-72.8178.2000112.6M610 Q611 R612 W617 E618 V630 M658 L662M610-L614 HydrophobicContact CE-CD1 3.88Å; M610-L614 HydrophobicContact CE-CD2 3.8Å; M610-L614 HydrophobicContact CE-CG 3.77Å; M610-L614 HydrophobicContact CG-CD1 4.37Å; M610-L614 WeakPolarHBondContact O-CG 3.31Å; M610-L614 PolarHBondContact O-N 3.05Å; Q611-L614 PolarHBondContact O-N 3.31Å; R612-L614 VanDerWaalsContact C-N 3.32Å; R612-L614 PolarHBondContact O-N 3.44Å; L614-W617 HydrophobicContact CD2-CE3 4.31Å; L614-W617 PolarHBondContact O-N 2.77Å; L614-E618 WeakPolarHBondContact O-CB 3.4Å; L614-E618 PolarHBondContact O-N 3.04Å; L614-V630 HydrophobicContact CD2-CG1 4.32Å; L614-M658 HydrophobicContact CD1-CB 3.81Å; L614-M658 HydrophobicContact CD1-CG 3.7Å; L614-M658 HydrophobicContact CD1-SD 4.06Å; L614-L662 HydrophobicContact CD2-CD1 4.43Å; L614-L662 HydrophobicContact CD2-CD2 3.58Å; L614-L662 HydrophobicContact CD2-CG 4.06Å
615M90.6Very high89.2Confident113 Ų11356.8 Ų56.856%0.55731%0.311SS*.Hα-helixtrans-63.8-44.2175.8-71.2-161.1-57.100111.4Q611 R612 W617 E618 D619Q611-M615 WeakPolarHBondContact O-CG 3.29Å; Q611-M615 PolarHBondContact O-N 3.43Å; R612-M615 PolarHBondContact O-N 3.26Å; M615-W617 VanDerWaalsContact C-N 3.27Å; M615-W617 PolarHBondContact O-N 3.39Å; M615-E618 PolarHBondContact O-N 3.45Å; M615-D619 WeakPolarHBondContact O-CB 3.38Å; M615-D619 VanDerWaalsContact O-CG 3.29Å; M615-D619 PolarHBondContact O-N 3.34Å
616E90.9Very high88.9Confident97 Ų9758.3 Ų58.345%0.45332%0.318SS..Hα-helixtrans-61.5-36.1175.5-73.6175.5-164.400112.5R612 G620R612-E616 WeakPolarHBondContact O-CG 3.44Å; R612-E616 PolarHBondContact O-N 2.91Å; E616-G620 PolarHBondContact O-N 3.19Å
617W91.8Very high88.8Confident25 Ų2558.2 Ų58.210%0.09532%0.318CS..Hα-helixtrans-71.3-38176.4-170.442000112V613 L614 M615 G620 G621 Y622 K623 V627 V630 L662V613-W617 WeakPolarHBondContact O-CB 3.49Å; V613-W617 PolarHBondContact O-N 3.32Å; L614-W617 HydrophobicContact CD2-CE3 4.31Å; L614-W617 PolarHBondContact O-N 2.77Å; M615-W617 VanDerWaalsContact C-N 3.27Å; M615-W617 PolarHBondContact O-N 3.39Å; W617-G620 PolarHBondContact O-N 3.46Å; W617-G621 PolarHBondContact O-N 3.3Å; W617-Y622 AromaticContact CD2-CD1 3.83Å; W617-Y622 HydrophobicContact CD2-CD1 3.83Å; W617-Y622 AromaticContact CE3-CD1 3.85Å; W617-Y622 HydrophobicContact CE3-CD1 3.85Å; W617-Y622 HydrophobicContact CE3-CE1 4.34Å; W617-Y622 HydrophobicContact CG-CD1 4.32Å; W617-Y622 HydrophobicContact CH2-CD1 4.42Å; W617-Y622 HydrophobicContact CZ2-CD1 4.4Å; W617-Y622 HydrophobicContact CZ3-CD1 4.15Å; W617-Y622 WeakPolarHBondContact O-CA 3.34Å; W617-Y622 PolarHBondContact O-N 3.03Å; W617-K623 PolarHBondContact NE1-O 3.25Å; W617-V627 HydrophobicContact CZ2-CG2 3.74Å; W617-V630 HydrophobicContact CB-CG2 4.13Å; W617-V630 HydrophobicContact CD2-CG2 3.77Å; W617-V630 HydrophobicContact CE3-CG1 4.45Å; W617-V630 HydrophobicContact CE3-CG2 3.93Å; W617-V630 HydrophobicContact CG-CG2 3.87Å; W617-L662 HydrophobicContact CE3-CD2 4.41Å; W617-L662 HydrophobicContact CZ3-CD2 3.73Å
618E90.4Very high88.6Confident84 Ų8461.7 Ų61.739%0.39334%0.336SS..Hα-helixtrans-65.9-51.1174.2175.6160.8-157.200111.9L614 M615 G620 G621 Y622 Q661L614-E618 WeakPolarHBondContact O-CB 3.4Å; L614-E618 PolarHBondContact O-N 3.04Å; M615-E618 PolarHBondContact O-N 3.45Å; E618-G620 PolarHBondContact O-N 3.4Å; E618-G621 PolarHBondContact O-N 3.13Å; E618-Y622 HydrophobicContact CB-CE1 3.79Å; E618-Y622 VanDerWaalsContact CD-OH 3.27Å; E618-Y622 HydrophobicContact CG-CE1 4.26Å; E618-Y622 HydrophobicContact CG-CE2 4.5Å; E618-Y622 VanDerWaalsContact CG-OH 3.31Å; E618-Y622 WeakPolarHBondContact CG-OH 3.45Å; E618-Y622 PolarHBondContact OE1-OH 3.13Å; E618-Q661 PolarHBondContact OE2-NE2 2.69Å; E618-Q661 VanDerWaalsContact OE2-NE2 3.08Å
619D90.1Very high88.3Confident143 Ų14365.3 Ų65.377%0.76535%0.345SS*.Hα-helixtrans-60.9-32.3175.5-69.7-19.6000111.7M615 G621M615-D619 WeakPolarHBondContact O-CB 3.38Å; M615-D619 VanDerWaalsContact O-CG 3.29Å; M615-D619 PolarHBondContact O-N 3.34Å; D619-G621 PolarHBondContact O-N 3.3Å
620G85.1Confident88.2Confident21 Ų2165.1 Ų65.122%0.21634%0.344CS..THydrogen-bonded Turntrans-73.5-4.7174.700000114.9E616 W617 E618 K623E616-G620 PolarHBondContact O-N 3.19Å; W617-G620 PolarHBondContact O-N 3.46Å; E618-G620 PolarHBondContact O-N 3.4Å; G620-K623 WeakPolarHBondContact O-CD 3.27Å; G620-K623 VanDerWaalsContact O-CE 3.29Å; G620-K623 WeakPolarHBondContact O-CE 3.46Å; G620-K623 WeakPolarHBondContact O-CG 3.45Å
621G87.4Confident88.1Confident53 Ų5365.8 Ų65.855%0.54635%0.347SS..THydrogen-bonded Turntrans77.429.3-17900000114.2W617 E618 D619 K623W617-G621 PolarHBondContact O-N 3.3Å; E618-G621 PolarHBondContact O-N 3.13Å; D619-G621 PolarHBondContact O-N 3.3Å; G621-K623 PolarHBondContact O-N 3.14Å
622Y87.7Confident87.8Confident62 Ų6264 Ų6424%0.24334%0.342CS..SBendtrans56.541.4178.1-52.5-70.8000114.6W617 E618 R665W617-Y622 AromaticContact CD2-CD1 3.83Å; W617-Y622 HydrophobicContact CD2-CD1 3.83Å; W617-Y622 AromaticContact CE3-CD1 3.85Å; W617-Y622 HydrophobicContact CE3-CD1 3.85Å; W617-Y622 HydrophobicContact CE3-CE1 4.34Å; W617-Y622 HydrophobicContact CG-CD1 4.32Å; W617-Y622 HydrophobicContact CH2-CD1 4.42Å; W617-Y622 HydrophobicContact CZ2-CD1 4.4Å; W617-Y622 HydrophobicContact CZ3-CD1 4.15Å; W617-Y622 WeakPolarHBondContact O-CA 3.34Å; W617-Y622 PolarHBondContact O-N 3.03Å; E618-Y622 HydrophobicContact CB-CE1 3.79Å; E618-Y622 VanDerWaalsContact CD-OH 3.27Å; E618-Y622 HydrophobicContact CG-CE1 4.26Å; E618-Y622 HydrophobicContact CG-CE2 4.5Å; E618-Y622 VanDerWaalsContact CG-OH 3.31Å; E618-Y622 WeakPolarHBondContact CG-OH 3.45Å; E618-Y622 PolarHBondContact OE1-OH 3.13Å; Y622-R665 HydrophobicContact CE1-CG 4.45Å; Y622-R665 PolarHBondContact OH-NE 3.23Å; Y622-R665 PolarHBondContact OH-NH2 3.47Å
623K87.1Confident87.6Confident138 Ų13858.9 Ų58.960%0.632%0.324SS*.  trans-67139.2-178.9-70.3174.1-175.91750111.5W617 G620 G621 G625 Q626W617-K623 PolarHBondContact NE1-O 3.25Å; G620-K623 WeakPolarHBondContact O-CD 3.27Å; G620-K623 VanDerWaalsContact O-CE 3.29Å; G620-K623 WeakPolarHBondContact O-CE 3.46Å; G620-K623 WeakPolarHBondContact O-CG 3.45Å; G621-K623 PolarHBondContact O-N 3.14Å; K623-G625 VanDerWaalsContact C-N 3.28Å; K623-G625 PolarHBondContact O-N 3.25Å; K623-Q626 PolarHBondContact O-N 3Å
624L83.7Confident87.4Confident73 Ų7358.4 Ų58.438%0.38232%0.321SS..G310 helixtrans-60.1-36179.9-163.974.8000112.6Q626 V627 H674 L677L624-Q626 PolarHBondContact O-N 3.33Å; L624-V627 HydrophobicContact CD1-CG2 4.23Å; L624-V627 WeakPolarHBondContact O-CB 3.06Å; L624-V627 VanDerWaalsContact O-CG2 3.31Å; L624-V627 WeakPolarHBondContact O-CG2 3.43Å; L624-V627 PolarHBondContact O-N 3.26Å; L624-H674 HydrophobicContact CD1-CB 4.44Å; L624-H674 HydrophobicContact CD2-CB 4.22Å; L624-H674 WeakPolarHBondContact CD2-ND1 3.4Å; L624-L677 HydrophobicContact CD1-CD1 4.07Å; L624-L677 HydrophobicContact CD1-CD2 3.99Å; L624-L677 HydrophobicContact CD1-CG 3.92Å
625G83.2Confident87.2Confident73 Ų7358.5 Ų58.575%0.75332%0.323SS*.G310 helixtrans-67.4-3.8179.400000115.6K623K623-G625 VanDerWaalsContact C-N 3.28Å; K623-G625 PolarHBondContact O-N 3.25Å
626Q84.3Confident86.8Confident60 Ų6053.1 Ų53.128%0.2830%0.297SS..G310 helixtrans-104-5.5173.4-69.3176.2-36.700112.6K623 L624 D628 K629 V630K623-Q626 PolarHBondContact O-N 3Å; L624-Q626 PolarHBondContact O-N 3.33Å; Q626-D628 VanDerWaalsContact C-N 3.28Å; Q626-D628 PolarHBondContact O-N 3.19Å; Q626-K629 WeakPolarHBondContact O-CB 3.33Å; Q626-K629 PolarHBondContact O-N 3.41Å; Q626-V630 PolarHBondContact O-N 3.15Å
627V87Confident86.5Confident2 Ų248.5 Ų48.51%0.01228%0.275CS..Hα-helixtrans-65.9-29.8-174.7177.70000112.1W617 L624 K629 V630 N631 V676 L677 T680W617-V627 HydrophobicContact CZ2-CG2 3.74Å; L624-V627 HydrophobicContact CD1-CG2 4.23Å; L624-V627 WeakPolarHBondContact O-CB 3.06Å; L624-V627 VanDerWaalsContact O-CG2 3.31Å; L624-V627 WeakPolarHBondContact O-CG2 3.43Å; L624-V627 PolarHBondContact O-N 3.26Å; V627-K629 VanDerWaalsContact C-N 3.29Å; V627-K629 PolarHBondContact O-N 3.21Å; V627-V630 CarbonylContact O-C 3.59Å; V627-V630 WeakPolarHBondContact O-CA 3.45Å; V627-V630 WeakPolarHBondContact O-CB 3.18Å; V627-V630 PolarHBondContact O-N 3.15Å; V627-N631 WeakPolarHBondContact O-CB 3.33Å; V627-N631 PolarHBondContact O-N 3.48Å; V627-V676 HydrophobicContact CB-CG1 3.88Å; V627-V676 HydrophobicContact CG1-CG1 3.64Å; V627-L677 HydrophobicContact CG1-CD2 4.22Å; V627-L677 HydrophobicContact CG2-CD2 4.41Å; V627-T680 VanDerWaalsContact CG1-OG1 3.29Å; V627-T680 WeakPolarHBondContact CG1-OG1 3.44Å
628D85.1Confident86.1Confident92 Ų9247.7 Ų47.749%0.49227%0.272SS..Hα-helixtrans-60-40.7175.7-64.7-40.6000112Q626 V630 N631 T632 V676Q626-D628 VanDerWaalsContact C-N 3.28Å; Q626-D628 PolarHBondContact O-N 3.19Å; D628-V630 VanDerWaalsContact C-N 3.31Å; D628-V630 PolarHBondContact O-N 3.32Å; D628-N631 PolarHBondContact O-N 3.07Å; D628-T632 PolarHBondContact O-N 3.31Å; D628-T632 PolarHBondContact O-OG1 2.98Å; D628-V676 WeakPolarHBondContact OD1-CG1 3.46Å
629K85.4Confident85.5Confident118 Ų11844.3 Ų44.351%0.51326%0.258SS..Hα-helixtrans-64-38.8174.4-64.4-176.3177.5-176.20111.6V613 Q626 V627 A633V613-K629 HydrophobicContact CG1-CB 4.44Å; Q626-K629 WeakPolarHBondContact O-CB 3.33Å; Q626-K629 PolarHBondContact O-N 3.41Å; V627-K629 VanDerWaalsContact C-N 3.29Å; V627-K629 PolarHBondContact O-N 3.21Å; K629-A633 WeakPolarHBondContact O-CB 3.35Å; K629-A633 PolarHBondContact O-N 3.44Å
630V88.1Confident84.9Confident2 Ų237.6 Ų37.61%0.01222%0.222CC..Hα-helixtrans-65.1-42.8175.4-179.40000110.4M610 V613 L614 W617 Q626 V627 D628 A633 L634 L662M610-V630 HydrophobicContact CE-CG1 4.45Å; V613-V630 HydrophobicContact CG1-CG2 4.02Å; L614-V630 HydrophobicContact CD2-CG1 4.32Å; W617-V630 HydrophobicContact CB-CG2 4.13Å; W617-V630 HydrophobicContact CD2-CG2 3.77Å; W617-V630 HydrophobicContact CE3-CG1 4.45Å; W617-V630 HydrophobicContact CE3-CG2 3.93Å; W617-V630 HydrophobicContact CG-CG2 3.87Å; Q626-V630 PolarHBondContact O-N 3.15Å; V627-V630 CarbonylContact O-C 3.59Å; V627-V630 WeakPolarHBondContact O-CA 3.45Å; V627-V630 WeakPolarHBondContact O-CB 3.18Å; V627-V630 PolarHBondContact O-N 3.15Å; D628-V630 VanDerWaalsContact C-N 3.31Å; D628-V630 PolarHBondContact O-N 3.32Å; V630-A633 PolarHBondContact O-N 3.45Å; V630-L634 WeakPolarHBondContact O-CB 3.3Å; V630-L634 PolarHBondContact O-N 2.59Å; V630-L662 HydrophobicContact CG1-CD2 3.98Å
631N88.6Confident84.4Confident14 Ų1436.8 Ų36.88%0.07521%0.213CC..Hα-helixtrans-64.1-43.3177.6-74.5-12.3000111.6V627 D628 L634 G635 V676 T680 L683V627-N631 WeakPolarHBondContact O-CB 3.33Å; V627-N631 PolarHBondContact O-N 3.48Å; D628-N631 PolarHBondContact O-N 3.07Å; N631-L634 PolarHBondContact O-N 3.15Å; N631-G635 PolarHBondContact O-N 3.18Å; N631-V676 PolarHBondContact ND2-O 3.4Å; N631-V676 VanDerWaalsContact ND2-O 3.14Å; N631-T680 PolarHBondContact ND2-OG1 2.87Å; N631-T680 VanDerWaalsContact OD1-CA 3.27Å; N631-T680 WeakPolarHBondContact OD1-CA 3.38Å; N631-T680 VanDerWaalsContact OD1-CB 3.26Å; N631-T680 WeakPolarHBondContact OD1-CB 3.32Å; N631-T680 PolarHBondContact OD1-OG1 2.76Å; N631-L683 HydrophobicContact CB-CD1 4.03Å; N631-L683 VanDerWaalsContact O-CD1 3.24Å; N631-L683 WeakPolarHBondContact O-CD1 3.46Å
632T84.9Confident83.6Confident47 Ų4742 Ų4229%0.28822%0.216SC..Hα-helixtrans-62.1-45.7175.2-49.30000111.5V580 L583 H587 D628 G635 S636V580-T632 HydrophobicContact CG1-CG2 4.5Å; L583-T632 HydrophobicContact CB-CG2 3.92Å; L583-T632 HydrophobicContact CD1-CG2 3.8Å; H587-T632 PolarHBondContact CE1-O 3.22Å; H587-T632 VanDerWaalsContact CE1-O 3.31Å; H587-T632 PolarHBondContact NE2-O 3.11Å; H587-T632 VanDerWaalsContact NE2-O 3.09Å; D628-T632 PolarHBondContact O-N 3.31Å; D628-T632 PolarHBondContact O-OG1 2.98Å; T632-G635 PolarHBondContact O-N 3.29Å; T632-S636 PolarHBondContact O-N 3.15Å; T632-S636 PolarHBondContact O-OG 3.37Å
633A86.6Confident82.3Confident4 Ų439.6 Ų39.63%0.03321%0.21CC..Hα-helixtrans-67.3-40.4178.600000112.2M610 V613 K629 V630 S636 L637M610-A633 HydrophobicContact SD-CB 3.45Å; M610-A633 WeakPolarHBondContact SD-CB 3.18Å; V613-A633 HydrophobicContact CB-CB 4.3Å; V613-A633 HydrophobicContact CG1-CB 4.21Å; V613-A633 HydrophobicContact CG2-CB 4.23Å; K629-A633 WeakPolarHBondContact O-CB 3.35Å; K629-A633 PolarHBondContact O-N 3.44Å; V630-A633 PolarHBondContact O-N 3.45Å; A633-S636 PolarHBondContact O-N 3Å; A633-L637 PolarHBondContact O-N 2.91Å
634L87.5Confident80.9Confident0 Ų035.2 Ų35.20%019%0.192CC..Hα-helixtrans-66-36.8176.3-178.863.3000112M610 V630 N631 S636 L637 L638 L662 T680 L683 L684M610-L634 HydrophobicContact CE-CB 4.14Å; M610-L634 HydrophobicContact CE-CD1 4.29Å; V630-L634 WeakPolarHBondContact O-CB 3.3Å; V630-L634 PolarHBondContact O-N 2.59Å; N631-L634 PolarHBondContact O-N 3.15Å; L634-S636 VanDerWaalsContact C-N 3.29Å; L634-S636 PolarHBondContact O-N 3.07Å; L634-L637 HydrophobicContact CD1-CD2 4.24Å; L634-L637 WeakPolarHBondContact O-CB 3.4Å; L634-L637 PolarHBondContact O-N 2.99Å; L634-L638 WeakPolarHBondContact O-CB 3.44Å; L634-L638 PolarHBondContact O-N 2.79Å; L634-L662 HydrophobicContact CD1-CD1 3.91Å; L634-L662 HydrophobicContact CD2-CD1 4.2Å; L634-T680 HydrophobicContact CD2-CG2 4.49Å; L634-L683 HydrophobicContact CB-CD1 4.42Å; L634-L683 HydrophobicContact CD2-CB 3.55Å; L634-L683 HydrophobicContact CD2-CD1 4.35Å; L634-L683 HydrophobicContact CG-CB 3.93Å; L634-L683 HydrophobicContact CG-CD1 4.46Å; L634-L684 HydrophobicContact CD1-CD2 4.31Å; L634-L684 HydrophobicContact CD2-CD2 3.8Å; L634-L684 HydrophobicContact CD2-CG 3.8Å
635G86.1Confident79.1Confident7 Ų738.3 Ų38.37%0.07222%0.216CC..Hα-helixtrans-60.8-38.917300000112.3H587 N631 T632 L638 S639H587-G635 PolarHBondContact CD2-O 3.15Å; H587-G635 VanDerWaalsContact NE2-CA 3.35Å; H587-G635 WeakPolarHBondContact NE2-CA 3.37Å; N631-G635 PolarHBondContact O-N 3.18Å; T632-G635 PolarHBondContact O-N 3.29Å; G635-L638 WeakPolarHBondContact O-CB 3.45Å; G635-L638 PolarHBondContact O-N 3.34Å; G635-S639 PolarHBondContact O-N 3.27Å; G635-S639 VanDerWaalsContact O-N 3.09Å
636S82.6Confident77.4Confident1 Ų139.2 Ų39.21%0.00721%0.211CC..Hα-helixtrans-72.2-34.7176.9-580000111.7L583 H587 T632 A633 L634 L638 S639 L640L583-S636 WeakPolarHBondContact CB-OG 3.3Å; L583-S636 WeakPolarHBondContact CD2-OG 3.48Å; H587-S636 PolarHBondContact CD2-N 3.38Å; H587-S636 PolarHBondContact CE1-OG 3.35Å; H587-S636 PolarHBondContact NE2-N 3.06Å; H587-S636 PolarHBondContact NE2-OG 3.25Å; T632-S636 PolarHBondContact O-N 3.15Å; T632-S636 PolarHBondContact O-OG 3.37Å; A633-S636 PolarHBondContact O-N 3Å; L634-S636 VanDerWaalsContact C-N 3.29Å; L634-S636 PolarHBondContact O-N 3.07Å; S636-L638 VanDerWaalsContact C-N 3.3Å; S636-L638 PolarHBondContact O-N 3.05Å; S636-S639 PolarHBondContact O-N 3.2Å; S636-S639 PolarHBondContact O-OG 3.16Å; S636-L640 PolarHBondContact O-N 2.72Å
637L84.9Confident75.9Confident0 Ų038.3 Ų38.30%021%0.21CC..Hα-helixtrans-65.8-35.7171.1-169.672.3000111.9I607 M610 A633 L634 L640 L641 V655 M658I607-L637 HydrophobicContact CG1-CD1 4.33Å; M610-L637 HydrophobicContact CG-CD2 4.24Å; A633-L637 PolarHBondContact O-N 2.91Å; L634-L637 HydrophobicContact CD1-CD2 4.24Å; L634-L637 WeakPolarHBondContact O-CB 3.4Å; L634-L637 PolarHBondContact O-N 2.99Å; L637-L640 WeakPolarHBondContact O-CB 3.38Å; L637-L640 PolarHBondContact O-N 3.41Å; L637-L641 WeakPolarHBondContact O-CG 3.38Å; L637-L641 PolarHBondContact O-N 2.89Å; L637-L641 VanDerWaalsContact O-N 3.07Å; L637-V655 HydrophobicContact CD1-CG1 4.37Å; L637-V655 HydrophobicContact CD1-CG2 3.85Å; L637-V655 HydrophobicContact CD2-CG1 3.96Å; L637-V655 HydrophobicContact CG-CG1 4.23Å; L637-M658 HydrophobicContact CD1-CE 4.06Å; L637-M658 HydrophobicContact CD2-CE 4.09Å
638L83Confident74.4Confident7 Ų743.7 Ų43.74%0.03724%0.235CC..Hα-helixtrans-67.3-37.2176.3178.863.4000112.3L634 G635 S636 L640 L641 R642 L683 S686 A687L634-L638 WeakPolarHBondContact O-CB 3.44Å; L634-L638 PolarHBondContact O-N 2.79Å; G635-L638 WeakPolarHBondContact O-CB 3.45Å; G635-L638 PolarHBondContact O-N 3.34Å; S636-L638 VanDerWaalsContact C-N 3.3Å; S636-L638 PolarHBondContact O-N 3.05Å; L638-L640 VanDerWaalsContact C-N 3.29Å; L638-L640 PolarHBondContact O-N 2.96Å; L638-L641 PolarHBondContact O-N 3.09Å; L638-R642 HydrophobicContact CD1-CG 4.35Å; L638-R642 WeakPolarHBondContact O-CG 3.45Å; L638-R642 PolarHBondContact O-N 3.1Å; L638-L683 HydrophobicContact CD2-CD2 3.87Å; L638-S686 VanDerWaalsContact CD1-C 3.5Å; L638-A687 HydrophobicContact CD1-CB 4.05Å
639S76.3Confident72.9Confident13 Ų1347.6 Ų47.69%0.09125%0.25CS..Hα-helixtrans-64-36.617570.60000111.6W586 G635 S636W586-S639 PolarHBondContact O-OG 3.35Å; G635-S639 PolarHBondContact O-N 3.27Å; G635-S639 VanDerWaalsContact O-N 3.09Å; S636-S639 PolarHBondContact O-N 3.2Å; S636-S639 PolarHBondContact O-OG 3.16Å
640L78.6Confident71.4Confident2 Ų250 Ų501%0.0126%0.264CS..Hα-helixtrans-60.2-47.9170.9178.5149.2000112.1L591 E603 I607 S636 L637 L638 R642 G643L591-L640 HydrophobicContact CD1-CB 3.76Å; L591-L640 HydrophobicContact CD1-CD1 4.01Å; L591-L640 HydrophobicContact CD1-CG 3.78Å; E603-L640 HydrophobicContact CB-CD1 3.78Å; E603-L640 HydrophobicContact CG-CD1 3.62Å; E603-L640 HydrophobicContact CG-CG 4.2Å; I607-L640 HydrophobicContact CD1-CD1 4.46Å; I607-L640 HydrophobicContact CG1-CD1 4.38Å; S636-L640 PolarHBondContact O-N 2.72Å; L637-L640 WeakPolarHBondContact O-CB 3.38Å; L637-L640 PolarHBondContact O-N 3.41Å; L638-L640 VanDerWaalsContact C-N 3.29Å; L638-L640 PolarHBondContact O-N 2.96Å; L640-R642 PolarHBondContact O-N 2.96Å; L640-G643 PolarHBondContact O-N 3.33Å
641L75.3Confident70.2Confident5 Ų550.7 Ų50.73%0.02627%0.269CS..Hα-helixtrans-64.4-38.3-179.1-74175000113.5L637 L638 G643 V655 I659 A687 V690 V691L637-L641 WeakPolarHBondContact O-CG 3.38Å; L637-L641 PolarHBondContact O-N 2.89Å; L637-L641 VanDerWaalsContact O-N 3.07Å; L638-L641 PolarHBondContact O-N 3.09Å; L641-G643 PolarHBondContact O-N 2.89Å; L641-V655 HydrophobicContact CD1-CG1 3.89Å; L641-V655 HydrophobicContact CD2-CG1 3.82Å; L641-V655 HydrophobicContact CG-CG1 4.15Å; L641-I659 HydrophobicContact CD1-CD1 4.01Å; L641-A687 HydrophobicContact CD1-CB 3.84Å; L641-V690 HydrophobicContact CB-CB 4.23Å; L641-V690 HydrophobicContact CB-CG1 4.09Å; L641-V690 HydrophobicContact CB-CG2 4.25Å; L641-V690 HydrophobicContact CD2-CG1 4.4Å; L641-V690 WeakPolarHBondContact O-CG1 3.36Å; L641-V691 HydrophobicContact CD1-CG1 4.43Å; L641-V691 HydrophobicContact CD2-CG1 3.71Å
642R70.8Confident69.3Low162 Ų16250.7 Ų50.761%0.61127%0.269SS*.THydrogen-bonded Turntrans-70-11.7179.4-71.7175.4175.2177.7-1.5113.7L638 L640L638-R642 HydrophobicContact CD1-CG 4.35Å; L638-R642 WeakPolarHBondContact O-CG 3.45Å; L638-R642 PolarHBondContact O-N 3.1Å; L640-R642 PolarHBondContact O-N 2.96Å
643G59Low69Low11 Ų1154.4 Ų54.411%0.11329%0.287CS..THydrogen-bonded Turntrans-85-10.6-178.100000116L640 L641L640-G643 PolarHBondContact O-N 3.33Å; L641-G643 PolarHBondContact O-N 2.89Å
644H57.1Low68.8Low47 Ų4756.4 Ų56.422%0.21830%0.3CS..  trans-116.5130.4-167.5-81.3-73000113.6E603 P647E603-H644 IonicContact OE1-CD2 2.85Å; E603-H644 IonicContact OE1-CE1 3.4Å; E603-H644 PolarHBondContact OE1-CE1 3.24Å; E603-H644 IonicContact OE1-NE2 2.89Å; E603-H644 PolarHBondContact OE1-NE2 3.08Å; E603-H644 IonicContact OE2-NE2 3.86Å; H644-P647 HydrophobicContact CB-CB 4.46Å
645P46.1Very low68.7Low137 Ų13756.4 Ų56.489%0.8930%0.301SS*.SBendtrans-77.7-22.1162.325.5-23.8000112.6
646S48.8Very low68.7Low93 Ų9356.9 Ų56.965%0.6530%0.302SS*.SBendtrans-160.3106.9170.556.40000109.7
647P51.8Low68.9Low41 Ų4166 Ų6627%0.26634%0.336SS..  trans-65149.5176.626.1-32.3000110.9H644 E649H644-P647 HydrophobicContact CB-CB 4.46Å; P647-E649 PolarHBondContact O-N 3.24Å
648E55.6Low69.1Low115 Ų11566.3 Ų66.354%0.53734%0.338SS..  trans-54138168.9-66.9179.4176.500110Q650 C651 S652E648-Q650 PolarHBondContact O-N 3.42Å; E648-Q650 VanDerWaalsContact O-N 3.08Å; E648-C651 PolarHBondContact O-N 3.45Å; E648-C651 VanDerWaalsContact O-N 3.09Å; E648-S652 PolarHBondContact O-N 2.9Å; E648-S652 VanDerWaalsContact O-N 3.11Å
649E54.7Low69.5Low173 Ų17366 Ų6681%0.80834%0.336SS*.Hα-helixtrans-54.1-35.4-168.9-76.3-179156.100113.6P647 L653P647-E649 PolarHBondContact O-N 3.24Å; E649-L653 WeakPolarHBondContact O-CG 3.4Å; E649-L653 PolarHBondContact O-N 3.27Å
650Q53.5Low70.1Confident169 Ų16966.6 Ų66.679%0.7934%0.339SS*.Hα-helixtrans-74.5-37.4-179.7-74.4179-9.500113.8E648E648-Q650 PolarHBondContact O-N 3.42Å; E648-Q650 VanDerWaalsContact O-N 3.08Å
651C63.3Low70.6Confident17 Ų1768.8 Ų68.812%0.11535%0.349CS..Hα-helixtrans-65.6-42.6174.8-177.40000110.2I607 E648 L653 S654 V655I607-C651 WeakPolarHBondContact CD1-SG 3.35Å; E648-C651 PolarHBondContact O-N 3.45Å; E648-C651 VanDerWaalsContact O-N 3.09Å; C651-L653 PolarHBondContact O-N 2.92Å; C651-S654 PolarHBondContact O-N 3.43Å; C651-V655 WeakPolarHBondContact O-CG2 3.26Å; C651-V655 PolarHBondContact O-N 3.23Å
652S69.8Low71.4Confident13 Ų1368.8 Ų68.89%0.09135%0.349CS..Hα-helixtrans-57.1-44.8177.5-1700000113.3E648 V655 V656 N694E648-S652 PolarHBondContact O-N 2.9Å; E648-S652 VanDerWaalsContact O-N 3.11Å; S652-V655 PolarHBondContact O-N 2.99Å; S652-V656 WeakPolarHBondContact O-CB 3.41Å; S652-V656 WeakPolarHBondContact O-CG2 3.44Å; S652-V656 PolarHBondContact O-N 3.17Å; S652-N694 PolarHBondContact OG-ND2 3.05Å
653L77.6Confident72.4Confident125 Ų12561.1 Ų61.165%0.65432%0.321SS*.Hα-helixtrans-65.6-42.9-177.7-73.8168.4000113.4E649 C651 V655 R657E649-L653 WeakPolarHBondContact O-CG 3.4Å; E649-L653 PolarHBondContact O-N 3.27Å; C651-L653 PolarHBondContact O-N 2.92Å; L653-V655 VanDerWaalsContact C-N 3.34Å; L653-R657 WeakPolarHBondContact O-CB 3.47Å; L653-R657 PolarHBondContact O-N 3.43Å
654S82.6Confident73.8Confident46 Ų4664.4 Ų64.432%0.32234%0.342SS..Hα-helixtrans-64.5-41.2178.9-63.90000111.3C651 R657 M658C651-S654 PolarHBondContact O-N 3.43Å; S654-R657 PolarHBondContact O-N 3.35Å; S654-M658 WeakPolarHBondContact O-CG 3.29Å; S654-M658 PolarHBondContact O-N 2.94Å; S654-M658 VanDerWaalsContact O-N 3.15Å
655V84.5Confident75.4Confident1 Ų168 Ų681%0.00635%0.353CS..Hα-helixtrans-68.9-43.7178.6176.30000112.1I607 L637 L641 C651 S652 L653 R657 M658 I659I607-V655 HydrophobicContact CD1-CG2 4.44Å; I607-V655 HydrophobicContact CG1-CG2 4.45Å; L637-V655 HydrophobicContact CD1-CG1 4.37Å; L637-V655 HydrophobicContact CD1-CG2 3.85Å; L637-V655 HydrophobicContact CD2-CG1 3.96Å; L637-V655 HydrophobicContact CG-CG1 4.23Å; L641-V655 HydrophobicContact CD1-CG1 3.89Å; L641-V655 HydrophobicContact CD2-CG1 3.82Å; L641-V655 HydrophobicContact CG-CG1 4.15Å; C651-V655 WeakPolarHBondContact O-CG2 3.26Å; C651-V655 PolarHBondContact O-N 3.23Å; S652-V655 PolarHBondContact O-N 2.99Å; L653-V655 VanDerWaalsContact C-N 3.34Å; V655-R657 VanDerWaalsContact C-N 3.3Å; V655-R657 PolarHBondContact O-N 3.19Å; V655-M658 HydrophobicContact CB-CE 4.47Å; V655-M658 HydrophobicContact CG2-CE 4.05Å; V655-M658 PolarHBondContact O-N 2.81Å; V655-I659 HydrophobicContact CG1-CD1 3.68Å; V655-I659 HydrophobicContact CG1-CG1 4.36Å; V655-I659 WeakPolarHBondContact O-CG1 3.15Å; V655-I659 PolarHBondContact O-N 3.5Å
656V86.4Confident77.5Confident16 Ų1662.1 Ų62.110%0.09731%0.314CS..Hα-helixtrans-58.9-41.8174.9167.60000111.2S652 I659 T660 V691 N694 I695S652-V656 WeakPolarHBondContact O-CB 3.41Å; S652-V656 WeakPolarHBondContact O-CG2 3.44Å; S652-V656 PolarHBondContact O-N 3.17Å; V656-I659 PolarHBondContact O-N 3.29Å; V656-T660 WeakPolarHBondContact O-CB 3.27Å; V656-T660 PolarHBondContact O-N 3.4Å; V656-T660 PolarHBondContact O-OG1 2.85Å; V656-V691 HydrophobicContact CG2-CB 4.08Å; V656-V691 HydrophobicContact CG2-CG1 4.37Å; V656-N694 VanDerWaalsContact CG1-O 3.3Å; V656-N694 WeakPolarHBondContact CG1-O 3.24Å; V656-N694 HydrophobicContact CG2-CB 3.81Å; V656-I695 HydrophobicContact CG1-CG1 4.38Å
657R87.6Confident79.4Confident194 Ų19461 Ų6173%0.73230%0.301SS*.Hα-helixtrans-61.1-46.8176.6-178.9179.1169.8-179-3.5111.7L653 S654 V655 T660 Q661L653-R657 WeakPolarHBondContact O-CB 3.47Å; L653-R657 PolarHBondContact O-N 3.43Å; S654-R657 PolarHBondContact O-N 3.35Å; V655-R657 VanDerWaalsContact C-N 3.3Å; V655-R657 PolarHBondContact O-N 3.19Å; R657-T660 PolarHBondContact O-N 3.01Å; R657-Q661 WeakPolarHBondContact O-CB 3.38Å; R657-Q661 PolarHBondContact O-N 3.46Å
658M89.8Confident81Confident6 Ų660.5 Ų60.53%0.0330%0.298CS..Hα-helixtrans-62.6-45.5178.5-70.2-174-68.700112.1I607 M610 Q611 L614 L637 S654 V655 T660 Q661 L662I607-M658 HydrophobicContact CG2-CE 4.17Å; M610-M658 HydrophobicContact CB-CE 4.45Å; M610-M658 HydrophobicContact CB-SD 3.94Å; M610-M658 HydrophobicContact CG-CE 4.22Å; M610-M658 HydrophobicContact CG-SD 3.52Å; M610-M658 VanDerWaalsContact CG-SD 3.52Å; Q611-M658 HydrophobicContact CG-SD 3.6Å; Q611-M658 VanDerWaalsContact CG-SD 3.6Å; L614-M658 HydrophobicContact CD1-CB 3.81Å; L614-M658 HydrophobicContact CD1-CG 3.7Å; L614-M658 HydrophobicContact CD1-SD 4.06Å; L637-M658 HydrophobicContact CD1-CE 4.06Å; L637-M658 HydrophobicContact CD2-CE 4.09Å; S654-M658 WeakPolarHBondContact O-CG 3.29Å; S654-M658 PolarHBondContact O-N 2.94Å; S654-M658 VanDerWaalsContact O-N 3.15Å; V655-M658 HydrophobicContact CB-CE 4.47Å; V655-M658 HydrophobicContact CG2-CE 4.05Å; V655-M658 PolarHBondContact O-N 2.81Å; M658-T660 VanDerWaalsContact C-N 3.35Å; M658-T660 PolarHBondContact O-N 3.2Å; M658-Q661 PolarHBondContact O-N 2.94Å; M658-L662 WeakPolarHBondContact O-CG 3.46Å; M658-L662 PolarHBondContact O-N 2.99Å
659I90.3Very high82.4Confident0 Ų058.4 Ų58.40%030%0.296CS..Hα-helixtrans-63.2-42177.7-67.3167.1000110.9L641 V655 V656 L662 W663 L684 A687 V691 I695L641-I659 HydrophobicContact CD1-CD1 4.01Å; V655-I659 HydrophobicContact CG1-CD1 3.68Å; V655-I659 HydrophobicContact CG1-CG1 4.36Å; V655-I659 WeakPolarHBondContact O-CG1 3.15Å; V655-I659 PolarHBondContact O-N 3.5Å; V656-I659 PolarHBondContact O-N 3.29Å; I659-L662 PolarHBondContact O-N 3.23Å; I659-W663 PolarHBondContact O-N 3.35Å; I659-L684 HydrophobicContact CG2-CD2 4.47Å; I659-A687 HydrophobicContact CD1-CB 3.84Å; I659-A687 HydrophobicContact CG1-CB 4.38Å; I659-V691 HydrophobicContact CD1-CG2 3.61Å; I659-I695 HydrophobicContact CG2-CD1 3.72Å
660T89.2Confident83.8Confident25 Ų2554.3 Ų54.315%0.15328%0.277CS..Hα-helixtrans-64.2-40.9177.1-54.60000111.6V656 R657 M658 L662 W663 S664V656-T660 WeakPolarHBondContact O-CB 3.27Å; V656-T660 PolarHBondContact O-N 3.4Å; V656-T660 PolarHBondContact O-OG1 2.85Å; R657-T660 PolarHBondContact O-N 3.01Å; M658-T660 VanDerWaalsContact C-N 3.35Å; M658-T660 PolarHBondContact O-N 3.2Å; T660-L662 VanDerWaalsContact C-N 3.35Å; T660-W663 PolarHBondContact O-N 2.98Å; T660-S664 PolarHBondContact O-N 3.31Å; T660-S664 VanDerWaalsContact O-N 3.08Å
661Q89.4Confident85.3Confident49 Ų4946.3 Ų46.323%0.22924%0.239CC..Hα-helixtrans-60.7-44.3174.6-178.2176.8-1.700111.1E618 R657 M658 S664E618-Q661 PolarHBondContact OE2-NE2 2.69Å; E618-Q661 VanDerWaalsContact OE2-NE2 3.08Å; R657-Q661 WeakPolarHBondContact O-CB 3.38Å; R657-Q661 PolarHBondContact O-N 3.46Å; M658-Q661 PolarHBondContact O-N 2.94Å; Q661-S664 PolarHBondContact O-N 3.44Å; Q661-S664 PolarHBondContact O-OG 2.8Å
662L91.2Very high86Confident5 Ų549.7 Ų49.73%0.02625%0.254CS..Hα-helixtrans-63.5-44.8176.7-73.4172.2000112.3M610 L614 W617 V630 L634 M658 I659 T660 S664 R665 M666 L684M610-L662 HydrophobicContact CE-CD1 3.74Å; L614-L662 HydrophobicContact CD2-CD1 4.43Å; L614-L662 HydrophobicContact CD2-CD2 3.58Å; L614-L662 HydrophobicContact CD2-CG 4.06Å; W617-L662 HydrophobicContact CE3-CD2 4.41Å; W617-L662 HydrophobicContact CZ3-CD2 3.73Å; V630-L662 HydrophobicContact CG1-CD2 3.98Å; L634-L662 HydrophobicContact CD1-CD1 3.91Å; L634-L662 HydrophobicContact CD2-CD1 4.2Å; M658-L662 WeakPolarHBondContact O-CG 3.46Å; M658-L662 PolarHBondContact O-N 2.99Å; I659-L662 PolarHBondContact O-N 3.23Å; T660-L662 VanDerWaalsContact C-N 3.35Å; L662-S664 VanDerWaalsContact C-N 3.28Å; L662-S664 PolarHBondContact O-N 3.37Å; L662-R665 PolarHBondContact O-N 3.23Å; L662-M666 PolarHBondContact O-N 3.28Å; L662-L684 HydrophobicContact CB-CD1 4.12Å; L662-L684 HydrophobicContact CB-CD2 3.65Å; L662-L684 HydrophobicContact CD1-CD2 3.73Å; L662-L684 HydrophobicContact CG-CD2 4.33Å
663W92.6Very high86.6Confident1 Ų153.7 Ų53.70%0.00428%0.278CS..Hα-helixtrans-58.6-38.6175.9-80.9121.6000112.9I659 T660 R665 M666 L681 L684 L685 T688 A699 Q702 A703 C706I659-W663 PolarHBondContact O-N 3.35Å; T660-W663 PolarHBondContact O-N 2.98Å; W663-R665 PolarHBondContact O-N 3.43Å; W663-M666 HydrophobicContact CE3-CB 4.17Å; W663-M666 HydrophobicContact CE3-CG 3.96Å; W663-M666 HydrophobicContact CZ3-CG 4.28Å; W663-M666 PolarHBondContact O-N 3.45Å; W663-M666 VanDerWaalsContact O-N 3.13Å; W663-L681 HydrophobicContact CH2-CD1 3.7Å; W663-L681 HydrophobicContact CZ3-CD1 3.77Å; W663-L684 HydrophobicContact CD2-CD1 4.42Å; W663-L684 HydrophobicContact CE3-CD1 4.41Å; W663-L684 HydrophobicContact CH2-CB 3.97Å; W663-L684 HydrophobicContact CZ2-CB 3.67Å; W663-L685 HydrophobicContact CH2-CD2 3.89Å; W663-L685 HydrophobicContact CH2-CG 4.17Å; W663-L685 HydrophobicContact CZ2-CD2 4.24Å; W663-T688 PolarHBondContact NE1-OG1 3.33Å; W663-A699 HydrophobicContact CB-CB 4.01Å; W663-A699 HydrophobicContact CG-CB 4.14Å; W663-Q702 WeakPolarHBondContact O-CG 3.48Å; W663-A703 HydrophobicContact CD2-CB 4.28Å; W663-A703 HydrophobicContact CE3-CB 4.13Å; W663-A703 HydrophobicContact CH2-CB 3.39Å; W663-A703 HydrophobicContact CZ2-CB 3.54Å; W663-A703 VanDerWaalsContact CZ3-CA 3.47Å; W663-A703 HydrophobicContact CZ3-CB 3.72Å; W663-C706 HydrophobicContact CZ3-CB 4.42Å
664S88.9Confident86.9Confident80 Ų8051.3 Ų51.356%0.55926%0.263SS*.THydrogen-bonded Turntrans-62.3-15.5177.277.90000114.1T660 Q661 L662T660-S664 PolarHBondContact O-N 3.31Å; T660-S664 VanDerWaalsContact O-N 3.08Å; Q661-S664 PolarHBondContact O-N 3.44Å; Q661-S664 PolarHBondContact O-OG 2.8Å; L662-S664 VanDerWaalsContact C-N 3.28Å; L662-S664 PolarHBondContact O-N 3.37Å
665R89.4Confident86.8Confident122 Ų12255.2 Ų55.246%0.4628%0.28SS..THydrogen-bonded Turntrans-104.4-11.1179.1-59.6-55.2-173-1700.8113.7Y622 L662 W663Y622-R665 HydrophobicContact CE1-CG 4.45Å; Y622-R665 PolarHBondContact OH-NE 3.23Å; Y622-R665 PolarHBondContact OH-NH2 3.47Å; L662-R665 PolarHBondContact O-N 3.23Å; W663-R665 PolarHBondContact O-N 3.43Å
666M91.1Very high86.8Confident14 Ų1457.4 Ų57.47%0.06929%0.293CS..  trans-73.4128.8177.2-66.4-62.4-75.100110.1L662 W663 L671 T680 L681 L684 Q702L662-M666 PolarHBondContact O-N 3.28Å; W663-M666 HydrophobicContact CE3-CB 4.17Å; W663-M666 HydrophobicContact CE3-CG 3.96Å; W663-M666 HydrophobicContact CZ3-CG 4.28Å; W663-M666 PolarHBondContact O-N 3.45Å; W663-M666 VanDerWaalsContact O-N 3.13Å; M666-L671 HydrophobicContact CE-CD1 4.21Å; M666-L671 HydrophobicContact CE-CD2 3.73Å; M666-L671 HydrophobicContact CE-CG 4.32Å; M666-T680 HydrophobicContact SD-CG2 4.02Å; M666-L681 HydrophobicContact CE-CB 3.83Å; M666-L681 HydrophobicContact CE-CD1 4.14Å; M666-L684 HydrophobicContact CE-CD1 4.23Å; M666-L684 HydrophobicContact CG-CD1 3.6Å; M666-L684 HydrophobicContact SD-CD1 3.76Å; M666-Q702 PolarHBondContact O-NE2 3.08Å
667N88.2Confident86.8Confident68 Ų6857.4 Ų57.436%0.36429%0.292SS..  trans-120.2125177.4-172.7-39.4000110.9S669 Q670 L671N667-S669 VanDerWaalsContact C-N 3.26Å; N667-S669 PolarHBondContact O-N 3.27Å; N667-S669 WeakPolarHBondContact OD1-CB 3.45Å; N667-S669 PolarHBondContact OD1-N 3.09Å; N667-S669 PolarHBondContact OD1-OG 2.84Å; N667-Q670 HydrophobicContact CB-CB 4.3Å; N667-Q670 HydrophobicContact CB-CG 4.13Å; N667-Q670 PolarHBondContact O-N 2.87Å; N667-Q670 VanDerWaalsContact O-N 3.15Å; N667-L671 PolarHBondContact O-N 3.36Å
668P85.6Confident86.8Confident31 Ų3149 Ų4920%0.20126%0.261CS..Hα-helixtrans-52.2-37.7177.2-27.935.1000114.9L705 A709P668-L705 HydrophobicContact CG-CB 4.12Å; P668-A709 HydrophobicContact CB-CB 3.73Å
669S84.3Confident86.6Confident72 Ų7251.7 Ų51.750%0.50328%0.275SS..Hα-helixtrans-71.5-31.6-17962.60000113.5N667N667-S669 VanDerWaalsContact C-N 3.26Å; N667-S669 PolarHBondContact O-N 3.27Å; N667-S669 WeakPolarHBondContact OD1-CB 3.45Å; N667-S669 PolarHBondContact OD1-N 3.09Å; N667-S669 PolarHBondContact OD1-OG 2.84Å
670Q85.4Confident86.7Confident87 Ų8751.9 Ų51.941%0.40728%0.277SS..Hα-helixtrans-80.1-25.3179.9-66.1-176.6-52.700112.4N667 Q672 T673 H674 L677N667-Q670 HydrophobicContact CB-CB 4.3Å; N667-Q670 HydrophobicContact CB-CG 4.13Å; N667-Q670 PolarHBondContact O-N 2.87Å; N667-Q670 VanDerWaalsContact O-N 3.15Å; Q670-Q672 VanDerWaalsContact C-N 3.25Å; Q670-Q672 PolarHBondContact O-N 3.34Å; Q670-T673 WeakPolarHBondContact CA-OG1 3.21Å; Q670-T673 PolarHBondContact O-N 2.96Å; Q670-T673 PolarHBondContact O-OG1 3.04Å; Q670-H674 PolarHBondContact O-N 2.83Å; Q670-L677 HydrophobicContact CB-CD1 3.75Å
671L83.8Confident86.8Confident1 Ų150.7 Ų50.71%0.00527%0.269CS..Hα-helixtrans-66.3-27.9176.5-76.9164.4000113.4M666 N667 T673 L677 Q678 L681 C706 V710M666-L671 HydrophobicContact CE-CD1 4.21Å; M666-L671 HydrophobicContact CE-CD2 3.73Å; M666-L671 HydrophobicContact CE-CG 4.32Å; N667-L671 PolarHBondContact O-N 3.36Å; L671-T673 VanDerWaalsContact C-N 3.3Å; L671-L677 HydrophobicContact CD2-CB 3.68Å; L671-L677 WeakPolarHBondContact CD2-O 3.18Å; L671-Q678 PolarHBondContact O-NE2 3.28Å; L671-L681 HydrophobicContact CD1-CD2 4.12Å; L671-L681 HydrophobicContact CD2-CB 4.01Å; L671-L681 HydrophobicContact CD2-CD2 4.16Å; L671-C706 HydrophobicContact CD1-CB 3.5Å; L671-C706 VanDerWaalsContact CD1-CB 3.5Å; L671-V710 HydrophobicContact CB-CG2 3.96Å; L671-V710 HydrophobicContact CD1-CG2 4.48Å
672Q78.9Confident86.9Confident88 Ų8851.6 Ų51.641%0.41127%0.273SS..THydrogen-bonded Turntrans-76.8-19.5176.8-64.7-179.9-10.500112.5Q670 A709Q670-Q672 VanDerWaalsContact C-N 3.25Å; Q670-Q672 PolarHBondContact O-N 3.34Å; Q672-A709 PolarHBondContact NE2-O 3.48Å
673T80.9Confident86.9Confident97 Ų9752.8 Ų52.860%0.59528%0.279SS*.THydrogen-bonded Turntrans-108.2-25.8-173.546.40000113.4Q670 L671Q670-T673 WeakPolarHBondContact CA-OG1 3.21Å; Q670-T673 PolarHBondContact O-N 2.96Å; Q670-T673 PolarHBondContact O-OG1 3.04Å; L671-T673 VanDerWaalsContact C-N 3.3Å
674H83.9Confident86.9Confident74 Ų7452.8 Ų52.834%0.34328%0.279SS..  trans-124.7110.4-175.3-59.8-62.3000112.6L624 Q670 V676 L677L624-H674 HydrophobicContact CD1-CB 4.44Å; L624-H674 HydrophobicContact CD2-CB 4.22Å; L624-H674 WeakPolarHBondContact CD2-ND1 3.4Å; Q670-H674 PolarHBondContact O-N 2.83Å; H674-V676 VanDerWaalsContact C-N 3.31Å; H674-V676 PolarHBondContact O-N 3.37Å; H674-L677 HydrophobicContact CB-CD1 4.03Å; H674-L677 HydrophobicContact CB-CG 4.15Å; H674-L677 PolarHBondContact O-N 3.31Å; H674-L677 VanDerWaalsContact O-N 3.15Å
675L81.9Confident87.1Confident129 Ų12949 Ų4968%0.67525%0.252SS*.Hα-helixtrans-59.2-36.8-180-66.6174.3000113.5L677 Q678 D679L675-L677 PolarHBondContact O-N 2.91Å; L675-L677 VanDerWaalsContact O-N 3.15Å; L675-Q678 WeakPolarHBondContact O-CA 3.4Å; L675-Q678 VanDerWaalsContact O-CB 3.27Å; L675-Q678 WeakPolarHBondContact O-CB 3.34Å; L675-Q678 PolarHBondContact O-N 2.61Å; L675-D679 PolarHBondContact O-N 3.4Å
676V83.3Confident87.1Confident46 Ų4643.8 Ų43.828%0.27924%0.235SC..Hα-helixtrans-57.7-31.3178.6178.40000112.2V627 D628 N631 H674 D679 T680V627-V676 HydrophobicContact CB-CG1 3.88Å; V627-V676 HydrophobicContact CG1-CG1 3.64Å; D628-V676 WeakPolarHBondContact OD1-CG1 3.46Å; N631-V676 PolarHBondContact ND2-O 3.4Å; N631-V676 VanDerWaalsContact ND2-O 3.14Å; H674-V676 VanDerWaalsContact C-N 3.31Å; H674-V676 PolarHBondContact O-N 3.37Å; V676-D679 PolarHBondContact O-N 3.06Å; V676-T680 PolarHBondContact O-N 3.4Å; V676-T680 PolarHBondContact O-OG1 3.34Å; V676-T680 VanDerWaalsContact O-OG1 3.13Å
677L87.3Confident87Confident16 Ų1643.1 Ų43.18%0.08423%0.232CC..Hα-helixtrans-76.4-22.5176.3-63.8177.5000112.6L624 V627 Q670 L671 H674 L675 D679 T680 L681L624-L677 HydrophobicContact CD1-CD1 4.07Å; L624-L677 HydrophobicContact CD1-CD2 3.99Å; L624-L677 HydrophobicContact CD1-CG 3.92Å; V627-L677 HydrophobicContact CG1-CD2 4.22Å; V627-L677 HydrophobicContact CG2-CD2 4.41Å; Q670-L677 HydrophobicContact CB-CD1 3.75Å; L671-L677 HydrophobicContact CD2-CB 3.68Å; L671-L677 WeakPolarHBondContact CD2-O 3.18Å; H674-L677 HydrophobicContact CB-CD1 4.03Å; H674-L677 HydrophobicContact CB-CG 4.15Å; H674-L677 PolarHBondContact O-N 3.31Å; H674-L677 VanDerWaalsContact O-N 3.15Å; L675-L677 PolarHBondContact O-N 2.91Å; L675-L677 VanDerWaalsContact O-N 3.15Å; L677-D679 VanDerWaalsContact C-N 3.35Å; L677-T680 WeakPolarHBondContact O-CB 3.31Å; L677-T680 PolarHBondContact O-N 3.29Å; L677-L681 WeakPolarHBondContact O-CB 3.3Å; L677-L681 PolarHBondContact O-N 2.84Å
678Q87.6Confident87.1Confident18 Ų1839.9 Ų39.98%0.08421%0.214CC..Hα-helixtrans-70-35.3173-60.3-174.35.700111L671 L675 L681 K682 L719L671-Q678 PolarHBondContact O-NE2 3.28Å; L675-Q678 WeakPolarHBondContact O-CA 3.4Å; L675-Q678 VanDerWaalsContact O-CB 3.27Å; L675-Q678 WeakPolarHBondContact O-CB 3.34Å; L675-Q678 PolarHBondContact O-N 2.61Å; Q678-L681 WeakPolarHBondContact O-CB 3.38Å; Q678-L681 PolarHBondContact O-N 3.39Å; Q678-K682 PolarHBondContact O-N 3.33Å; Q678-L719 HydrophobicContact CB-CD2 4.25Å
679D86.2Confident87.3Confident62 Ų6240.3 Ų40.333%0.33222%0.216SC..Hα-helixtrans-65.7-43170.2-71.2-39.4000111.6L675 V676 L677 L681 K682 L683L675-D679 PolarHBondContact O-N 3.4Å; V676-D679 PolarHBondContact O-N 3.06Å; L677-D679 VanDerWaalsContact C-N 3.35Å; D679-L681 VanDerWaalsContact C-N 3.29Å; D679-L681 PolarHBondContact O-N 3.35Å; D679-K682 WeakPolarHBondContact O-CB 3.36Å; D679-K682 PolarHBondContact O-N 3.21Å; D679-L683 WeakPolarHBondContact O-CG 3.23Å; D679-L683 PolarHBondContact O-N 3.02Å
680T90.8Very high87.3Confident4 Ų439.9 Ų39.93%0.02521%0.21CC..Hα-helixtrans-57.4-44.3171.2-46.50000111.1V627 N631 L634 M666 V676 L677 L683 L684V627-T680 VanDerWaalsContact CG1-OG1 3.29Å; V627-T680 WeakPolarHBondContact CG1-OG1 3.44Å; N631-T680 PolarHBondContact ND2-OG1 2.87Å; N631-T680 VanDerWaalsContact OD1-CA 3.27Å; N631-T680 WeakPolarHBondContact OD1-CA 3.38Å; N631-T680 VanDerWaalsContact OD1-CB 3.26Å; N631-T680 WeakPolarHBondContact OD1-CB 3.32Å; N631-T680 PolarHBondContact OD1-OG1 2.76Å; L634-T680 HydrophobicContact CD2-CG2 4.49Å; M666-T680 HydrophobicContact SD-CG2 4.02Å; V676-T680 PolarHBondContact O-N 3.4Å; V676-T680 PolarHBondContact O-OG1 3.34Å; V676-T680 VanDerWaalsContact O-OG1 3.13Å; L677-T680 WeakPolarHBondContact O-CB 3.31Å; L677-T680 PolarHBondContact O-N 3.29Å; T680-L683 PolarHBondContact O-N 3.25Å; T680-L684 HydrophobicContact CG2-CD1 3.93Å; T680-L684 HydrophobicContact CG2-CG 4.29Å; T680-L684 WeakPolarHBondContact O-CB 3.49Å; T680-L684 VanDerWaalsContact O-CG 3.31Å; T680-L684 WeakPolarHBondContact O-CG 3.4Å; T680-L684 PolarHBondContact O-N 3.37Å
681L91.9Very high87.3Confident0 Ų036 Ų360%019%0.193CC..Hα-helixtrans-61.4-46.8178.3-178.763.8000111.5W663 M666 L671 L677 Q678 D679 L683 L684 L685 C706 V710 L719W663-L681 HydrophobicContact CH2-CD1 3.7Å; W663-L681 HydrophobicContact CZ3-CD1 3.77Å; M666-L681 HydrophobicContact CE-CB 3.83Å; M666-L681 HydrophobicContact CE-CD1 4.14Å; L671-L681 HydrophobicContact CD1-CD2 4.12Å; L671-L681 HydrophobicContact CD2-CB 4.01Å; L671-L681 HydrophobicContact CD2-CD2 4.16Å; L677-L681 WeakPolarHBondContact O-CB 3.3Å; L677-L681 PolarHBondContact O-N 2.84Å; Q678-L681 WeakPolarHBondContact O-CB 3.38Å; Q678-L681 PolarHBondContact O-N 3.39Å; D679-L681 VanDerWaalsContact C-N 3.29Å; D679-L681 PolarHBondContact O-N 3.35Å; L681-L683 VanDerWaalsContact C-N 3.33Å; L681-L683 PolarHBondContact O-N 3.14Å; L681-L684 PolarHBondContact O-N 3.25Å; L681-L685 HydrophobicContact CD1-CD1 4.1Å; L681-L685 HydrophobicContact CD1-CG 4.05Å; L681-L685 HydrophobicContact CG-CD1 3.88Å; L681-L685 HydrophobicContact CG-CG 4.28Å; L681-L685 WeakPolarHBondContact O-CB 3.26Å; L681-L685 VanDerWaalsContact O-CG 3.24Å; L681-L685 WeakPolarHBondContact O-CG 3.47Å; L681-L685 PolarHBondContact O-N 3.01Å; L681-C706 HydrophobicContact CD1-CB 3.87Å; L681-V710 HydrophobicContact CD2-CG2 4.02Å; L681-L719 HydrophobicContact CB-CD1 4.36Å; L681-L719 HydrophobicContact CD2-CD1 4.12Å; L681-L719 HydrophobicContact CD2-CD2 4.17Å; L681-L719 HydrophobicContact CG-CD1 4.04Å
682K91.6Very high87.4Confident69 Ų6936.3 Ų36.330%0.319%0.194SC..Hα-helixtrans-54.9-48.5176176.6-156.5-178.7179.50111.5Q678 D679 S686 Y718 L719 A722Q678-K682 PolarHBondContact O-N 3.33Å; D679-K682 WeakPolarHBondContact O-CB 3.36Å; D679-K682 PolarHBondContact O-N 3.21Å; K682-S686 WeakPolarHBondContact O-CB 3.49Å; K682-S686 PolarHBondContact O-N 3.19Å; K682-S686 VanDerWaalsContact O-N 3.07Å; K682-S686 PolarHBondContact O-OG 3.15Å; K682-Y718 HydrophobicContact CD-CD2 3.7Å; K682-Y718 HydrophobicContact CD-CE2 4.12Å; K682-Y718 HydrophobicContact CG-CD2 4.25Å; K682-L719 HydrophobicContact CB-CD1 3.87Å; K682-A722 HydrophobicContact CG-CB 4.02Å
683L90.5Very high87.6Confident30 Ų3039.5 Ų39.516%0.15721%0.207CC..Hα-helixtrans-66.8-42.8-179.6-68.3175000111.6N631 L634 L638 D679 T680 L681 S686 A687N631-L683 HydrophobicContact CB-CD1 4.03Å; N631-L683 VanDerWaalsContact O-CD1 3.24Å; N631-L683 WeakPolarHBondContact O-CD1 3.46Å; L634-L683 HydrophobicContact CB-CD1 4.42Å; L634-L683 HydrophobicContact CD2-CB 3.55Å; L634-L683 HydrophobicContact CD2-CD1 4.35Å; L634-L683 HydrophobicContact CG-CB 3.93Å; L634-L683 HydrophobicContact CG-CD1 4.46Å; L638-L683 HydrophobicContact CD2-CD2 3.87Å; D679-L683 WeakPolarHBondContact O-CG 3.23Å; D679-L683 PolarHBondContact O-N 3.02Å; T680-L683 PolarHBondContact O-N 3.25Å; L681-L683 VanDerWaalsContact C-N 3.33Å; L681-L683 PolarHBondContact O-N 3.14Å; L683-S686 PolarHBondContact O-N 2.93Å; L683-A687 WeakPolarHBondContact O-CB 3.26Å; L683-A687 PolarHBondContact O-N 3.05Å
684L92.9Very high87.7Confident0 Ų039.4 Ų39.40%020%0.203CC..Hα-helixtrans-64.9-44.6177.5-77.5176.3000112.6L634 I659 L662 W663 M666 T680 L681 S686 A687 T688L634-L684 HydrophobicContact CD1-CD2 4.31Å; L634-L684 HydrophobicContact CD2-CD2 3.8Å; L634-L684 HydrophobicContact CD2-CG 3.8Å; I659-L684 HydrophobicContact CG2-CD2 4.47Å; L662-L684 HydrophobicContact CB-CD1 4.12Å; L662-L684 HydrophobicContact CB-CD2 3.65Å; L662-L684 HydrophobicContact CD1-CD2 3.73Å; L662-L684 HydrophobicContact CG-CD2 4.33Å; W663-L684 HydrophobicContact CD2-CD1 4.42Å; W663-L684 HydrophobicContact CE3-CD1 4.41Å; W663-L684 HydrophobicContact CH2-CB 3.97Å; W663-L684 HydrophobicContact CZ2-CB 3.67Å; M666-L684 HydrophobicContact CE-CD1 4.23Å; M666-L684 HydrophobicContact CG-CD1 3.6Å; M666-L684 HydrophobicContact SD-CD1 3.76Å; T680-L684 HydrophobicContact CG2-CD1 3.93Å; T680-L684 HydrophobicContact CG2-CG 4.29Å; T680-L684 WeakPolarHBondContact O-CB 3.49Å; T680-L684 VanDerWaalsContact O-CG 3.31Å; T680-L684 WeakPolarHBondContact O-CG 3.4Å; T680-L684 PolarHBondContact O-N 3.37Å; L681-L684 PolarHBondContact O-N 3.25Å; L684-S686 VanDerWaalsContact C-N 3.31Å; L684-S686 PolarHBondContact O-N 3.39Å; L684-A687 PolarHBondContact O-N 3.29Å; L684-T688 WeakPolarHBondContact O-CB 3.39Å; L684-T688 PolarHBondContact O-N 2.85Å; L684-T688 PolarHBondContact O-OG1 3.22Å
685L92.9Very high87.7Confident0 Ų036.4 Ų36.40%019%0.189CC..Hα-helixtrans-59.1-45.8174.7-72.1170.7000110.6W663 L681 A687 T688 T689 A703 L707 L719 A722 A723 F726W663-L685 HydrophobicContact CH2-CD2 3.89Å; W663-L685 HydrophobicContact CH2-CG 4.17Å; W663-L685 HydrophobicContact CZ2-CD2 4.24Å; L681-L685 HydrophobicContact CD1-CD1 4.1Å; L681-L685 HydrophobicContact CD1-CG 4.05Å; L681-L685 HydrophobicContact CG-CD1 3.88Å; L681-L685 HydrophobicContact CG-CG 4.28Å; L681-L685 WeakPolarHBondContact O-CB 3.26Å; L681-L685 VanDerWaalsContact O-CG 3.24Å; L681-L685 WeakPolarHBondContact O-CG 3.47Å; L681-L685 PolarHBondContact O-N 3.01Å; L685-A687 PolarHBondContact O-N 3.1Å; L685-T688 PolarHBondContact O-N 2.79Å; L685-T689 PolarHBondContact O-N 3.49Å; L685-T689 PolarHBondContact O-OG1 3.18Å; L685-A703 HydrophobicContact CD2-CB 4.4Å; L685-L707 HydrophobicContact CD1-CD1 4.4Å; L685-L719 HydrophobicContact CD1-CD1 3.98Å; L685-A722 HydrophobicContact CB-CB 4.46Å; L685-A723 HydrophobicContact CD1-CB 4.32Å; L685-F726 HydrophobicContact CB-CB 4.28Å; L685-F726 HydrophobicContact CD2-CB 4.05Å; L685-F726 HydrophobicContact CD2-CD1 3.57Å; L685-F726 HydrophobicContact CD2-CD2 4.42Å; L685-F726 HydrophobicContact CD2-CE1 4.08Å; L685-F726 HydrophobicContact CD2-CG 3.75Å
686S91Very high87.8Confident14 Ų1438 Ų3810%0.09819%0.186CC..Hα-helixtrans-62.4-41.1177.8-62.80000112.7L638 K682 L683 L684 T689L638-S686 VanDerWaalsContact CD1-C 3.5Å; K682-S686 WeakPolarHBondContact O-CB 3.49Å; K682-S686 PolarHBondContact O-N 3.19Å; K682-S686 VanDerWaalsContact O-N 3.07Å; K682-S686 PolarHBondContact O-OG 3.15Å; L683-S686 PolarHBondContact O-N 2.93Å; L684-S686 VanDerWaalsContact C-N 3.31Å; L684-S686 PolarHBondContact O-N 3.39Å; S686-T689 WeakPolarHBondContact O-CB 3.37Å
687A88.9Confident87.8Confident0 Ų038 Ų380%019%0.187CC..Hα-helixtrans-70.1-44.4178.600000111L638 L641 I659 L683 L684 L685 T689 V690 V691L638-A687 HydrophobicContact CD1-CB 4.05Å; L641-A687 HydrophobicContact CD1-CB 3.84Å; I659-A687 HydrophobicContact CD1-CB 3.84Å; I659-A687 HydrophobicContact CG1-CB 4.38Å; L683-A687 WeakPolarHBondContact O-CB 3.26Å; L683-A687 PolarHBondContact O-N 3.05Å; L684-A687 PolarHBondContact O-N 3.29Å; L685-A687 PolarHBondContact O-N 3.1Å; A687-T689 VanDerWaalsContact C-N 3.28Å; A687-T689 PolarHBondContact O-N 3.38Å; A687-V690 PolarHBondContact O-N 2.94Å; A687-V691 WeakPolarHBondContact O-CG2 3.36Å; A687-V691 PolarHBondContact O-N 3.12Å
688T90.2Very high87.7Confident0 Ų043.3 Ų43.30%021%0.211CC..Hα-helixtrans-60-38178.7-590000111.5W663 L684 L685 V690 V691 V692 I695 F726W663-T688 PolarHBondContact NE1-OG1 3.33Å; L684-T688 WeakPolarHBondContact O-CB 3.39Å; L684-T688 PolarHBondContact O-N 2.85Å; L684-T688 PolarHBondContact O-OG1 3.22Å; L685-T688 PolarHBondContact O-N 2.79Å; T688-V690 PolarHBondContact O-N 3.18Å; T688-V691 CarbonylContact O-C 3.28Å; T688-V691 PolarHBondContact O-N 3.48Å; T688-V692 HydrophobicContact CG2-CG2 4.47Å; T688-V692 WeakPolarHBondContact O-CA 3.44Å; T688-V692 WeakPolarHBondContact O-CB 3.36Å; T688-V692 PolarHBondContact O-N 2.76Å; T688-I695 HydrophobicContact CG2-CD1 3.64Å; T688-F726 HydrophobicContact CG2-CD2 3.84Å; T688-F726 HydrophobicContact CG2-CE2 3.48Å; T688-F726 VanDerWaalsContact CG2-CE2 3.48Å
689T89.3Confident87.7Confident39 Ų3942.7 Ų42.724%0.23921%0.21CC..Hα-helixtrans-52.3-38.1174.8-58.10000112.3L685 S686 A687 F726L685-T689 PolarHBondContact O-N 3.49Å; L685-T689 PolarHBondContact O-OG1 3.18Å; S686-T689 WeakPolarHBondContact O-CB 3.37Å; A687-T689 VanDerWaalsContact C-N 3.28Å; A687-T689 PolarHBondContact O-N 3.38Å; T689-F726 WeakPolarHBondContact OG1-CA 3.38Å; T689-F726 PolarHBondContact OG1-N 3.39Å
690V84.4Confident87.8Confident63 Ų6340 Ų4038%0.38220%0.195SC..Hα-helixtrans-78.4-43.1-178-177.80000111.6L641 A687 T688L641-V690 HydrophobicContact CB-CB 4.23Å; L641-V690 HydrophobicContact CB-CG1 4.09Å; L641-V690 HydrophobicContact CB-CG2 4.25Å; L641-V690 HydrophobicContact CD2-CG1 4.4Å; L641-V690 WeakPolarHBondContact O-CG1 3.36Å; A687-V690 PolarHBondContact O-N 2.94Å; T688-V690 PolarHBondContact O-N 3.18Å
691V85.7Confident87.7Confident6 Ų640.7 Ų40.74%0.03620%0.201CC..Hα-helixtrans-97.114.3-174.6-650000113.5L641 V656 I659 A687 T688 K693 N694 I695L641-V691 HydrophobicContact CD1-CG1 4.43Å; L641-V691 HydrophobicContact CD2-CG1 3.71Å; V656-V691 HydrophobicContact CG2-CB 4.08Å; V656-V691 HydrophobicContact CG2-CG1 4.37Å; I659-V691 HydrophobicContact CD1-CG2 3.61Å; A687-V691 WeakPolarHBondContact O-CG2 3.36Å; A687-V691 PolarHBondContact O-N 3.12Å; T688-V691 CarbonylContact O-C 3.28Å; T688-V691 PolarHBondContact O-N 3.48Å; V691-K693 PolarHBondContact O-N 3.29Å; V691-N694 PolarHBondContact O-N 3.33Å; V691-I695 HydrophobicContact CB-CD1 4.44Å; V691-I695 HydrophobicContact CB-CG1 4.5Å; V691-I695 HydrophobicContact CG2-CD1 3.35Å; V691-I695 HydrophobicContact CG2-CG1 3.83Å; V691-I695 PolarHBondContact O-N 3.32Å
692V85.9Confident87.6Confident7 Ų743.1 Ų43.14%0.04221%0.212CC..G310 helixtrans-56.3-31.5-165.485.70000114T688 N694 F726 L730 I733T688-V692 HydrophobicContact CG2-CG2 4.47Å; T688-V692 WeakPolarHBondContact O-CA 3.44Å; T688-V692 WeakPolarHBondContact O-CB 3.36Å; T688-V692 PolarHBondContact O-N 2.76Å; V692-N694 VanDerWaalsContact C-N 3.31Å; V692-N694 PolarHBondContact O-N 3Å; V692-F726 HydrophobicContact CG2-CE2 4.42Å; V692-L730 HydrophobicContact CG2-CD2 3.83Å; V692-I733 HydrophobicContact CB-CD1 4.2Å; V692-I733 HydrophobicContact CG1-CD1 3.98Å; V692-I733 HydrophobicContact CG1-CG1 4.36Å; V692-I733 HydrophobicContact CG2-CD1 3.52Å
693K83.4Confident87.6Confident155 Ų15539.8 Ų39.867%0.67420%0.197SC*.G310 helixtrans-69.9-24.5178.5-67.9-172.7175.3-173.70114.1V691V691-K693 PolarHBondContact O-N 3.29Å
694N82.8Confident87.6Confident96 Ų9638.4 Ų38.451%0.51319%0.19SC..G310 helixtrans-106.9-3.9-173.1-60.7-24.5000112.2S652 V656 V691 V692S652-N694 PolarHBondContact OG-ND2 3.05Å; V656-N694 VanDerWaalsContact CG1-O 3.3Å; V656-N694 WeakPolarHBondContact CG1-O 3.24Å; V656-N694 HydrophobicContact CG2-CB 3.81Å; V691-N694 PolarHBondContact O-N 3.33Å; V692-N694 VanDerWaalsContact C-N 3.31Å; V692-N694 PolarHBondContact O-N 3Å
695I84.2Confident87.5Confident11 Ų1140.6 Ų40.66%0.05620%0.202CC..SBendtrans-84.3146.4178.4-77.3-178.4000110.4V656 I659 T688 V691 A699 I700V656-I695 HydrophobicContact CG1-CG1 4.38Å; I659-I695 HydrophobicContact CG2-CD1 3.72Å; T688-I695 HydrophobicContact CG2-CD1 3.64Å; V691-I695 HydrophobicContact CB-CD1 4.44Å; V691-I695 HydrophobicContact CB-CG1 4.5Å; V691-I695 HydrophobicContact CG2-CD1 3.35Å; V691-I695 HydrophobicContact CG2-CG1 3.83Å; V691-I695 PolarHBondContact O-N 3.32Å; I695-A699 HydrophobicContact CG2-CB 3.63Å; I695-I700 HydrophobicContact CG2-CG1 4.08Å
696R83.9Confident87.4Confident163 Ų16340.6 Ų40.662%0.61520%0.202SC*.  trans-71.9146.8179.3-54.7-174.6179.2148.7-0.6112.2E698 A699 I700R696-E698 WeakPolarHBondContact CB-OE2 3.44Å; R696-E698 PolarHBondContact O-N 3.35Å; R696-E698 VanDerWaalsContact O-N 3.14Å; R696-A699 PolarHBondContact O-N 3.49Å; R696-A699 VanDerWaalsContact O-N 3.08Å; R696-I700 PolarHBondContact O-N 3.37Å
697P83.1Confident87.4Confident46 Ų4640 Ų4030%0.29920%0.197SC..Hα-helixtrans-55-32.3179.4-26.535.5000114.5A699 I700 S701P697-A699 VanDerWaalsContact C-N 3.32Å; P697-A699 PolarHBondContact O-N 3.13Å; P697-I700 PolarHBondContact O-N 3.01Å; P697-S701 PolarHBondContact O-N 2.97Å
698E84.8Confident87.4Confident126 Ų12643 Ų4359%0.58921%0.211SC*.Hα-helixtrans-64.9-37.6179.6-5776.9-165.400111.7R696 S701 Q702R696-E698 WeakPolarHBondContact CB-OE2 3.44Å; R696-E698 PolarHBondContact O-N 3.35Å; R696-E698 VanDerWaalsContact O-N 3.14Å; E698-S701 PolarHBondContact O-N 2.86Å; E698-Q702 WeakPolarHBondContact O-CB 3.37Å; E698-Q702 PolarHBondContact O-N 2.83Å
699A87.7Confident87.3Confident6 Ų643.7 Ų43.75%0.0522%0.217CC..Hα-helixtrans-70.7-33.5176.500000111.8W663 I695 R696 P697 Q702 A703W663-A699 HydrophobicContact CB-CB 4.01Å; W663-A699 HydrophobicContact CG-CB 4.14Å; I695-A699 HydrophobicContact CG2-CB 3.63Å; R696-A699 PolarHBondContact O-N 3.49Å; R696-A699 VanDerWaalsContact O-N 3.08Å; P697-A699 VanDerWaalsContact C-N 3.32Å; P697-A699 PolarHBondContact O-N 3.13Å; A699-Q702 PolarHBondContact O-N 2.96Å; A699-A703 WeakPolarHBondContact O-CB 3.31Å; A699-A703 PolarHBondContact O-N 3.31Å
700I88.3Confident87.1Confident4 Ų442 Ų422%0.02121%0.207CC..Hα-helixtrans-67-44.4173.4-60.8172.9000110.3I695 R696 P697 Q702 A703 L704 F726 L730 I733 F735I695-I700 HydrophobicContact CG2-CG1 4.08Å; R696-I700 PolarHBondContact O-N 3.37Å; P697-I700 PolarHBondContact O-N 3.01Å; I700-Q702 VanDerWaalsContact C-N 3.32Å; I700-Q702 PolarHBondContact O-N 3.38Å; I700-A703 PolarHBondContact O-N 2.96Å; I700-L704 HydrophobicContact CG2-CD1 4.25Å; I700-L704 WeakPolarHBondContact O-CG 3.34Å; I700-L704 PolarHBondContact O-N 3.48Å; I700-F726 HydrophobicContact CG2-CZ 4.26Å; I700-L730 HydrophobicContact CD1-CD2 4.5Å; I700-L730 HydrophobicContact CG2-CD1 4.48Å; I700-L730 HydrophobicContact CG2-CD2 3.79Å; I700-I733 HydrophobicContact CD1-CD1 3.75Å; I700-F735 HydrophobicContact CD1-CE1 4.27Å; I700-F735 HydrophobicContact CG2-CE1 3.98Å; I700-F735 HydrophobicContact CG2-CZ 4.34Å
701S87.6Confident87.2Confident20 Ų2039.9 Ų39.914%0.1419%0.194CC..Hα-helixtrans-59.8-43.4175.3-172.50000111.3P697 E698 A703 L704 L705P697-S701 PolarHBondContact O-N 2.97Å; E698-S701 PolarHBondContact O-N 2.86Å; S701-A703 PolarHBondContact O-N 2.99Å; S701-L704 PolarHBondContact O-N 3.17Å; S701-L705 WeakPolarHBondContact O-CB 3.43Å; S701-L705 WeakPolarHBondContact O-CG 3.4Å; S701-L705 PolarHBondContact O-N 2.83Å
702Q90.4Very high86.8Confident50 Ų5044.1 Ų44.123%0.23422%0.224CC..Hα-helixtrans-63.8-40.1175.6-16762.914.600112.6W663 M666 E698 A699 I700 L705 C706W663-Q702 WeakPolarHBondContact O-CG 3.48Å; M666-Q702 PolarHBondContact O-NE2 3.08Å; E698-Q702 WeakPolarHBondContact O-CB 3.37Å; E698-Q702 PolarHBondContact O-N 2.83Å; A699-Q702 PolarHBondContact O-N 2.96Å; I700-Q702 VanDerWaalsContact C-N 3.32Å; I700-Q702 PolarHBondContact O-N 3.38Å; Q702-L705 WeakPolarHBondContact O-CB 3.31Å; Q702-L705 PolarHBondContact O-N 2.78Å; Q702-C706 WeakPolarHBondContact O-CB 3.24Å; Q702-C706 PolarHBondContact O-N 3.04Å; Q702-C706 PolarHBondContact O-SG 3.37Å; Q702-C706 VanDerWaalsContact O-SG 3.37Å
703A91.6Very high86.2Confident0 Ų048.4 Ų48.40%024%0.243CC..Hα-helixtrans-62-43.2175.900000112.3W663 L685 A699 I700 S701 C706 L707 F726W663-A703 HydrophobicContact CD2-CB 4.28Å; W663-A703 HydrophobicContact CE3-CB 4.13Å; W663-A703 HydrophobicContact CH2-CB 3.39Å; W663-A703 HydrophobicContact CZ2-CB 3.54Å; W663-A703 VanDerWaalsContact CZ3-CA 3.47Å; W663-A703 HydrophobicContact CZ3-CB 3.72Å; L685-A703 HydrophobicContact CD2-CB 4.4Å; A699-A703 WeakPolarHBondContact O-CB 3.31Å; A699-A703 PolarHBondContact O-N 3.31Å; I700-A703 PolarHBondContact O-N 2.96Å; S701-A703 PolarHBondContact O-N 2.99Å; A703-C706 PolarHBondContact O-N 3.49Å; A703-L707 VanDerWaalsContact O-CB 3.31Å; A703-L707 WeakPolarHBondContact O-CB 3.38Å; A703-L707 PolarHBondContact O-N 3.35Å; A703-F726 HydrophobicContact CB-CE1 3.97Å; A703-F726 HydrophobicContact CB-CE2 4.39Å; A703-F726 HydrophobicContact CB-CZ 3.66Å
704L91.4Very high85.6Confident0 Ų051.3 Ų51.30%026%0.256CS..Hα-helixtrans-66-40.3176.4-68.5170.3000112I700 S701 L707 E708 F726 L727 L730 V743 L747 L750I700-L704 HydrophobicContact CG2-CD1 4.25Å; I700-L704 WeakPolarHBondContact O-CG 3.34Å; I700-L704 PolarHBondContact O-N 3.48Å; S701-L704 PolarHBondContact O-N 3.17Å; L704-L707 PolarHBondContact O-N 2.95Å; L704-E708 WeakPolarHBondContact O-CB 3.46Å; L704-E708 PolarHBondContact O-N 3.25Å; L704-F726 HydrophobicContact CD2-CE1 3.9Å; L704-F726 HydrophobicContact CG-CE1 4.27Å; L704-L727 HydrophobicContact CD2-CD2 3.82Å; L704-L730 HydrophobicContact CD2-CD1 4.06Å; L704-V743 HydrophobicContact CD1-CB 4.45Å; L704-V743 HydrophobicContact CD1-CG1 3.7Å; L704-V743 HydrophobicContact CD1-CG2 4.5Å; L704-L747 HydrophobicContact CD2-CD1 4.12Å; L704-L750 HydrophobicContact CD2-CD1 3.78Å
705L90.6Very high85.4Confident47 Ų4747.6 Ų47.625%0.24624%0.237CC..Hα-helixtrans-59.6-48.3173.7-83.6168.6000112.5P668 S701 Q702 L707 A709 R746P668-L705 HydrophobicContact CG-CB 4.12Å; S701-L705 WeakPolarHBondContact O-CB 3.43Å; S701-L705 WeakPolarHBondContact O-CG 3.4Å; S701-L705 PolarHBondContact O-N 2.83Å; Q702-L705 WeakPolarHBondContact O-CB 3.31Å; Q702-L705 PolarHBondContact O-N 2.78Å; L705-L707 VanDerWaalsContact C-N 3.3Å; L705-L707 PolarHBondContact O-N 2.96Å; L705-A709 PolarHBondContact O-N 3.27Å; L705-R746 VanDerWaalsContact CD2-NH1 3.26Å; L705-R746 VanDerWaalsContact CG-NH1 3.3Å
706C90.8Very high85.4Confident0 Ų048.9 Ų48.90%025%0.246CC..Hα-helixtrans-63.3-38.6177.2-74.30000111.6W663 L671 L681 Q702 A703 V710W663-C706 HydrophobicContact CZ3-CB 4.42Å; L671-C706 HydrophobicContact CD1-CB 3.5Å; L671-C706 VanDerWaalsContact CD1-CB 3.5Å; L681-C706 HydrophobicContact CD1-CB 3.87Å; Q702-C706 WeakPolarHBondContact O-CB 3.24Å; Q702-C706 PolarHBondContact O-N 3.04Å; Q702-C706 PolarHBondContact O-SG 3.37Å; Q702-C706 VanDerWaalsContact O-SG 3.37Å; A703-C706 PolarHBondContact O-N 3.49Å; C706-V710 WeakPolarHBondContact O-CG2 3.39Å; C706-V710 PolarHBondContact O-N 3.45Å
707L90.5Very high85.5Confident0 Ų045 Ų450%024%0.237CC..Hα-helixtrans-69.2-45.4178.9-178.359.8000112.2L685 A703 L704 L705 A709 V710 V711 A723 L727 L750L685-L707 HydrophobicContact CD1-CD1 4.4Å; A703-L707 VanDerWaalsContact O-CB 3.31Å; A703-L707 WeakPolarHBondContact O-CB 3.38Å; A703-L707 PolarHBondContact O-N 3.35Å; L704-L707 PolarHBondContact O-N 2.95Å; L705-L707 VanDerWaalsContact C-N 3.3Å; L705-L707 PolarHBondContact O-N 2.96Å; L707-A709 VanDerWaalsContact C-N 3.27Å; L707-A709 PolarHBondContact O-N 3.07Å; L707-V710 PolarHBondContact O-N 3.48Å; L707-V710 VanDerWaalsContact O-N 3.1Å; L707-V711 HydrophobicContact CD1-CG2 3.62Å; L707-V711 HydrophobicContact CG-CG2 3.96Å; L707-V711 WeakPolarHBondContact O-CB 3.36Å; L707-V711 VanDerWaalsContact O-CG2 3.32Å; L707-V711 WeakPolarHBondContact O-CG2 3.45Å; L707-V711 PolarHBondContact O-N 3.05Å; L707-A723 HydrophobicContact CD1-CB 3.37Å; L707-A723 HydrophobicContact CD2-CB 3.72Å; L707-A723 HydrophobicContact CG-CB 4.2Å; L707-L727 HydrophobicContact CD2-CD1 4.2Å; L707-L727 HydrophobicContact CD2-CD2 4.12Å; L707-L727 HydrophobicContact CD2-CG 4.17Å; L707-L750 HydrophobicContact CD2-CD1 3.95Å; L707-L750 HydrophobicContact CD2-CD2 4.29Å; L707-L750 HydrophobicContact CG-CD1 4.29Å; L707-L750 HydrophobicContact CG-CD2 4Å
708E89.7Confident85.6Confident64 Ų6447.2 Ų47.230%0.29924%0.241SC..Hα-helixtrans-56.6-41.5177-175.3177-165.400111.9L704 V710 S712 R746 L750L704-E708 WeakPolarHBondContact O-CB 3.46Å; L704-E708 PolarHBondContact O-N 3.25Å; E708-V710 VanDerWaalsContact C-N 3.28Å; E708-V710 PolarHBondContact O-N 3.35Å; E708-S712 WeakPolarHBondContact O-CB 3.35Å; E708-S712 PolarHBondContact O-N 3.23Å; E708-S712 VanDerWaalsContact O-N 3.14Å; E708-S712 PolarHBondContact O-OG 3.25Å; E708-R746 VanDerWaalsContact OE2-CD 3.32Å; E708-R746 WeakPolarHBondContact OE2-CD 3.21Å; E708-R746 IonicContact OE2-CZ 3.74Å; E708-R746 IonicContact OE2-NE 2.68Å; E708-R746 PolarHBondContact OE2-NE 3.25Å; E708-L750 HydrophobicContact CB-CD2 4.48Å
709A87.6Confident85.8Confident15 Ų1541.2 Ų41.212%0.12421%0.213CC..Hα-helixtrans-65.2-27.4178.500000114.1P668 Q672 L705 L707P668-A709 HydrophobicContact CB-CB 3.73Å; Q672-A709 PolarHBondContact NE2-O 3.48Å; L705-A709 PolarHBondContact O-N 3.27Å; L707-A709 VanDerWaalsContact C-N 3.27Å; L707-A709 PolarHBondContact O-N 3.07Å
710V85.4Confident86Confident4 Ų441.4 Ų41.42%0.02421%0.213CC..Hα-helixtrans-95.2-36.9-179.5-176.40000111.8L671 L681 C706 L707 E708 S712 Q713 C715 L719L671-V710 HydrophobicContact CB-CG2 3.96Å; L671-V710 HydrophobicContact CD1-CG2 4.48Å; L681-V710 HydrophobicContact CD2-CG2 4.02Å; C706-V710 WeakPolarHBondContact O-CG2 3.39Å; C706-V710 PolarHBondContact O-N 3.45Å; L707-V710 PolarHBondContact O-N 3.48Å; L707-V710 VanDerWaalsContact O-N 3.1Å; E708-V710 VanDerWaalsContact C-N 3.28Å; E708-V710 PolarHBondContact O-N 3.35Å; V710-S712 PolarHBondContact O-N 3.08Å; V710-Q713 PolarHBondContact O-N 2.91Å; V710-Q713 VanDerWaalsContact O-N 3.1Å; V710-C715 HydrophobicContact CG1-CB 4.04Å; V710-C715 VanDerWaalsContact CG1-SG 3.59Å; V710-L719 HydrophobicContact CG1-CD2 3.74Å
711V84.9Confident86.1Confident18 Ų1844.2 Ų44.211%0.10923%0.227CC..Hα-helixtrans-66.1-28176.11710000111.9L707 Q713 L720 L750 V753L707-V711 HydrophobicContact CD1-CG2 3.62Å; L707-V711 HydrophobicContact CG-CG2 3.96Å; L707-V711 WeakPolarHBondContact O-CB 3.36Å; L707-V711 VanDerWaalsContact O-CG2 3.32Å; L707-V711 WeakPolarHBondContact O-CG2 3.45Å; L707-V711 PolarHBondContact O-N 3.05Å; V711-Q713 PolarHBondContact O-N 2.91Å; V711-L720 HydrophobicContact CG2-CD2 3.86Å; V711-L750 HydrophobicContact CB-CD2 4.05Å; V711-L750 HydrophobicContact CG1-CD2 4.15Å; V711-L750 HydrophobicContact CG2-CD2 4.01Å; V711-V753 HydrophobicContact CG1-CB 4.13Å; V711-V753 HydrophobicContact CG1-CG1 3.58Å
712S77.2Confident86.3Confident95 Ų9543.8 Ų43.866%0.66423%0.225SC*.THydrogen-bonded Turntrans-68.8-6.2173.9-59.90000113.7E708 V710E708-S712 WeakPolarHBondContact O-CB 3.35Å; E708-S712 PolarHBondContact O-N 3.23Å; E708-S712 VanDerWaalsContact O-N 3.14Å; E708-S712 PolarHBondContact O-OG 3.25Å; V710-S712 PolarHBondContact O-N 3.08Å
713Q73.9Confident86.4Confident96 Ų9641.4 Ų41.445%0.44921%0.214SC..SBendtrans-121.6173176.1-61.9-173.42.100110.5V710 V711 C715V710-Q713 PolarHBondContact O-N 2.91Å; V710-Q713 VanDerWaalsContact O-N 3.1Å; V711-Q713 PolarHBondContact O-N 2.91Å; Q713-C715 PolarHBondContact O-N 3.43Å
714K71.2Confident86.5Confident217 Ų21741.7 Ų41.794%0.94322%0.216SC*.  trans-69.197.6173.7-168.5176.7-178.7179.80109.3
715C78.8Confident86.4Confident17 Ų1742.9 Ų42.912%0.11523%0.228CC..  trans-92.7146.8-176.4-178.70000111.6V710 Q713 L719 L720V710-C715 HydrophobicContact CG1-CB 4.04Å; V710-C715 VanDerWaalsContact CG1-SG 3.59Å; Q713-C715 PolarHBondContact O-N 3.43Å; C715-L719 VanDerWaalsContact SG-CD2 3.56Å; C715-L720 HydrophobicContact CB-CD1 4.3Å; C715-L720 HydrophobicContact CB-CD2 3.84Å; C715-L720 HydrophobicContact CB-CG 4.07Å; C715-L720 VanDerWaalsContact SG-CD2 3.59Å
716P83.5Confident86.6Confident39 Ų3940.7 Ų40.725%0.25322%0.217SC..  trans-64.8138.5171.5-2032.1000113.3Y718 L719 L720P716-Y718 VanDerWaalsContact C-N 3.26Å; P716-Y718 HydrophobicContact CB-CD1 3.7Å; P716-Y718 HydrophobicContact CB-CE1 3.25Å; P716-Y718 HydrophobicContact CB-CE2 4.24Å; P716-Y718 HydrophobicContact CB-CG 4.36Å; P716-Y718 HydrophobicContact CG-CE1 3.98Å; P716-Y718 PolarHBondContact O-N 2.88Å; P716-Y718 VanDerWaalsContact O-N 3.14Å; P716-L719 PolarHBondContact O-N 3.29Å; P716-L720 PolarHBondContact O-N 2.85Å
717D87.6Confident86.7Confident80 Ų8040.7 Ų40.743%0.42822%0.217SC..Hα-helixtrans-52.7-39.4-178.8-68.917000113.4L719 L720 L721 L762D717-L719 PolarHBondContact O-N 2.86Å; D717-L720 PolarHBondContact O-N 3.46Å; D717-L721 WeakPolarHBondContact O-CG 3.33Å; D717-L721 PolarHBondContact O-N 3.3Å; D717-L762 HydrophobicContact CB-CD1 4.34Å; D717-L762 HydrophobicContact CB-CD2 4.21Å
718Y84.8Confident86.9Confident93 Ų9341.7 Ų41.737%0.36522%0.224SC..Hα-helixtrans-63-29.6-178.964.6-104.9000113.4K682 P716 A722K682-Y718 HydrophobicContact CD-CD2 3.7Å; K682-Y718 HydrophobicContact CD-CE2 4.12Å; K682-Y718 HydrophobicContact CG-CD2 4.25Å; P716-Y718 VanDerWaalsContact C-N 3.26Å; P716-Y718 HydrophobicContact CB-CD1 3.7Å; P716-Y718 HydrophobicContact CB-CE1 3.25Å; P716-Y718 HydrophobicContact CB-CE2 4.24Å; P716-Y718 HydrophobicContact CB-CG 4.36Å; P716-Y718 HydrophobicContact CG-CE1 3.98Å; P716-Y718 PolarHBondContact O-N 2.88Å; P716-Y718 VanDerWaalsContact O-N 3.14Å; Y718-A722 PolarHBondContact O-N 3.46Å
719L89.1Confident86.9Confident0 Ų039 Ų390%021%0.212CC..Hα-helixtrans-79.7-39.4178.5175.158.9000109.9Q678 L681 K682 L685 V710 C715 P716 D717 L721 A722 A723Q678-L719 HydrophobicContact CB-CD2 4.25Å; L681-L719 HydrophobicContact CB-CD1 4.36Å; L681-L719 HydrophobicContact CD2-CD1 4.12Å; L681-L719 HydrophobicContact CD2-CD2 4.17Å; L681-L719 HydrophobicContact CG-CD1 4.04Å; K682-L719 HydrophobicContact CB-CD1 3.87Å; L685-L719 HydrophobicContact CD1-CD1 3.98Å; V710-L719 HydrophobicContact CG1-CD2 3.74Å; C715-L719 VanDerWaalsContact SG-CD2 3.56Å; P716-L719 PolarHBondContact O-N 3.29Å; D717-L719 PolarHBondContact O-N 2.86Å; L719-L721 VanDerWaalsContact C-N 3.3Å; L719-L721 PolarHBondContact O-N 3.36Å; L719-A722 PolarHBondContact O-N 3.32Å; L719-A723 WeakPolarHBondContact O-CB 3.49Å; L719-A723 PolarHBondContact O-N 3.41Å
720L90.9Very high87.1Confident11 Ų1138.2 Ų38.26%0.05821%0.206CC..Hα-helixtrans-62.3-37.3173.5-60.9-179.1000111.9V711 C715 P716 D717 A723 L724 L754 L762V711-L720 HydrophobicContact CG2-CD2 3.86Å; C715-L720 HydrophobicContact CB-CD1 4.3Å; C715-L720 HydrophobicContact CB-CD2 3.84Å; C715-L720 HydrophobicContact CB-CG 4.07Å; C715-L720 VanDerWaalsContact SG-CD2 3.59Å; P716-L720 PolarHBondContact O-N 2.85Å; D717-L720 PolarHBondContact O-N 3.46Å; L720-A723 WeakPolarHBondContact O-CB 3.43Å; L720-A723 PolarHBondContact O-N 3.19Å; L720-L724 WeakPolarHBondContact O-CG 3.25Å; L720-L724 PolarHBondContact O-N 3.07Å; L720-L754 HydrophobicContact CB-CD2 4.47Å; L720-L754 HydrophobicContact CD2-CD2 3.99Å; L720-L762 HydrophobicContact CB-CD2 4.02Å; L720-L762 HydrophobicContact CD1-CD1 3.71Å
721L90.7Very high87.1Confident62 Ų6238.1 Ų38.133%0.32521%0.205SC..Hα-helixtrans-63.1-42.6172.7-69.6173.6000112.4D717 L719 A723 L724 G725 L762 H765D717-L721 WeakPolarHBondContact O-CG 3.33Å; D717-L721 PolarHBondContact O-N 3.3Å; L719-L721 VanDerWaalsContact C-N 3.3Å; L719-L721 PolarHBondContact O-N 3.36Å; L721-A723 VanDerWaalsContact C-N 3.32Å; L721-A723 PolarHBondContact O-N 3.3Å; L721-L724 PolarHBondContact O-N 3.13Å; L721-G725 PolarHBondContact O-N 3.01Å; L721-G725 VanDerWaalsContact O-N 3.17Å; L721-L762 HydrophobicContact CD2-CD2 3.88Å; L721-L762 HydrophobicContact CG-CD2 3.93Å; L721-H765 HydrophobicContact CD2-CB 3.98Å; L721-H765 WeakPolarHBondContact CD2-CD2 3.25Å
722A91.3Very high87Confident12 Ų1242.2 Ų42.210%0.09922%0.221CC..Hα-helixtrans-64.6-38.2174.800000111.8K682 L685 Y718 L719 G725 F726K682-A722 HydrophobicContact CG-CB 4.02Å; L685-A722 HydrophobicContact CB-CB 4.46Å; Y718-A722 PolarHBondContact O-N 3.46Å; L719-A722 PolarHBondContact O-N 3.32Å; A722-G725 PolarHBondContact O-N 2.84Å; A722-F726 PolarHBondContact O-N 3.05Å
723A92.8Very high87.4Confident0 Ų038.7 Ų38.70%020%0.195CC..Hα-helixtrans-62.8-45.9175.200000112.3L685 L707 L719 L720 L721 G725 F726 L727L685-A723 HydrophobicContact CD1-CB 4.32Å; L707-A723 HydrophobicContact CD1-CB 3.37Å; L707-A723 HydrophobicContact CD2-CB 3.72Å; L707-A723 HydrophobicContact CG-CB 4.2Å; L719-A723 WeakPolarHBondContact O-CB 3.49Å; L719-A723 PolarHBondContact O-N 3.41Å; L720-A723 WeakPolarHBondContact O-CB 3.43Å; L720-A723 PolarHBondContact O-N 3.19Å; L721-A723 VanDerWaalsContact C-N 3.32Å; L721-A723 PolarHBondContact O-N 3.3Å; A723-G725 VanDerWaalsContact C-N 3.31Å; A723-G725 PolarHBondContact O-N 3.5Å; A723-F726 WeakPolarHBondContact O-CB 3.31Å; A723-F726 PolarHBondContact O-N 3.28Å; A723-F726 VanDerWaalsContact O-N 3.13Å; A723-L727 WeakPolarHBondContact O-CB 3.32Å; A723-L727 VanDerWaalsContact O-CG 3.25Å; A723-L727 WeakPolarHBondContact O-CG 3.45Å; A723-L727 PolarHBondContact O-N 3.35Å
724L93.2Very high87.9Confident5 Ų540.7 Ų40.73%0.02620%0.202CC..Hα-helixtrans-59.5-41.2176.5-75.5171.8000112.1L720 L721 S728 L754 H765 A766 A769L720-L724 WeakPolarHBondContact O-CG 3.25Å; L720-L724 PolarHBondContact O-N 3.07Å; L721-L724 PolarHBondContact O-N 3.13Å; L724-S728 WeakPolarHBondContact O-CB 3.44Å; L724-S728 PolarHBondContact O-N 3.17Å; L724-S728 PolarHBondContact O-OG 3.42Å; L724-L754 HydrophobicContact CD2-CB 4.08Å; L724-L754 HydrophobicContact CD2-CD1 3.59Å; L724-L754 HydrophobicContact CD2-CG 4.34Å; L724-L754 HydrophobicContact CG-CD1 4.13Å; L724-H765 HydrophobicContact CD1-CB 3.81Å; L724-A766 HydrophobicContact CD1-CB 4.24Å; L724-A766 HydrophobicContact CD2-CB 3.94Å; L724-A769 HydrophobicContact CB-CB 4.05Å; L724-A769 HydrophobicContact CD2-CB 3.98Å
725G91.2Very high88.5Confident26 Ų2630.5 Ų30.527%0.26816%0.158SC..Hα-helixtrans-57.5-50.1171.600000112.1L721 A722 A723 S728 S729L721-G725 PolarHBondContact O-N 3.01Å; L721-G725 VanDerWaalsContact O-N 3.17Å; A722-G725 PolarHBondContact O-N 2.84Å; A723-G725 VanDerWaalsContact C-N 3.31Å; A723-G725 PolarHBondContact O-N 3.5Å; G725-S728 PolarHBondContact O-N 3.21Å; G725-S728 PolarHBondContact O-OG 3.26Å; G725-S729 PolarHBondContact O-N 2.89Å
726F93.6Very high88.7Confident0 Ų032.5 Ų32.50%017%0.171CC..Hα-helixtrans-60-51.8177.3168.8-111.5000112.4L685 T688 T689 V692 I700 A703 L704 A722 A723 S728 S729 L730L685-F726 HydrophobicContact CB-CB 4.28Å; L685-F726 HydrophobicContact CD2-CB 4.05Å; L685-F726 HydrophobicContact CD2-CD1 3.57Å; L685-F726 HydrophobicContact CD2-CD2 4.42Å; L685-F726 HydrophobicContact CD2-CE1 4.08Å; L685-F726 HydrophobicContact CD2-CG 3.75Å; T688-F726 HydrophobicContact CG2-CD2 3.84Å; T688-F726 HydrophobicContact CG2-CE2 3.48Å; T688-F726 VanDerWaalsContact CG2-CE2 3.48Å; T689-F726 WeakPolarHBondContact OG1-CA 3.38Å; T689-F726 PolarHBondContact OG1-N 3.39Å; V692-F726 HydrophobicContact CG2-CE2 4.42Å; I700-F726 HydrophobicContact CG2-CZ 4.26Å; A703-F726 HydrophobicContact CB-CE1 3.97Å; A703-F726 HydrophobicContact CB-CE2 4.39Å; A703-F726 HydrophobicContact CB-CZ 3.66Å; L704-F726 HydrophobicContact CD2-CE1 3.9Å; L704-F726 HydrophobicContact CG-CE1 4.27Å; A722-F726 PolarHBondContact O-N 3.05Å; A723-F726 WeakPolarHBondContact O-CB 3.31Å; A723-F726 PolarHBondContact O-N 3.28Å; A723-F726 VanDerWaalsContact O-N 3.13Å; F726-S728 VanDerWaalsContact C-N 3.31Å; F726-S728 PolarHBondContact O-N 3.44Å; F726-S729 WeakPolarHBondContact O-CB 3.36Å; F726-S729 PolarHBondContact O-N 2.89Å; F726-S729 PolarHBondContact O-OG 2.96Å; F726-L730 HydrophobicContact CD1-CD1 4.49Å; F726-L730 HydrophobicContact CE1-CD1 3.92Å; F726-L730 HydrophobicContact CE2-CD1 4.44Å; F726-L730 HydrophobicContact CE2-CD2 3.86Å; F726-L730 HydrophobicContact CE2-CG 4.31Å; F726-L730 HydrophobicContact CZ-CD1 3.9Å; F726-L730 HydrophobicContact CZ-CD2 3.96Å; F726-L730 HydrophobicContact CZ-CG 4.25Å; F726-L730 PolarHBondContact O-N 2.66Å
727L93.9Very high88.5Confident0 Ų038.3 Ų38.30%020%0.195CC..Hα-helixtrans-58.4-42.5-179.8-67172.6000111.8L704 L707 A723 S729 L730 L747 L750 F751 L754L704-L727 HydrophobicContact CD2-CD2 3.82Å; L707-L727 HydrophobicContact CD2-CD1 4.2Å; L707-L727 HydrophobicContact CD2-CD2 4.12Å; L707-L727 HydrophobicContact CD2-CG 4.17Å; A723-L727 WeakPolarHBondContact O-CB 3.32Å; A723-L727 VanDerWaalsContact O-CG 3.25Å; A723-L727 WeakPolarHBondContact O-CG 3.45Å; A723-L727 PolarHBondContact O-N 3.35Å; L727-S729 PolarHBondContact O-N 2.78Å; L727-L730 HydrophobicContact CD2-CD1 4.39Å; L727-L730 WeakPolarHBondContact O-CB 3.47Å; L727-L730 PolarHBondContact O-N 2.89Å; L727-L747 HydrophobicContact CD2-CD1 3.58Å; L727-L750 HydrophobicContact CD1-CB 4.23Å; L727-L750 HydrophobicContact CD2-CB 4.46Å; L727-L750 HydrophobicContact CD2-CD1 4.15Å; L727-F751 HydrophobicContact CB-CE1 4.05Å; L727-F751 HydrophobicContact CB-CE2 4.15Å; L727-F751 HydrophobicContact CB-CZ 3.64Å; L727-L754 HydrophobicContact CD1-CD1 3.49Å; L727-L754 VanDerWaalsContact CD1-CD1 3.49Å
728S92.9Very high88Confident22 Ų2241.4 Ų41.415%0.15421%0.211CC..Hα-helixtrans-59.6-36.4176.478.10000112.5L724 G725 F726 L730 G731 Y772L724-S728 WeakPolarHBondContact O-CB 3.44Å; L724-S728 PolarHBondContact O-N 3.17Å; L724-S728 PolarHBondContact O-OG 3.42Å; G725-S728 PolarHBondContact O-N 3.21Å; G725-S728 PolarHBondContact O-OG 3.26Å; F726-S728 VanDerWaalsContact C-N 3.31Å; F726-S728 PolarHBondContact O-N 3.44Å; S728-L730 VanDerWaalsContact C-N 3.31Å; S728-L730 PolarHBondContact O-N 3.21Å; S728-G731 PolarHBondContact O-N 3.06Å; S728-Y772 WeakPolarHBondContact O-CD1 3.36Å
729S90.7Very high87.8Confident6 Ų638.8 Ų38.84%0.04221%0.206CC..Hα-helixtrans-71.4-24.6-178.276.40000113.7G725 F726 L727 G731 K732G725-S729 PolarHBondContact O-N 2.89Å; F726-S729 WeakPolarHBondContact O-CB 3.36Å; F726-S729 PolarHBondContact O-N 2.89Å; F726-S729 PolarHBondContact O-OG 2.96Å; L727-S729 PolarHBondContact O-N 2.78Å; S729-G731 PolarHBondContact O-N 3.49Å; S729-K732 PolarHBondContact O-N 3.38Å
730L90.9Very high87.5Confident0 Ų041 Ų410%022%0.217CC..G310 helixtrans-66.9-17.5179.1-62.9178.6000113V692 I700 L704 F726 L727 S728 K732 I733 F735 L747 F773V692-L730 HydrophobicContact CG2-CD2 3.83Å; I700-L730 HydrophobicContact CD1-CD2 4.5Å; I700-L730 HydrophobicContact CG2-CD1 4.48Å; I700-L730 HydrophobicContact CG2-CD2 3.79Å; L704-L730 HydrophobicContact CD2-CD1 4.06Å; F726-L730 HydrophobicContact CD1-CD1 4.49Å; F726-L730 HydrophobicContact CE1-CD1 3.92Å; F726-L730 HydrophobicContact CE2-CD1 4.44Å; F726-L730 HydrophobicContact CE2-CD2 3.86Å; F726-L730 HydrophobicContact CE2-CG 4.31Å; F726-L730 HydrophobicContact CZ-CD1 3.9Å; F726-L730 HydrophobicContact CZ-CD2 3.96Å; F726-L730 HydrophobicContact CZ-CG 4.25Å; F726-L730 PolarHBondContact O-N 2.66Å; L727-L730 HydrophobicContact CD2-CD1 4.39Å; L727-L730 WeakPolarHBondContact O-CB 3.47Å; L727-L730 PolarHBondContact O-N 2.89Å; S728-L730 VanDerWaalsContact C-N 3.31Å; S728-L730 PolarHBondContact O-N 3.21Å; L730-K732 PolarHBondContact O-N 2.87Å; L730-K732 VanDerWaalsContact O-N 3.1Å; L730-I733 HydrophobicContact CD2-CD1 3.74Å; L730-I733 PolarHBondContact O-N 3.49Å; L730-F735 HydrophobicContact CB-CZ 4.46Å; L730-F735 HydrophobicContact CD2-CZ 4.33Å; L730-L747 HydrophobicContact CD1-CD1 3.58Å; L730-F773 HydrophobicContact CB-CE2 4.36Å
731G85.7Confident87Confident1 Ų144.8 Ų44.81%0.0124%0.244CC..G310 helixtrans-59.9-21.7174.500000112.8S728 S729 I733 F773 N776 T777S728-G731 PolarHBondContact O-N 3.06Å; S729-G731 PolarHBondContact O-N 3.49Å; G731-I733 VanDerWaalsContact C-N 3.28Å; G731-I733 PolarHBondContact O-N 3.33Å; G731-F773 VanDerWaalsContact CA-CD2 3.44Å; G731-F773 VanDerWaalsContact N-CD2 3.31Å; G731-N776 CarbonylContact O-C 3.59Å; G731-N776 VanDerWaalsContact O-C 3.28Å; G731-T777 VanDerWaalsContact O-CA 3.26Å; G731-T777 WeakPolarHBondContact O-CA 3.34Å; G731-T777 PolarHBondContact O-N 3.1Å
732K82.9Confident86.6Confident104 Ų10447.2 Ų47.245%0.45225%0.254SS..G310 helixtrans-82.5-2.1178.5-62.3175.9-176.7167.30114S729 L730 Y772S729-K732 PolarHBondContact O-N 3.38Å; L730-K732 PolarHBondContact O-N 2.87Å; L730-K732 VanDerWaalsContact O-N 3.1Å; K732-Y772 WeakPolarHBondContact CE-OH 3.3Å; K732-Y772 PolarHBondContact NZ-OH 3.05Å
733I86Confident86.3Confident22 Ų2246.8 Ų46.811%0.11325%0.25CC..  trans-110.5132.1-168.6-56178.9000110V692 I700 L730 G731 F735V692-I733 HydrophobicContact CB-CD1 4.2Å; V692-I733 HydrophobicContact CG1-CD1 3.98Å; V692-I733 HydrophobicContact CG1-CG1 4.36Å; V692-I733 HydrophobicContact CG2-CD1 3.52Å; I700-I733 HydrophobicContact CD1-CD1 3.75Å; L730-I733 HydrophobicContact CD2-CD1 3.74Å; L730-I733 PolarHBondContact O-N 3.49Å; G731-I733 VanDerWaalsContact C-N 3.28Å; G731-I733 PolarHBondContact O-N 3.33Å; I733-F735 HydrophobicContact CB-CE1 4.5Å; I733-F735 HydrophobicContact CB-CZ 4.22Å; I733-F735 HydrophobicContact CG2-CD1 4.14Å; I733-F735 HydrophobicContact CG2-CE1 3.87Å; I733-F735 HydrophobicContact CG2-CZ 4.09Å
734F84Confident86.2Confident137 Ų13746.8 Ų46.860%0.60125%0.25SC*.PPolyproline II helixtrans-93.3120.1166-170.6-96.7000109.1N778F734-N778 HydrophobicContact CD2-CB 4.27Å
735F84Confident86Confident3 Ų349.7 Ų49.71%0.01327%0.269CS..PPolyproline II helixtrans-88.5132.6-179.6-65.6-71.9000109.5I700 L730 I733 Q740 V743 L744 H779I700-F735 HydrophobicContact CD1-CE1 4.27Å; I700-F735 HydrophobicContact CG2-CE1 3.98Å; I700-F735 HydrophobicContact CG2-CZ 4.34Å; L730-F735 HydrophobicContact CB-CZ 4.46Å; L730-F735 HydrophobicContact CD2-CZ 4.33Å; I733-F735 HydrophobicContact CB-CE1 4.5Å; I733-F735 HydrophobicContact CB-CZ 4.22Å; I733-F735 HydrophobicContact CG2-CD1 4.14Å; I733-F735 HydrophobicContact CG2-CE1 3.87Å; I733-F735 HydrophobicContact CG2-CZ 4.09Å; F735-Q740 HydrophobicContact CB-CG 3.92Å; F735-Q740 PolarHBondContact O-NE2 3.22Å; F735-V743 HydrophobicContact CD1-CG1 4.09Å; F735-V743 HydrophobicContact CD2-CG1 4.19Å; F735-V743 HydrophobicContact CE1-CG1 3.91Å; F735-V743 HydrophobicContact CE2-CG1 4.02Å; F735-V743 HydrophobicContact CG-CG1 4.23Å; F735-V743 HydrophobicContact CZ-CG1 3.87Å; F735-L744 HydrophobicContact CD2-CD2 3.89Å; F735-L744 HydrophobicContact CE2-CD2 4.39Å; F735-H779 AromaticContact CD2-CD2 3.8Å; F735-H779 AromaticContact CD2-NE2 3.52Å; F735-H779 PolarHBondContact N-NE2 3.34Å
736P82.7Confident86Confident59 Ų5951.3 Ų51.338%0.38327%0.267SS..PPolyproline II helixtrans-62.7147.6172.2-2132.7000112.1D738 C739 Q740P736-D738 PolarHBondContact O-N 3.44Å; P736-D738 VanDerWaalsContact O-N 3.12Å; P736-C739 PolarHBondContact O-N 2.97Å; P736-Q740 WeakPolarHBondContact O-CG 3.49Å; P736-Q740 PolarHBondContact O-N 3.29Å
737E79Confident85.8Confident161 Ų16151.3 Ų51.375%0.75227%0.267SS*.Hα-helixtrans-51.4-38.4-175.8-67.5-175.2172.700113.1C739 Q740E737-C739 PolarHBondContact O-N 3.31Å; E737-C739 VanDerWaalsContact O-N 3.14Å; E737-Q740 PolarHBondContact O-N 2.73Å
738D78.9Confident85.8Confident145 Ų14551.5 Ų51.578%0.77527%0.268SS*.Hα-helixtrans-59.5-27.3-179.7-56.7-31.6000113.7P736P736-D738 PolarHBondContact O-N 3.44Å; P736-D738 VanDerWaalsContact O-N 3.12Å
739C79.4Confident85.7Confident39 Ų3953.4 Ų53.426%0.26428%0.282SS..Hα-helixtrans-105.9-16.2-177.4-630000113.2P736 E737 S741 Q742 V743P736-C739 PolarHBondContact O-N 2.97Å; E737-C739 PolarHBondContact O-N 3.31Å; E737-C739 VanDerWaalsContact O-N 3.14Å; C739-S741 VanDerWaalsContact C-N 3.33Å; C739-S741 PolarHBondContact O-N 2.99Å; C739-Q742 PolarHBondContact O-N 3.14Å; C739-V743 WeakPolarHBondContact O-CB 3.39Å; C739-V743 WeakPolarHBondContact O-CG2 3.38Å; C739-V743 PolarHBondContact O-N 2.7Å; C739-V743 VanDerWaalsContact O-N 3.1Å
740Q83.4Confident85.8Confident46 Ų4653.3 Ų53.322%0.21528%0.281CS..Hα-helixtrans-59.6-42.3-175.1-77.3-179.913.400112.3F735 P736 E737 Q742 V743 L744F735-Q740 HydrophobicContact CB-CG 3.92Å; F735-Q740 PolarHBondContact O-NE2 3.22Å; P736-Q740 WeakPolarHBondContact O-CG 3.49Å; P736-Q740 PolarHBondContact O-N 3.29Å; E737-Q740 PolarHBondContact O-N 2.73Å; Q740-Q742 PolarHBondContact O-N 3.37Å; Q740-Q742 VanDerWaalsContact O-N 3.1Å; Q740-V743 PolarHBondContact O-N 3.13Å; Q740-L744 HydrophobicContact CB-CD1 3.77Å; Q740-L744 HydrophobicContact CB-CG 4.21Å; Q740-L744 HydrophobicContact CG-CD1 3.81Å; Q740-L744 HydrophobicContact CG-CG 4.39Å; Q740-L744 PolarHBondContact O-N 3.47Å
741S80.4Confident85.9Confident90 Ų9053.3 Ų53.363%0.62928%0.281SS*.Hα-helixtrans-58.6-25.4-17962.90000114.2C739C739-S741 VanDerWaalsContact C-N 3.33Å; C739-S741 PolarHBondContact O-N 2.99Å
742Q81.3Confident86.1Confident114 Ų11454.3 Ų54.353%0.53329%0.291SS..Hα-helixtrans-99.8-31.5179.1-62.4-177.14.600112.7C739 Q740 R746C739-Q742 PolarHBondContact O-N 3.14Å; Q740-Q742 PolarHBondContact O-N 3.37Å; Q740-Q742 VanDerWaalsContact O-N 3.1Å; Q742-R746 WeakPolarHBondContact O-CD 3.45Å; Q742-R746 WeakPolarHBondContact O-CG 3.18Å
743V86.3Confident86.5Confident3 Ų352.8 Ų52.82%0.01829%0.29CS..Hα-helixtrans-88.3-46.4-171.6169.70000112.2L704 F735 C739 Q740 R746 L747L704-V743 HydrophobicContact CD1-CB 4.45Å; L704-V743 HydrophobicContact CD1-CG1 3.7Å; L704-V743 HydrophobicContact CD1-CG2 4.5Å; F735-V743 HydrophobicContact CD1-CG1 4.09Å; F735-V743 HydrophobicContact CD2-CG1 4.19Å; F735-V743 HydrophobicContact CE1-CG1 3.91Å; F735-V743 HydrophobicContact CE2-CG1 4.02Å; F735-V743 HydrophobicContact CG-CG1 4.23Å; F735-V743 HydrophobicContact CZ-CG1 3.87Å; C739-V743 WeakPolarHBondContact O-CB 3.39Å; C739-V743 WeakPolarHBondContact O-CG2 3.38Å; C739-V743 PolarHBondContact O-N 2.7Å; C739-V743 VanDerWaalsContact O-N 3.1Å; Q740-V743 PolarHBondContact O-N 3.13Å; V743-R746 PolarHBondContact O-N 3.28Å; V743-L747 WeakPolarHBondContact O-CB 3.45Å; V743-L747 PolarHBondContact O-N 3.15Å
744L88.9Confident86.7Confident0 Ų052 Ų520%029%0.286CS..Hα-helixtrans-67.3-44.6-171.8-57.8-179.7000112.8F735 Q740 R746 L747 S748 H779 E781 V782F735-L744 HydrophobicContact CD2-CD2 3.89Å; F735-L744 HydrophobicContact CE2-CD2 4.39Å; Q740-L744 HydrophobicContact CB-CD1 3.77Å; Q740-L744 HydrophobicContact CB-CG 4.21Å; Q740-L744 HydrophobicContact CG-CD1 3.81Å; Q740-L744 HydrophobicContact CG-CG 4.39Å; Q740-L744 PolarHBondContact O-N 3.47Å; L744-R746 VanDerWaalsContact C-N 3.31Å; L744-R746 PolarHBondContact O-N 2.76Å; L744-L747 WeakPolarHBondContact O-CB 3.47Å; L744-L747 PolarHBondContact O-N 3.23Å; L744-S748 PolarHBondContact O-N 3.37Å; L744-S748 PolarHBondContact O-OG 3.48Å; L744-H779 HydrophobicContact CD1-CB 4.32Å; L744-H779 HydrophobicContact CD2-CB 3.92Å; L744-E781 WeakPolarHBondContact CB-OE1 2.91Å; L744-E781 HydrophobicContact CD1-CG 4.34Å; L744-E781 WeakPolarHBondContact CD1-OE1 3.4Å; L744-V782 HydrophobicContact CB-CG2 4.01Å; L744-V782 HydrophobicContact CD2-CG2 3.79Å; L744-V782 HydrophobicContact CG-CG2 4.42Å
745P89.9Confident87Confident65 Ų6545.5 Ų45.542%0.42226%0.257SS..Hα-helixtrans-61.5-36.9176.8-24.535.4000113.5S748 S749P745-S748 PolarHBondContact O-N 3.45Å; P745-S749 WeakPolarHBondContact O-CB 3.47Å; P745-S749 PolarHBondContact O-N 3.38Å
746R90.4Very high87.3Confident61 Ų6147.9 Ų47.923%0.2328%0.278CS..Hα-helixtrans-66.7-42.5176.4-74.4-176.5171.3138.613.9111.8L705 E708 Q742 V743 L744 S748 S749 L750L705-R746 VanDerWaalsContact CD2-NH1 3.26Å; L705-R746 VanDerWaalsContact CG-NH1 3.3Å; E708-R746 VanDerWaalsContact OE2-CD 3.32Å; E708-R746 WeakPolarHBondContact OE2-CD 3.21Å; E708-R746 IonicContact OE2-CZ 3.74Å; E708-R746 IonicContact OE2-NE 2.68Å; E708-R746 PolarHBondContact OE2-NE 3.25Å; Q742-R746 WeakPolarHBondContact O-CD 3.45Å; Q742-R746 WeakPolarHBondContact O-CG 3.18Å; V743-R746 PolarHBondContact O-N 3.28Å; L744-R746 VanDerWaalsContact C-N 3.31Å; L744-R746 PolarHBondContact O-N 2.76Å; R746-S748 VanDerWaalsContact C-N 3.31Å; R746-S748 PolarHBondContact O-N 2.95Å; R746-S749 PolarHBondContact O-N 3.43Å; R746-L750 WeakPolarHBondContact O-CB 3.46Å; R746-L750 VanDerWaalsContact O-CG 3.3Å; R746-L750 WeakPolarHBondContact O-CG 3.43Å; R746-L750 PolarHBondContact O-N 3.33Å
747L91.1Very high87.5Confident0 Ų047.3 Ų47.30%027%0.272CS..Hα-helixtrans-60.1-44.7177.5-16470.4000110.8L704 L727 L730 V743 L744 L750 F751 F773 V782L704-L747 HydrophobicContact CD2-CD1 4.12Å; L727-L747 HydrophobicContact CD2-CD1 3.58Å; L730-L747 HydrophobicContact CD1-CD1 3.58Å; V743-L747 WeakPolarHBondContact O-CB 3.45Å; V743-L747 PolarHBondContact O-N 3.15Å; L744-L747 WeakPolarHBondContact O-CB 3.47Å; L744-L747 PolarHBondContact O-N 3.23Å; L747-L750 PolarHBondContact O-N 2.64Å; L747-F751 HydrophobicContact CD1-CE2 4.26Å; L747-F751 HydrophobicContact CG-CD2 4.24Å; L747-F751 HydrophobicContact CG-CE2 4.17Å; L747-F751 WeakPolarHBondContact O-CD2 3.47Å; L747-F751 PolarHBondContact O-N 2.93Å; L747-F751 VanDerWaalsContact O-N 3.09Å; L747-F773 HydrophobicContact CD2-CE1 4.34Å; L747-F773 HydrophobicContact CD2-CE2 3.58Å; L747-F773 HydrophobicContact CD2-CZ 3.39Å; L747-F773 HydrophobicContact CG-CZ 4.37Å; L747-V782 HydrophobicContact CB-CG1 4.1Å; L747-V782 HydrophobicContact CD2-CG1 3.84Å; L747-V782 HydrophobicContact CD2-CG2 4.12Å; L747-V782 HydrophobicContact CG-CG1 3.88Å
748S92.2Very high87.7Confident4 Ų449.6 Ų49.63%0.02828%0.279CS..Hα-helixtrans-60-46175.1-52.40000112.3L744 P745 R746 G752 V782 Q785 S786L744-S748 PolarHBondContact O-N 3.37Å; L744-S748 PolarHBondContact O-OG 3.48Å; P745-S748 PolarHBondContact O-N 3.45Å; R746-S748 VanDerWaalsContact C-N 3.31Å; R746-S748 PolarHBondContact O-N 2.95Å; S748-G752 PolarHBondContact O-N 3.47Å; S748-V782 WeakPolarHBondContact OG-CA 3.48Å; S748-Q785 WeakPolarHBondContact OG-CB 3.45Å; S748-Q785 PolarHBondContact OG-OE1 3.47Å; S748-S786 WeakPolarHBondContact CA-OG 3.35Å; S748-S786 PolarHBondContact O-OG 3.08Å
749S91.8Very high88.2Confident62 Ų6244.4 Ų44.443%0.43425%0.254SS..Hα-helixtrans-62.4-47.4179.2-178.40000111.9P745 R746 G752 V753P745-S749 WeakPolarHBondContact O-CB 3.47Å; P745-S749 PolarHBondContact O-N 3.38Å; R746-S749 PolarHBondContact O-N 3.43Å; S749-G752 PolarHBondContact O-N 2.98Å; S749-G752 VanDerWaalsContact O-N 3.16Å; S749-V753 WeakPolarHBondContact O-CG2 3.16Å; S749-V753 PolarHBondContact O-N 3.29Å
750L92.3Very high88.5Confident4 Ų452.2 Ų52.22%0.02128%0.278CS..Hα-helixtrans-62-45.6-179.9-74.3167.5000112.1L704 L707 E708 V711 L727 R746 L747 G752 V753 L754L704-L750 HydrophobicContact CD2-CD1 3.78Å; L707-L750 HydrophobicContact CD2-CD1 3.95Å; L707-L750 HydrophobicContact CD2-CD2 4.29Å; L707-L750 HydrophobicContact CG-CD1 4.29Å; L707-L750 HydrophobicContact CG-CD2 4Å; E708-L750 HydrophobicContact CB-CD2 4.48Å; V711-L750 HydrophobicContact CB-CD2 4.05Å; V711-L750 HydrophobicContact CG1-CD2 4.15Å; V711-L750 HydrophobicContact CG2-CD2 4.01Å; L727-L750 HydrophobicContact CD1-CB 4.23Å; L727-L750 HydrophobicContact CD2-CB 4.46Å; L727-L750 HydrophobicContact CD2-CD1 4.15Å; R746-L750 WeakPolarHBondContact O-CB 3.46Å; R746-L750 VanDerWaalsContact O-CG 3.3Å; R746-L750 WeakPolarHBondContact O-CG 3.43Å; R746-L750 PolarHBondContact O-N 3.33Å; L747-L750 PolarHBondContact O-N 2.64Å; L750-G752 VanDerWaalsContact C-N 3.33Å; L750-V753 PolarHBondContact O-N 3.29Å; L750-L754 WeakPolarHBondContact O-CB 3.48Å; L750-L754 VanDerWaalsContact O-CG 3.26Å; L750-L754 WeakPolarHBondContact O-CG 3.3Å; L750-L754 PolarHBondContact O-N 2.81Å
751F92.9Very high88.8Confident0 Ų052.9 Ų52.90%028%0.283CS..Hα-helixtrans-63.1-40.7173.4-85.2-60.5000111.9L727 L747 V753 L754 L755 F770 F773 V782 S786L727-F751 HydrophobicContact CB-CE1 4.05Å; L727-F751 HydrophobicContact CB-CE2 4.15Å; L727-F751 HydrophobicContact CB-CZ 3.64Å; L747-F751 HydrophobicContact CD1-CE2 4.26Å; L747-F751 HydrophobicContact CG-CD2 4.24Å; L747-F751 HydrophobicContact CG-CE2 4.17Å; L747-F751 WeakPolarHBondContact O-CD2 3.47Å; L747-F751 PolarHBondContact O-N 2.93Å; L747-F751 VanDerWaalsContact O-N 3.09Å; F751-V753 PolarHBondContact O-N 3.08Å; F751-L754 PolarHBondContact O-N 2.84Å; F751-L755 VanDerWaalsContact O-CB 3.25Å; F751-L755 WeakPolarHBondContact O-CB 3.31Å; F751-L755 WeakPolarHBondContact O-CD1 3.48Å; F751-L755 WeakPolarHBondContact O-CG 3.25Å; F751-L755 PolarHBondContact O-N 3.39Å; F751-F770 HydrophobicContact CB-CD2 4.1Å; F751-F770 HydrophobicContact CB-CE2 4.47Å; F751-F770 HydrophobicContact CD1-CB 4.06Å; F751-F770 AromaticContact CD1-CD2 3.78Å; F751-F770 HydrophobicContact CD1-CD2 3.78Å; F751-F770 HydrophobicContact CD1-CG 4.43Å; F751-F770 HydrophobicContact CD2-CD2 4.33Å; F751-F770 HydrophobicContact CE1-CB 4.09Å; F751-F770 HydrophobicContact CE1-CD2 4.24Å; F751-F770 AromaticContact CG-CD2 3.83Å; F751-F770 HydrophobicContact CG-CD2 3.83Å; F751-F770 HydrophobicContact CG-CE2 4.49Å; F751-F773 HydrophobicContact CE2-CB 4.14Å; F751-F773 AromaticContact CE2-CD1 3.81Å; F751-F773 HydrophobicContact CE2-CD1 3.81Å; F751-F773 AromaticContact CE2-CD2 3.98Å; F751-F773 HydrophobicContact CE2-CD2 3.98Å; F751-F773 HydrophobicContact CE2-CE1 4.23Å; F751-F773 HydrophobicContact CE2-CE2 4.41Å; F751-F773 AromaticContact CE2-CG 3.68Å; F751-F773 HydrophobicContact CE2-CG 3.68Å; F751-F773 HydrophobicContact CZ-CB 3.72Å; F751-F773 HydrophobicContact CZ-CD1 4.25Å; F751-F773 HydrophobicContact CZ-CD2 4.21Å; F751-F773 AromaticContact CZ-CG 3.79Å; F751-F773 HydrophobicContact CZ-CG 3.79Å; F751-V782 HydrophobicContact CD2-CG1 4.48Å; F751-S786 WeakPolarHBondContact CB-OG 3.42Å
752G90.8Very high89.3Confident22 Ų2248.8 Ų48.823%0.22725%0.254CS..Hα-helixtrans-57.6-44.6175.900000113S748 S749 L750 A756S748-G752 PolarHBondContact O-N 3.47Å; S749-G752 PolarHBondContact O-N 2.98Å; S749-G752 VanDerWaalsContact O-N 3.16Å; L750-G752 VanDerWaalsContact C-N 3.33Å; G752-A756 WeakPolarHBondContact O-CB 3.23Å; G752-A756 PolarHBondContact O-N 2.95Å
753V90.1Very high89.7Confident71 Ų7144.9 Ų44.943%0.4324%0.236SC..Hα-helixtrans-66.4-47.9177.2175.40000111.4V711 S749 L750 F751 L755 A756 D757V711-V753 HydrophobicContact CG1-CB 4.13Å; V711-V753 HydrophobicContact CG1-CG1 3.58Å; S749-V753 WeakPolarHBondContact O-CG2 3.16Å; S749-V753 PolarHBondContact O-N 3.29Å; L750-V753 PolarHBondContact O-N 3.29Å; F751-V753 PolarHBondContact O-N 3.08Å; V753-L755 PolarHBondContact O-N 3.34Å; V753-A756 PolarHBondContact O-N 2.64Å; V753-A756 VanDerWaalsContact O-N 3.16Å; V753-D757 PolarHBondContact O-N 3.19Å
754L90.6Very high90Very high6 Ų647.9 Ų47.93%0.03125%0.25CC..Hα-helixtrans-69.4-34.9-176.1-65.5169.5000112.8L720 L724 L727 L750 F751 A756 D757 A766L720-L754 HydrophobicContact CB-CD2 4.47Å; L720-L754 HydrophobicContact CD2-CD2 3.99Å; L724-L754 HydrophobicContact CD2-CB 4.08Å; L724-L754 HydrophobicContact CD2-CD1 3.59Å; L724-L754 HydrophobicContact CD2-CG 4.34Å; L724-L754 HydrophobicContact CG-CD1 4.13Å; L727-L754 HydrophobicContact CD1-CD1 3.49Å; L727-L754 VanDerWaalsContact CD1-CD1 3.49Å; L750-L754 WeakPolarHBondContact O-CB 3.48Å; L750-L754 VanDerWaalsContact O-CG 3.26Å; L750-L754 WeakPolarHBondContact O-CG 3.3Å; L750-L754 PolarHBondContact O-N 2.81Å; F751-L754 PolarHBondContact O-N 2.84Å; L754-A756 PolarHBondContact O-N 3.41Å; L754-D757 VanDerWaalsContact O-CB 3.31Å; L754-D757 WeakPolarHBondContact O-CB 3.42Å; L754-D757 PolarHBondContact O-N 3.07Å; L754-A766 HydrophobicContact CB-CB 4.26Å; L754-A766 WeakPolarHBondContact O-CB 3.36Å
755L91.2Very high90.2Very high0 Ų051.1 Ų51.10%027%0.265CS..Hα-helixtrans-71.1-22.2174.2-71168.5000112.5F751 V753 D757 H763 A766 L767 F770 L787 T792 V796F751-L755 VanDerWaalsContact O-CB 3.25Å; F751-L755 WeakPolarHBondContact O-CB 3.31Å; F751-L755 WeakPolarHBondContact O-CD1 3.48Å; F751-L755 WeakPolarHBondContact O-CG 3.25Å; F751-L755 PolarHBondContact O-N 3.39Å; V753-L755 PolarHBondContact O-N 3.34Å; L755-D757 VanDerWaalsContact C-N 3.33Å; L755-H763 PolarHBondContact O-CE1 3.39Å; L755-H763 PolarHBondContact O-ND1 3.45Å; L755-A766 HydrophobicContact CD2-CB 4Å; L755-A766 HydrophobicContact CG-CB 4.48Å; L755-L767 HydrophobicContact CD2-CD2 4.03Å; L755-L767 HydrophobicContact CD2-CG 4.45Å; L755-F770 HydrophobicContact CD1-CB 4.23Å; L755-F770 HydrophobicContact CD1-CD1 4.24Å; L755-F770 HydrophobicContact CD1-CD2 3.82Å; L755-F770 HydrophobicContact CD1-CE2 4.2Å; L755-F770 HydrophobicContact CD1-CG 3.82Å; L755-F770 HydrophobicContact CD2-CB 4.01Å; L755-F770 HydrophobicContact CD2-CG 4.39Å; L755-F770 HydrophobicContact CG-CB 4.47Å; L755-L787 HydrophobicContact CD1-CD2 4.07Å; L755-T792 HydrophobicContact CB-CG2 3.39Å; L755-T792 HydrophobicContact CD1-CG2 4.22Å; L755-T792 HydrophobicContact CG-CG2 4.39Å; L755-V796 HydrophobicContact CD1-CG2 4.27Å; L755-V796 HydrophobicContact CD2-CG2 4.06Å
756A89.3Confident90.4Very high54 Ų5448 Ų4845%0.44625%0.245SC..THydrogen-bonded Turntrans-86.5-0.6174.900000113.6G752 V753 L754G752-A756 WeakPolarHBondContact O-CB 3.23Å; G752-A756 PolarHBondContact O-N 2.95Å; V753-A756 PolarHBondContact O-N 2.64Å; V753-A756 VanDerWaalsContact O-N 3.16Å; L754-A756 PolarHBondContact O-N 3.41Å
757D87Confident90.5Very high47 Ų4745.7 Ų45.725%0.25124%0.236SC..  trans-60.7145.2-179.2-157.8-66.5000112V753 L754 L755 S759 L762V753-D757 PolarHBondContact O-N 3.19Å; L754-D757 VanDerWaalsContact O-CB 3.31Å; L754-D757 WeakPolarHBondContact O-CB 3.42Å; L754-D757 PolarHBondContact O-N 3.07Å; L755-D757 VanDerWaalsContact C-N 3.33Å; D757-S759 VanDerWaalsContact OD1-CB 3.3Å; D757-S759 WeakPolarHBondContact OD1-CB 3.26Å; D757-S759 PolarHBondContact OD1-N 3.29Å; D757-L762 HydrophobicContact CB-CB 4.45Å
758K84.4Confident90.6Very high208 Ų20849.3 Ų49.390%0.90425%0.254SS*.SBendtrans-87.6-25.2-178-63.9-177.7-177.8176.20112.6W760K758-W760 PolarHBondContact O-N 2.96Å
759S88.1Confident90.7Very high37 Ų3749.6 Ų49.626%0.25926%0.256SS..  trans-65.9121.7176.8176.20000109.1D757 L761 L762 H763D757-S759 VanDerWaalsContact OD1-CB 3.3Å; D757-S759 WeakPolarHBondContact OD1-CB 3.26Å; D757-S759 PolarHBondContact OD1-N 3.29Å; S759-L761 PolarHBondContact O-N 3.06Å; S759-L762 PolarHBondContact O-N 3.13Å; S759-H763 WeakPolarHBondContact O-CB 3.5Å; S759-H763 PolarHBondContact O-N 2.72Å
760W86.8Confident90.9Very high202 Ų20246.8 Ų46.877%0.76524%0.236SC*.Hα-helixtrans-60.2-34.9-177.472.8-92000112K758 Q764K758-W760 PolarHBondContact O-N 2.96Å; W760-Q764 WeakPolarHBondContact O-CB 3.2Å; W760-Q764 PolarHBondContact O-N 3.46Å
761L88.9Confident90.9Very high60 Ų6048.6 Ų48.631%0.31425%0.249SC..Hα-helixtrans-70.1-49.5-178.5179.465.5000110.7S759 H763 Q764 H765S759-L761 PolarHBondContact O-N 3.06Å; L761-H763 VanDerWaalsContact C-N 3.33Å; L761-Q764 PolarHBondContact O-N 2.81Å; L761-H765 PolarHBondContact O-CD2 3.37Å; L761-H765 VanDerWaalsContact O-CD2 3.26Å; L761-H765 PolarHBondContact O-N 2.96Å
762L90.7Very high90.8Very high5 Ų553.3 Ų53.33%0.02627%0.267CS..Hα-helixtrans-64.5-41.1177.1-66.8178000111D717 L720 L721 D757 S759 Q764 H765 A766D717-L762 HydrophobicContact CB-CD1 4.34Å; D717-L762 HydrophobicContact CB-CD2 4.21Å; L720-L762 HydrophobicContact CB-CD2 4.02Å; L720-L762 HydrophobicContact CD1-CD1 3.71Å; L721-L762 HydrophobicContact CD2-CD2 3.88Å; L721-L762 HydrophobicContact CG-CD2 3.93Å; D757-L762 HydrophobicContact CB-CB 4.45Å; S759-L762 PolarHBondContact O-N 3.13Å; L762-Q764 PolarHBondContact O-N 3.25Å; L762-H765 PolarHBondContact O-N 2.89Å; L762-A766 VanDerWaalsContact O-CB 3.25Å; L762-A766 WeakPolarHBondContact O-CB 3.47Å; L762-A766 PolarHBondContact O-N 2.73Å
763H91Very high90.9Very high32 Ų3252.3 Ų52.315%0.14826%0.257CS..Hα-helixtrans-61.1-44.6176.8-173.567.5000112L755 S759 L761 A766 L767L755-H763 PolarHBondContact O-CE1 3.39Å; L755-H763 PolarHBondContact O-ND1 3.45Å; S759-H763 WeakPolarHBondContact O-CB 3.5Å; S759-H763 PolarHBondContact O-N 2.72Å; L761-H763 VanDerWaalsContact C-N 3.33Å; H763-A766 WeakPolarHBondContact O-CB 3.5Å; H763-A766 PolarHBondContact O-N 3.23Å; H763-L767 WeakPolarHBondContact O-CG 3.37Å; H763-L767 PolarHBondContact O-N 3.01Å
764Q92.2Very high90.9Very high65 Ų6550.4 Ų50.430%0.30425%0.248SC..Hα-helixtrans-61.4-47.3176.3177.958.530.800111.7W760 L761 L762 A766 L767 E768W760-Q764 WeakPolarHBondContact O-CB 3.2Å; W760-Q764 PolarHBondContact O-N 3.46Å; L761-Q764 PolarHBondContact O-N 2.81Å; L762-Q764 PolarHBondContact O-N 3.25Å; Q764-A766 VanDerWaalsContact C-N 3.29Å; Q764-A766 PolarHBondContact O-N 2.94Å; Q764-L767 WeakPolarHBondContact O-CB 3.44Å; Q764-L767 PolarHBondContact O-N 3.34Å; Q764-E768 PolarHBondContact NE2-OE1 3.49Å; Q764-E768 WeakPolarHBondContact O-CG 3.35Å; Q764-E768 PolarHBondContact O-N 2.94Å
765H93.1Very high90.8Very high69 Ų6953.1 Ų53.132%0.31928%0.278SS..Hα-helixtrans-66.2-31.3176.2-76.3-57.4000112.8L721 L724 L761 L762 E768 A769L721-H765 HydrophobicContact CD2-CB 3.98Å; L721-H765 WeakPolarHBondContact CD2-CD2 3.25Å; L724-H765 HydrophobicContact CD1-CB 3.81Å; L761-H765 PolarHBondContact O-CD2 3.37Å; L761-H765 VanDerWaalsContact O-CD2 3.26Å; L761-H765 PolarHBondContact O-N 2.96Å; L762-H765 PolarHBondContact O-N 2.89Å; H765-E768 IonicContact CE1-OE2 3.53Å; H765-E768 IonicContact ND1-OE2 2.8Å; H765-E768 PolarHBondContact ND1-OE2 3.5Å; H765-E768 PolarHBondContact O-N 2.74Å; H765-A769 VanDerWaalsContact O-CB 3.23Å; H765-A769 WeakPolarHBondContact O-CB 3.42Å; H765-A769 PolarHBondContact O-N 2.88Å
766A94.1Very high90.7Very high0 Ų056.6 Ų56.60%030%0.297CS..Hα-helixtrans-66.2-42.1174.200000111.5L724 L754 L755 L762 H763 Q764 A769 F770L724-A766 HydrophobicContact CD1-CB 4.24Å; L724-A766 HydrophobicContact CD2-CB 3.94Å; L754-A766 HydrophobicContact CB-CB 4.26Å; L754-A766 WeakPolarHBondContact O-CB 3.36Å; L755-A766 HydrophobicContact CD2-CB 4Å; L755-A766 HydrophobicContact CG-CB 4.48Å; L762-A766 VanDerWaalsContact O-CB 3.25Å; L762-A766 WeakPolarHBondContact O-CB 3.47Å; L762-A766 PolarHBondContact O-N 2.73Å; H763-A766 WeakPolarHBondContact O-CB 3.5Å; H763-A766 PolarHBondContact O-N 3.23Å; Q764-A766 VanDerWaalsContact C-N 3.29Å; Q764-A766 PolarHBondContact O-N 2.94Å; A766-A769 PolarHBondContact O-N 2.94Å; A766-F770 WeakPolarHBondContact O-CB 3.33Å; A766-F770 PolarHBondContact O-N 3.35Å
767L92.9Very high90.7Very high11 Ų1154.8 Ų54.86%0.05828%0.28CS..Hα-helixtrans-61-44.4173.6-70170000111.8L755 H763 Q764 S771 V796 Y799L755-L767 HydrophobicContact CD2-CD2 4.03Å; L755-L767 HydrophobicContact CD2-CG 4.45Å; H763-L767 WeakPolarHBondContact O-CG 3.37Å; H763-L767 PolarHBondContact O-N 3.01Å; Q764-L767 WeakPolarHBondContact O-CB 3.44Å; Q764-L767 PolarHBondContact O-N 3.34Å; L767-S771 WeakPolarHBondContact O-CB 3.19Å; L767-S771 PolarHBondContact O-N 2.86Å; L767-V796 HydrophobicContact CD2-CB 4.28Å; L767-V796 HydrophobicContact CD2-CG2 3.6Å; L767-Y799 HydrophobicContact CB-CD1 4.01Å; L767-Y799 HydrophobicContact CB-CD2 4.26Å; L767-Y799 HydrophobicContact CB-CE1 4.17Å; L767-Y799 HydrophobicContact CB-CE2 4.43Å; L767-Y799 HydrophobicContact CB-CG 4.05Å; L767-Y799 HydrophobicContact CD1-CD2 4.06Å; L767-Y799 HydrophobicContact CD1-CG 4.06Å; L767-Y799 HydrophobicContact CD2-CG 4.38Å; L767-Y799 HydrophobicContact CG-CG 4.41Å
768E93.3Very high90.5Very high77 Ų7758.2 Ų58.236%0.3630%0.298SS..Hα-helixtrans-62.8-50.4176.5-73.1168-171.100112Q764 H765 S771 Y772 Y799Q764-E768 PolarHBondContact NE2-OE1 3.49Å; Q764-E768 WeakPolarHBondContact O-CG 3.35Å; Q764-E768 PolarHBondContact O-N 2.94Å; H765-E768 IonicContact CE1-OE2 3.53Å; H765-E768 IonicContact ND1-OE2 2.8Å; H765-E768 PolarHBondContact ND1-OE2 3.5Å; H765-E768 PolarHBondContact O-N 2.74Å; E768-S771 PolarHBondContact O-N 3.46Å; E768-Y772 WeakPolarHBondContact O-CB 3.42Å; E768-Y772 PolarHBondContact O-N 3.24Å; E768-Y799 WeakPolarHBondContact CG-OH 3.46Å
769A94Very high90.7Very high9 Ų948.9 Ų48.97%0.07426%0.258CS..Hα-helixtrans-63.2-43.6-179.800000112L724 H765 A766 Y772 F773L724-A769 HydrophobicContact CB-CB 4.05Å; L724-A769 HydrophobicContact CD2-CB 3.98Å; H765-A769 VanDerWaalsContact O-CB 3.23Å; H765-A769 WeakPolarHBondContact O-CB 3.42Å; H765-A769 PolarHBondContact O-N 2.88Å; A766-A769 PolarHBondContact O-N 2.94Å; A769-Y772 PolarHBondContact O-N 3.42Å; A769-F773 WeakPolarHBondContact O-CB 3.35Å; A769-F773 PolarHBondContact O-N 3.48Å
770F94.7Very high90.5Very high4 Ų454.5 Ų54.52%0.01828%0.28CS..Hα-helixtrans-66.1-43.6176.7-179.1-99.9000111.7F751 L755 A766 Y772 F773 A774 I783 L787 V796F751-F770 HydrophobicContact CB-CD2 4.1Å; F751-F770 HydrophobicContact CB-CE2 4.47Å; F751-F770 HydrophobicContact CD1-CB 4.06Å; F751-F770 AromaticContact CD1-CD2 3.78Å; F751-F770 HydrophobicContact CD1-CD2 3.78Å; F751-F770 HydrophobicContact CD1-CG 4.43Å; F751-F770 HydrophobicContact CD2-CD2 4.33Å; F751-F770 HydrophobicContact CE1-CB 4.09Å; F751-F770 HydrophobicContact CE1-CD2 4.24Å; F751-F770 AromaticContact CG-CD2 3.83Å; F751-F770 HydrophobicContact CG-CD2 3.83Å; F751-F770 HydrophobicContact CG-CE2 4.49Å; L755-F770 HydrophobicContact CD1-CB 4.23Å; L755-F770 HydrophobicContact CD1-CD1 4.24Å; L755-F770 HydrophobicContact CD1-CD2 3.82Å; L755-F770 HydrophobicContact CD1-CE2 4.2Å; L755-F770 HydrophobicContact CD1-CG 3.82Å; L755-F770 HydrophobicContact CD2-CB 4.01Å; L755-F770 HydrophobicContact CD2-CG 4.39Å; L755-F770 HydrophobicContact CG-CB 4.47Å; A766-F770 WeakPolarHBondContact O-CB 3.33Å; A766-F770 PolarHBondContact O-N 3.35Å; F770-Y772 VanDerWaalsContact C-N 3.32Å; F770-Y772 PolarHBondContact O-N 3.44Å; F770-F773 PolarHBondContact O-N 2.88Å; F770-A774 HydrophobicContact CE1-CB 4.43Å; F770-A774 VanDerWaalsContact O-CB 3.24Å; F770-A774 WeakPolarHBondContact O-CB 3.49Å; F770-A774 PolarHBondContact O-N 3.28Å; F770-I783 HydrophobicContact CZ-CG2 3.9Å; F770-L787 HydrophobicContact CE1-CD1 4.03Å; F770-L787 HydrophobicContact CE1-CD2 4.08Å; F770-L787 HydrophobicContact CE1-CG 4.27Å; F770-L787 HydrophobicContact CZ-CD1 3.93Å; F770-L787 HydrophobicContact CZ-CD2 3.97Å; F770-L787 HydrophobicContact CZ-CG 3.86Å; F770-V796 HydrophobicContact CD1-CG1 4.12Å; F770-V796 HydrophobicContact CE1-CG1 3.97Å
771S91.8Very high90.6Very high42 Ų4249 Ų4929%0.29426%0.263SS..Hα-helixtrans-61.2-41.9176.1177.90000111.7L767 E768 G775L767-S771 WeakPolarHBondContact O-CB 3.19Å; L767-S771 PolarHBondContact O-N 2.86Å; E768-S771 PolarHBondContact O-N 3.46Å; S771-G775 PolarHBondContact O-N 3.31Å
772Y91.9Very high90.6Very high99 Ų9946.1 Ų46.139%0.38825%0.248SC..Hα-helixtrans-63.9-44.3174.9-173.9-94.5000112.1S728 K732 E768 A769 F770 N776S728-Y772 WeakPolarHBondContact O-CD1 3.36Å; K732-Y772 WeakPolarHBondContact CE-OH 3.3Å; K732-Y772 PolarHBondContact NZ-OH 3.05Å; E768-Y772 WeakPolarHBondContact O-CB 3.42Å; E768-Y772 PolarHBondContact O-N 3.24Å; A769-Y772 PolarHBondContact O-N 3.42Å; F770-Y772 VanDerWaalsContact C-N 3.32Å; F770-Y772 PolarHBondContact O-N 3.44Å; Y772-N776 PolarHBondContact O-N 3.04Å; Y772-N776 PolarHBondContact O-ND2 2.89Å
773F93.3Very high90.5Very high1 Ų148 Ų480%0.00426%0.257CS..Hα-helixtrans-61-53.1176.4175.7-93.9000111.6L730 G731 L747 F751 A769 F770 G775 N776 T777 V782L730-F773 HydrophobicContact CB-CE2 4.36Å; G731-F773 VanDerWaalsContact CA-CD2 3.44Å; G731-F773 VanDerWaalsContact N-CD2 3.31Å; L747-F773 HydrophobicContact CD2-CE1 4.34Å; L747-F773 HydrophobicContact CD2-CE2 3.58Å; L747-F773 HydrophobicContact CD2-CZ 3.39Å; L747-F773 HydrophobicContact CG-CZ 4.37Å; F751-F773 HydrophobicContact CE2-CB 4.14Å; F751-F773 AromaticContact CE2-CD1 3.81Å; F751-F773 HydrophobicContact CE2-CD1 3.81Å; F751-F773 AromaticContact CE2-CD2 3.98Å; F751-F773 HydrophobicContact CE2-CD2 3.98Å; F751-F773 HydrophobicContact CE2-CE1 4.23Å; F751-F773 HydrophobicContact CE2-CE2 4.41Å; F751-F773 AromaticContact CE2-CG 3.68Å; F751-F773 HydrophobicContact CE2-CG 3.68Å; F751-F773 HydrophobicContact CZ-CB 3.72Å; F751-F773 HydrophobicContact CZ-CD1 4.25Å; F751-F773 HydrophobicContact CZ-CD2 4.21Å; F751-F773 AromaticContact CZ-CG 3.79Å; F751-F773 HydrophobicContact CZ-CG 3.79Å; A769-F773 WeakPolarHBondContact O-CB 3.35Å; A769-F773 PolarHBondContact O-N 3.48Å; F770-F773 PolarHBondContact O-N 2.88Å; F773-G775 PolarHBondContact O-N 3.37Å; F773-N776 PolarHBondContact O-N 3.44Å; F773-T777 HydrophobicContact CD1-CG2 4.08Å; F773-T777 HydrophobicContact CE1-CG2 3.68Å; F773-T777 HydrophobicContact CZ-CG2 4.02Å; F773-T777 WeakPolarHBondContact CZ-OG1 3.21Å; F773-T777 WeakPolarHBondContact O-CB 3.41Å; F773-T777 WeakPolarHBondContact O-CG2 3.21Å; F773-T777 PolarHBondContact O-N 3.4Å; F773-V782 HydrophobicContact CE1-CB 3.98Å; F773-V782 HydrophobicContact CE1-CG1 3.63Å; F773-V782 HydrophobicContact CZ-CB 4.21Å; F773-V782 HydrophobicContact CZ-CG1 3.93Å
774A90.1Very high90.3Very high30 Ų3050.3 Ų50.325%0.24828%0.277CS..Hα-helixtrans-60.1-32.8-177.600000112.6F770 N776 I783F770-A774 HydrophobicContact CE1-CB 4.43Å; F770-A774 VanDerWaalsContact O-CB 3.24Å; F770-A774 WeakPolarHBondContact O-CB 3.49Å; F770-A774 PolarHBondContact O-N 3.28Å; A774-N776 VanDerWaalsContact C-N 3.35Å; A774-I783 HydrophobicContact CB-CD1 3.85Å; A774-I783 HydrophobicContact CB-CG1 4.08Å
775G88.3Confident90.2Very high64 Ų6451.1 Ų51.166%0.6628%0.281SS*.Hα-helixtrans-76.5-14.917700000115.4S771 F773S771-G775 PolarHBondContact O-N 3.31Å; F773-G775 PolarHBondContact O-N 3.37Å
776N88.6Confident90Very high73 Ų7348 Ų4839%0.3927%0.267SS..Hα-helixtrans-119.3-19.6-174.7-69.2-69.1000114.2G731 Y772 F773 A774G731-N776 CarbonylContact O-C 3.59Å; G731-N776 VanDerWaalsContact O-C 3.28Å; Y772-N776 PolarHBondContact O-N 3.04Å; Y772-N776 PolarHBondContact O-ND2 2.89Å; F773-N776 PolarHBondContact O-N 3.44Å; A774-N776 VanDerWaalsContact C-N 3.35Å
777T88.9Confident89.8Confident15 Ų1549.5 Ų49.59%0.09228%0.275CS..  trans-74.9146.7-174.2-170.70000113.3G731 F773 H779 I783G731-T777 VanDerWaalsContact O-CA 3.26Å; G731-T777 WeakPolarHBondContact O-CA 3.34Å; G731-T777 PolarHBondContact O-N 3.1Å; F773-T777 HydrophobicContact CD1-CG2 4.08Å; F773-T777 HydrophobicContact CE1-CG2 3.68Å; F773-T777 HydrophobicContact CZ-CG2 4.02Å; F773-T777 WeakPolarHBondContact CZ-OG1 3.21Å; F773-T777 WeakPolarHBondContact O-CB 3.41Å; F773-T777 WeakPolarHBondContact O-CG2 3.21Å; F773-T777 PolarHBondContact O-N 3.4Å; T777-H779 PolarHBondContact OG1-N 3.49Å; T777-H779 VanDerWaalsContact OG1-N 3.09Å; T777-I783 HydrophobicContact CG2-CD1 3.87Å; T777-I783 HydrophobicContact CG2-CG1 4.15Å
778N84.4Confident89.4Confident119 Ų11953.7 Ų53.764%0.63630%0.304SS*.SBendtrans-93.7-3.7168.2-64.3-45.2000112.6F734F734-N778 HydrophobicContact CD2-CB 4.27Å
779H86.8Confident89.2Confident12 Ų1254.1 Ų54.16%0.05631%0.312CS..  trans-102.375.2-177.3-56.4-70.6000110.4F735 L744 T777 E781 V782F735-H779 AromaticContact CD2-CD2 3.8Å; F735-H779 AromaticContact CD2-NE2 3.52Å; F735-H779 PolarHBondContact N-NE2 3.34Å; L744-H779 HydrophobicContact CD1-CB 4.32Å; L744-H779 HydrophobicContact CD2-CB 3.92Å; T777-H779 PolarHBondContact OG1-N 3.49Å; T777-H779 VanDerWaalsContact OG1-N 3.09Å; H779-E781 PolarHBondContact O-N 3.16Å; H779-V782 HydrophobicContact CB-CG2 4.03Å; H779-V782 WeakPolarHBondContact O-CB 3.45Å; H779-V782 PolarHBondContact O-N 2.93Å; H779-V782 VanDerWaalsContact O-N 3.11Å
780E85.5Confident88.9Confident155 Ų15559.2 Ų59.272%0.72433%0.334SS*.Hα-helixtrans-60.9-25.4-177.1-66.2-173.8177.300113.6V782 I783 S784E780-V782 PolarHBondContact O-N 3.16Å; E780-I783 WeakPolarHBondContact O-CB 3.4Å; E780-I783 PolarHBondContact O-N 3.3Å; E780-S784 PolarHBondContact O-N 3.09Å
781E88.2Confident88.5Confident87 Ų8764.9 Ų64.941%0.40736%0.36SS..Hα-helixtrans-59.1-30175.159.5170-143.100113L744 H779 I783 S784 Q785L744-E781 WeakPolarHBondContact CB-OE1 2.91Å; L744-E781 HydrophobicContact CD1-CG 4.34Å; L744-E781 WeakPolarHBondContact CD1-OE1 3.4Å; H779-E781 PolarHBondContact O-N 3.16Å; E781-I783 VanDerWaalsContact C-N 3.32Å; E781-I783 PolarHBondContact O-N 3.03Å; E781-S784 PolarHBondContact O-OG 3.27Å; E781-S784 VanDerWaalsContact O-OG 3.07Å; E781-Q785 VanDerWaalsContact O-CB 3.27Å; E781-Q785 WeakPolarHBondContact O-CB 3.45Å; E781-Q785 WeakPolarHBondContact O-CG 3.43Å; E781-Q785 PolarHBondContact O-N 3.14Å
782V89Confident88.3Confident0 Ų063.1 Ų63.10%035%0.348CS..Hα-helixtrans-67.7-38.4176.6179.20000110.5L744 L747 S748 F751 F773 H779 E780 S786L744-V782 HydrophobicContact CB-CG2 4.01Å; L744-V782 HydrophobicContact CD2-CG2 3.79Å; L744-V782 HydrophobicContact CG-CG2 4.42Å; L747-V782 HydrophobicContact CB-CG1 4.1Å; L747-V782 HydrophobicContact CD2-CG1 3.84Å; L747-V782 HydrophobicContact CD2-CG2 4.12Å; L747-V782 HydrophobicContact CG-CG1 3.88Å; S748-V782 WeakPolarHBondContact OG-CA 3.48Å; F751-V782 HydrophobicContact CD2-CG1 4.48Å; F773-V782 HydrophobicContact CE1-CB 3.98Å; F773-V782 HydrophobicContact CE1-CG1 3.63Å; F773-V782 HydrophobicContact CZ-CB 4.21Å; F773-V782 HydrophobicContact CZ-CG1 3.93Å; H779-V782 HydrophobicContact CB-CG2 4.03Å; H779-V782 WeakPolarHBondContact O-CB 3.45Å; H779-V782 PolarHBondContact O-N 2.93Å; H779-V782 VanDerWaalsContact O-N 3.11Å; E780-V782 PolarHBondContact O-N 3.16Å; V782-S786 VanDerWaalsContact O-CB 3.25Å; V782-S786 WeakPolarHBondContact O-CB 3.5Å; V782-S786 PolarHBondContact O-N 3.27Å; V782-S786 PolarHBondContact O-OG 3.11Å
783I88.6Confident88.1Confident43 Ų4361.9 Ų61.922%0.22135%0.345CS..Hα-helixtrans-64.7-48.9179.7-55.5173.7000109.6F770 A774 T777 E780 E781 S786 L787F770-I783 HydrophobicContact CZ-CG2 3.9Å; A774-I783 HydrophobicContact CB-CD1 3.85Å; A774-I783 HydrophobicContact CB-CG1 4.08Å; T777-I783 HydrophobicContact CG2-CD1 3.87Å; T777-I783 HydrophobicContact CG2-CG1 4.15Å; E780-I783 WeakPolarHBondContact O-CB 3.4Å; E780-I783 PolarHBondContact O-N 3.3Å; E781-I783 VanDerWaalsContact C-N 3.32Å; E781-I783 PolarHBondContact O-N 3.03Å; I783-S786 PolarHBondContact O-N 3.09Å; I783-L787 HydrophobicContact CG2-CD1 4.48Å; I783-L787 WeakPolarHBondContact O-CG 3.39Å
784S87.2Confident87.8Confident81 Ų8165.1 Ų65.157%0.56636%0.364SS*.Hα-helixtrans-66.7-41.7-178.261.60000112.1E780 E781 L787E780-S784 PolarHBondContact O-N 3.09Å; E781-S784 PolarHBondContact O-OG 3.27Å; E781-S784 VanDerWaalsContact O-OG 3.07Å; S784-L787 PolarHBondContact O-N 3.49Å
785Q89.3Confident87.7Confident82 Ų8267.1 Ų67.138%0.38337%0.368SS..Hα-helixtrans-72.3-28.6179.3-69.3173.47.100113.6S748 E781 L787 C788S748-Q785 WeakPolarHBondContact OG-CB 3.45Å; S748-Q785 PolarHBondContact OG-OE1 3.47Å; E781-Q785 VanDerWaalsContact O-CB 3.27Å; E781-Q785 WeakPolarHBondContact O-CB 3.45Å; E781-Q785 WeakPolarHBondContact O-CG 3.43Å; E781-Q785 PolarHBondContact O-N 3.14Å; Q785-L787 PolarHBondContact O-N 3.01Å; Q785-C788 PolarHBondContact O-SG 3.07Å
786S89.9Confident87.7Confident5 Ų564.3 Ų64.34%0.03534%0.338CS..Hα-helixtrans-69.3-23.1175.2-59.70000112.9S748 F751 V782 I783S748-S786 WeakPolarHBondContact CA-OG 3.35Å; S748-S786 PolarHBondContact O-OG 3.08Å; F751-S786 WeakPolarHBondContact CB-OG 3.42Å; V782-S786 VanDerWaalsContact O-CB 3.25Å; V782-S786 WeakPolarHBondContact O-CB 3.5Å; V782-S786 PolarHBondContact O-N 3.27Å; V782-S786 PolarHBondContact O-OG 3.11Å; I783-S786 PolarHBondContact O-N 3.09Å
787L90.3Very high87.7Confident30 Ų3065.2 Ų65.216%0.15734%0.341CS..THydrogen-bonded Turntrans-108.226-173.4-59.1179.7000113.3L755 F770 I783 S784 Q785 V789 T792 K793 V796L755-L787 HydrophobicContact CD1-CD2 4.07Å; F770-L787 HydrophobicContact CE1-CD1 4.03Å; F770-L787 HydrophobicContact CE1-CD2 4.08Å; F770-L787 HydrophobicContact CE1-CG 4.27Å; F770-L787 HydrophobicContact CZ-CD1 3.93Å; F770-L787 HydrophobicContact CZ-CD2 3.97Å; F770-L787 HydrophobicContact CZ-CG 3.86Å; I783-L787 HydrophobicContact CG2-CD1 4.48Å; I783-L787 WeakPolarHBondContact O-CG 3.39Å; S784-L787 PolarHBondContact O-N 3.49Å; Q785-L787 PolarHBondContact O-N 3.01Å; L787-V789 PolarHBondContact O-N 3.04Å; L787-T792 HydrophobicContact CD2-CG2 4.46Å; L787-K793 HydrophobicContact CB-CB 4.28Å; L787-K793 HydrophobicContact CB-CG 4.49Å; L787-V796 HydrophobicContact CD1-CG1 4.47Å; L787-V796 HydrophobicContact CD2-CB 4.23Å; L787-V796 HydrophobicContact CD2-CG1 4.4Å; L787-V796 HydrophobicContact CD2-CG2 3.81Å
788C84.3Confident87.6Confident100 Ų10068 Ų6868%0.67636%0.356SS*.  trans-62.7-21.3178.5-70.50000113.9Q785Q785-C788 PolarHBondContact O-SG 3.07Å
789V88.7Confident87.8Confident85 Ų8566 Ų6652%0.51534%0.34SS..SBendtrans-93.9118.4178.2-178.50000109.7L787 E791 T792 K793L787-V789 PolarHBondContact O-N 3.04Å; V789-E791 VanDerWaalsContact C-N 3.29Å; V789-E791 HydrophobicContact CG1-CB 4.32Å; V789-E791 PolarHBondContact O-N 3.39Å; V789-T792 PolarHBondContact O-N 3.36Å; V789-T792 VanDerWaalsContact O-N 3.14Å; V789-K793 WeakPolarHBondContact O-CB 3.24Å; V789-K793 PolarHBondContact O-N 3.47Å
790E86.3Confident87.8Confident116 Ų11670.2 Ų70.254%0.54236%0.362SS..Hα-helixtrans-60.2-33.3-175.6-75.9-61.914500113.7K793 T794E790-K793 IonicContact OE1-NZ 3.66Å; E790-K793 PolarHBondContact OE1-NZ 3.25Å; E790-K793 IonicContact OE2-NZ 3.59Å; E790-K793 PolarHBondContact OE2-NZ 3.34Å; E790-T794 WeakPolarHBondContact O-CB 3.32Å; E790-T794 PolarHBondContact O-N 2.9Å; E790-T794 PolarHBondContact O-OG1 3.44Å
791E86.6Confident87.9Confident123 Ų12366 Ų6658%0.57535%0.35SS*.Hα-helixtrans-63.1-48.7174.9-169.8-170.215200111.7V789 T794 K795V789-E791 VanDerWaalsContact C-N 3.29Å; V789-E791 HydrophobicContact CG1-CB 4.32Å; V789-E791 PolarHBondContact O-N 3.39Å; E791-T794 PolarHBondContact O-N 3.32Å; E791-K795 WeakPolarHBondContact O-CG 3.46Å; E791-K795 PolarHBondContact O-N 2.95Å; E791-K795 WeakPolarHBondContact OE1-CE 3.41Å; E791-K795 IonicContact OE1-NZ 3.82Å; E791-K795 PolarHBondContact OE1-NZ 3.02Å
792T87.4Confident87.8Confident6 Ų670.3 Ų70.34%0.03737%0.368CS..Hα-helixtrans-62.7-44.8178.3-55.50000111.1L755 L787 V789 T794 K795 V796L755-T792 HydrophobicContact CB-CG2 3.39Å; L755-T792 HydrophobicContact CD1-CG2 4.22Å; L755-T792 HydrophobicContact CG-CG2 4.39Å; L787-T792 HydrophobicContact CD2-CG2 4.46Å; V789-T792 PolarHBondContact O-N 3.36Å; V789-T792 VanDerWaalsContact O-N 3.14Å; T792-T794 VanDerWaalsContact C-N 3.34Å; T792-T794 PolarHBondContact O-N 2.9Å; T792-K795 PolarHBondContact O-N 2.92Å; T792-V796 WeakPolarHBondContact O-CG2 3.42Å; T792-V796 PolarHBondContact O-N 3.36Å
793K89Confident87.3Confident73 Ų7374.4 Ų74.432%0.31739%0.393SS..Hα-helixtrans-58.1-44.6175179.8178.1164.5-161.10112L787 V789 E790 K795 V796 I797L787-K793 HydrophobicContact CB-CB 4.28Å; L787-K793 HydrophobicContact CB-CG 4.49Å; V789-K793 WeakPolarHBondContact O-CB 3.24Å; V789-K793 PolarHBondContact O-N 3.47Å; E790-K793 IonicContact OE1-NZ 3.66Å; E790-K793 PolarHBondContact OE1-NZ 3.25Å; E790-K793 IonicContact OE2-NZ 3.59Å; E790-K793 PolarHBondContact OE2-NZ 3.34Å; K793-K795 PolarHBondContact O-N 2.73Å; K793-V796 PolarHBondContact O-N 2.92Å; K793-I797 HydrophobicContact CG-CD1 3.86Å; K793-I797 WeakPolarHBondContact O-CB 3.17Å; K793-I797 VanDerWaalsContact O-CG1 3.24Å; K793-I797 WeakPolarHBondContact O-CG1 3.42Å; K793-I797 PolarHBondContact O-N 3.39Å
794T87.3Confident86.2Confident68 Ų6880 Ų8042%0.41742%0.422SS..Hα-helixtrans-61.7-43.5176.8-57.20000111.5E790 E791 T792 I797 N798E790-T794 WeakPolarHBondContact O-CB 3.32Å; E790-T794 PolarHBondContact O-N 2.9Å; E790-T794 PolarHBondContact O-OG1 3.44Å; E791-T794 PolarHBondContact O-N 3.32Å; T792-T794 VanDerWaalsContact C-N 3.34Å; T792-T794 PolarHBondContact O-N 2.9Å; T794-I797 PolarHBondContact O-N 3.21Å; T794-N798 WeakPolarHBondContact O-CB 3.33Å; T794-N798 PolarHBondContact O-N 2.91Å; T794-N798 PolarHBondContact O-ND2 3.38Å
795K86.8Confident85Confident72 Ų7285.7 Ų85.731%0.31344%0.437SS..Hα-helixtrans-61.8-44.7176.4-73.2167.6169.8170.20112E791 T792 K793 N798 Y799E791-K795 WeakPolarHBondContact O-CG 3.46Å; E791-K795 PolarHBondContact O-N 2.95Å; E791-K795 WeakPolarHBondContact OE1-CE 3.41Å; E791-K795 IonicContact OE1-NZ 3.82Å; E791-K795 PolarHBondContact OE1-NZ 3.02Å; T792-K795 PolarHBondContact O-N 2.92Å; K793-K795 PolarHBondContact O-N 2.73Å; K795-N798 PolarHBondContact O-N 3.08Å; K795-Y799 PolarHBondContact O-N 3.23Å
796V88.5Confident83.9Confident5 Ų588.6 Ų88.63%0.0346%0.46CS..Hα-helixtrans-63.5-45.4176.7172.10000111.3L755 L767 F770 L787 T792 K793 N798 Y799 L800L755-V796 HydrophobicContact CD1-CG2 4.27Å; L755-V796 HydrophobicContact CD2-CG2 4.06Å; L767-V796 HydrophobicContact CD2-CB 4.28Å; L767-V796 HydrophobicContact CD2-CG2 3.6Å; F770-V796 HydrophobicContact CD1-CG1 4.12Å; F770-V796 HydrophobicContact CE1-CG1 3.97Å; L787-V796 HydrophobicContact CD1-CG1 4.47Å; L787-V796 HydrophobicContact CD2-CB 4.23Å; L787-V796 HydrophobicContact CD2-CG1 4.4Å; L787-V796 HydrophobicContact CD2-CG2 3.81Å; T792-V796 WeakPolarHBondContact O-CG2 3.42Å; T792-V796 PolarHBondContact O-N 3.36Å; K793-V796 PolarHBondContact O-N 2.92Å; V796-N798 PolarHBondContact O-N 3.43Å; V796-Y799 PolarHBondContact O-N 3.42Å; V796-L800 HydrophobicContact CG1-CD1 3.9Å; V796-L800 HydrophobicContact CG1-CG 4.35Å; V796-L800 WeakPolarHBondContact O-CG 3.4Å; V796-L800 PolarHBondContact O-N 3.31Å
797I88Confident82.7Confident92 Ų9296.2 Ų96.247%0.47250%0.499SS..Hα-helixtrans-58.7-48.8176.4-70.7167000110.1K793 T794 Y799 L800 S801K793-I797 HydrophobicContact CG-CD1 3.86Å; K793-I797 WeakPolarHBondContact O-CB 3.17Å; K793-I797 VanDerWaalsContact O-CG1 3.24Å; K793-I797 WeakPolarHBondContact O-CG1 3.42Å; K793-I797 PolarHBondContact O-N 3.39Å; T794-I797 PolarHBondContact O-N 3.21Å; I797-Y799 VanDerWaalsContact C-N 3.28Å; I797-Y799 PolarHBondContact O-N 2.64Å; I797-L800 PolarHBondContact O-N 3.43Å; I797-S801 WeakPolarHBondContact O-CB 3.49Å; I797-S801 PolarHBondContact O-N 3.26Å; I797-S801 PolarHBondContact O-OG 3.46Å
798N87.3Confident82Confident75 Ų7598.7 Ų98.740%0.40151%0.51SS..Hα-helixtrans-59.3-38.4179-72.5-21.4000112.8T794 K795 V796 S801 K802 T803T794-N798 WeakPolarHBondContact O-CB 3.33Å; T794-N798 PolarHBondContact O-N 2.91Å; T794-N798 PolarHBondContact O-ND2 3.38Å; K795-N798 PolarHBondContact O-N 3.08Å; V796-N798 PolarHBondContact O-N 3.43Å; N798-S801 VanDerWaalsContact CA-OG 3.31Å; N798-S801 WeakPolarHBondContact CA-OG 3.25Å; N798-S801 PolarHBondContact O-OG 2.93Å; N798-S801 VanDerWaalsContact O-OG 3.09Å; N798-K802 PolarHBondContact O-N 3.44Å; N798-T803 PolarHBondContact O-N 2.94Å
799Y88.5Confident81.9Confident77 Ų7797.8 Ų97.830%0.30250%0.498SS..Hα-helixtrans-65.3-49.6175174.3-101.5000111.5L767 E768 K795 V796 I797 S801 K802L767-Y799 HydrophobicContact CB-CD1 4.01Å; L767-Y799 HydrophobicContact CB-CD2 4.26Å; L767-Y799 HydrophobicContact CB-CE1 4.17Å; L767-Y799 HydrophobicContact CB-CE2 4.43Å; L767-Y799 HydrophobicContact CB-CG 4.05Å; L767-Y799 HydrophobicContact CD1-CD2 4.06Å; L767-Y799 HydrophobicContact CD1-CG 4.06Å; L767-Y799 HydrophobicContact CD2-CG 4.38Å; L767-Y799 HydrophobicContact CG-CG 4.41Å; E768-Y799 WeakPolarHBondContact CG-OH 3.46Å; K795-Y799 PolarHBondContact O-N 3.23Å; V796-Y799 PolarHBondContact O-N 3.42Å; I797-Y799 VanDerWaalsContact C-N 3.28Å; I797-Y799 PolarHBondContact O-N 2.64Å; Y799-S801 VanDerWaalsContact C-N 3.34Å; Y799-S801 PolarHBondContact O-N 3.03Å; Y799-K802 PolarHBondContact O-N 3.35Å
800L87.2Confident81.5Confident99 Ų9999.6 Ų99.652%0.51851%0.509SS..Hα-helixtrans-65.5-35.6-179.9-67.6175.5000112.5V796 I797 K802V796-L800 HydrophobicContact CG1-CD1 3.9Å; V796-L800 HydrophobicContact CG1-CG 4.35Å; V796-L800 WeakPolarHBondContact O-CG 3.4Å; V796-L800 PolarHBondContact O-N 3.31Å; I797-L800 PolarHBondContact O-N 3.43Å; L800-K802 PolarHBondContact O-N 3.44Å
801S87.1Confident81.3Confident67 Ų6799.7 Ų99.747%0.46951%0.51SS..THydrogen-bonded Turntrans-75.9-1.7174.160.70000113.4I797 N798 Y799 T803I797-S801 WeakPolarHBondContact O-CB 3.49Å; I797-S801 PolarHBondContact O-N 3.26Å; I797-S801 PolarHBondContact O-OG 3.46Å; N798-S801 VanDerWaalsContact CA-OG 3.31Å; N798-S801 WeakPolarHBondContact CA-OG 3.25Å; N798-S801 PolarHBondContact O-OG 2.93Å; N798-S801 VanDerWaalsContact O-OG 3.09Å; Y799-S801 VanDerWaalsContact C-N 3.34Å; Y799-S801 PolarHBondContact O-N 3.03Å; S801-T803 PolarHBondContact O-N 2.92Å; S801-T803 PolarHBondContact OG-OG1 3.46Å
802K86Confident81.2Confident178 Ų17896.3 Ų96.377%0.77450%0.499SS*.THydrogen-bonded Turntrans52.335.1-176.3-56.6-179.8180178.70112.2N798 Y799 L800 L804N798-K802 PolarHBondContact O-N 3.44Å; Y799-K802 PolarHBondContact O-N 3.35Å; L800-K802 PolarHBondContact O-N 3.44Å; K802-L804 PolarHBondContact O-N 3.39Å
803T79.4Confident81.2Confident86 Ų86100.9 Ų100.953%0.52852%0.516SS..  trans-70.2103.6-179.1-58.40000108.7N798 S801N798-T803 PolarHBondContact O-N 2.94Å; S801-T803 PolarHBondContact O-N 2.92Å; S801-T803 PolarHBondContact OG-OG1 3.46Å
804L65.2Low81Confident160 Ų16099.1 Ų99.184%0.83851%0.51SS*.PPolyproline II helixtrans-68.7133.4177.9-67.8169.8000109.7K802K802-L804 PolarHBondContact O-N 3.39Å
805K62.4Low80.9Confident201 Ų201101.5 Ų101.587%0.87451%0.514SS*.PPolyproline II helixtrans-63.8152.4163.4-74.5-178.2178.1176.90109.3L807K805-L807 PolarHBondContact O-N 2.96Å
806V65.3Low81.1Confident143 Ų143102.8 Ų102.887%0.86752%0.518SS*.PPolyproline II helixtrans-46.4128.5177.3-179.90000110E808V806-E808 PolarHBondContact O-N 3.43Å
807L65.2Low81.2Confident165 Ų165102.9 Ų102.986%0.86452%0.518SS*.PPolyproline II helixtrans-58.6120.5176.2-81.6156.3000109K805 D809K805-L807 PolarHBondContact O-N 2.96Å; L807-D809 PolarHBondContact O-N 2.91Å
808E76.6Confident81.1Confident82 Ų82103 Ų10338%0.38352%0.515SS..PPolyproline II helixtrans-58.6133.2170.3-172-178.3-15100108.7V806 R813 R816V806-E808 PolarHBondContact O-N 3.43Å; E808-R813 HydrophobicContact CG-CB 4.09Å; E808-R813 WeakPolarHBondContact OE2-CB 3.47Å; E808-R816 IonicContact OE1-CZ 3.64Å; E808-R816 IonicContact OE1-NE 3.61Å; E808-R816 PolarHBondContact OE1-NE 2.61Å; E808-R816 IonicContact OE1-NH2 2.68Å; E808-R816 IonicContact OE2-CZ 3.74Å; E808-R816 IonicContact OE2-NE 3.9Å; E808-R816 PolarHBondContact OE2-NE 2.92Å; E808-R816 IonicContact OE2-NH2 3.83Å; E808-R816 PolarHBondContact OE2-NH2 3.4Å
809D81.9Confident81.2Confident81 Ų81105.7 Ų105.743%0.43353%0.528SS..PPolyproline II helixtrans-65.7153.6175.172.387.9000110.9L807 E811 S812 R813L807-D809 PolarHBondContact O-N 2.91Å; D809-E811 VanDerWaalsContact C-N 3.27Å; D809-E811 PolarHBondContact O-N 2.94Å; D809-E811 PolarHBondContact OD1-N 3.44Å; D809-E811 VanDerWaalsContact OD1-N 3.15Å; D809-S812 VanDerWaalsContact CG-OG 3.22Å; D809-S812 PolarHBondContact O-N 2.81Å; D809-S812 WeakPolarHBondContact OD1-CB 3.31Å; D809-S812 PolarHBondContact OD1-N 2.99Å; D809-S812 PolarHBondContact OD1-OG 3.29Å; D809-S812 WeakPolarHBondContact OD2-CB 3.39Å; D809-S812 PolarHBondContact OD2-OG 3.32Å; D809-R813 WeakPolarHBondContact O-CB 3.24Å; D809-R813 PolarHBondContact O-N 3.2Å
810V79.8Confident81.3Confident122 Ų122104.9 Ų104.974%0.73953%0.528SS*.Hα-helixtrans-62.1-35.9-172.41790000111.9L814V810-L814 WeakPolarHBondContact O-CB 3.45Å; V810-L814 PolarHBondContact O-N 3.46Å
811E81.2Confident81.5Confident119 Ų119101.3 Ų101.356%0.55651%0.508SS*.Hα-helixtrans-74.1-44.7-176.3-163.5-169.8147.800111.4D809 R813 L814 K815D809-E811 VanDerWaalsContact C-N 3.27Å; D809-E811 PolarHBondContact O-N 2.94Å; D809-E811 PolarHBondContact OD1-N 3.44Å; D809-E811 VanDerWaalsContact OD1-N 3.15Å; E811-R813 VanDerWaalsContact C-N 3.32Å; E811-R813 PolarHBondContact O-N 3.02Å; E811-L814 PolarHBondContact O-N 2.9Å; E811-K815 WeakPolarHBondContact O-CG 3.5Å; E811-K815 PolarHBondContact O-N 3.47Å; E811-K815 WeakPolarHBondContact OE1-CE 3.37Å; E811-K815 IonicContact OE1-NZ 3.81Å; E811-K815 PolarHBondContact OE1-NZ 3.2Å
812S85.4Confident81.6Confident51 Ų51101 Ų10136%0.35751%0.509SS..Hα-helixtrans-61.4-41.8173.1-64.70000111.4D809 L814 K815 R816D809-S812 VanDerWaalsContact CG-OG 3.22Å; D809-S812 PolarHBondContact O-N 2.81Å; D809-S812 WeakPolarHBondContact OD1-CB 3.31Å; D809-S812 PolarHBondContact OD1-N 2.99Å; D809-S812 PolarHBondContact OD1-OG 3.29Å; D809-S812 WeakPolarHBondContact OD2-CB 3.39Å; D809-S812 PolarHBondContact OD2-OG 3.32Å; S812-L814 PolarHBondContact O-N 3.46Å; S812-K815 PolarHBondContact O-N 3.09Å; S812-R816 WeakPolarHBondContact O-CB 3.29Å; S812-R816 PolarHBondContact O-N 3.04Å
813R86.6Confident82Confident102 Ų10297 Ų9739%0.38550%0.5SS..Hα-helixtrans-59.6-45.6174.3179.2172.9173.2178.1-1.8111.6K450 E808 D809 E811 R816 L817K450-R813 PolarHBondContact O-NH2 2.89Å; E808-R813 HydrophobicContact CG-CB 4.09Å; E808-R813 WeakPolarHBondContact OE2-CB 3.47Å; D809-R813 WeakPolarHBondContact O-CB 3.24Å; D809-R813 PolarHBondContact O-N 3.2Å; E811-R813 VanDerWaalsContact C-N 3.32Å; E811-R813 PolarHBondContact O-N 3.02Å; R813-R816 PolarHBondContact O-N 3.19Å; R813-L817 HydrophobicContact CG-CD1 4.09Å; R813-L817 VanDerWaalsContact O-CG 3.31Å; R813-L817 WeakPolarHBondContact O-CG 2.98Å; R813-L817 PolarHBondContact O-N 3.33Å
814L85.3Confident82.5Confident37 Ų3795.3 Ų95.319%0.19449%0.487CS..Hα-helixtrans-62.8-45.9178.3-16899.1000111.2L344 T447 V451 V810 E811 S812 R816 L817 K818L344-L814 HydrophobicContact CB-CD1 4.35Å; L344-L814 HydrophobicContact CD1-CD1 3.9Å; T447-L814 HydrophobicContact CG2-CD1 4.02Å; V451-L814 HydrophobicContact CG2-CD1 4.44Å; V810-L814 WeakPolarHBondContact O-CB 3.45Å; V810-L814 PolarHBondContact O-N 3.46Å; E811-L814 PolarHBondContact O-N 2.9Å; S812-L814 PolarHBondContact O-N 3.46Å; L814-R816 VanDerWaalsContact C-N 3.34Å; L814-R816 PolarHBondContact O-N 3.03Å; L814-L817 PolarHBondContact O-N 2.94Å; L814-K818 WeakPolarHBondContact O-CG 3.44Å; L814-K818 PolarHBondContact O-N 2.83Å
815K86.3Confident83.7Confident117 Ų11790.8 Ų90.851%0.50946%0.461SS..Hα-helixtrans-58.4-44.9176.3-77.2168.8171.1163.70111.6E811 S812 K818 L819E811-K815 WeakPolarHBondContact O-CG 3.5Å; E811-K815 PolarHBondContact O-N 3.47Å; E811-K815 WeakPolarHBondContact OE1-CE 3.37Å; E811-K815 IonicContact OE1-NZ 3.81Å; E811-K815 PolarHBondContact OE1-NZ 3.2Å; S812-K815 PolarHBondContact O-N 3.09Å; K815-K818 PolarHBondContact O-N 3.33Å; K815-L819 PolarHBondContact O-N 3.25Å
816R90.1Very high85.2Confident100 Ų10086.5 Ų86.538%0.37744%0.444SS..Hα-helixtrans-62.5-45.4176.2-177.3177.855.772.6-3112E808 S812 R813 L814 K818 L819 E820E808-R816 IonicContact OE1-CZ 3.64Å; E808-R816 IonicContact OE1-NE 3.61Å; E808-R816 PolarHBondContact OE1-NE 2.61Å; E808-R816 IonicContact OE1-NH2 2.68Å; E808-R816 IonicContact OE2-CZ 3.74Å; E808-R816 IonicContact OE2-NE 3.9Å; E808-R816 PolarHBondContact OE2-NE 2.92Å; E808-R816 IonicContact OE2-NH2 3.83Å; E808-R816 PolarHBondContact OE2-NH2 3.4Å; S812-R816 WeakPolarHBondContact O-CB 3.29Å; S812-R816 PolarHBondContact O-N 3.04Å; R813-R816 PolarHBondContact O-N 3.19Å; L814-R816 VanDerWaalsContact C-N 3.34Å; L814-R816 PolarHBondContact O-N 3.03Å; R816-K818 VanDerWaalsContact C-N 3.3Å; R816-K818 PolarHBondContact O-N 3.27Å; R816-L819 PolarHBondContact O-N 3.01Å; R816-E820 IonicContact NH1-OE2 2.7Å; R816-E820 PolarHBondContact NH1-OE2 2.92Å; R816-E820 WeakPolarHBondContact O-CB 3.17Å; R816-E820 PolarHBondContact O-N 3.47Å
817L90.1Very high86.4Confident6 Ų684.4 Ų84.43%0.03143%0.425CS..Hα-helixtrans-63.4-35.2178.2-72.7172.6000112.5Y446 T447 K450 V451 R813 L814 E820 K821Y446-L817 HydrophobicContact CE1-CD2 4.42Å; T447-L817 HydrophobicContact CG2-CB 4.17Å; T447-L817 HydrophobicContact CG2-CD1 4.5Å; K450-L817 HydrophobicContact CB-CD1 4.03Å; K450-L817 HydrophobicContact CB-CD2 3.86Å; K450-L817 HydrophobicContact CG-CD2 4.24Å; V451-L817 HydrophobicContact CG2-CD1 3.45Å; V451-L817 VanDerWaalsContact CG2-CD1 3.45Å; R813-L817 HydrophobicContact CG-CD1 4.09Å; R813-L817 VanDerWaalsContact O-CG 3.31Å; R813-L817 WeakPolarHBondContact O-CG 2.98Å; R813-L817 PolarHBondContact O-N 3.33Å; L814-L817 PolarHBondContact O-N 2.94Å; L817-E820 PolarHBondContact O-N 3.4Å; L817-K821 PolarHBondContact O-N 3.41Å
818K86.3Confident87.8Confident96 Ų9677.1 Ų77.142%0.41739%0.387SS..Hα-helixtrans-63.2-40.6173.3-73.2179.9178.8-173.40112.2L814 K815 R816L814-K818 WeakPolarHBondContact O-CG 3.44Å; L814-K818 PolarHBondContact O-N 2.83Å; K815-K818 PolarHBondContact O-N 3.33Å; R816-K818 VanDerWaalsContact C-N 3.3Å; R816-K818 PolarHBondContact O-N 3.27Å
819L89.7Confident88.4Confident130 Ų13079.9 Ų79.968%0.68140%0.398SS*.Hα-helixtrans-68.2-41.5174.3-66.1171.5000111.7K815 R816 K821 A822K815-L819 PolarHBondContact O-N 3.25Å; R816-L819 PolarHBondContact O-N 3.01Å; L819-K821 VanDerWaalsContact C-N 3.33Å; L819-K821 PolarHBondContact O-N 2.87Å; L819-A822 PolarHBondContact O-N 3.09Å
820E91.3Very high88.9Confident61 Ų6181 Ų8129%0.28540%0.398SS..Hα-helixtrans-62.6-39178.6-168.3-178.4147.100112Y446 R816 L817 A822 V823 I824Y446-E820 HydrophobicContact CE1-CB 4.33Å; Y446-E820 HydrophobicContact CE1-CG 4.25Å; Y446-E820 PolarHBondContact OH-OE1 3.24Å; R816-E820 IonicContact NH1-OE2 2.7Å; R816-E820 PolarHBondContact NH1-OE2 2.92Å; R816-E820 WeakPolarHBondContact O-CB 3.17Å; R816-E820 PolarHBondContact O-N 3.47Å; L817-E820 PolarHBondContact O-N 3.4Å; E820-A822 VanDerWaalsContact C-N 3.34Å; E820-A822 PolarHBondContact O-N 2.93Å; E820-V823 PolarHBondContact O-N 3Å; E820-V823 VanDerWaalsContact O-N 3.15Å; E820-I824 HydrophobicContact CG-CG1 4.34Å; E820-I824 WeakPolarHBondContact O-CG1 3.26Å; E820-I824 PolarHBondContact O-N 3.43Å
821K91Very high89.3Confident23 Ų2377.7 Ų77.710%0.138%0.377CS..Hα-helixtrans-51.9-50.7176.4179.9-180172.9-175.70111.8E394 R444 Y446 L817 L819 V823 I824 E825E394-K821 IonicContact OE1-NZ 2.85Å; E394-K821 PolarHBondContact OE1-NZ 2.7Å; E394-K821 IonicContact OE2-NZ 3.4Å; E394-K821 PolarHBondContact OE2-NZ 2.99Å; R444-K821 WeakPolarHBondContact O-CE 3.44Å; R444-K821 PolarHBondContact O-NZ 3.39Å; Y446-K821 HydrophobicContact CD1-CB 3.7Å; Y446-K821 HydrophobicContact CD1-CG 4.2Å; Y446-K821 HydrophobicContact CE1-CB 4.41Å; Y446-K821 HydrophobicContact CG-CB 4.16Å; Y446-K821 HydrophobicContact CG-CG 4.16Å; L817-K821 PolarHBondContact O-N 3.41Å; L819-K821 VanDerWaalsContact C-N 3.33Å; L819-K821 PolarHBondContact O-N 2.87Å; K821-V823 VanDerWaalsContact C-N 3.29Å; K821-V823 PolarHBondContact O-N 2.95Å; K821-I824 PolarHBondContact O-N 2.91Å; K821-E825 WeakPolarHBondContact CE-OE1 3.36Å; K821-E825 HydrophobicContact CG-CG 4.35Å; K821-E825 IonicContact NZ-OE1 3.31Å; K821-E825 WeakPolarHBondContact O-CB 3.41Å; K821-E825 WeakPolarHBondContact O-CG 3.37Å; K821-E825 PolarHBondContact O-N 3.22Å
822A89.6Confident89.7Confident61 Ų6174.8 Ų74.850%0.50436%0.363SS..Hα-helixtrans-61.3-38.6-178.500000112.2L819 E820 Q826L819-A822 PolarHBondContact O-N 3.09Å; E820-A822 VanDerWaalsContact C-N 3.34Å; E820-A822 PolarHBondContact O-N 2.93Å; A822-Q826 WeakPolarHBondContact O-CB 3.34Å; A822-Q826 PolarHBondContact O-N 3.25Å
823V93.1Very high89.5Confident94 Ų9475.6 Ų75.657%0.5737%0.369SS*.Hα-helixtrans-66.2-45.4177.2178.60000111E820 K821 Q826 H827E820-V823 PolarHBondContact O-N 3Å; E820-V823 VanDerWaalsContact O-N 3.15Å; K821-V823 VanDerWaalsContact C-N 3.29Å; K821-V823 PolarHBondContact O-N 2.95Å; V823-Q826 PolarHBondContact O-N 2.73Å; V823-H827 WeakPolarHBondContact O-CB 3.48Å; V823-H827 PolarHBondContact O-N 3.02Å
824I91.3Very high88.4Confident51 Ų5178.5 Ų78.526%0.26238%0.384SS..Hα-helixtrans-66.8-41.4179.1-66.1-63.6000111.3Y446 E820 K821 Q826 H827 N828Y446-I824 HydrophobicContact CD2-CG2 4.5Å; Y446-I824 HydrophobicContact CE2-CB 4.35Å; Y446-I824 HydrophobicContact CE2-CG1 4.2Å; Y446-I824 HydrophobicContact CE2-CG2 4.12Å; E820-I824 HydrophobicContact CG-CG1 4.34Å; E820-I824 WeakPolarHBondContact O-CG1 3.26Å; E820-I824 PolarHBondContact O-N 3.43Å; K821-I824 PolarHBondContact O-N 2.91Å; I824-Q826 VanDerWaalsContact C-N 3.35Å; I824-Q826 PolarHBondContact O-N 3.48Å; I824-H827 WeakPolarHBondContact O-CB 3.36Å; I824-H827 PolarHBondContact O-N 2.96Å; I824-N828 WeakPolarHBondContact O-CB 3.44Å; I824-N828 VanDerWaalsContact O-CG 3.3Å; I824-N828 PolarHBondContact O-N 3.25Å
825E90.4Very high87.1Confident65 Ų6581.3 Ų81.330%0.30440%0.396SS..Hα-helixtrans-62.4-43176.2-76180169.800111.9K821 H827 N828 K829K821-E825 WeakPolarHBondContact CE-OE1 3.36Å; K821-E825 HydrophobicContact CG-CG 4.35Å; K821-E825 IonicContact NZ-OE1 3.31Å; K821-E825 WeakPolarHBondContact O-CB 3.41Å; K821-E825 WeakPolarHBondContact O-CG 3.37Å; K821-E825 PolarHBondContact O-N 3.22Å; E825-H827 VanDerWaalsContact C-N 3.33Å; E825-N828 PolarHBondContact O-N 3.2Å; E825-K829 WeakPolarHBondContact O-CB 3.47Å; E825-K829 VanDerWaalsContact O-CG 3.31Å; E825-K829 WeakPolarHBondContact O-CG 3.36Å; E825-K829 PolarHBondContact O-N 3.48Å
826Q92.3Very high85.2Confident110 Ų11080.6 Ų80.651%0.51441%0.406SS..Hα-helixtrans-63.6-41174.6-169.9-174.612.400111.5A822 V823 I824 K830A822-Q826 WeakPolarHBondContact O-CB 3.34Å; A822-Q826 PolarHBondContact O-N 3.25Å; V823-Q826 PolarHBondContact O-N 2.73Å; I824-Q826 VanDerWaalsContact C-N 3.35Å; I824-Q826 PolarHBondContact O-N 3.48Å; Q826-K830 WeakPolarHBondContact O-CG 3.47Å; Q826-K830 PolarHBondContact O-N 3.47Å
827H92.1Very high82.7Confident100 Ų10077.8 Ų77.846%0.46341%0.409SS..Hα-helixtrans-61.3-49.1176.5-178.973.6000111.7V823 I824 E825 K829 K830 L831V823-H827 WeakPolarHBondContact O-CB 3.48Å; V823-H827 PolarHBondContact O-N 3.02Å; I824-H827 WeakPolarHBondContact O-CB 3.36Å; I824-H827 PolarHBondContact O-N 2.96Å; E825-H827 VanDerWaalsContact C-N 3.33Å; H827-K829 PolarHBondContact O-N 3.06Å; H827-K830 WeakPolarHBondContact O-CB 3.45Å; H827-K830 PolarHBondContact O-N 2.98Å; H827-L831 PolarHBondContact O-N 3.44Å
828N92.9Very high80.4Confident12 Ų1283.1 Ų83.16%0.06445%0.446CS..Hα-helixtrans-62.3-43.1179-69.9-10.6000111.6A504 I824 E825 K830 L831 E832A504-N828 HydrophobicContact CB-CB 3.95Å; I824-N828 WeakPolarHBondContact O-CB 3.44Å; I824-N828 VanDerWaalsContact O-CG 3.3Å; I824-N828 PolarHBondContact O-N 3.25Å; E825-N828 PolarHBondContact O-N 3.2Å; N828-K830 VanDerWaalsContact C-N 3.32Å; N828-K830 PolarHBondContact O-N 3.37Å; N828-L831 PolarHBondContact O-N 3.14Å; N828-E832 WeakPolarHBondContact O-CG 3.17Å; N828-E832 PolarHBondContact O-N 3.05Å
829K90.6Very high78Confident140 Ų14085.1 Ų85.161%0.60946%0.461SS*.Hα-helixtrans-59.7-40.8175-75.1177.9-178.4-177.90112.2E825 H827 L831 E832 S833E825-K829 WeakPolarHBondContact O-CB 3.47Å; E825-K829 VanDerWaalsContact O-CG 3.31Å; E825-K829 WeakPolarHBondContact O-CG 3.36Å; E825-K829 PolarHBondContact O-N 3.48Å; H827-K829 PolarHBondContact O-N 3.06Å; K829-L831 VanDerWaalsContact C-N 3.34Å; K829-E832 PolarHBondContact O-N 3.43Å; K829-S833 VanDerWaalsContact O-CB 3.29Å; K829-S833 WeakPolarHBondContact O-CB 3.27Å; K829-S833 PolarHBondContact O-N 3.46Å; K829-S833 PolarHBondContact O-OG 3.07Å
830K91.9Very high75.3Confident103 Ų10388.9 Ų88.945%0.44847%0.472SS..Hα-helixtrans-64.9-36.3176.3-75.8177.5179.4-174.10112.5Q826 H827 N828 S833 K834Q826-K830 WeakPolarHBondContact O-CG 3.47Å; Q826-K830 PolarHBondContact O-N 3.47Å; H827-K830 WeakPolarHBondContact O-CB 3.45Å; H827-K830 PolarHBondContact O-N 2.98Å; N828-K830 VanDerWaalsContact C-N 3.32Å; N828-K830 PolarHBondContact O-N 3.37Å; K830-S833 PolarHBondContact O-OG 3.24Å; K830-K834 WeakPolarHBondContact O-CB 3.44Å; K830-K834 VanDerWaalsContact O-CG 3.23Å; K830-K834 WeakPolarHBondContact O-CG 3.38Å; K830-K834 PolarHBondContact O-N 3.1Å
831L88.5Confident72.5Confident54 Ų5495 Ų9528%0.28350%0.501SS..Hα-helixtrans-66-48.8175.2-70.1175.9000110.6A504 Y547 H827 N828 K829 S833 K834A504-L831 HydrophobicContact CB-CB 4.11Å; A504-L831 HydrophobicContact CB-CD1 4.13Å; Y547-L831 HydrophobicContact CD1-CB 4.33Å; Y547-L831 HydrophobicContact CD1-CD1 4.33Å; Y547-L831 HydrophobicContact CE1-CB 3.91Å; H827-L831 PolarHBondContact O-N 3.44Å; N828-L831 PolarHBondContact O-N 3.14Å; K829-L831 VanDerWaalsContact C-N 3.34Å; L831-S833 VanDerWaalsContact C-N 3.35Å; L831-S833 PolarHBondContact O-N 3.04Å; L831-K834 PolarHBondContact O-N 2.99Å
832E88.8Confident69.5Low57 Ų5797 Ų9727%0.26652%0.522SS..Hα-helixtrans-67.3-32.2-178.9-67.8166.2167.500112.4R443 A504 N828 K829 S836R443-E832 IonicContact CZ-OE1 2.76Å; R443-E832 IonicContact CZ-OE2 3.82Å; R443-E832 IonicContact NH1-OE1 3.82Å; R443-E832 PolarHBondContact NH1-OE1 3.1Å; R443-E832 IonicContact NH1-OE2 3.98Å; R443-E832 PolarHBondContact NH1-OE2 3.44Å; R443-E832 IonicContact NH2-OE1 3.48Å; R443-E832 PolarHBondContact NH2-OE1 3.24Å; R443-E832 IonicContact NH2-OE2 2.87Å; R443-E832 PolarHBondContact NH2-OE2 2.78Å; A504-E832 HydrophobicContact CB-CG 3.87Å; A504-E832 PolarHBondContact N-OE1 3.23Å; A504-E832 VanDerWaalsContact N-OE1 3.09Å; N828-E832 WeakPolarHBondContact O-CG 3.17Å; N828-E832 PolarHBondContact O-N 3.05Å; K829-E832 PolarHBondContact O-N 3.43Å; E832-S836 PolarHBondContact O-OG 3.32Å
833S80.6Confident66.7Low68 Ų6898.6 Ų98.648%0.47654%0.535SS..Hα-helixtrans-78-32.617972.90000113.7K829 K830 L831 E835 S836K829-S833 VanDerWaalsContact O-CB 3.29Å; K829-S833 WeakPolarHBondContact O-CB 3.27Å; K829-S833 PolarHBondContact O-N 3.46Å; K829-S833 PolarHBondContact O-OG 3.07Å; K830-S833 PolarHBondContact O-OG 3.24Å; L831-S833 VanDerWaalsContact C-N 3.35Å; L831-S833 PolarHBondContact O-N 3.04Å; S833-E835 PolarHBondContact O-N 3.25Å; S833-S836 PolarHBondContact O-N 3.02Å; S833-S836 PolarHBondContact O-OG 3.05Å; S833-S836 VanDerWaalsContact O-OG 3.08Å
834K64.9Low63.8Low163 Ų163103.1 Ų103.171%0.70955%0.55SS**Hα-helixtrans-66.8-19-179.9-81.8178.5178.1-171.20113.2K830 L831K830-K834 WeakPolarHBondContact O-CB 3.44Å; K830-K834 VanDerWaalsContact O-CG 3.23Å; K830-K834 WeakPolarHBondContact O-CG 3.38Å; K830-K834 PolarHBondContact O-N 3.1Å; L831-K834 PolarHBondContact O-N 2.99Å
835E56.9Low60.9Low96 Ų96106.3 Ų106.345%0.44957%0.572SS.*THydrogen-bonded Turntrans-99.6-10.7-178.7-68.5176.4153.900113.4Y547 Q548 S833Y547-E835 PolarHBondContact OH-OE2 3.22Å; Q548-E835 PolarHBondContact NE2-OE2 3.1Å; Q548-E835 PolarHBondContact OE1-OE1 3.41Å; S833-E835 PolarHBondContact O-N 3.25Å
836S47.3Very low58.1Low102 Ų102111.2 Ų111.271%0.71360%0.595SS**SBendtrans-91.4-2.8179.849.50000115.5E832 S833E832-S836 PolarHBondContact O-OG 3.32Å; S833-S836 PolarHBondContact O-N 3.02Å; S833-S836 PolarHBondContact O-OG 3.05Å; S833-S836 VanDerWaalsContact O-OG 3.08Å
837G38.3Very low55.2Low42 Ų42110.6 Ų110.643%0.43361%0.608SS.*SBendtrans-178.9115.5176.300000117.9D839G837-D839 PolarHBondContact O-N 2.95Å
838S41.8Very low52.5Low118 Ų118113.1 Ų113.183%0.82562%0.624SS**  trans43.7-1141.3800000126.1K840S838-K840 PolarHBondContact O-N 3.5Å
839D34Very low49.4Very low137 Ų137118.8 Ų118.873%0.73366%0.659SS**  trans-104.375.5-176.6-75.2-15.5000114.1G837 Q841G837-D839 PolarHBondContact O-N 2.95Å; D839-Q841 PolarHBondContact O-N 2.99Å; D839-Q841 VanDerWaalsContact O-N 3.1Å
840K33.9Very low46.4Very low210 Ų210121 Ų12191%0.91367%0.671SS**THydrogen-bonded Turntrans-69.713.8169.3-91.9-173.8176.7-178.90114.7S838S838-K840 PolarHBondContact O-N 3.5Å
841Q31.6Very low43.6Very low188 Ų188121.8 Ų121.888%0.87969%0.687SS**THydrogen-bonded Turntrans-122.8-1.9-173.6-87.2-179.9-12.300116.9D839D839-Q841 PolarHBondContact O-N 2.99Å; D839-Q841 VanDerWaalsContact O-N 3.1Å
842A29.3Very low40.7Very low66 Ų66128.1 Ų128.155%0.54572%0.715SS.*SBendtrans-99.7-6179.700000115E844A842-E844 VanDerWaalsContact C-N 3.32Å; A842-E844 PolarHBondContact O-N 3.48Å
843A30.9Very low38.1Very low94 Ų94131.1 Ų131.178%0.77774%0.74SS**THydrogen-bonded Turntrans-78.9-7.4-171.600000115.1
844E32Very low35.7Very low190 Ų190132.8 Ų132.889%0.88875%0.752SS**THydrogen-bonded Turntrans-96.7-1.6-179.3-72.3-174.616700114.3A842A842-E844 VanDerWaalsContact C-N 3.32Å; A842-E844 PolarHBondContact O-N 3.48Å
845T29.4Very low34.3Very low118 Ų118131 Ų13172%0.72476%0.756SS**SBendtrans-116.7-6.6-172.9-22.40000115.9
846E31.7Very low33.1Very low168 Ų168136.3 Ų136.379%0.78578%0.778SS**SBendtrans-98.68.9178.6-73.8-170.8164.300114.7I848E846-I848 PolarHBondContact O-N 3.13Å
847A31.1Very low32.6Very low96 Ų96143 Ų14379%0.79379%0.788SS**SBendtrans-75.13.7176.500000114.4
848I35.6Very low32.4Very low154 Ų154145.6 Ų145.679%0.7981%0.805SS**SBendtrans-132.776.8-178.5-48.2175.3000109.4E846E846-I848 PolarHBondContact O-N 3.13Å
849T27.4Very low32Very low130 Ų130151.3 Ų151.380%0.79881%0.808SS**  trans-166.785.4149.89.90000108
850E29.3Very low32.2Very low186 Ų186153.9 Ų153.987%0.86982%0.816SS**PPolyproline II helixtrans-62.6130.1161.9-69.3-170.5162.600108.4E852E850-E852 PolarHBondContact O-N 3.42Å
851P31.5Very low32.4Very low121 Ų121152.5 Ų152.579%0.78681%0.813SS**PPolyproline II helixtrans-68.7130.5166.828-29.5000108.5
852E29.1Very low33.1Very low186 Ų186147.3 Ų147.387%0.86979%0.794SS**PPolyproline II helixtrans-47.4136.2178.8-74.1-177.5144.100112.2E850 S854E850-E852 PolarHBondContact O-N 3.42Å; E852-S854 PolarHBondContact O-N 3Å
853P32.9Very low34.2Very low120 Ų120147 Ų14778%0.77979%0.788SS**PPolyproline II helixtrans-69.2121.9171.227-30.1000109.7
854S31.4Very low35.4Very low104 Ų104145.3 Ų145.373%0.72777%0.774SS**PPolyproline II helixtrans-47.1142.4169.854.30000111.8E852 K856E852-S854 PolarHBondContact O-N 3Å; S854-K856 PolarHBondContact O-N 3.36Å
855P35.8Very low36.6Very low125 Ų125142.2 Ų142.281%0.81276%0.764SS**PPolyproline II helixtrans-61.1135.1-172.224-32.1000111.4R857P855-R857 PolarHBondContact O-N 3.4Å
856K31.6Very low38Very low207 Ų207142.2 Ų142.290%0.976%0.755SS**  trans-42.9119.4174.4-73.7174.2175174.30110.4S854 A858S854-K856 PolarHBondContact O-N 3.36Å; K856-A858 PolarHBondContact O-N 2.77Å
857R36.3Very low39.3Very low244 Ų244138.7 Ų138.792%0.92174%0.739SS**PPolyproline II helixtrans-56.1130.1159-90.9-177.3178.5173.2-0.2108P855 R859P855-R857 PolarHBondContact O-N 3.4Å; R857-R859 PolarHBondContact O-N 2.85Å
858A33.5Very low41.1Very low96 Ų96142 Ų14279%0.79373%0.732SS**PPolyproline II helixtrans-54.6132.9171.400000109.4K856 Q860K856-A858 PolarHBondContact O-N 2.77Å; A858-Q860 PolarHBondContact O-N 3Å
859R32.9Very low42.6Very low237 Ų237140.5 Ų140.589%0.89472%0.721SS**PPolyproline II helixtrans-59.3116.1173.3-151.4178.1-169.8-179.11.1106.7R857 E861R857-R859 PolarHBondContact O-N 2.85Å; R859-E861 PolarHBondContact O-N 3.44Å; R859-E861 VanDerWaalsContact O-N 3.13Å
860Q38.7Very low44.6Very low191 Ų191142.2 Ų142.289%0.89371%0.713SS**  trans-66.3108.6163.2-97.6175.1-30.500106.2A858 T862A858-Q860 PolarHBondContact O-N 3Å; Q860-T862 PolarHBondContact O-N 3.37Å
861E39.4Very low46.7Very low182 Ų182139.5 Ų139.585%0.8570%0.701SS**PPolyproline II helixtrans-61.8119.8167-71.8178.6163.500107.4R859 S863R859-E861 PolarHBondContact O-N 3.44Å; R859-E861 VanDerWaalsContact O-N 3.13Å; E861-S863 PolarHBondContact O-N 3.39Å
862T44.9Very low49Very low78 Ų78139.1 Ų139.148%0.47969%0.691SS.*PPolyproline II helixtrans-56.1133.5168.330.90000108.4Q860 A864Q860-T862 PolarHBondContact O-N 3.37Å; T862-A864 PolarHBondContact O-N 2.89Å
863S53.4Low51.2Low59 Ų59135.3 Ų135.341%0.41367%0.673SS.*PPolyproline II helixtrans-60.6138.6-179.365.30000109.3E861 D865 E866E861-S863 PolarHBondContact O-N 3.39Å; S863-D865 PolarHBondContact O-N 3.33Å; S863-E866 PolarHBondContact O-N 3.06Å; S863-E866 WeakPolarHBondContact OG-CG 3.45Å
864A55.5Low53.2Low59 Ų59133.4 Ų133.449%0.48866%0.659SS.*Hα-helixtrans-55-31.6-176.600000112.4T862 E866 E867 Y868T862-A864 PolarHBondContact O-N 2.89Å; A864-E866 PolarHBondContact O-N 3.46Å; A864-E867 PolarHBondContact O-N 3.12Å; A864-Y868 HydrophobicContact CB-CE2 4.2Å; A864-Y868 WeakPolarHBondContact O-CD2 3.48Å; A864-Y868 PolarHBondContact O-N 3.36Å
865D57.7Low55.5Low126 Ų126130.8 Ų130.867%0.67464%0.644SS**Hα-helixtrans-63-37.8177.7-76.1-16.3000113S863 E867 Y868 E869S863-D865 PolarHBondContact O-N 3.33Å; D865-E867 VanDerWaalsContact C-N 3.33Å; D865-E867 PolarHBondContact O-N 3.24Å; D865-Y868 PolarHBondContact O-N 2.93Å; D865-E869 PolarHBondContact O-N 2.98Å
866E59.3Low57.4Low117 Ų117129.8 Ų129.855%0.54763%0.628SS.*Hα-helixtrans-68.5-32.3176.7-73.8176-171.700112.1S863 A864 R870S863-E866 PolarHBondContact O-N 3.06Å; S863-E866 WeakPolarHBondContact OG-CG 3.45Å; A864-E866 PolarHBondContact O-N 3.46Å; E866-R870 VanDerWaalsContact O-CB 3.29Å; E866-R870 WeakPolarHBondContact O-CB 3.46Å; E866-R870 PolarHBondContact O-N 3.14Å
867E59.3Low59.3Low94 Ų94123.5 Ų123.544%0.43961%0.61SS.*Hα-helixtrans-70.2-43.6173.4-78-171.3159.800111.7A864 D865 E869 R870 H871A864-E867 PolarHBondContact O-N 3.12Å; D865-E867 VanDerWaalsContact C-N 3.33Å; D865-E867 PolarHBondContact O-N 3.24Å; E867-E869 VanDerWaalsContact C-N 3.34Å; E867-E869 PolarHBondContact O-N 2.78Å; E867-R870 PolarHBondContact O-N 3.26Å; E867-H871 PolarHBondContact O-CD2 3.21Å; E867-H871 PolarHBondContact O-N 3.23Å
868Y67.8Low61.3Low166 Ų166115.1 Ų115.165%0.65159%0.589SS**Hα-helixtrans-59.1-45.4174.2-74.5-69.1000111.5A864 D865 H871 I872A864-Y868 HydrophobicContact CB-CE2 4.2Å; A864-Y868 WeakPolarHBondContact O-CD2 3.48Å; A864-Y868 PolarHBondContact O-N 3.36Å; D865-Y868 PolarHBondContact O-N 2.93Å; Y868-H871 PolarHBondContact O-N 3.11Å; Y868-I872 WeakPolarHBondContact O-CG1 3.37Å; Y868-I872 PolarHBondContact O-N 3.07Å
869E67.9Low63.5Low122 Ų122114.2 Ų114.257%0.5757%0.571SS**Hα-helixtrans-65.3-42.6179.9-171163.6-169.600112.1D865 E867 H871 I872 Q873D865-E869 PolarHBondContact O-N 2.98Å; E867-E869 VanDerWaalsContact C-N 3.34Å; E867-E869 PolarHBondContact O-N 2.78Å; E869-H871 PolarHBondContact O-N 3.21Å; E869-I872 PolarHBondContact O-N 3.09Å; E869-Q873 WeakPolarHBondContact O-CB 2.94Å; E869-Q873 WeakPolarHBondContact O-CG 3.34Å; E869-Q873 PolarHBondContact O-N 3.36Å
870R69.3Low65.7Low166 Ų166109.3 Ų109.363%0.62656%0.556SS**Hα-helixtrans-60.4-43.5175.5-178.8-176.8-84.9162.1-3.7111.9E866 E867 T874E866-R870 VanDerWaalsContact O-CB 3.29Å; E866-R870 WeakPolarHBondContact O-CB 3.46Å; E866-R870 PolarHBondContact O-N 3.14Å; E867-R870 PolarHBondContact O-N 3.26Å; R870-T874 WeakPolarHBondContact O-CB 3.36Å; R870-T874 PolarHBondContact O-N 2.83Å; R870-T874 PolarHBondContact O-OG1 2.77Å
871H72.3Confident67.5Low130 Ų130102.9 Ų102.960%0.60254%0.535SS*.Hα-helixtrans-66.8-39.9179.1-77.2-60.1000112.2E867 Y868 E869 T874 A875E867-H871 PolarHBondContact O-CD2 3.21Å; E867-H871 PolarHBondContact O-N 3.23Å; Y868-H871 PolarHBondContact O-N 3.11Å; E869-H871 PolarHBondContact O-N 3.21Å; H871-T874 PolarHBondContact O-N 3.06Å; H871-A875 WeakPolarHBondContact O-CB 3.43Å; H871-A875 PolarHBondContact O-N 2.97Å
872I81Confident69.3Low113 Ų11397.3 Ų97.358%0.57951%0.511SS*.Hα-helixtrans-68.4-43.8176.5-67.9-63.7000111.8Y868 E869 T874 A875 Q876Y868-I872 WeakPolarHBondContact O-CG1 3.37Å; Y868-I872 PolarHBondContact O-N 3.07Å; E869-I872 PolarHBondContact O-N 3.09Å; I872-T874 VanDerWaalsContact C-N 3.29Å; I872-T874 PolarHBondContact O-N 3.49Å; I872-A875 PolarHBondContact O-N 3.48Å; I872-Q876 WeakPolarHBondContact O-CB 3.36Å; I872-Q876 PolarHBondContact O-N 2.88Å
873Q73.4Confident70.8Confident106 Ų10698.9 Ų98.950%0.49551%0.512SS..Hα-helixtrans-60.6-39.4176.4-80.4-178.1-1.600112.1E869 Q876 S877E869-Q873 WeakPolarHBondContact O-CB 2.94Å; E869-Q873 WeakPolarHBondContact O-CG 3.34Å; E869-Q873 PolarHBondContact O-N 3.36Å; Q873-Q876 PolarHBondContact O-N 3.05Å; Q873-S877 WeakPolarHBondContact O-CB 3.5Å; Q873-S877 PolarHBondContact O-N 3.26Å; Q873-S877 PolarHBondContact O-OG 3.16Å
874T76.1Confident71.8Confident79 Ų7998.5 Ų98.549%0.48551%0.513SS..Hα-helixtrans-65.9-44.3177.1-55.60000111.4R870 H871 I872 S877 S878R870-T874 WeakPolarHBondContact O-CB 3.36Å; R870-T874 PolarHBondContact O-N 2.83Å; R870-T874 PolarHBondContact O-OG1 2.77Å; H871-T874 PolarHBondContact O-N 3.06Å; I872-T874 VanDerWaalsContact C-N 3.29Å; I872-T874 PolarHBondContact O-N 3.49Å; T874-S877 PolarHBondContact O-N 3.48Å; T874-S878 WeakPolarHBondContact O-CB 3.46Å; T874-S878 PolarHBondContact O-N 3.07Å; T874-S878 PolarHBondContact O-OG 3.37Å
875A79.1Confident72.6Confident49 Ų49100.5 Ų100.541%0.40552%0.515SS..Hα-helixtrans-63.5-42.9176.500000112H871 I872 S878 L879H871-A875 WeakPolarHBondContact O-CB 3.43Å; H871-A875 PolarHBondContact O-N 2.97Å; I872-A875 PolarHBondContact O-N 3.48Å; A875-S878 PolarHBondContact O-N 3.01Å; A875-L879 PolarHBondContact O-N 3.41Å
876Q76.5Confident73.2Confident104 Ų10497.8 Ų97.849%0.48650%0.503SS..Hα-helixtrans-66.1-41.1179.8-162.9179.59.200112I872 Q873 S878 L879 K880I872-Q876 WeakPolarHBondContact O-CB 3.36Å; I872-Q876 PolarHBondContact O-N 2.88Å; Q873-Q876 PolarHBondContact O-N 3.05Å; Q876-S878 VanDerWaalsContact C-N 3.34Å; Q876-L879 PolarHBondContact O-N 3.36Å; Q876-K880 WeakPolarHBondContact O-CG 3.46Å; Q876-K880 PolarHBondContact O-N 2.99Å
877S71.7Confident73.4Confident75 Ų7598.1 Ų98.152%0.52451%0.505SS..Hα-helixtrans-63.7-41175.9-58.10000111.5Q873 T874 K880 A881Q873-S877 WeakPolarHBondContact O-CB 3.5Å; Q873-S877 PolarHBondContact O-N 3.26Å; Q873-S877 PolarHBondContact O-OG 3.16Å; T874-S877 PolarHBondContact O-N 3.48Å; S877-K880 PolarHBondContact O-N 3.04Å; S877-A881 PolarHBondContact O-N 3.41Å
878S77.6Confident73.3Confident69 Ų6997.1 Ų97.148%0.48351%0.508SS..Hα-helixtrans-65.6-40.8177.3-57.70000112.3T874 A875 Q876 A881 L882T874-S878 WeakPolarHBondContact O-CB 3.46Å; T874-S878 PolarHBondContact O-N 3.07Å; T874-S878 PolarHBondContact O-OG 3.37Å; A875-S878 PolarHBondContact O-N 3.01Å; Q876-S878 VanDerWaalsContact C-N 3.34Å; S878-A881 PolarHBondContact O-N 3.33Å; S878-L882 WeakPolarHBondContact O-CB 3.38Å; S878-L882 PolarHBondContact O-N 2.93Å
879L79.8Confident72.7Confident77 Ų7795.5 Ų95.540%0.40350%0.504SS..Hα-helixtrans-67.2-37.8175.4-76.1168.5000112.5A875 Q876 L882 H883 L904A875-L879 PolarHBondContact O-N 3.41Å; Q876-L879 PolarHBondContact O-N 3.36Å; L879-L882 PolarHBondContact O-N 3.33Å; L879-H883 PolarHBondContact O-N 3.01Å; L879-L904 HydrophobicContact CD2-CD2 4.5Å
880K78.6Confident72Confident134 Ų13493.9 Ų93.958%0.58351%0.512SS*.Hα-helixtrans-63.1-43.1173.5-75.6176.2178.9177.60111.8Q876 S877 L882 H883 A884Q876-K880 WeakPolarHBondContact O-CG 3.46Å; Q876-K880 PolarHBondContact O-N 2.99Å; S877-K880 PolarHBondContact O-N 3.04Å; K880-L882 VanDerWaalsContact C-N 3.3Å; K880-L882 PolarHBondContact O-N 3.28Å; K880-H883 WeakPolarHBondContact O-CB 3.27Å; K880-H883 PolarHBondContact O-N 2.84Å; K880-A884 PolarHBondContact O-N 3.37Å
881A76.9Confident71.3Confident55 Ų5590.6 Ų90.646%0.45551%0.514SS..Hα-helixtrans-62.4-38.9174.800000111.9S877 S878 A884 L885S877-A881 PolarHBondContact O-N 3.41Å; S878-A881 PolarHBondContact O-N 3.33Å; A881-A884 PolarHBondContact O-N 3.01Å; A881-L885 WeakPolarHBondContact O-CG 3.29Å; A881-L885 PolarHBondContact O-N 3.48Å; A881-L885 VanDerWaalsContact O-N 3.07Å
882L78.1Confident70.5Confident66 Ų6690.9 Ų90.935%0.34652%0.518SS..Hα-helixtrans-68.2-37.3176.4-156.4118.4000112.3S878 L879 K880 L885 V886 L900 L904S878-L882 WeakPolarHBondContact O-CB 3.38Å; S878-L882 PolarHBondContact O-N 2.93Å; L879-L882 PolarHBondContact O-N 3.33Å; K880-L882 VanDerWaalsContact C-N 3.3Å; K880-L882 PolarHBondContact O-N 3.28Å; L882-L885 WeakPolarHBondContact O-CB 3.29Å; L882-L885 PolarHBondContact O-N 2.73Å; L882-V886 WeakPolarHBondContact O-CG2 3.3Å; L882-V886 PolarHBondContact O-N 3.47Å; L882-V886 VanDerWaalsContact O-N 3.13Å; L882-L900 HydrophobicContact CD2-CD1 4.24Å; L882-L904 HydrophobicContact CD2-CD2 4.27Å
883H75.4Confident69.2Low110 Ų11093 Ų9351%0.50954%0.536SS..Hα-helixtrans-61.8-46.1172.1-169-89.2000111.5L879 K880 L885 V886 E887L879-H883 PolarHBondContact O-N 3.01Å; K880-H883 WeakPolarHBondContact O-CB 3.27Å; K880-H883 PolarHBondContact O-N 2.84Å; H883-L885 VanDerWaalsContact C-N 3.25Å; H883-L885 PolarHBondContact O-N 3.1Å; H883-V886 PolarHBondContact O-N 2.97Å; H883-E887 IonicContact CE1-OE1 3.25Å; H883-E887 PolarHBondContact CE1-OE1 3.3Å; H883-E887 VanDerWaalsContact CE1-OE1 3.25Å; H883-E887 IonicContact CE1-OE2 3.33Å; H883-E887 PolarHBondContact CE1-OE2 2.9Å; H883-E887 VanDerWaalsContact ND1-CD 3.35Å; H883-E887 IonicContact ND1-OE1 3.83Å; H883-E887 IonicContact ND1-OE2 3.04Å; H883-E887 PolarHBondContact ND1-OE2 2.91Å; H883-E887 PolarHBondContact O-N 3.31Å
884A75.4Confident68.4Low52 Ų5291 Ų9143%0.4354%0.537SS..Hα-helixtrans-61.6-32.6176.600000112.7K880 A881 S888K880-A884 PolarHBondContact O-N 3.37Å; A881-A884 PolarHBondContact O-N 3.01Å; A884-S888 VanDerWaalsContact O-CB 3.25Å; A884-S888 WeakPolarHBondContact O-CB 3.5Å; A884-S888 PolarHBondContact O-N 3.32Å; A884-S888 PolarHBondContact O-OG 3.47Å
885L72.6Confident67.8Low101 Ų10192.6 Ų92.653%0.52955%0.549SS..Hα-helixtrans-70.3-32.6173.3-79.7163.3000113.1A881 L882 H883 S888 K889A881-L885 WeakPolarHBondContact O-CG 3.29Å; A881-L885 PolarHBondContact O-N 3.48Å; A881-L885 VanDerWaalsContact O-N 3.07Å; L882-L885 WeakPolarHBondContact O-CB 3.29Å; L882-L885 PolarHBondContact O-N 2.73Å; H883-L885 VanDerWaalsContact C-N 3.25Å; H883-L885 PolarHBondContact O-N 3.1Å; L885-S888 PolarHBondContact O-OG 3.33Å; L885-K889 WeakPolarHBondContact O-CB 3.49Å; L885-K889 WeakPolarHBondContact O-CG 3.42Å; L885-K889 PolarHBondContact O-N 2.88Å
886V68.4Low67.2Low69 Ų6994.1 Ų94.142%0.41856%0.555SS.*Hα-helixtrans-77.2-39.4175.9174.80000110.9L882 H883 A890 L900L882-V886 WeakPolarHBondContact O-CG2 3.3Å; L882-V886 PolarHBondContact O-N 3.47Å; L882-V886 VanDerWaalsContact O-N 3.13Å; H883-V886 PolarHBondContact O-N 2.97Å; V886-A890 PolarHBondContact O-N 2.96Å; V886-L900 HydrophobicContact CG2-CD2 4.24Å
887E64.9Low67.2Low124 Ų12492.2 Ų92.258%0.57955%0.551SS**Hα-helixtrans-70.1-43.3175.7-80.4-176.3140.500112.9H883 K889 A890H883-E887 IonicContact CE1-OE1 3.25Å; H883-E887 PolarHBondContact CE1-OE1 3.3Å; H883-E887 VanDerWaalsContact CE1-OE1 3.25Å; H883-E887 IonicContact CE1-OE2 3.33Å; H883-E887 PolarHBondContact CE1-OE2 2.9Å; H883-E887 VanDerWaalsContact ND1-CD 3.35Å; H883-E887 IonicContact ND1-OE1 3.83Å; H883-E887 IonicContact ND1-OE2 3.04Å; H883-E887 PolarHBondContact ND1-OE2 2.91Å; H883-E887 PolarHBondContact O-N 3.31Å; E887-K889 PolarHBondContact O-N 3.29Å; E887-A890 VanDerWaalsContact O-CB 3.3Å; E887-A890 WeakPolarHBondContact O-CB 3.49Å; E887-A890 PolarHBondContact O-N 3.07Å; E887-A890 VanDerWaalsContact O-N 3.09Å
888S57.6Low67.2Low72 Ų7294.1 Ų94.150%0.50357%0.565SS.*Hα-helixtrans-64.8-30.417962.30000112.7A884 L885 A890 S891A884-S888 VanDerWaalsContact O-CB 3.25Å; A884-S888 WeakPolarHBondContact O-CB 3.5Å; A884-S888 PolarHBondContact O-N 3.32Å; A884-S888 PolarHBondContact O-OG 3.47Å; L885-S888 PolarHBondContact O-OG 3.33Å; S888-A890 VanDerWaalsContact C-N 3.35Å; S888-S891 PolarHBondContact O-OG 3.04Å; S888-S891 VanDerWaalsContact O-OG 3.08Å
889K54.5Low67.4Low132 Ų13298.2 Ų98.257%0.57457%0.57SS**G310 helixtrans-82.3-4.5175.2-72.9-173.4177.5-176.30114.4L885 E887 S891 M892L885-K889 WeakPolarHBondContact O-CB 3.49Å; L885-K889 WeakPolarHBondContact O-CG 3.42Å; L885-K889 PolarHBondContact O-N 2.88Å; E887-K889 PolarHBondContact O-N 3.29Å; K889-S891 PolarHBondContact O-N 3.13Å; K889-M892 PolarHBondContact O-N 3.01Å
890A53.5Low67.4Low88 Ų8895.8 Ų95.873%0.72756%0.557SS**G310 helixtrans-68.1-12171.600000113.3V886 E887 S888V886-A890 PolarHBondContact O-N 2.96Å; E887-A890 VanDerWaalsContact O-CB 3.3Å; E887-A890 WeakPolarHBondContact O-CB 3.49Å; E887-A890 PolarHBondContact O-N 3.07Å; E887-A890 VanDerWaalsContact O-N 3.09Å; S888-A890 VanDerWaalsContact C-N 3.35Å
891S53.4Low67.3Low98 Ų9896.7 Ų96.769%0.68556%0.561SS**G310 helixtrans-91.3-4.3173.669.90000114.6S888 K889S888-S891 PolarHBondContact O-OG 3.04Å; S888-S891 VanDerWaalsContact O-OG 3.08Å; K889-S891 PolarHBondContact O-N 3.13Å
892M55.1Low67.5Low136 Ų13696.5 Ų96.567%0.6756%0.559SS**SBendtrans-125.3136.2179.2-72.1-86.491.200109.6K889 A894K889-M892 PolarHBondContact O-N 3.01Å; M892-A894 PolarHBondContact O-N 3.29Å
893T55.8Low67.6Low157 Ų15798.9 Ų98.996%0.96357%0.567SS**SBendtrans-68.326.8-170.942.10000116
894A56.5Low67.9Low64 Ų6496.8 Ų96.853%0.52956%0.559SS.*  trans-106.1116.1177.100000110.6M892M892-A894 PolarHBondContact O-N 3.29Å
895P62.2Low68.1Low112 Ų11299.8 Ų99.873%0.72756%0.564SS**PPolyproline II helixtrans-65152.6177.126.6-32.5000111.2
896P67Low68.5Low81 Ų81100.3 Ų100.353%0.52656%0.564SS.*PPolyproline II helixtrans-58.4149.2174.923.5-31.8000110.7S898 L900P896-S898 PolarHBondContact O-N 3.45Å; P896-L900 HydrophobicContact CB-CD2 4.07Å
897P77.1Confident69.1Low64 Ų64101.2 Ų101.242%0.41657%0.566SS.*PPolyproline II helixtrans-54.7135.6-177.6-22.330.8000111.8W899 L900P897-W899 HydrophobicContact CB-CD2 4.15Å; P897-W899 HydrophobicContact CB-CG 4.22Å; P897-W899 HydrophobicContact CB-CZ2 4.03Å; P897-W899 VanDerWaalsContact CB-NE1 3.26Å; P897-W899 HydrophobicContact CG-CZ2 4.14Å; P897-W899 PolarHBondContact O-N 3.4Å; P897-W899 VanDerWaalsContact O-N 3.11Å; P897-L900 WeakPolarHBondContact O-CB 3.48Å; P897-L900 PolarHBondContact O-N 2.99Å
898S70.8Confident69.8Low116 Ų116101.8 Ų101.881%0.81157%0.571SS**Hα-helixtrans-58.9-28.1-175.654.30000113.7P896 L900P896-S898 PolarHBondContact O-N 3.45Å; S898-L900 VanDerWaalsContact C-N 3.34Å
899W81.6Confident70.9Confident155 Ų155101 Ų10159%0.58756%0.563SS**Hα-helixtrans-74.8-19.5176.360.3-102.8000113.8P897 K901 A902 K903P897-W899 HydrophobicContact CB-CD2 4.15Å; P897-W899 HydrophobicContact CB-CG 4.22Å; P897-W899 HydrophobicContact CB-CZ2 4.03Å; P897-W899 VanDerWaalsContact CB-NE1 3.26Å; P897-W899 HydrophobicContact CG-CZ2 4.14Å; P897-W899 PolarHBondContact O-N 3.4Å; P897-W899 VanDerWaalsContact O-N 3.11Å; W899-K901 VanDerWaalsContact C-N 3.32Å; W899-K901 PolarHBondContact O-N 3.44Å; W899-A902 PolarHBondContact O-N 2.94Å; W899-K903 HydrophobicContact CE3-CB 4.36Å; W899-K903 HydrophobicContact CE3-CG 3.93Å; W899-K903 HydrophobicContact CZ3-CG 4.34Å; W899-K903 PolarHBondContact O-N 3.28Å
900L79.8Confident72.1Confident25 Ų2599.7 Ų99.713%0.13156%0.562CS.*Hα-helixtrans-61.8-42.2-175.2-174.562.5000111.2L882 V886 P896 P897 S898 A902 K903 L904L882-L900 HydrophobicContact CD2-CD1 4.24Å; V886-L900 HydrophobicContact CG2-CD2 4.24Å; P896-L900 HydrophobicContact CB-CD2 4.07Å; P897-L900 WeakPolarHBondContact O-CB 3.48Å; P897-L900 PolarHBondContact O-N 2.99Å; S898-L900 VanDerWaalsContact C-N 3.34Å; L900-A902 PolarHBondContact O-N 3.05Å; L900-K903 PolarHBondContact O-N 3.45Å; L900-L904 HydrophobicContact CG-CD1 4.11Å; L900-L904 WeakPolarHBondContact O-CB 3.41Å; L900-L904 WeakPolarHBondContact O-CG 3.34Å; L900-L904 PolarHBondContact O-N 2.9Å
901K77.4Confident73.3Confident153 Ų15399.7 Ų99.767%0.66555%0.548SS*.Hα-helixtrans-62.8-41.7178.1-169.3174.7-178.7178.50111.8W899 L904 Q905W899-K901 VanDerWaalsContact C-N 3.32Å; W899-K901 PolarHBondContact O-N 3.44Å; K901-L904 PolarHBondContact O-N 2.86Å; K901-Q905 WeakPolarHBondContact O-CB 3.39Å; K901-Q905 WeakPolarHBondContact O-CG 3.42Å; K901-Q905 PolarHBondContact O-N 3.19Å
902A80Confident74.5Confident51 Ų51103 Ų10342%0.42155%0.546SS..Hα-helixtrans-65.7-39.5176.900000111.8W899 L900 Q905 Q906W899-A902 PolarHBondContact O-N 2.94Å; L900-A902 PolarHBondContact O-N 3.05Å; A902-Q905 PolarHBondContact O-N 3.38Å; A902-Q906 WeakPolarHBondContact O-CG 3.43Å; A902-Q906 PolarHBondContact O-N 2.87Å
903K80.6Confident75.5Confident116 Ų116101.5 Ų101.550%0.50454%0.537SS..Hα-helixtrans-69.6-39.2176.4-77-72.6173.2-167.10112.9W899 L900 Q905 Q906 L907W899-K903 HydrophobicContact CE3-CB 4.36Å; W899-K903 HydrophobicContact CE3-CG 3.93Å; W899-K903 HydrophobicContact CZ3-CG 4.34Å; W899-K903 PolarHBondContact O-N 3.28Å; L900-K903 PolarHBondContact O-N 3.45Å; K903-Q905 VanDerWaalsContact C-N 3.32Å; K903-Q905 PolarHBondContact O-N 3.3Å; K903-Q906 PolarHBondContact O-N 2.95Å; K903-L907 WeakPolarHBondContact O-CB 3.36Å; K903-L907 PolarHBondContact O-N 2.97Å
904L81.5Confident76.4Confident67 Ų6799.7 Ų99.735%0.35152%0.52SS..Hα-helixtrans-63.9-37.8172.8-72.9171.1000111.6L879 L882 L900 K901 L907 M908L879-L904 HydrophobicContact CD2-CD2 4.5Å; L882-L904 HydrophobicContact CD2-CD2 4.27Å; L900-L904 HydrophobicContact CG-CD1 4.11Å; L900-L904 WeakPolarHBondContact O-CB 3.41Å; L900-L904 WeakPolarHBondContact O-CG 3.34Å; L900-L904 PolarHBondContact O-N 2.9Å; K901-L904 PolarHBondContact O-N 2.86Å; L904-L907 PolarHBondContact O-N 2.93Å; L904-M908 WeakPolarHBondContact O-CG 3.38Å; L904-M908 PolarHBondContact O-N 3.31Å
905Q80Confident76.8Confident114 Ų114101.5 Ų101.553%0.53353%0.525SS..Hα-helixtrans-65.2-41.3172.7-79.2178.4-34.900112.7K901 A902 K903 L907 M908 T909K901-Q905 WeakPolarHBondContact O-CB 3.39Å; K901-Q905 WeakPolarHBondContact O-CG 3.42Å; K901-Q905 PolarHBondContact O-N 3.19Å; A902-Q905 PolarHBondContact O-N 3.38Å; K903-Q905 VanDerWaalsContact C-N 3.32Å; K903-Q905 PolarHBondContact O-N 3.3Å; Q905-L907 VanDerWaalsContact C-N 3.3Å; Q905-L907 PolarHBondContact O-N 3.08Å; Q905-M908 PolarHBondContact O-N 3.42Å; Q905-T909 PolarHBondContact O-N 3.09Å; Q905-T909 PolarHBondContact O-OG1 3.22Å
906Q80.4Confident76.9Confident113 Ų113100 Ų10053%0.52852%0.517SS..Hα-helixtrans-59.1-42.7172-75.7-179.6-11.600111.3A902 K903 T909 L910A902-Q906 WeakPolarHBondContact O-CG 3.43Å; A902-Q906 PolarHBondContact O-N 2.87Å; K903-Q906 PolarHBondContact O-N 2.95Å; Q906-T909 WeakPolarHBondContact O-CB 3.25Å; Q906-T909 PolarHBondContact O-N 2.87Å; Q906-L910 PolarHBondContact O-N 3.44Å
907L82.3Confident76.4Confident87 Ų87101.4 Ų101.446%0.45552%0.524SS..Hα-helixtrans-67.5-40.4179.4-139.5132.7000112K903 L904 Q905 T909 L910 I911K903-L907 WeakPolarHBondContact O-CB 3.36Å; K903-L907 PolarHBondContact O-N 2.97Å; L904-L907 PolarHBondContact O-N 2.93Å; Q905-L907 VanDerWaalsContact C-N 3.3Å; Q905-L907 PolarHBondContact O-N 3.08Å; L907-T909 VanDerWaalsContact C-N 3.29Å; L907-T909 PolarHBondContact O-N 3.25Å; L907-L910 PolarHBondContact O-N 3.48Å; L907-I911 HydrophobicContact CD2-CD1 3.99Å; L907-I911 VanDerWaalsContact O-CG1 3.3Å; L907-I911 WeakPolarHBondContact O-CG1 3.5Å; L907-I911 PolarHBondContact O-N 3.28Å
908M79.3Confident75.1Confident137 Ų137109 Ų10968%0.67554%0.544SS*.Hα-helixtrans-62.3-36.1171.3-75.5-177.872.100112.3L904 Q905 R912L904-M908 WeakPolarHBondContact O-CG 3.38Å; L904-M908 PolarHBondContact O-N 3.31Å; Q905-M908 PolarHBondContact O-N 3.42Å; M908-R912 WeakPolarHBondContact O-CB 3.48Å; M908-R912 PolarHBondContact O-N 3.4Å
909T80.6Confident73.9Confident56 Ų56112.6 Ų112.634%0.34455%0.548SS..Hα-helixtrans-66.6-42.6176.1-50.30000110.5Q905 Q906 L907 R912 E913Q905-T909 PolarHBondContact O-N 3.09Å; Q905-T909 PolarHBondContact O-OG1 3.22Å; Q906-T909 WeakPolarHBondContact O-CB 3.25Å; Q906-T909 PolarHBondContact O-N 2.87Å; L907-T909 VanDerWaalsContact C-N 3.29Å; L907-T909 PolarHBondContact O-N 3.25Å; T909-R912 WeakPolarHBondContact O-CB 3.3Å; T909-R912 PolarHBondContact O-N 3.28Å; T909-E913 WeakPolarHBondContact O-CG 3.16Å; T909-E913 PolarHBondContact O-N 3.47Å
910L78.8Confident72.1Confident104 Ų104110.1 Ų110.155%0.54555%0.554SS.*Hα-helixtrans-65.4-41.9177.1-141112.2000112.2Q906 L907 R912 E913 I914Q906-L910 PolarHBondContact O-N 3.44Å; L907-L910 PolarHBondContact O-N 3.48Å; L910-R912 VanDerWaalsContact C-N 3.3Å; L910-R912 PolarHBondContact O-N 3.49Å; L910-E913 PolarHBondContact O-N 2.95Å; L910-I914 HydrophobicContact CD2-CD1 4.24Å; L910-I914 VanDerWaalsContact O-CG1 3.27Å; L910-I914 WeakPolarHBondContact O-CG1 3.4Å; L910-I914 PolarHBondContact O-N 3.18Å
911I80.2Confident69.8Low87 Ų87119.5 Ų119.545%0.44661%0.613SS.*Hα-helixtrans-60.8-43.5173.2-69.5166.3000110L907 E913 I914 T915L907-I911 HydrophobicContact CD2-CD1 3.99Å; L907-I911 VanDerWaalsContact O-CG1 3.3Å; L907-I911 WeakPolarHBondContact O-CG1 3.5Å; L907-I911 PolarHBondContact O-N 3.28Å; I911-E913 VanDerWaalsContact C-N 3.34Å; I911-E913 PolarHBondContact O-N 3.01Å; I911-I914 PolarHBondContact O-N 3.23Å; I911-T915 PolarHBondContact O-N 3.38Å; I911-T915 PolarHBondContact O-OG1 3.21Å
912R76.9Confident69.4Low168 Ų168117.8 Ų117.863%0.63461%0.61SS**Hα-helixtrans-62.8-41177.4-170.4179.564.9141.62.7111.6M908 T909 L910 T915 S916M908-R912 WeakPolarHBondContact O-CB 3.48Å; M908-R912 PolarHBondContact O-N 3.4Å; T909-R912 WeakPolarHBondContact O-CB 3.3Å; T909-R912 PolarHBondContact O-N 3.28Å; L910-R912 VanDerWaalsContact C-N 3.3Å; L910-R912 PolarHBondContact O-N 3.49Å; R912-T915 VanDerWaalsContact CA-OG1 3.29Å; R912-T915 WeakPolarHBondContact CA-OG1 3.42Å; R912-T915 PolarHBondContact O-N 2.92Å; R912-T915 PolarHBondContact O-OG1 3.38Å; R912-S916 WeakPolarHBondContact O-CB 3.37Å; R912-S916 PolarHBondContact O-N 3.47Å; R912-S916 PolarHBondContact O-OG 2.88Å
913E76.3Confident68.8Low104 Ų104121.3 Ų121.349%0.48662%0.62SS.*Hα-helixtrans-61.5-48.9174.7-76.8169.5-174.400111.1T909 L910 I911 T915 S916 V917T909-E913 WeakPolarHBondContact O-CG 3.16Å; T909-E913 PolarHBondContact O-N 3.47Å; L910-E913 PolarHBondContact O-N 2.95Å; I911-E913 VanDerWaalsContact C-N 3.34Å; I911-E913 PolarHBondContact O-N 3.01Å; E913-T915 VanDerWaalsContact C-N 3.3Å; E913-T915 PolarHBondContact O-N 3.11Å; E913-S916 WeakPolarHBondContact CA-OG 3.48Å; E913-S916 WeakPolarHBondContact O-CA 3.49Å; E913-S916 PolarHBondContact O-N 2.97Å; E913-S916 PolarHBondContact O-OG 3.39Å; E913-V917 VanDerWaalsContact O-CG2 3.29Å; E913-V917 WeakPolarHBondContact O-CG2 3.5Å; E913-V917 PolarHBondContact O-N 2.75Å; E913-V917 VanDerWaalsContact O-N 3.1Å
914I74.6Confident68.2Low119 Ų119121.6 Ų121.661%0.6163%0.626SS**Hα-helixtrans-58-41.5176.2-66.4163.9000111.4L910 I911 S916L910-I914 HydrophobicContact CD2-CD1 4.24Å; L910-I914 VanDerWaalsContact O-CG1 3.27Å; L910-I914 WeakPolarHBondContact O-CG1 3.4Å; L910-I914 PolarHBondContact O-N 3.18Å; I911-I914 PolarHBondContact O-N 3.23Å; I914-S916 VanDerWaalsContact C-N 3.31Å; I914-S916 PolarHBondContact O-N 2.77Å
915T64.9Low67.4Low102 Ų102124.8 Ų124.863%0.62664%0.643SS**Hα-helixtrans-72.3-21.4175.347.20000114.1I911 R912 E913I911-T915 PolarHBondContact O-N 3.38Å; I911-T915 PolarHBondContact O-OG1 3.21Å; R912-T915 VanDerWaalsContact CA-OG1 3.29Å; R912-T915 WeakPolarHBondContact CA-OG1 3.42Å; R912-T915 PolarHBondContact O-N 2.92Å; R912-T915 PolarHBondContact O-OG1 3.38Å; E913-T915 VanDerWaalsContact C-N 3.3Å; E913-T915 PolarHBondContact O-N 3.11Å
916S65.1Low66.6Low80 Ų80125.5 Ų125.556%0.55965%0.65SS**Hα-helixtrans-86.5-15.3178.473.50000113.9R912 E913 I914 R918R912-S916 WeakPolarHBondContact O-CB 3.37Å; R912-S916 PolarHBondContact O-N 3.47Å; R912-S916 PolarHBondContact O-OG 2.88Å; E913-S916 WeakPolarHBondContact CA-OG 3.48Å; E913-S916 WeakPolarHBondContact O-CA 3.49Å; E913-S916 PolarHBondContact O-N 2.97Å; E913-S916 PolarHBondContact O-OG 3.39Å; I914-S916 VanDerWaalsContact C-N 3.31Å; I914-S916 PolarHBondContact O-N 2.77Å; S916-R918 PolarHBondContact O-N 2.97Å; S916-R918 VanDerWaalsContact O-N 3.16Å
917V56.4Low65.7Low112 Ų112126.3 Ų126.368%0.67966%0.658SS**SBendtrans-71.3-4.3-178.7168.20000113E913E913-V917 VanDerWaalsContact O-CG2 3.29Å; E913-V917 WeakPolarHBondContact O-CG2 3.5Å; E913-V917 PolarHBondContact O-N 2.75Å; E913-V917 VanDerWaalsContact O-N 3.1Å
918R50.2Low64.5Low223 Ų223129.1 Ų129.184%0.84267%0.672SS**  trans-102.972169.5-79.9-173176.6175.90.7112.4S916S916-R918 PolarHBondContact O-N 2.97Å; S916-R918 VanDerWaalsContact O-N 3.16Å
919H45.3Very low63.4Low192 Ų192128.5 Ų128.589%0.88967%0.672SS**SBendtrans-161.457.1147-84.8-51000110
920S42.6Very low62Low102 Ų102134.6 Ų134.671%0.71370%0.699SS**  trans-168.3121.4147.831.20000108.4
921T32.1Very low60.4Low222 Ų222137.4 Ų137.4100%1.36271%0.713SS**  trans68.10-179.3540000117.5

Retrieved 921 of 921 residues in 2701.9 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).